data_16374_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16374
_Entry.PDB_ID 2KKX
_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 8.970 -0.184 1
1 8 . 1 1 1 A 2 2 GLN HA H 91 4.005 3.920 0.085 1
1 15 . 1 1 1 A 2 2 GLN C C 91 177.270 177.996 -0.726 1
1 16 . 1 1 1 A 2 2 GLN CA C 91 58.220 59.676 -1.456 1
1 17 . 1 1 1 A 2 2 GLN CB C 91 28.650 28.696 -0.046 1
1 19 . 1 1 1 A 2 2 GLN N N 91 121.993 122.618 -0.625 1
1 21 . 1 1 1 A 3 3 GLU H H 92 8.430 8.266 0.164 1
1 22 . 1 1 1 A 3 3 GLU HA H 92 4.007 4.118 -0.111 1
1 27 . 1 1 1 A 3 3 GLU C C 92 178.287 178.866 -0.579 1
1 28 . 1 1 1 A 3 3 GLU CA C 92 59.490 59.215 0.275 1
1 29 . 1 1 1 A 3 3 GLU CB C 92 29.506 29.290 0.216 1
1 31 . 1 1 1 A 3 3 GLU N N 92 120.195 118.742 1.453 1
1 32 . 1 1 1 A 4 4 SER H H 93 8.209 7.805 0.404 1
1 33 . 1 1 1 A 4 4 SER HA H 93 4.272 4.267 0.005 1
1 36 . 1 1 1 A 4 4 SER C C 93 177.369 177.463 -0.094 1
1 37 . 1 1 1 A 4 4 SER CA C 93 61.044 61.218 -0.174 1
1 38 . 1 1 1 A 4 4 SER CB C 93 62.950 62.858 0.092 1
1 39 . 1 1 1 A 4 4 SER N N 93 115.524 114.930 0.594 1
1 40 . 1 1 1 A 5 5 ILE H H 94 8.080 7.970 0.110 1
1 41 . 1 1 1 A 5 5 ILE HA H 94 3.530 3.621 -0.091 1
1 51 . 1 1 1 A 5 5 ILE C C 94 177.778 177.656 0.122 1
1 52 . 1 1 1 A 5 5 ILE CA C 94 65.710 65.206 0.504 1
1 53 . 1 1 1 A 5 5 ILE CB C 94 37.800 37.590 0.210 1
1 57 . 1 1 1 A 5 5 ILE N N 94 124.148 121.993 2.155 1
1 58 . 1 1 1 A 6 6 GLN H H 95 8.374 8.258 0.116 1
1 59 . 1 1 1 A 6 6 GLN HA H 95 4.125 4.111 0.014 1
1 66 . 1 1 1 A 6 6 GLN C C 95 179.726 179.113 0.613 1
1 67 . 1 1 1 A 6 6 GLN CA C 95 59.190 59.298 -0.108 1
1 68 . 1 1 1 A 6 6 GLN CB C 95 27.060 28.137 -1.077 1
1 70 . 1 1 1 A 6 6 GLN N N 95 118.257 118.927 -0.670 1
1 72 . 1 1 1 A 7 7 ASN H H 96 8.456 8.074 0.382 1
1 73 . 1 1 1 A 7 7 ASN HA H 96 4.446 4.493 -0.047 1
1 78 . 1 1 1 A 7 7 ASN C C 96 177.257 178.504 -1.247 1
1 79 . 1 1 1 A 7 7 ASN CA C 96 56.020 56.367 -0.347 1
1 80 . 1 1 1 A 7 7 ASN CB C 96 38.126 37.932 0.194 1
1 81 . 1 1 1 A 7 7 ASN N N 96 118.597 118.736 -0.139 1
1 83 . 1 1 1 A 8 8 LYS H H 97 7.732 7.587 0.145 1
1 84 . 1 1 1 A 8 8 LYS HA H 97 4.129 4.066 0.063 1
1 93 . 1 1 1 A 8 8 LYS C C 97 179.143 179.623 -0.480 1
1 94 . 1 1 1 A 8 8 LYS CA C 97 59.126 59.763 -0.637 1
1 95 . 1 1 1 A 8 8 LYS CB C 97 32.070 32.436 -0.366 1
1 99 . 1 1 1 A 8 8 LYS N N 97 122.381 118.631 3.750 1
1 100 . 1 1 1 A 9 9 ILE H H 98 8.452 8.334 0.118 1
1 101 . 1 1 1 A 9 9 ILE HA H 98 3.480 3.729 -0.249 1
1 111 . 1 1 1 A 9 9 ILE C C 98 177.406 178.262 -0.856 1
1 112 . 1 1 1 A 9 9 ILE CA C 98 66.430 65.298 1.132 1
1 113 . 1 1 1 A 9 9 ILE CB C 98 37.980 37.797 0.183 1
1 117 . 1 1 1 A 9 9 ILE N N 98 119.950 121.049 -1.099 1
1 118 . 1 1 1 A 10 10 SER H H 99 7.924 8.103 -0.179 1
1 119 . 1 1 1 A 10 10 SER HA H 99 3.983 4.191 -0.208 1
1 122 . 1 1 1 A 10 10 SER C C 99 176.327 176.765 -0.438 1
1 123 . 1 1 1 A 10 10 SER CA C 99 61.990 61.192 0.798 1
1 124 . 1 1 1 A 10 10 SER CB C 99 62.790 63.134 -0.344 1
1 125 . 1 1 1 A 10 10 SER N N 99 113.568 115.955 -2.387 1
1 126 . 1 1 1 A 11 11 GLN H H 100 7.832 7.219 0.613 1
1 127 . 1 1 1 A 11 11 GLN HA H 100 4.238 4.213 0.025 1
1 134 . 1 1 1 A 11 11 GLN C C 100 178.088 178.270 -0.182 1
1 135 . 1 1 1 A 11 11 GLN CA C 100 57.900 58.208 -0.308 1
1 136 . 1 1 1 A 11 11 GLN CB C 100 29.790 29.051 0.739 1
1 138 . 1 1 1 A 11 11 GLN N N 100 117.487 120.404 -2.917 1
1 140 . 1 1 1 A 12 12 CYS H H 101 7.920 8.378 -0.458 1
1 141 . 1 1 1 A 12 12 CYS HA H 101 4.657 4.323 0.334 1
1 144 . 1 1 1 A 12 12 CYS C C 101 175.446 175.087 0.359 1
1 145 . 1 1 1 A 12 12 CYS CA C 101 60.654 62.835 -2.181 1
1 146 . 1 1 1 A 12 12 CYS CB C 101 29.310 26.595 2.715 1
1 147 . 1 1 1 A 12 12 CYS N N 101 114.221 119.521 -5.300 1
1 148 . 1 1 1 A 13 13 LYS H H 102 8.029 7.313 0.716 1
1 149 . 1 1 1 A 13 13 LYS HA H 102 5.069 4.768 0.301 1
1 158 . 1 1 1 A 13 13 LYS C C 102 174.800 176.262 -1.462 1
1 159 . 1 1 1 A 13 13 LYS CA C 102 56.394 56.009 0.385 1
1 160 . 1 1 1 A 13 13 LYS CB C 102 32.770 33.482 -0.712 1
1 164 . 1 1 1 A 13 13 LYS N N 102 124.129 119.229 4.900 1
1 165 . 1 1 1 A 14 14 PHE H H 103 8.737 8.579 0.158 1
1 166 . 1 1 1 A 14 14 PHE HA H 103 5.059 5.023 0.036 1
1 174 . 1 1 1 A 14 14 PHE C C 103 173.560 172.102 1.458 1
1 175 . 1 1 1 A 14 14 PHE CA C 103 55.470 55.929 -0.459 1
1 176 . 1 1 1 A 14 14 PHE CB C 103 41.760 40.740 1.020 1
1 180 . 1 1 1 A 14 14 PHE N N 103 118.661 116.367 2.294 1
1 181 . 1 1 1 A 15 15 SER H H 104 8.826 8.717 0.109 1
1 182 . 1 1 1 A 15 15 SER HA H 104 4.602 4.549 0.053 1
1 185 . 1 1 1 A 15 15 SER C C 104 173.795 173.536 0.259 1
1 186 . 1 1 1 A 15 15 SER CA C 104 58.610 57.279 1.331 1
1 187 . 1 1 1 A 15 15 SER CB C 104 62.690 63.314 -0.624 1
1 188 . 1 1 1 A 15 15 SER N N 104 117.781 116.009 1.772 1
1 189 . 1 1 1 A 16 16 VAL H H 105 7.784 8.172 -0.388 1
1 190 . 1 1 1 A 16 16 VAL HA H 105 3.370 4.254 -0.884 1
1 198 . 1 1 1 A 16 16 VAL C C 105 174.987 175.376 -0.389 1
1 199 . 1 1 1 A 16 16 VAL CA C 105 63.580 62.542 1.038 1
1 200 . 1 1 1 A 16 16 VAL CB C 105 31.410 32.089 -0.679 1
1 203 . 1 1 1 A 16 16 VAL N N 105 129.075 127.153 1.922 1
1 204 . 1 1 1 A 17 17 CYS H H 106 8.536 8.704 -0.168 1
1 205 . 1 1 1 A 17 17 CYS HA H 106 5.011 5.041 -0.030 1
1 208 . 1 1 1 A 17 17 CYS CA C 106 55.260 56.217 -0.957 1
1 209 . 1 1 1 A 17 17 CYS CB C 106 28.210 28.585 -0.375 1
1 210 . 1 1 1 A 17 17 CYS N N 106 130.045 125.372 4.673 1
1 211 . 1 1 1 A 18 18 PRO HA H 107 3.991 4.392 -0.401 1
1 218 . 1 1 1 A 18 18 PRO C C 107 178.188 178.611 -0.423 1
1 219 . 1 1 1 A 18 18 PRO CA C 107 65.940 65.053 0.887 1
1 220 . 1 1 1 A 18 18 PRO CB C 107 32.000 32.000 0.000 1
1 223 . 1 1 1 A 19 19 GLU H H 108 9.260 9.153 0.107 1
1 224 . 1 1 1 A 19 19 GLU HA H 108 4.119 4.113 0.006 1
1 229 . 1 1 1 A 19 19 GLU C C 108 178.721 179.295 -0.574 1
1 230 . 1 1 1 A 19 19 GLU CA C 108 59.300 58.733 0.567 1
1 231 . 1 1 1 A 19 19 GLU CB C 108 28.920 28.804 0.116 1
1 233 . 1 1 1 A 19 19 GLU N N 108 118.270 116.274 1.996 1
1 234 . 1 1 1 A 20 20 ARG H H 109 7.672 7.940 -0.268 1
1 235 . 1 1 1 A 20 20 ARG HA H 109 4.331 4.115 0.216 1
1 242 . 1 1 1 A 20 20 ARG C C 109 177.977 178.626 -0.649 1
1 243 . 1 1 1 A 20 20 ARG CA C 109 57.350 59.085 -1.735 1
1 244 . 1 1 1 A 20 20 ARG CB C 109 30.820 30.446 0.374 1
1 247 . 1 1 1 A 20 20 ARG N N 109 118.357 119.635 -1.278 1
1 248 . 1 1 1 A 21 21 LEU H H 110 7.601 7.797 -0.196 1
1 249 . 1 1 1 A 21 21 LEU HA H 110 4.380 4.239 0.141 1
1 259 . 1 1 1 A 21 21 LEU C C 110 176.562 176.361 0.201 1
1 260 . 1 1 1 A 21 21 LEU CA C 110 56.096 55.373 0.723 1
1 261 . 1 1 1 A 21 21 LEU CB C 110 44.016 42.095 1.921 1
1 265 . 1 1 1 A 21 21 LEU N N 110 118.626 118.230 0.396 1
1 266 . 1 1 1 A 22 22 GLN H H 111 7.750 7.849 -0.099 1
1 267 . 1 1 1 A 22 22 GLN HA H 111 3.870 3.984 -0.114 1
1 274 . 1 1 1 A 22 22 GLN C C 111 173.336 174.727 -1.391 1
1 275 . 1 1 1 A 22 22 GLN CA C 111 56.510 57.355 -0.845 1
1 276 . 1 1 1 A 22 22 GLN CB C 111 26.800 26.673 0.127 1
1 278 . 1 1 1 A 22 22 GLN N N 111 113.926 115.570 -1.644 1
1 280 . 1 1 1 A 23 23 CYS H H 112 7.407 7.522 -0.115 1
1 281 . 1 1 1 A 23 23 CYS HA H 112 4.469 4.742 -0.273 1
1 284 . 1 1 1 A 23 23 CYS CA C 112 52.650 57.781 -5.131 1
1 285 . 1 1 1 A 23 23 CYS CB C 112 29.750 28.891 0.859 1
1 286 . 1 1 1 A 23 23 CYS N N 112 112.681 118.407 -5.726 1
1 287 . 1 1 1 A 24 24 PRO HA H 113 4.408 4.620 -0.212 1
1 294 . 1 1 1 A 24 24 PRO C C 113 178.175 177.427 0.748 1
1 295 . 1 1 1 A 24 24 PRO CA C 113 62.040 62.690 -0.650 1
1 296 . 1 1 1 A 24 24 PRO CB C 113 31.920 32.713 -0.793 1
1 299 . 1 1 1 A 25 25 LEU H H 114 8.593 8.434 0.159 1
1 300 . 1 1 1 A 25 25 LEU HA H 114 3.765 3.909 -0.144 1
1 310 . 1 1 1 A 25 25 LEU C C 114 179.950 178.851 1.099 1
1 311 . 1 1 1 A 25 25 LEU CA C 114 57.674 57.963 -0.289 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 114 123.729 123.612 0.117 1
1 317 . 1 1 1 A 26 26 GLU H H 115 9.108 8.564 0.544 1
1 318 . 1 1 1 A 26 26 GLU HA H 115 3.876 4.081 -0.205 1
1 323 . 1 1 1 A 26 26 GLU C C 115 177.505 178.536 -1.031 1
1 324 . 1 1 1 A 26 26 GLU CA C 115 59.410 59.147 0.263 1
1 325 . 1 1 1 A 26 26 GLU CB C 115 28.460 29.459 -0.999 1
1 327 . 1 1 1 A 26 26 GLU N N 115 116.817 117.317 -0.500 1
1 328 . 1 1 1 A 27 27 ALA H H 116 7.360 7.567 -0.207 1
1 329 . 1 1 1 A 27 27 ALA HA H 116 4.408 4.130 0.278 1
1 333 . 1 1 1 A 27 27 ALA C C 116 177.046 177.866 -0.820 1
1 334 . 1 1 1 A 27 27 ALA CA C 116 52.970 54.299 -1.329 1
1 335 . 1 1 1 A 27 27 ALA CB C 116 19.916 18.502 1.414 1
1 336 . 1 1 1 A 27 27 ALA N N 116 118.966 120.824 -1.858 1
1 337 . 1 1 1 A 28 28 ILE H H 117 7.168 7.118 0.050 1
1 338 . 1 1 1 A 28 28 ILE HA H 117 4.432 4.399 0.033 1
1 348 . 1 1 1 A 28 28 ILE C C 117 172.641 175.511 -2.870 1
1 349 . 1 1 1 A 28 28 ILE CA C 117 59.980 59.676 0.304 1
1 350 . 1 1 1 A 28 28 ILE CB C 117 37.350 37.888 -0.538 1
1 354 . 1 1 1 A 28 28 ILE N N 117 108.913 108.742 0.171 1
1 355 . 1 1 1 A 29 29 GLN H H 118 6.562 7.270 -0.708 1
1 356 . 1 1 1 A 29 29 GLN HA H 118 3.922 4.149 -0.227 1
1 363 . 1 1 1 A 29 29 GLN C C 118 175.049 175.400 -0.351 1
1 364 . 1 1 1 A 29 29 GLN CA C 118 54.596 55.885 -1.289 1
1 365 . 1 1 1 A 29 29 GLN CB C 118 29.570 28.965 0.605 1
1 367 . 1 1 1 A 29 29 GLN N N 118 116.455 123.262 -6.807 1
1 369 . 1 1 1 A 30 30 CYS H H 119 8.138 8.349 -0.211 1
1 370 . 1 1 1 A 30 30 CYS HA H 119 4.580 4.675 -0.095 1
1 373 . 1 1 1 A 30 30 CYS CA C 119 57.810 56.894 0.916 1
1 374 . 1 1 1 A 30 30 CYS CB C 119 30.200 28.718 1.482 1
1 375 . 1 1 1 A 30 30 CYS N N 119 134.136 125.168 8.968 1
1 376 . 1 1 1 A 31 31 PRO HA H 120 4.424 4.437 -0.013 1
1 383 . 1 1 1 A 31 31 PRO C C 120 177.431 177.650 -0.219 1
1 384 . 1 1 1 A 31 31 PRO CA C 120 64.060 64.020 0.040 1
1 385 . 1 1 1 A 31 31 PRO CB C 120 32.776 31.813 0.963 1
1 388 . 1 1 1 A 32 32 ILE H H 121 11.318 7.782 3.536 1
1 389 . 1 1 1 A 32 32 ILE HA H 121 4.038 3.991 0.047 1
1 399 . 1 1 1 A 32 32 ILE C C 121 178.485 178.077 0.408 1
1 400 . 1 1 1 A 32 32 ILE CA C 121 64.060 63.951 0.109 1
1 401 . 1 1 1 A 32 32 ILE CB C 121 39.340 38.350 0.990 1
1 405 . 1 1 1 A 32 32 ILE N N 121 124.500 117.125 7.375 1
1 406 . 1 1 1 A 33 33 THR H H 122 9.928 7.437 2.491 1
1 407 . 1 1 1 A 33 33 THR HA H 122 4.048 4.302 -0.254 1
1 412 . 1 1 1 A 33 33 THR C C 122 175.793 174.917 0.876 1
1 413 . 1 1 1 A 33 33 THR CA C 122 62.990 62.105 0.885 1
1 414 . 1 1 1 A 33 33 THR CB C 122 70.300 70.087 0.213 1
1 416 . 1 1 1 A 33 33 THR N N 122 115.136 109.560 5.576 1
1 417 . 1 1 1 A 34 34 LEU H H 123 8.439 7.703 0.736 1
1 418 . 1 1 1 A 34 34 LEU HA H 123 3.912 3.825 0.087 1
1 428 . 1 1 1 A 34 34 LEU C C 123 175.495 175.123 0.372 1
1 429 . 1 1 1 A 34 34 LEU CA C 123 56.290 56.232 0.058 1
1 430 . 1 1 1 A 34 34 LEU CB C 123 38.500 39.726 -1.226 1
1 434 . 1 1 1 A 34 34 LEU N N 123 117.230 118.760 -1.530 1
1 435 . 1 1 1 A 35 35 GLU H H 124 7.816 6.957 0.859 1
1 436 . 1 1 1 A 35 35 GLU HA H 124 4.634 4.809 -0.175 1
1 441 . 1 1 1 A 35 35 GLU C C 124 174.838 174.041 0.797 1
1 442 . 1 1 1 A 35 35 GLU CA C 124 53.780 54.737 -0.957 1
1 443 . 1 1 1 A 35 35 GLU CB C 124 33.710 32.430 1.280 1
1 445 . 1 1 1 A 35 35 GLU N N 124 116.577 114.135 2.442 1
1 446 . 1 1 1 A 36 36 GLN H H 125 8.532 8.428 0.104 1
1 447 . 1 1 1 A 36 36 GLN HA H 125 4.958 4.330 0.628 1
1 454 . 1 1 1 A 36 36 GLN CA C 125 53.350 53.498 -0.148 1
1 455 . 1 1 1 A 36 36 GLN CB C 125 29.950 29.355 0.595 1
1 457 . 1 1 1 A 36 36 GLN N N 125 123.034 123.875 -0.841 1
1 459 . 1 1 1 A 37 37 PRO HA H 126 4.458 4.590 -0.132 1
1 466 . 1 1 1 A 37 37 PRO C C 126 176.314 176.893 -0.579 1
1 467 . 1 1 1 A 37 37 PRO CA C 126 62.816 62.727 0.089 1
1 468 . 1 1 1 A 37 37 PRO CB C 126 33.070 32.657 0.413 1
1 471 . 1 1 1 A 38 38 GLU H H 127 8.626 8.364 0.262 1
1 472 . 1 1 1 A 38 38 GLU HA H 127 4.274 4.149 0.125 1
1 477 . 1 1 1 A 38 38 GLU C C 127 177.877 176.441 1.436 1
1 478 . 1 1 1 A 38 38 GLU CA C 127 58.730 57.916 0.814 1
1 479 . 1 1 1 A 38 38 GLU CB C 127 30.340 30.256 0.084 1
1 481 . 1 1 1 A 38 38 GLU N N 127 120.691 118.582 2.109 1
1 482 . 1 1 1 A 39 39 LYS H H 128 7.861 7.731 0.130 1
1 483 . 1 1 1 A 39 39 LYS HA H 128 4.889 4.701 0.188 1
1 492 . 1 1 1 A 39 39 LYS C C 128 175.446 174.911 0.535 1
1 493 . 1 1 1 A 39 39 LYS CA C 128 53.670 54.567 -0.897 1
1 494 . 1 1 1 A 39 39 LYS CB C 128 33.630 35.860 -2.230 1
1 498 . 1 1 1 A 39 39 LYS N N 128 117.878 117.005 0.873 1
1 499 . 1 1 1 A 40 40 GLY H H 129 8.426 7.915 0.511 1
1 500 . 1 1 1 A 40 40 GLY HA2 H 129 4.970 3.984 0.986 1
1 501 . 1 1 1 A 40 40 GLY HA3 H 129 2.458 4.137 -1.679 1
1 502 . 1 1 1 A 40 40 GLY C C 129 170.048 172.276 -2.228 1
1 503 . 1 1 1 A 40 40 GLY CA C 129 42.910 45.010 -2.100 1
1 504 . 1 1 1 A 40 40 GLY N N 129 112.604 105.515 7.089 1
1 505 . 1 1 1 A 41 41 ILE H H 130 8.596 8.998 -0.402 1
1 506 . 1 1 1 A 41 41 ILE HA H 130 4.636 5.177 -0.541 1
1 516 . 1 1 1 A 41 41 ILE C C 130 172.691 174.236 -1.545 1
1 517 . 1 1 1 A 41 41 ILE CA C 130 58.500 58.616 -0.116 1
1 518 . 1 1 1 A 41 41 ILE CB C 130 43.320 41.425 1.895 1
1 522 . 1 1 1 A 41 41 ILE N N 130 113.363 116.142 -2.779 1
1 523 . 1 1 1 A 42 42 PHE H H 131 8.994 8.933 0.061 1
1 524 . 1 1 1 A 42 42 PHE HA H 131 5.075 5.434 -0.359 1
1 532 . 1 1 1 A 42 42 PHE C C 131 175.111 174.682 0.429 1
1 533 . 1 1 1 A 42 42 PHE CA C 131 58.680 57.147 1.533 1
1 534 . 1 1 1 A 42 42 PHE CB C 131 42.220 40.461 1.759 1
1 538 . 1 1 1 A 42 42 PHE N N 131 125.156 122.218 2.938 1
1 539 . 1 1 1 A 43 43 VAL H H 132 8.399 9.189 -0.790 1
1 540 . 1 1 1 A 43 43 VAL HA H 132 4.920 4.656 0.264 1
1 548 . 1 1 1 A 43 43 VAL C C 132 178.175 175.354 2.821 1
1 549 . 1 1 1 A 43 43 VAL CA C 132 59.600 61.062 -1.462 1
1 550 . 1 1 1 A 43 43 VAL CB C 132 35.920 33.865 2.055 1
1 553 . 1 1 1 A 43 43 VAL N N 132 119.371 123.472 -4.101 1
1 554 . 1 1 1 A 44 44 LYS H H 133 10.041 8.456 1.585 1
1 555 . 1 1 1 A 44 44 LYS HA H 133 4.920 4.437 0.483 1
1 564 . 1 1 1 A 44 44 LYS C C 133 177.195 175.382 1.813 1
1 565 . 1 1 1 A 44 44 LYS CA C 133 57.310 56.231 1.079 1
1 566 . 1 1 1 A 44 44 LYS CB C 133 34.410 32.242 2.168 1
1 570 . 1 1 1 A 44 44 LYS N N 133 130.928 126.480 4.448 1
1 571 . 1 1 1 A 45 45 ASN H H 134 8.534 9.086 -0.552 1
1 572 . 1 1 1 A 45 45 ASN HA H 134 4.151 4.753 -0.602 1
1 577 . 1 1 1 A 45 45 ASN C C 134 174.217 175.333 -1.116 1
1 578 . 1 1 1 A 45 45 ASN CA C 134 55.290 52.376 2.914 1
1 579 . 1 1 1 A 45 45 ASN CB C 134 37.530 37.380 0.150 1
1 580 . 1 1 1 A 45 45 ASN N N 134 119.452 124.311 -4.859 1
1 582 . 1 1 1 A 46 46 SER H H 135 7.570 8.160 -0.590 1
1 583 . 1 1 1 A 46 46 SER HA H 135 4.220 4.166 0.054 1
1 586 . 1 1 1 A 46 46 SER C C 135 174.490 176.857 -2.367 1
1 587 . 1 1 1 A 46 46 SER CA C 135 57.090 61.281 -4.191 1
1 588 . 1 1 1 A 46 46 SER CB C 135 64.126 63.018 1.108 1
1 589 . 1 1 1 A 46 46 SER N N 135 105.613 121.401 -15.788 1
1 590 . 1 1 1 A 47 47 ASP H H 136 9.113 8.126 0.987 1
1 591 . 1 1 1 A 47 47 ASP HA H 136 4.220 4.320 -0.100 1
1 594 . 1 1 1 A 47 47 ASP CA C 136 57.610 57.129 0.481 1
1 595 . 1 1 1 A 47 47 ASP CB C 136 40.810 40.657 0.153 1
1 596 . 1 1 1 A 47 47 ASP N N 136 120.995 121.032 -0.037 1
1 597 . 1 1 1 A 48 48 GLY H H 137 8.172 8.301 -0.129 1
1 598 . 1 1 1 A 48 48 GLY HA2 H 137 4.096 3.775 0.321 1
1 599 . 1 1 1 A 48 48 GLY HA3 H 137 3.664 3.786 -0.122 1
1 600 . 1 1 1 A 48 48 GLY C C 137 173.990 175.340 -1.350 1
1 601 . 1 1 1 A 48 48 GLY CA C 137 45.130 47.448 -2.318 1
1 602 . 1 1 1 A 48 48 GLY N N 137 105.838 107.831 -1.993 1
1 603 . 1 1 1 A 49 49 SER H H 138 7.252 7.513 -0.261 1
1 604 . 1 1 1 A 49 49 SER HA H 138 4.503 4.745 -0.242 1
1 607 . 1 1 1 A 49 49 SER C C 138 173.857 173.861 -0.004 1
1 608 . 1 1 1 A 49 49 SER CA C 138 57.340 57.045 0.295 1
1 609 . 1 1 1 A 49 49 SER CB C 138 65.370 64.223 1.147 1
1 610 . 1 1 1 A 49 49 SER N N 138 114.942 112.325 2.617 1
1 611 . 1 1 1 A 50 50 ASP H H 139 8.276 7.976 0.300 1
1 612 . 1 1 1 A 50 50 ASP HA H 139 4.618 4.258 0.360 1
1 615 . 1 1 1 A 50 50 ASP C C 139 174.577 174.929 -0.352 1
1 616 . 1 1 1 A 50 50 ASP CA C 139 53.116 55.377 -2.261 1
1 617 . 1 1 1 A 50 50 ASP CB C 139 40.520 40.376 0.144 1
1 618 . 1 1 1 A 50 50 ASP N N 139 122.088 119.553 2.535 1
1 619 . 1 1 1 A 51 51 VAL H H 140 8.192 7.508 0.684 1
1 620 . 1 1 1 A 51 51 VAL HA H 140 4.299 4.139 0.160 1
1 628 . 1 1 1 A 51 51 VAL C C 140 175.867 175.328 0.539 1
1 629 . 1 1 1 A 51 51 VAL CA C 140 62.950 62.810 0.140 1
1 630 . 1 1 1 A 51 51 VAL CB C 140 33.230 31.943 1.287 1
1 632 . 1 1 1 A 51 51 VAL N N 140 121.167 119.860 1.307 1
1 633 . 1 1 1 A 52 52 CYS H H 141 8.391 8.865 -0.474 1
1 634 . 1 1 1 A 52 52 CYS HA H 141 5.247 5.046 0.201 1
1 637 . 1 1 1 A 52 52 CYS C C 141 172.778 174.860 -2.082 1
1 638 . 1 1 1 A 52 52 CYS CA C 141 56.480 57.978 -1.498 1
1 639 . 1 1 1 A 52 52 CYS CB C 141 31.960 28.634 3.326 1
1 640 . 1 1 1 A 52 52 CYS N N 141 121.884 126.602 -4.718 1
1 641 . 1 1 1 A 53 53 THR H H 142 8.777 9.136 -0.359 1
1 642 . 1 1 1 A 53 53 THR HA H 142 4.489 4.945 -0.456 1
1 648 . 1 1 1 A 53 53 THR C C 142 171.885 173.137 -1.252 1
1 649 . 1 1 1 A 53 53 THR CA C 142 62.070 61.751 0.319 1
1 650 . 1 1 1 A 53 53 THR CB C 142 71.390 70.497 0.893 1
1 652 . 1 1 1 A 53 53 THR N N 142 118.132 121.190 -3.058 1
1 653 . 1 1 1 A 54 54 LEU H H 143 8.409 8.664 -0.255 1
1 654 . 1 1 1 A 54 54 LEU HA H 143 4.276 4.575 -0.299 1
1 664 . 1 1 1 A 54 54 LEU C C 143 174.366 174.224 0.142 1
1 665 . 1 1 1 A 54 54 LEU CA C 143 54.330 53.209 1.121 1
1 666 . 1 1 1 A 54 54 LEU CB C 143 42.396 42.883 -0.487 1
1 670 . 1 1 1 A 54 54 LEU N N 143 127.980 129.304 -1.324 1
1 671 . 1 1 1 A 55 55 PHE H H 144 8.646 8.618 0.028 1
1 672 . 1 1 1 A 55 55 PHE HA H 144 5.455 4.789 0.666 1
1 680 . 1 1 1 A 55 55 PHE C C 144 176.054 175.249 0.805 1
1 681 . 1 1 1 A 55 55 PHE CA C 144 55.250 57.185 -1.935 1
1 682 . 1 1 1 A 55 55 PHE CB C 144 44.100 40.423 3.677 1
1 686 . 1 1 1 A 55 55 PHE N N 144 122.010 126.769 -4.759 1
1 687 . 1 1 1 A 56 56 ASP H H 145 11.575 8.231 3.344 1
1 688 . 1 1 1 A 56 56 ASP HA H 145 4.416 4.582 -0.166 1
1 691 . 1 1 1 A 56 56 ASP C C 145 176.748 177.398 -0.650 1
1 692 . 1 1 1 A 56 56 ASP CA C 145 55.840 54.760 1.080 1
1 693 . 1 1 1 A 56 56 ASP CB C 145 44.390 42.110 2.280 1
1 694 . 1 1 1 A 56 56 ASP N N 145 121.936 124.139 -2.203 1
1 695 . 1 1 1 A 57 57 ALA H H 146 8.508 8.673 -0.165 1
1 696 . 1 1 1 A 57 57 ALA HA H 146 3.797 4.008 -0.211 1
1 700 . 1 1 1 A 57 57 ALA C C 146 178.696 179.711 -1.015 1
1 701 . 1 1 1 A 57 57 ALA CA C 146 55.990 55.449 0.541 1
1 702 . 1 1 1 A 57 57 ALA CB C 146 18.840 18.132 0.708 1
1 703 . 1 1 1 A 57 57 ALA N N 146 130.243 129.557 0.686 1
1 704 . 1 1 1 A 58 58 ALA H H 147 8.378 7.563 0.815 1
1 705 . 1 1 1 A 58 58 ALA HA H 147 4.078 4.196 -0.118 1
1 709 . 1 1 1 A 58 58 ALA C C 147 181.091 179.577 1.514 1
1 710 . 1 1 1 A 58 58 ALA CA C 147 54.770 54.868 -0.098 1
1 711 . 1 1 1 A 58 58 ALA CB C 147 17.700 18.444 -0.744 1
1 712 . 1 1 1 A 58 58 ALA N N 147 121.997 119.340 2.657 1
1 713 . 1 1 1 A 59 59 ALA H H 148 9.138 7.859 1.279 1
1 714 . 1 1 1 A 59 59 ALA HA H 148 3.975 4.104 -0.129 1
1 718 . 1 1 1 A 59 59 ALA C C 148 180.508 179.921 0.587 1
1 719 . 1 1 1 A 59 59 ALA CA C 148 54.840 55.057 -0.217 1
1 720 . 1 1 1 A 59 59 ALA CB C 148 18.600 18.518 0.082 1
1 721 . 1 1 1 A 59 59 ALA N N 148 123.595 120.280 3.315 1
1 722 . 1 1 1 A 60 60 PHE H H 149 8.814 8.146 0.668 1
1 723 . 1 1 1 A 60 60 PHE HA H 149 3.722 4.037 -0.315 1
1 731 . 1 1 1 A 60 60 PHE C C 149 176.773 177.437 -0.664 1
1 732 . 1 1 1 A 60 60 PHE CA C 149 62.030 61.486 0.544 1
1 733 . 1 1 1 A 60 60 PHE CB C 149 39.960 38.794 1.166 1
1 737 . 1 1 1 A 60 60 PHE N N 149 120.354 120.020 0.334 1
1 738 . 1 1 1 A 61 61 SER H H 150 8.276 8.310 -0.034 1
1 739 . 1 1 1 A 61 61 SER HA H 150 3.880 4.045 -0.165 1
1 742 . 1 1 1 A 61 61 SER C C 150 177.691 177.228 0.463 1
1 743 . 1 1 1 A 61 61 SER CA C 150 62.190 61.365 0.825 1
1 744 . 1 1 1 A 61 61 SER CB C 150 63.016 63.142 -0.126 1
1 745 . 1 1 1 A 61 61 SER N N 150 112.086 113.638 -1.552 1
1 746 . 1 1 1 A 62 62 ARG H H 151 7.829 7.671 0.158 1
1 747 . 1 1 1 A 62 62 ARG HA H 151 3.971 4.056 -0.085 1
1 754 . 1 1 1 A 62 62 ARG C C 151 178.287 178.745 -0.458 1
1 755 . 1 1 1 A 62 62 ARG CA C 151 59.340 59.082 0.258 1
1 756 . 1 1 1 A 62 62 ARG CB C 151 29.760 29.808 -0.048 1
1 759 . 1 1 1 A 62 62 ARG N N 151 121.090 121.636 -0.546 1
1 760 . 1 1 1 A 63 63 LEU H H 152 7.390 7.639 -0.249 1
1 761 . 1 1 1 A 63 63 LEU HA H 152 3.791 3.942 -0.151 1
1 771 . 1 1 1 A 63 63 LEU C C 152 179.106 178.873 0.233 1
1 772 . 1 1 1 A 63 63 LEU CA C 152 58.900 57.870 1.030 1
1 773 . 1 1 1 A 63 63 LEU CB C 152 41.140 41.558 -0.418 1
1 777 . 1 1 1 A 63 63 LEU N N 152 121.129 119.348 1.781 1
1 778 . 1 1 1 A 64 64 VAL H H 153 7.552 8.055 -0.503 1
1 779 . 1 1 1 A 64 64 VAL HA H 153 3.411 3.482 -0.071 1
1 787 . 1 1 1 A 64 64 VAL C C 153 180.595 178.116 2.479 1
1 788 . 1 1 1 A 64 64 VAL CA C 153 65.644 66.423 -0.779 1
1 789 . 1 1 1 A 64 64 VAL CB C 153 31.410 31.425 -0.015 1
1 792 . 1 1 1 A 64 64 VAL N N 153 118.280 118.898 -0.618 1
1 793 . 1 1 1 A 65 65 GLY H H 154 8.061 8.125 -0.064 1
1 794 . 1 1 1 A 65 65 GLY HA2 H 154 3.846 3.740 0.106 1
1 795 . 1 1 1 A 65 65 GLY HA3 H 154 3.809 3.742 0.067 1
1 796 . 1 1 1 A 65 65 GLY C C 154 175.235 176.140 -0.905 1
1 797 . 1 1 1 A 65 65 GLY CA C 154 46.630 47.108 -0.478 1
1 798 . 1 1 1 A 65 65 GLY N N 154 108.622 107.753 0.869 1
1 799 . 1 1 1 A 66 66 GLU H H 155 7.528 7.648 -0.120 1
1 800 . 1 1 1 A 66 66 GLU HA H 155 4.228 4.371 -0.143 1
1 805 . 1 1 1 A 66 66 GLU C C 155 176.761 176.769 -0.008 1
1 806 . 1 1 1 A 66 66 GLU CA C 155 56.590 56.308 0.282 1
1 807 . 1 1 1 A 66 66 GLU CB C 155 30.490 30.507 -0.017 1
1 809 . 1 1 1 A 66 66 GLU N N 155 118.361 119.057 -0.696 1
1 810 . 1 1 1 A 67 67 GLY H H 156 7.884 7.951 -0.067 1
1 811 . 1 1 1 A 67 67 GLY HA2 H 156 3.918 3.913 0.005 1
1 812 . 1 1 1 A 67 67 GLY HA3 H 156 3.747 3.926 -0.179 1
1 813 . 1 1 1 A 67 67 GLY C C 156 174.788 174.421 0.367 1
1 814 . 1 1 1 A 67 67 GLY CA C 156 45.890 45.400 0.490 1
1 815 . 1 1 1 A 67 67 GLY N N 156 108.465 108.303 0.162 1
1 816 . 1 1 1 A 68 68 LEU H H 157 7.332 7.751 -0.419 1
1 817 . 1 1 1 A 68 68 LEU HA H 157 4.361 4.415 -0.054 1
1 827 . 1 1 1 A 68 68 LEU CA C 157 53.060 52.281 0.779 1
1 828 . 1 1 1 A 68 68 LEU CB C 157 41.100 41.973 -0.873 1
1 832 . 1 1 1 A 68 68 LEU N N 157 121.920 121.952 -0.032 1
1 833 . 1 1 1 A 69 69 PRO HA H 158 4.485 4.596 -0.111 1
1 840 . 1 1 1 A 69 69 PRO C C 158 174.602 176.228 -1.626 1
1 841 . 1 1 1 A 69 69 PRO CA C 158 61.556 62.227 -0.671 1
1 842 . 1 1 1 A 69 69 PRO CB C 158 32.370 32.938 -0.568 1
1 845 . 1 1 1 A 70 70 HIS H H 159 8.759 8.621 0.138 1
1 846 . 1 1 1 A 70 70 HIS HA H 159 3.947 4.501 -0.554 1
1 852 . 1 1 1 A 70 70 HIS CA C 159 56.250 55.135 1.115 1
1 853 . 1 1 1 A 70 70 HIS CB C 159 32.280 30.986 1.294 1
1 856 . 1 1 1 A 70 70 HIS N N 159 119.423 120.477 -1.054 1
1 857 . 1 1 1 A 71 71 PRO HA H 160 4.424 4.374 0.050 1
1 864 . 1 1 1 A 71 71 PRO C C 160 177.567 177.762 -0.195 1
1 865 . 1 1 1 A 71 71 PRO CA C 160 64.574 64.267 0.307 1
1 866 . 1 1 1 A 71 71 PRO CB C 160 32.340 31.733 0.607 1
1 869 . 1 1 1 A 72 72 LEU H H 161 10.123 7.471 2.652 1
1 870 . 1 1 1 A 72 72 LEU HA H 161 4.778 4.344 0.434 1
1 880 . 1 1 1 A 72 72 LEU C C 161 178.721 178.116 0.605 1
1 881 . 1 1 1 A 72 72 LEU CA C 161 55.800 56.665 -0.865 1
1 882 . 1 1 1 A 72 72 LEU CB C 161 42.440 42.901 -0.461 1
1 886 . 1 1 1 A 72 72 LEU N N 161 117.374 117.569 -0.195 1
1 887 . 1 1 1 A 73 73 THR H H 162 7.523 8.045 -0.522 1
1 888 . 1 1 1 A 73 73 THR HA H 162 4.291 4.555 -0.264 1
1 893 . 1 1 1 A 73 73 THR C C 162 175.557 174.275 1.282 1
1 894 . 1 1 1 A 73 73 THR CA C 162 61.440 62.606 -1.166 1
1 895 . 1 1 1 A 73 73 THR CB C 162 70.500 69.474 1.026 1
1 897 . 1 1 1 A 73 73 THR N N 162 107.787 111.824 -4.037 1
1 898 . 1 1 1 A 74 74 ARG H H 163 8.361 7.991 0.370 1
1 899 . 1 1 1 A 74 74 ARG HA H 163 3.836 4.240 -0.404 1
1 906 . 1 1 1 A 74 74 ARG C C 163 174.701 175.265 -0.564 1
1 907 . 1 1 1 A 74 74 ARG CA C 163 57.980 57.715 0.265 1
1 908 . 1 1 1 A 74 74 ARG CB C 163 26.770 27.254 -0.484 1
1 911 . 1 1 1 A 74 74 ARG N N 163 115.130 118.302 -3.172 1
1 912 . 1 1 1 A 75 75 GLU H H 164 7.430 8.074 -0.644 1
1 913 . 1 1 1 A 75 75 GLU HA H 164 4.636 4.480 0.156 1
1 918 . 1 1 1 A 75 75 GLU CA C 164 53.699 54.797 -1.098 1
1 919 . 1 1 1 A 75 75 GLU CB C 164 29.550 28.812 0.738 1
1 921 . 1 1 1 A 75 75 GLU N N 164 120.076 118.984 1.092 1
1 922 . 1 1 1 A 76 76 PRO HA H 165 4.272 4.504 -0.232 1
1 929 . 1 1 1 A 76 76 PRO C C 165 176.649 177.061 -0.412 1
1 930 . 1 1 1 A 76 76 PRO CA C 165 63.204 63.125 0.079 1
1 931 . 1 1 1 A 76 76 PRO CB C 165 31.680 31.578 0.102 1
1 934 . 1 1 1 A 77 77 ILE H H 166 8.812 8.203 0.609 1
1 935 . 1 1 1 A 77 77 ILE HA H 166 3.838 4.204 -0.366 1
1 945 . 1 1 1 A 77 77 ILE C C 166 175.235 176.056 -0.821 1
1 946 . 1 1 1 A 77 77 ILE CA C 166 62.816 61.178 1.638 1
1 947 . 1 1 1 A 77 77 ILE CB C 166 37.750 37.260 0.490 1
1 951 . 1 1 1 A 77 77 ILE N N 166 123.831 124.137 -0.306 1
1 952 . 1 1 1 A 78 78 THR H H 167 6.625 8.575 -1.950 1
1 953 . 1 1 1 A 78 78 THR HA H 167 4.632 5.083 -0.451 1
1 958 . 1 1 1 A 78 78 THR C C 167 174.143 174.406 -0.263 1
1 959 . 1 1 1 A 78 78 THR CA C 167 58.750 60.020 -1.270 1
1 960 . 1 1 1 A 78 78 THR CB C 167 71.320 71.413 -0.093 1
1 962 . 1 1 1 A 78 78 THR N N 167 115.293 118.455 -3.162 1
1 963 . 1 1 1 A 79 79 ALA H H 168 9.088 8.988 0.100 1
1 964 . 1 1 1 A 79 79 ALA HA H 168 3.916 4.163 -0.247 1
1 968 . 1 1 1 A 79 79 ALA C C 168 179.788 179.819 -0.031 1
1 969 . 1 1 1 A 79 79 ALA CA C 168 55.480 54.749 0.731 1
1 970 . 1 1 1 A 79 79 ALA CB C 168 17.630 18.554 -0.924 1
1 971 . 1 1 1 A 79 79 ALA N N 168 122.102 128.171 -6.069 1
1 972 . 1 1 1 A 80 80 SER H H 169 7.988 7.819 0.169 1
1 973 . 1 1 1 A 80 80 SER HA H 169 4.058 4.104 -0.046 1
1 976 . 1 1 1 A 80 80 SER C C 169 176.029 176.452 -0.423 1
1 977 . 1 1 1 A 80 80 SER CA C 169 60.750 62.226 -1.476 1
1 978 . 1 1 1 A 80 80 SER CB C 169 62.510 63.229 -0.719 1
1 979 . 1 1 1 A 80 80 SER N N 169 109.541 114.815 -5.274 1
1 980 . 1 1 1 A 81 81 ILE H H 170 6.968 7.550 -0.582 1
1 981 . 1 1 1 A 81 81 ILE HA H 170 4.315 4.300 0.015 1
1 991 . 1 1 1 A 81 81 ILE C C 170 174.242 175.352 -1.110 1
1 992 . 1 1 1 A 81 81 ILE CA C 170 62.296 61.857 0.439 1
1 993 . 1 1 1 A 81 81 ILE CB C 170 37.686 38.151 -0.465 1
1 997 . 1 1 1 A 81 81 ILE N N 170 112.476 113.969 -1.493 1
1 998 . 1 1 1 A 82 82 ILE H H 171 7.345 7.465 -0.120 1
1 999 . 1 1 1 A 82 82 ILE HA H 171 4.339 4.697 -0.358 1
1 1009 . 1 1 1 A 82 82 ILE C C 171 174.999 174.717 0.282 1
1 1010 . 1 1 1 A 82 82 ILE CA C 171 61.150 59.791 1.359 1
1 1011 . 1 1 1 A 82 82 ILE CB C 171 37.230 40.991 -3.761 1
1 1015 . 1 1 1 A 82 82 ILE N N 171 124.260 124.811 -0.551 1
1 1016 . 1 1 1 A 83 83 VAL H H 172 7.923 8.813 -0.890 1
1 1017 . 1 1 1 A 83 83 VAL HA H 172 4.673 4.996 -0.323 1
1 1025 . 1 1 1 A 83 83 VAL C C 172 174.887 175.438 -0.551 1
1 1026 . 1 1 1 A 83 83 VAL CA C 172 59.340 58.963 0.377 1
1 1027 . 1 1 1 A 83 83 VAL CB C 172 34.840 35.444 -0.604 1
1 1030 . 1 1 1 A 83 83 VAL N N 172 120.931 121.893 -0.962 1
1 1031 . 1 1 1 A 84 84 LYS H H 173 8.406 8.762 -0.356 1
1 1032 . 1 1 1 A 84 84 LYS HA H 173 4.410 4.400 0.010 1
1 1041 . 1 1 1 A 84 84 LYS C C 173 178.734 178.162 0.572 1
1 1042 . 1 1 1 A 84 84 LYS CA C 173 56.360 56.090 0.270 1
1 1043 . 1 1 1 A 84 84 LYS CB C 173 33.100 32.746 0.354 1
1 1047 . 1 1 1 A 84 84 LYS N N 173 121.251 121.454 -0.203 1
1 1048 . 1 1 1 A 85 85 HIS H H 174 9.221 8.497 0.724 1
1 1049 . 1 1 1 A 85 85 HIS HA H 174 4.024 4.616 -0.592 1
1 1053 . 1 1 1 A 85 85 HIS C C 174 177.183 176.860 0.323 1
1 1054 . 1 1 1 A 85 85 HIS CA C 174 59.460 58.942 0.518 1
1 1055 . 1 1 1 A 85 85 HIS CB C 174 27.920 29.516 -1.596 1
1 1057 . 1 1 1 A 85 85 HIS N N 174 121.545 121.105 0.440 1
1 1058 . 1 1 1 A 86 86 GLU H H 175 8.699 7.938 0.761 1
1 1059 . 1 1 1 A 86 86 GLU HA H 175 3.900 4.002 -0.102 1
1 1064 . 1 1 1 A 86 86 GLU C C 175 177.220 177.925 -0.705 1
1 1065 . 1 1 1 A 86 86 GLU CA C 175 58.420 58.895 -0.475 1
1 1066 . 1 1 1 A 86 86 GLU CB C 175 28.690 29.456 -0.766 1
1 1068 . 1 1 1 A 86 86 GLU N N 175 118.011 119.948 -1.937 1
1 1069 . 1 1 1 A 87 87 GLU H H 176 7.621 7.444 0.177 1
1 1070 . 1 1 1 A 87 87 GLU HA H 176 4.177 4.384 -0.207 1
1 1075 . 1 1 1 A 87 87 GLU C C 176 175.222 175.593 -0.371 1
1 1076 . 1 1 1 A 87 87 GLU CA C 176 56.390 56.818 -0.428 1
1 1077 . 1 1 1 A 87 87 GLU CB C 176 30.430 30.126 0.304 1
1 1079 . 1 1 1 A 87 87 GLU N N 176 116.753 116.232 0.521 1
1 1080 . 1 1 1 A 88 88 CYS H H 177 7.239 7.667 -0.428 1
1 1081 . 1 1 1 A 88 88 CYS HA H 177 5.148 5.218 -0.070 1
1 1084 . 1 1 1 A 88 88 CYS C C 177 173.249 173.138 0.111 1
1 1085 . 1 1 1 A 88 88 CYS CA C 177 57.240 57.247 -0.007 1
1 1086 . 1 1 1 A 88 88 CYS CB C 177 31.020 30.549 0.471 1
1 1087 . 1 1 1 A 88 88 CYS N N 177 116.096 116.166 -0.070 1
1 1088 . 1 1 1 A 89 89 ILE H H 178 8.912 8.781 0.131 1
1 1089 . 1 1 1 A 89 89 ILE HA H 178 4.580 5.031 -0.451 1
1 1099 . 1 1 1 A 89 89 ILE C C 178 173.386 174.104 -0.718 1
1 1100 . 1 1 1 A 89 89 ILE CA C 178 59.270 59.015 0.255 1
1 1101 . 1 1 1 A 89 89 ILE CB C 178 42.990 41.833 1.157 1
1 1105 . 1 1 1 A 89 89 ILE N N 178 119.490 120.789 -1.299 1
1 1106 . 1 1 1 A 90 90 TYR H H 179 9.047 8.579 0.468 1
1 1107 . 1 1 1 A 90 90 TYR HA H 179 3.753 4.026 -0.273 1
1 1112 . 1 1 1 A 90 90 TYR C C 179 173.932 174.110 -0.178 1
1 1113 . 1 1 1 A 90 90 TYR CA C 179 59.860 57.435 2.425 1
1 1114 . 1 1 1 A 90 90 TYR CB C 179 37.530 38.277 -0.747 1
1 1116 . 1 1 1 A 90 90 TYR N N 179 126.270 122.202 4.068 1
1 1117 . 1 1 1 A 91 91 ASP H H 180 7.462 8.399 -0.937 1
1 1118 . 1 1 1 A 91 91 ASP HA H 180 4.639 4.692 -0.053 1
1 1121 . 1 1 1 A 91 91 ASP C C 180 175.297 176.256 -0.959 1
1 1122 . 1 1 1 A 91 91 ASP CA C 180 52.496 52.970 -0.474 1
1 1123 . 1 1 1 A 91 91 ASP CB C 180 43.380 42.704 0.676 1
1 1124 . 1 1 1 A 91 91 ASP N N 180 129.593 125.235 4.358 1
1 1125 . 1 1 1 A 92 92 ASP H H 181 8.719 9.191 -0.472 1
1 1126 . 1 1 1 A 92 92 ASP HA H 181 4.109 4.359 -0.250 1
1 1129 . 1 1 1 A 92 92 ASP C C 181 177.555 177.326 0.229 1
1 1130 . 1 1 1 A 92 92 ASP CA C 181 56.390 56.486 -0.096 1
1 1131 . 1 1 1 A 92 92 ASP CB C 181 41.330 40.702 0.628 1
1 1132 . 1 1 1 A 92 92 ASP N N 181 125.691 127.351 -1.660 1
1 1133 . 1 1 1 A 93 93 THR H H 182 8.271 7.650 0.621 1
1 1134 . 1 1 1 A 93 93 THR HA H 182 4.036 4.040 -0.004 1
1 1139 . 1 1 1 A 93 93 THR C C 182 176.289 176.354 -0.065 1
1 1140 . 1 1 1 A 93 93 THR CA C 182 65.054 64.827 0.227 1
1 1141 . 1 1 1 A 93 93 THR CB C 182 68.560 68.867 -0.307 1
1 1143 . 1 1 1 A 93 93 THR N N 182 114.813 113.987 0.826 1
1 1144 . 1 1 1 A 94 94 ARG H H 183 7.753 7.363 0.390 1
1 1145 . 1 1 1 A 94 94 ARG HA H 183 4.139 4.302 -0.163 1
1 1152 . 1 1 1 A 94 94 ARG C C 183 176.897 176.969 -0.072 1
1 1153 . 1 1 1 A 94 94 ARG CA C 183 55.350 56.132 -0.782 1
1 1154 . 1 1 1 A 94 94 ARG CB C 183 30.930 30.968 -0.038 1
1 1157 . 1 1 1 A 94 94 ARG N N 183 120.101 117.828 2.273 1
1 1158 . 1 1 1 A 95 95 GLY H H 184 8.112 9.089 -0.977 1
1 1159 . 1 1 1 A 95 95 GLY HA2 H 184 3.838 3.859 -0.021 1
1 1160 . 1 1 1 A 95 95 GLY HA3 H 184 3.670 3.862 -0.192 1
1 1161 . 1 1 1 A 95 95 GLY C C 184 173.659 173.318 0.341 1
1 1162 . 1 1 1 A 95 95 GLY CA C 184 46.040 45.753 0.287 1
1 1163 . 1 1 1 A 95 95 GLY N N 184 108.106 109.488 -1.382 1
1 1164 . 1 1 1 A 96 96 ASN H H 185 6.833 7.374 -0.541 1
1 1165 . 1 1 1 A 96 96 ASN HA H 185 4.944 5.061 -0.117 1
1 1170 . 1 1 1 A 96 96 ASN C C 185 174.267 173.367 0.900 1
1 1171 . 1 1 1 A 96 96 ASN CA C 185 52.560 52.414 0.146 1
1 1172 . 1 1 1 A 96 96 ASN CB C 185 45.890 41.754 4.136 1
1 1173 . 1 1 1 A 96 96 ASN N N 185 113.392 117.041 -3.649 1
1 1175 . 1 1 1 A 97 97 PHE H H 186 9.108 8.658 0.450 1
1 1176 . 1 1 1 A 97 97 PHE HA H 186 4.782 4.762 0.020 1
1 1183 . 1 1 1 A 97 97 PHE C C 186 174.862 175.709 -0.847 1
1 1184 . 1 1 1 A 97 97 PHE CA C 186 60.056 59.614 0.442 1
1 1185 . 1 1 1 A 97 97 PHE CB C 186 40.180 39.245 0.935 1
1 1188 . 1 1 1 A 97 97 PHE N N 186 118.741 119.395 -0.654 1
1 1189 . 1 1 1 A 98 98 ILE H H 187 8.933 8.622 0.311 1
1 1190 . 1 1 1 A 98 98 ILE HA H 187 5.458 4.909 0.549 1
1 1200 . 1 1 1 A 98 98 ILE C C 187 176.041 175.157 0.884 1
1 1201 . 1 1 1 A 98 98 ILE CA C 187 57.610 59.152 -1.542 1
1 1202 . 1 1 1 A 98 98 ILE CB C 187 42.070 41.948 0.122 1
1 1206 . 1 1 1 A 98 98 ILE N N 187 117.857 119.001 -1.144 1
1 1207 . 1 1 1 A 99 99 ILE H H 188 8.284 8.369 -0.085 1
1 1208 . 1 1 1 A 99 99 ILE HA H 188 4.341 4.287 0.054 1
1 1218 . 1 1 1 A 99 99 ILE C C 188 176.413 176.490 -0.077 1
1 1219 . 1 1 1 A 99 99 ILE CA C 188 59.190 61.137 -1.947 1
1 1220 . 1 1 1 A 99 99 ILE CB C 188 37.940 38.256 -0.316 1
1 1224 . 1 1 1 A 99 99 ILE N N 188 121.796 122.333 -0.537 1
1 1225 . 1 1 1 A 100 100 LYS H H 189 8.463 8.549 -0.086 1
1 1226 . 1 1 1 A 100 100 LYS HA H 189 4.040 4.304 -0.264 1
1 1235 . 1 1 1 A 100 100 LYS C C 189 176.848 178.317 -1.469 1
1 1236 . 1 1 1 A 100 100 LYS CA C 189 57.241 55.786 1.455 1
1 1237 . 1 1 1 A 100 100 LYS CB C 189 33.400 33.126 0.274 1
1 1241 . 1 1 1 A 100 100 LYS N N 189 127.995 124.295 3.700 1
1 1242 . 1 1 1 A 101 101 GLY H H 190 8.346 8.514 -0.168 1
1 1243 . 1 1 1 A 101 101 GLY HA2 H 190 3.947 3.799 0.148 1
1 1244 . 1 1 1 A 101 101 GLY HA3 H 190 3.813 3.803 0.010 1
1 1245 . 1 1 1 A 101 101 GLY C C 190 172.902 174.344 -1.442 1
1 1246 . 1 1 1 A 101 101 GLY CA C 190 44.920 47.392 -2.472 1
1 1247 . 1 1 1 A 101 101 GLY N N 190 110.882 110.731 0.151 1
1 7 . 2 1 1 A 2 2 GLN H H 91 8.786 8.513 0.273 1
1 8 . 2 1 1 A 2 2 GLN HA H 91 4.005 3.886 0.119 1
1 15 . 2 1 1 A 2 2 GLN C C 91 177.270 177.740 -0.470 1
1 16 . 2 1 1 A 2 2 GLN CA C 91 58.220 59.148 -0.928 1
1 17 . 2 1 1 A 2 2 GLN CB C 91 28.650 28.473 0.177 1
1 19 . 2 1 1 A 2 2 GLN N N 91 121.993 126.442 -4.449 1
1 21 . 2 1 1 A 3 3 GLU H H 92 8.430 8.415 0.015 1
1 22 . 2 1 1 A 3 3 GLU HA H 92 4.007 4.169 -0.162 1
1 27 . 2 1 1 A 3 3 GLU C C 92 178.287 178.785 -0.498 1
1 28 . 2 1 1 A 3 3 GLU CA C 92 59.490 58.998 0.492 1
1 29 . 2 1 1 A 3 3 GLU CB C 92 29.506 28.026 1.480 1
1 31 . 2 1 1 A 3 3 GLU N N 92 120.195 118.037 2.158 1
1 32 . 2 1 1 A 4 4 SER H H 93 8.209 7.810 0.399 1
1 33 . 2 1 1 A 4 4 SER HA H 93 4.272 4.276 -0.004 1
1 36 . 2 1 1 A 4 4 SER C C 93 177.369 177.417 -0.048 1
1 37 . 2 1 1 A 4 4 SER CA C 93 61.044 61.360 -0.316 1
1 38 . 2 1 1 A 4 4 SER CB C 93 62.950 62.795 0.155 1
1 39 . 2 1 1 A 4 4 SER N N 93 115.524 115.884 -0.360 1
1 40 . 2 1 1 A 5 5 ILE H H 94 8.080 7.884 0.196 1
1 41 . 2 1 1 A 5 5 ILE HA H 94 3.530 3.622 -0.092 1
1 51 . 2 1 1 A 5 5 ILE C C 94 177.778 177.836 -0.058 1
1 52 . 2 1 1 A 5 5 ILE CA C 94 65.710 65.242 0.468 1
1 53 . 2 1 1 A 5 5 ILE CB C 94 37.800 37.352 0.448 1
1 57 . 2 1 1 A 5 5 ILE N N 94 124.148 122.124 2.024 1
1 58 . 2 1 1 A 6 6 GLN H H 95 8.374 7.868 0.506 1
1 59 . 2 1 1 A 6 6 GLN HA H 95 4.125 3.970 0.155 1
1 66 . 2 1 1 A 6 6 GLN C C 95 179.726 179.196 0.530 1
1 67 . 2 1 1 A 6 6 GLN CA C 95 59.190 59.233 -0.043 1
1 68 . 2 1 1 A 6 6 GLN CB C 95 27.060 28.085 -1.025 1
1 70 . 2 1 1 A 6 6 GLN N N 95 118.257 118.110 0.147 1
1 72 . 2 1 1 A 7 7 ASN H H 96 8.456 8.130 0.326 1
1 73 . 2 1 1 A 7 7 ASN HA H 96 4.446 4.530 -0.084 1
1 78 . 2 1 1 A 7 7 ASN C C 96 177.257 178.494 -1.237 1
1 79 . 2 1 1 A 7 7 ASN CA C 96 56.020 56.226 -0.206 1
1 80 . 2 1 1 A 7 7 ASN CB C 96 38.126 37.959 0.167 1
1 81 . 2 1 1 A 7 7 ASN N N 96 118.597 118.355 0.242 1
1 83 . 2 1 1 A 8 8 LYS H H 97 7.732 7.761 -0.029 1
1 84 . 2 1 1 A 8 8 LYS HA H 97 4.129 4.072 0.057 1
1 93 . 2 1 1 A 8 8 LYS C C 97 179.143 179.492 -0.349 1
1 94 . 2 1 1 A 8 8 LYS CA C 97 59.126 59.221 -0.095 1
1 95 . 2 1 1 A 8 8 LYS CB C 97 32.070 32.090 -0.020 1
1 99 . 2 1 1 A 8 8 LYS N N 97 122.381 118.688 3.693 1
1 100 . 2 1 1 A 9 9 ILE H H 98 8.452 8.093 0.359 1
1 101 . 2 1 1 A 9 9 ILE HA H 98 3.480 3.804 -0.324 1
1 111 . 2 1 1 A 9 9 ILE C C 98 177.406 178.101 -0.695 1
1 112 . 2 1 1 A 9 9 ILE CA C 98 66.430 64.904 1.526 1
1 113 . 2 1 1 A 9 9 ILE CB C 98 37.980 37.752 0.228 1
1 117 . 2 1 1 A 9 9 ILE N N 98 119.950 121.248 -1.298 1
1 118 . 2 1 1 A 10 10 SER H H 99 7.924 7.930 -0.006 1
1 119 . 2 1 1 A 10 10 SER HA H 99 3.983 4.149 -0.166 1
1 122 . 2 1 1 A 10 10 SER C C 99 176.327 176.126 0.201 1
1 123 . 2 1 1 A 10 10 SER CA C 99 61.990 61.717 0.273 1
1 124 . 2 1 1 A 10 10 SER CB C 99 62.790 63.027 -0.237 1
1 125 . 2 1 1 A 10 10 SER N N 99 113.568 116.045 -2.477 1
1 126 . 2 1 1 A 11 11 GLN H H 100 7.832 7.677 0.155 1
1 127 . 2 1 1 A 11 11 GLN HA H 100 4.238 4.233 0.005 1
1 134 . 2 1 1 A 11 11 GLN C C 100 178.088 176.875 1.213 1
1 135 . 2 1 1 A 11 11 GLN CA C 100 57.900 58.121 -0.221 1
1 136 . 2 1 1 A 11 11 GLN CB C 100 29.790 28.264 1.526 1
1 138 . 2 1 1 A 11 11 GLN N N 100 117.487 119.436 -1.949 1
1 140 . 2 1 1 A 12 12 CYS H H 101 7.920 7.872 0.048 1
1 141 . 2 1 1 A 12 12 CYS HA H 101 4.657 4.669 -0.012 1
1 144 . 2 1 1 A 12 12 CYS C C 101 175.446 174.751 0.695 1
1 145 . 2 1 1 A 12 12 CYS CA C 101 60.654 59.120 1.534 1
1 146 . 2 1 1 A 12 12 CYS CB C 101 29.310 28.340 0.970 1
1 147 . 2 1 1 A 12 12 CYS N N 101 114.221 116.312 -2.091 1
1 148 . 2 1 1 A 13 13 LYS H H 102 8.029 7.202 0.827 1
1 149 . 2 1 1 A 13 13 LYS HA H 102 5.069 4.678 0.391 1
1 158 . 2 1 1 A 13 13 LYS C C 102 174.800 176.195 -1.395 1
1 159 . 2 1 1 A 13 13 LYS CA C 102 56.394 55.974 0.420 1
1 160 . 2 1 1 A 13 13 LYS CB C 102 32.770 33.383 -0.613 1
1 164 . 2 1 1 A 13 13 LYS N N 102 124.129 119.316 4.813 1
1 165 . 2 1 1 A 14 14 PHE H H 103 8.737 8.534 0.203 1
1 166 . 2 1 1 A 14 14 PHE HA H 103 5.059 5.088 -0.029 1
1 174 . 2 1 1 A 14 14 PHE C C 103 173.560 173.284 0.276 1
1 175 . 2 1 1 A 14 14 PHE CA C 103 55.470 56.173 -0.703 1
1 176 . 2 1 1 A 14 14 PHE CB C 103 41.760 41.303 0.457 1
1 180 . 2 1 1 A 14 14 PHE N N 103 118.661 116.552 2.109 1
1 181 . 2 1 1 A 15 15 SER H H 104 8.826 8.690 0.136 1
1 182 . 2 1 1 A 15 15 SER HA H 104 4.602 4.547 0.055 1
1 185 . 2 1 1 A 15 15 SER C C 104 173.795 174.052 -0.257 1
1 186 . 2 1 1 A 15 15 SER CA C 104 58.610 58.105 0.505 1
1 187 . 2 1 1 A 15 15 SER CB C 104 62.690 63.331 -0.641 1
1 188 . 2 1 1 A 15 15 SER N N 104 117.781 114.899 2.882 1
1 189 . 2 1 1 A 16 16 VAL H H 105 7.784 8.386 -0.602 1
1 190 . 2 1 1 A 16 16 VAL HA H 105 3.370 4.307 -0.937 1
1 198 . 2 1 1 A 16 16 VAL C C 105 174.987 175.412 -0.425 1
1 199 . 2 1 1 A 16 16 VAL CA C 105 63.580 63.100 0.480 1
1 200 . 2 1 1 A 16 16 VAL CB C 105 31.410 31.066 0.344 1
1 203 . 2 1 1 A 16 16 VAL N N 105 129.075 125.878 3.197 1
1 204 . 2 1 1 A 17 17 CYS H H 106 8.536 8.709 -0.173 1
1 205 . 2 1 1 A 17 17 CYS HA H 106 5.011 5.005 0.006 1
1 208 . 2 1 1 A 17 17 CYS CA C 106 55.260 56.320 -1.060 1
1 209 . 2 1 1 A 17 17 CYS CB C 106 28.210 28.535 -0.325 1
1 210 . 2 1 1 A 17 17 CYS N N 106 130.045 127.539 2.506 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 107 178.188 178.639 -0.451 1
1 219 . 2 1 1 A 18 18 PRO CA C 107 65.940 65.087 0.853 1
1 220 . 2 1 1 A 18 18 PRO CB C 107 32.000 31.929 0.071 1
1 223 . 2 1 1 A 19 19 GLU H H 108 9.260 9.146 0.114 1
1 224 . 2 1 1 A 19 19 GLU HA H 108 4.119 4.128 -0.009 1
1 229 . 2 1 1 A 19 19 GLU C C 108 178.721 179.224 -0.503 1
1 230 . 2 1 1 A 19 19 GLU CA C 108 59.300 58.676 0.624 1
1 231 . 2 1 1 A 19 19 GLU CB C 108 28.920 28.640 0.280 1
1 233 . 2 1 1 A 19 19 GLU N N 108 118.270 116.328 1.942 1
1 234 . 2 1 1 A 20 20 ARG H H 109 7.672 7.962 -0.290 1
1 235 . 2 1 1 A 20 20 ARG HA H 109 4.331 4.095 0.236 1
1 242 . 2 1 1 A 20 20 ARG C C 109 177.977 178.822 -0.845 1
1 243 . 2 1 1 A 20 20 ARG CA C 109 57.350 58.890 -1.540 1
1 244 . 2 1 1 A 20 20 ARG CB C 109 30.820 30.500 0.320 1
1 247 . 2 1 1 A 20 20 ARG N N 109 118.357 119.797 -1.440 1
1 248 . 2 1 1 A 21 21 LEU H H 110 7.601 7.906 -0.305 1
1 249 . 2 1 1 A 21 21 LEU HA H 110 4.380 4.247 0.133 1
1 259 . 2 1 1 A 21 21 LEU C C 110 176.562 176.414 0.148 1
1 260 . 2 1 1 A 21 21 LEU CA C 110 56.096 55.607 0.489 1
1 261 . 2 1 1 A 21 21 LEU CB C 110 44.016 42.158 1.858 1
1 265 . 2 1 1 A 21 21 LEU N N 110 118.626 118.596 0.030 1
1 266 . 2 1 1 A 22 22 GLN H H 111 7.750 7.520 0.230 1
1 267 . 2 1 1 A 22 22 GLN HA H 111 3.870 3.979 -0.109 1
1 274 . 2 1 1 A 22 22 GLN C C 111 173.336 174.813 -1.477 1
1 275 . 2 1 1 A 22 22 GLN CA C 111 56.510 57.387 -0.877 1
1 276 . 2 1 1 A 22 22 GLN CB C 111 26.800 26.740 0.060 1
1 278 . 2 1 1 A 22 22 GLN N N 111 113.926 115.469 -1.543 1
1 280 . 2 1 1 A 23 23 CYS H H 112 7.407 7.860 -0.453 1
1 281 . 2 1 1 A 23 23 CYS HA H 112 4.469 4.735 -0.266 1
1 284 . 2 1 1 A 23 23 CYS CA C 112 52.650 58.118 -5.468 1
1 285 . 2 1 1 A 23 23 CYS CB C 112 29.750 28.297 1.453 1
1 286 . 2 1 1 A 23 23 CYS N N 112 112.681 118.454 -5.773 1
1 287 . 2 1 1 A 24 24 PRO HA H 113 4.408 4.616 -0.208 1
1 294 . 2 1 1 A 24 24 PRO C C 113 178.175 177.797 0.378 1
1 295 . 2 1 1 A 24 24 PRO CA C 113 62.040 63.002 -0.962 1
1 296 . 2 1 1 A 24 24 PRO CB C 113 31.920 32.426 -0.506 1
1 299 . 2 1 1 A 25 25 LEU H H 114 8.593 8.478 0.115 1
1 300 . 2 1 1 A 25 25 LEU HA H 114 3.765 3.925 -0.160 1
1 310 . 2 1 1 A 25 25 LEU C C 114 179.950 178.778 1.172 1
1 311 . 2 1 1 A 25 25 LEU CA C 114 57.674 57.708 -0.034 1
1 312 . 2 1 1 A 25 25 LEU CB C 114 40.690 41.492 -0.802 1
1 316 . 2 1 1 A 25 25 LEU N N 114 123.729 123.557 0.172 1
1 317 . 2 1 1 A 26 26 GLU H H 115 9.108 8.556 0.552 1
1 318 . 2 1 1 A 26 26 GLU HA H 115 3.876 4.075 -0.199 1
1 323 . 2 1 1 A 26 26 GLU C C 115 177.505 178.545 -1.040 1
1 324 . 2 1 1 A 26 26 GLU CA C 115 59.410 59.134 0.276 1
1 325 . 2 1 1 A 26 26 GLU CB C 115 28.460 29.447 -0.987 1
1 327 . 2 1 1 A 26 26 GLU N N 115 116.817 117.492 -0.675 1
1 328 . 2 1 1 A 27 27 ALA H H 116 7.360 7.755 -0.395 1
1 329 . 2 1 1 A 27 27 ALA HA H 116 4.408 4.102 0.306 1
1 333 . 2 1 1 A 27 27 ALA C C 116 177.046 177.891 -0.845 1
1 334 . 2 1 1 A 27 27 ALA CA C 116 52.970 54.540 -1.570 1
1 335 . 2 1 1 A 27 27 ALA CB C 116 19.916 18.293 1.623 1
1 336 . 2 1 1 A 27 27 ALA N N 116 118.966 121.180 -2.214 1
1 337 . 2 1 1 A 28 28 ILE H H 117 7.168 6.894 0.274 1
1 338 . 2 1 1 A 28 28 ILE HA H 117 4.432 4.312 0.120 1
1 348 . 2 1 1 A 28 28 ILE C C 117 172.641 175.066 -2.425 1
1 349 . 2 1 1 A 28 28 ILE CA C 117 59.980 59.426 0.554 1
1 350 . 2 1 1 A 28 28 ILE CB C 117 37.350 37.314 0.036 1
1 354 . 2 1 1 A 28 28 ILE N N 117 108.913 108.788 0.125 1
1 355 . 2 1 1 A 29 29 GLN H H 118 6.562 7.276 -0.714 1
1 356 . 2 1 1 A 29 29 GLN HA H 118 3.922 4.372 -0.450 1
1 363 . 2 1 1 A 29 29 GLN C C 118 175.049 175.597 -0.548 1
1 364 . 2 1 1 A 29 29 GLN CA C 118 54.596 55.523 -0.927 1
1 365 . 2 1 1 A 29 29 GLN CB C 118 29.570 29.782 -0.212 1
1 367 . 2 1 1 A 29 29 GLN N N 118 116.455 123.342 -6.887 1
1 369 . 2 1 1 A 30 30 CYS H H 119 8.138 8.424 -0.286 1
1 370 . 2 1 1 A 30 30 CYS HA H 119 4.580 4.624 -0.044 1
1 373 . 2 1 1 A 30 30 CYS CA C 119 57.810 57.115 0.695 1
1 374 . 2 1 1 A 30 30 CYS CB C 119 30.200 28.712 1.488 1
1 375 . 2 1 1 A 30 30 CYS N N 119 134.136 125.354 8.782 1
1 376 . 2 1 1 A 31 31 PRO HA H 120 4.424 4.447 -0.023 1
1 383 . 2 1 1 A 31 31 PRO C C 120 177.431 177.861 -0.430 1
1 384 . 2 1 1 A 31 31 PRO CA C 120 64.060 64.084 -0.024 1
1 385 . 2 1 1 A 31 31 PRO CB C 120 32.776 31.786 0.990 1
1 388 . 2 1 1 A 32 32 ILE H H 121 11.318 7.636 3.682 1
1 389 . 2 1 1 A 32 32 ILE HA H 121 4.038 3.959 0.079 1
1 399 . 2 1 1 A 32 32 ILE C C 121 178.485 177.729 0.756 1
1 400 . 2 1 1 A 32 32 ILE CA C 121 64.060 64.248 -0.188 1
1 401 . 2 1 1 A 32 32 ILE CB C 121 39.340 38.127 1.213 1
1 405 . 2 1 1 A 32 32 ILE N N 121 124.500 117.131 7.369 1
1 406 . 2 1 1 A 33 33 THR H H 122 9.928 7.385 2.543 1
1 407 . 2 1 1 A 33 33 THR HA H 122 4.048 4.327 -0.279 1
1 412 . 2 1 1 A 33 33 THR C C 122 175.793 174.889 0.904 1
1 413 . 2 1 1 A 33 33 THR CA C 122 62.990 61.858 1.132 1
1 414 . 2 1 1 A 33 33 THR CB C 122 70.300 69.754 0.546 1
1 416 . 2 1 1 A 33 33 THR N N 122 115.136 109.534 5.602 1
1 417 . 2 1 1 A 34 34 LEU H H 123 8.439 7.702 0.737 1
1 418 . 2 1 1 A 34 34 LEU HA H 123 3.912 3.855 0.057 1
1 428 . 2 1 1 A 34 34 LEU C C 123 175.495 174.988 0.507 1
1 429 . 2 1 1 A 34 34 LEU CA C 123 56.290 56.248 0.042 1
1 430 . 2 1 1 A 34 34 LEU CB C 123 38.500 39.931 -1.431 1
1 434 . 2 1 1 A 34 34 LEU N N 123 117.230 119.422 -2.192 1
1 435 . 2 1 1 A 35 35 GLU H H 124 7.816 6.981 0.835 1
1 436 . 2 1 1 A 35 35 GLU HA H 124 4.634 4.733 -0.099 1
1 441 . 2 1 1 A 35 35 GLU C C 124 174.838 174.059 0.779 1
1 442 . 2 1 1 A 35 35 GLU CA C 124 53.780 54.604 -0.824 1
1 443 . 2 1 1 A 35 35 GLU CB C 124 33.710 32.508 1.202 1
1 445 . 2 1 1 A 35 35 GLU N N 124 116.577 114.320 2.257 1
1 446 . 2 1 1 A 36 36 GLN H H 125 8.532 8.469 0.063 1
1 447 . 2 1 1 A 36 36 GLN HA H 125 4.958 4.338 0.620 1
1 454 . 2 1 1 A 36 36 GLN CA C 125 53.350 53.628 -0.278 1
1 455 . 2 1 1 A 36 36 GLN CB C 125 29.950 29.368 0.582 1
1 457 . 2 1 1 A 36 36 GLN N N 125 123.034 123.725 -0.691 1
1 459 . 2 1 1 A 37 37 PRO HA H 126 4.458 4.655 -0.197 1
1 466 . 2 1 1 A 37 37 PRO C C 126 176.314 176.986 -0.672 1
1 467 . 2 1 1 A 37 37 PRO CA C 126 62.816 62.522 0.294 1
1 468 . 2 1 1 A 37 37 PRO CB C 126 33.070 32.978 0.092 1
1 471 . 2 1 1 A 38 38 GLU H H 127 8.626 8.407 0.219 1
1 472 . 2 1 1 A 38 38 GLU HA H 127 4.274 4.167 0.107 1
1 477 . 2 1 1 A 38 38 GLU C C 127 177.877 176.520 1.357 1
1 478 . 2 1 1 A 38 38 GLU CA C 127 58.730 58.271 0.459 1
1 479 . 2 1 1 A 38 38 GLU CB C 127 30.340 30.079 0.261 1
1 481 . 2 1 1 A 38 38 GLU N N 127 120.691 119.340 1.351 1
1 482 . 2 1 1 A 39 39 LYS H H 128 7.861 7.684 0.177 1
1 483 . 2 1 1 A 39 39 LYS HA H 128 4.889 4.711 0.178 1
1 492 . 2 1 1 A 39 39 LYS C C 128 175.446 174.758 0.688 1
1 493 . 2 1 1 A 39 39 LYS CA C 128 53.670 54.691 -1.021 1
1 494 . 2 1 1 A 39 39 LYS CB C 128 33.630 35.820 -2.190 1
1 498 . 2 1 1 A 39 39 LYS N N 128 117.878 116.578 1.300 1
1 499 . 2 1 1 A 40 40 GLY H H 129 8.426 8.038 0.388 1
1 500 . 2 1 1 A 40 40 GLY HA2 H 129 4.970 3.997 0.973 1
1 501 . 2 1 1 A 40 40 GLY HA3 H 129 2.458 4.136 -1.678 1
1 502 . 2 1 1 A 40 40 GLY C C 129 170.048 172.156 -2.108 1
1 503 . 2 1 1 A 40 40 GLY CA C 129 42.910 44.965 -2.055 1
1 504 . 2 1 1 A 40 40 GLY N N 129 112.604 105.527 7.077 1
1 505 . 2 1 1 A 41 41 ILE H H 130 8.596 8.942 -0.346 1
1 506 . 2 1 1 A 41 41 ILE HA H 130 4.636 5.103 -0.467 1
1 516 . 2 1 1 A 41 41 ILE C C 130 172.691 174.334 -1.643 1
1 517 . 2 1 1 A 41 41 ILE CA C 130 58.500 58.633 -0.133 1
1 518 . 2 1 1 A 41 41 ILE CB C 130 43.320 41.569 1.751 1
1 522 . 2 1 1 A 41 41 ILE N N 130 113.363 115.755 -2.392 1
1 523 . 2 1 1 A 42 42 PHE H H 131 8.994 9.063 -0.069 1
1 524 . 2 1 1 A 42 42 PHE HA H 131 5.075 5.377 -0.302 1
1 532 . 2 1 1 A 42 42 PHE C C 131 175.111 175.389 -0.278 1
1 533 . 2 1 1 A 42 42 PHE CA C 131 58.680 57.202 1.478 1
1 534 . 2 1 1 A 42 42 PHE CB C 131 42.220 40.426 1.794 1
1 538 . 2 1 1 A 42 42 PHE N N 131 125.156 122.175 2.981 1
1 539 . 2 1 1 A 43 43 VAL H H 132 8.399 9.269 -0.870 1
1 540 . 2 1 1 A 43 43 VAL HA H 132 4.920 4.861 0.059 1
1 548 . 2 1 1 A 43 43 VAL C C 132 178.175 175.219 2.956 1
1 549 . 2 1 1 A 43 43 VAL CA C 132 59.600 60.720 -1.120 1
1 550 . 2 1 1 A 43 43 VAL CB C 132 35.920 34.989 0.931 1
1 553 . 2 1 1 A 43 43 VAL N N 132 119.371 122.831 -3.460 1
1 554 . 2 1 1 A 44 44 LYS H H 133 10.041 8.522 1.519 1
1 555 . 2 1 1 A 44 44 LYS HA H 133 4.920 4.551 0.369 1
1 564 . 2 1 1 A 44 44 LYS C C 133 177.195 175.647 1.548 1
1 565 . 2 1 1 A 44 44 LYS CA C 133 57.310 56.494 0.816 1
1 566 . 2 1 1 A 44 44 LYS CB C 133 34.410 32.557 1.853 1
1 570 . 2 1 1 A 44 44 LYS N N 133 130.928 126.705 4.223 1
1 571 . 2 1 1 A 45 45 ASN H H 134 8.534 8.837 -0.303 1
1 572 . 2 1 1 A 45 45 ASN HA H 134 4.151 4.597 -0.446 1
1 577 . 2 1 1 A 45 45 ASN C C 134 174.217 175.181 -0.964 1
1 578 . 2 1 1 A 45 45 ASN CA C 134 55.290 52.501 2.789 1
1 579 . 2 1 1 A 45 45 ASN CB C 134 37.530 38.286 -0.756 1
1 580 . 2 1 1 A 45 45 ASN N N 134 119.452 124.277 -4.825 1
1 582 . 2 1 1 A 46 46 SER H H 135 7.570 7.945 -0.375 1
1 583 . 2 1 1 A 46 46 SER HA H 135 4.220 4.116 0.104 1
1 586 . 2 1 1 A 46 46 SER C C 135 174.490 176.911 -2.421 1
1 587 . 2 1 1 A 46 46 SER CA C 135 57.090 61.554 -4.464 1
1 588 . 2 1 1 A 46 46 SER CB C 135 64.126 62.955 1.171 1
1 589 . 2 1 1 A 46 46 SER N N 135 105.613 121.548 -15.935 1
1 590 . 2 1 1 A 47 47 ASP H H 136 9.113 8.247 0.866 1
1 591 . 2 1 1 A 47 47 ASP HA H 136 4.220 4.317 -0.097 1
1 594 . 2 1 1 A 47 47 ASP CA C 136 57.610 57.045 0.565 1
1 595 . 2 1 1 A 47 47 ASP CB C 136 40.810 40.301 0.509 1
1 596 . 2 1 1 A 47 47 ASP N N 136 120.995 120.862 0.133 1
1 597 . 2 1 1 A 48 48 GLY H H 137 8.172 7.913 0.259 1
1 598 . 2 1 1 A 48 48 GLY HA2 H 137 4.096 3.717 0.379 1
1 599 . 2 1 1 A 48 48 GLY HA3 H 137 3.664 3.727 -0.063 1
1 600 . 2 1 1 A 48 48 GLY C C 137 173.990 175.065 -1.075 1
1 601 . 2 1 1 A 48 48 GLY CA C 137 45.130 47.315 -2.185 1
1 602 . 2 1 1 A 48 48 GLY N N 137 105.838 107.701 -1.863 1
1 603 . 2 1 1 A 49 49 SER H H 138 7.252 7.581 -0.329 1
1 604 . 2 1 1 A 49 49 SER HA H 138 4.503 4.647 -0.144 1
1 607 . 2 1 1 A 49 49 SER C C 138 173.857 173.460 0.397 1
1 608 . 2 1 1 A 49 49 SER CA C 138 57.340 57.194 0.146 1
1 609 . 2 1 1 A 49 49 SER CB C 138 65.370 64.433 0.937 1
1 610 . 2 1 1 A 49 49 SER N N 138 114.942 112.287 2.655 1
1 611 . 2 1 1 A 50 50 ASP H H 139 8.276 7.985 0.291 1
1 612 . 2 1 1 A 50 50 ASP HA H 139 4.618 4.220 0.398 1
1 615 . 2 1 1 A 50 50 ASP C C 139 174.577 175.036 -0.459 1
1 616 . 2 1 1 A 50 50 ASP CA C 139 53.116 55.567 -2.451 1
1 617 . 2 1 1 A 50 50 ASP CB C 139 40.520 39.440 1.080 1
1 618 . 2 1 1 A 50 50 ASP N N 139 122.088 118.119 3.969 1
1 619 . 2 1 1 A 51 51 VAL H H 140 8.192 7.484 0.708 1
1 620 . 2 1 1 A 51 51 VAL HA H 140 4.299 4.247 0.052 1
1 628 . 2 1 1 A 51 51 VAL C C 140 175.867 175.243 0.624 1
1 629 . 2 1 1 A 51 51 VAL CA C 140 62.950 62.008 0.942 1
1 630 . 2 1 1 A 51 51 VAL CB C 140 33.230 32.567 0.663 1
1 632 . 2 1 1 A 51 51 VAL N N 140 121.167 119.230 1.937 1
1 633 . 2 1 1 A 52 52 CYS H H 141 8.391 8.871 -0.480 1
1 634 . 2 1 1 A 52 52 CYS HA H 141 5.247 5.081 0.166 1
1 637 . 2 1 1 A 52 52 CYS C C 141 172.778 174.854 -2.076 1
1 638 . 2 1 1 A 52 52 CYS CA C 141 56.480 58.087 -1.607 1
1 639 . 2 1 1 A 52 52 CYS CB C 141 31.960 28.656 3.304 1
1 640 . 2 1 1 A 52 52 CYS N N 141 121.884 125.379 -3.495 1
1 641 . 2 1 1 A 53 53 THR H H 142 8.777 9.089 -0.312 1
1 642 . 2 1 1 A 53 53 THR HA H 142 4.489 4.957 -0.468 1
1 648 . 2 1 1 A 53 53 THR C C 142 171.885 172.696 -0.811 1
1 649 . 2 1 1 A 53 53 THR CA C 142 62.070 61.474 0.596 1
1 650 . 2 1 1 A 53 53 THR CB C 142 71.390 71.067 0.323 1
1 652 . 2 1 1 A 53 53 THR N N 142 118.132 119.464 -1.332 1
1 653 . 2 1 1 A 54 54 LEU H H 143 8.409 8.524 -0.115 1
1 654 . 2 1 1 A 54 54 LEU HA H 143 4.276 4.695 -0.419 1
1 664 . 2 1 1 A 54 54 LEU C C 143 174.366 174.190 0.176 1
1 665 . 2 1 1 A 54 54 LEU CA C 143 54.330 53.095 1.235 1
1 666 . 2 1 1 A 54 54 LEU CB C 143 42.396 42.903 -0.507 1
1 670 . 2 1 1 A 54 54 LEU N N 143 127.980 128.707 -0.727 1
1 671 . 2 1 1 A 55 55 PHE H H 144 8.646 8.633 0.013 1
1 672 . 2 1 1 A 55 55 PHE HA H 144 5.455 4.778 0.677 1
1 680 . 2 1 1 A 55 55 PHE C C 144 176.054 175.254 0.800 1
1 681 . 2 1 1 A 55 55 PHE CA C 144 55.250 56.954 -1.704 1
1 682 . 2 1 1 A 55 55 PHE CB C 144 44.100 40.602 3.498 1
1 686 . 2 1 1 A 55 55 PHE N N 144 122.010 126.818 -4.808 1
1 687 . 2 1 1 A 56 56 ASP H H 145 11.575 8.290 3.285 1
1 688 . 2 1 1 A 56 56 ASP HA H 145 4.416 4.572 -0.156 1
1 691 . 2 1 1 A 56 56 ASP C C 145 176.748 177.399 -0.651 1
1 692 . 2 1 1 A 56 56 ASP CA C 145 55.840 54.652 1.188 1
1 693 . 2 1 1 A 56 56 ASP CB C 145 44.390 42.122 2.268 1
1 694 . 2 1 1 A 56 56 ASP N N 145 121.936 123.811 -1.875 1
1 695 . 2 1 1 A 57 57 ALA H H 146 8.508 8.658 -0.150 1
1 696 . 2 1 1 A 57 57 ALA HA H 146 3.797 4.008 -0.211 1
1 700 . 2 1 1 A 57 57 ALA C C 146 178.696 179.781 -1.085 1
1 701 . 2 1 1 A 57 57 ALA CA C 146 55.990 55.375 0.615 1
1 702 . 2 1 1 A 57 57 ALA CB C 146 18.840 18.065 0.775 1
1 703 . 2 1 1 A 57 57 ALA N N 146 130.243 129.572 0.671 1
1 704 . 2 1 1 A 58 58 ALA H H 147 8.378 7.512 0.866 1
1 705 . 2 1 1 A 58 58 ALA HA H 147 4.078 4.179 -0.101 1
1 709 . 2 1 1 A 58 58 ALA C C 147 181.091 179.643 1.448 1
1 710 . 2 1 1 A 58 58 ALA CA C 147 54.770 54.984 -0.214 1
1 711 . 2 1 1 A 58 58 ALA CB C 147 17.700 18.308 -0.608 1
1 712 . 2 1 1 A 58 58 ALA N N 147 121.997 119.432 2.565 1
1 713 . 2 1 1 A 59 59 ALA H H 148 9.138 7.847 1.291 1
1 714 . 2 1 1 A 59 59 ALA HA H 148 3.975 4.031 -0.056 1
1 718 . 2 1 1 A 59 59 ALA C C 148 180.508 179.723 0.785 1
1 719 . 2 1 1 A 59 59 ALA CA C 148 54.840 55.165 -0.325 1
1 720 . 2 1 1 A 59 59 ALA CB C 148 18.600 18.601 -0.001 1
1 721 . 2 1 1 A 59 59 ALA N N 148 123.595 120.240 3.355 1
1 722 . 2 1 1 A 60 60 PHE H H 149 8.814 8.096 0.718 1
1 723 . 2 1 1 A 60 60 PHE HA H 149 3.722 4.013 -0.291 1
1 731 . 2 1 1 A 60 60 PHE C C 149 176.773 177.578 -0.805 1
1 732 . 2 1 1 A 60 60 PHE CA C 149 62.030 61.489 0.541 1
1 733 . 2 1 1 A 60 60 PHE CB C 149 39.960 38.771 1.189 1
1 737 . 2 1 1 A 60 60 PHE N N 149 120.354 119.872 0.482 1
1 738 . 2 1 1 A 61 61 SER H H 150 8.276 8.189 0.087 1
1 739 . 2 1 1 A 61 61 SER HA H 150 3.880 4.151 -0.271 1
1 742 . 2 1 1 A 61 61 SER C C 150 177.691 177.304 0.387 1
1 743 . 2 1 1 A 61 61 SER CA C 150 62.190 61.273 0.917 1
1 744 . 2 1 1 A 61 61 SER CB C 150 63.016 63.175 -0.159 1
1 745 . 2 1 1 A 61 61 SER N N 150 112.086 114.085 -1.999 1
1 746 . 2 1 1 A 62 62 ARG H H 151 7.829 7.726 0.103 1
1 747 . 2 1 1 A 62 62 ARG HA H 151 3.971 4.048 -0.077 1
1 754 . 2 1 1 A 62 62 ARG C C 151 178.287 178.641 -0.354 1
1 755 . 2 1 1 A 62 62 ARG CA C 151 59.340 59.237 0.103 1
1 756 . 2 1 1 A 62 62 ARG CB C 151 29.760 29.829 -0.069 1
1 759 . 2 1 1 A 62 62 ARG N N 151 121.090 121.567 -0.477 1
1 760 . 2 1 1 A 63 63 LEU H H 152 7.390 7.671 -0.281 1
1 761 . 2 1 1 A 63 63 LEU HA H 152 3.791 3.928 -0.137 1
1 771 . 2 1 1 A 63 63 LEU C C 152 179.106 179.051 0.055 1
1 772 . 2 1 1 A 63 63 LEU CA C 152 58.900 57.922 0.978 1
1 773 . 2 1 1 A 63 63 LEU CB C 152 41.140 41.395 -0.255 1
1 777 . 2 1 1 A 63 63 LEU N N 152 121.129 119.340 1.789 1
1 778 . 2 1 1 A 64 64 VAL H H 153 7.552 7.964 -0.412 1
1 779 . 2 1 1 A 64 64 VAL HA H 153 3.411 3.542 -0.131 1
1 787 . 2 1 1 A 64 64 VAL C C 153 180.595 178.728 1.867 1
1 788 . 2 1 1 A 64 64 VAL CA C 153 65.644 66.098 -0.454 1
1 789 . 2 1 1 A 64 64 VAL CB C 153 31.410 31.407 0.003 1
1 792 . 2 1 1 A 64 64 VAL N N 153 118.280 118.046 0.234 1
1 793 . 2 1 1 A 65 65 GLY H H 154 8.061 8.326 -0.265 1
1 794 . 2 1 1 A 65 65 GLY HA2 H 154 3.846 3.837 0.009 1
1 795 . 2 1 1 A 65 65 GLY HA3 H 154 3.809 3.839 -0.030 1
1 796 . 2 1 1 A 65 65 GLY C C 154 175.235 174.894 0.341 1
1 797 . 2 1 1 A 65 65 GLY CA C 154 46.630 46.775 -0.145 1
1 798 . 2 1 1 A 65 65 GLY N N 154 108.622 107.990 0.632 1
1 799 . 2 1 1 A 66 66 GLU H H 155 7.528 7.484 0.044 1
1 800 . 2 1 1 A 66 66 GLU HA H 155 4.228 4.382 -0.154 1
1 805 . 2 1 1 A 66 66 GLU C C 155 176.761 176.887 -0.126 1
1 806 . 2 1 1 A 66 66 GLU CA C 155 56.590 55.979 0.611 1
1 807 . 2 1 1 A 66 66 GLU CB C 155 30.490 30.520 -0.030 1
1 809 . 2 1 1 A 66 66 GLU N N 155 118.361 118.205 0.156 1
1 810 . 2 1 1 A 67 67 GLY H H 156 7.884 7.861 0.023 1
1 811 . 2 1 1 A 67 67 GLY HA2 H 156 3.918 3.879 0.039 1
1 812 . 2 1 1 A 67 67 GLY HA3 H 156 3.747 3.891 -0.144 1
1 813 . 2 1 1 A 67 67 GLY C C 156 174.788 174.441 0.347 1
1 814 . 2 1 1 A 67 67 GLY CA C 156 45.890 45.717 0.173 1
1 815 . 2 1 1 A 67 67 GLY N N 156 108.465 109.425 -0.960 1
1 816 . 2 1 1 A 68 68 LEU H H 157 7.332 7.936 -0.604 1
1 817 . 2 1 1 A 68 68 LEU HA H 157 4.361 4.447 -0.086 1
1 827 . 2 1 1 A 68 68 LEU CA C 157 53.060 52.262 0.798 1
1 828 . 2 1 1 A 68 68 LEU CB C 157 41.100 41.767 -0.667 1
1 832 . 2 1 1 A 68 68 LEU N N 157 121.920 121.865 0.055 1
1 833 . 2 1 1 A 69 69 PRO HA H 158 4.485 4.545 -0.060 1
1 840 . 2 1 1 A 69 69 PRO C C 158 174.602 176.212 -1.610 1
1 841 . 2 1 1 A 69 69 PRO CA C 158 61.556 62.266 -0.710 1
1 842 . 2 1 1 A 69 69 PRO CB C 158 32.370 32.549 -0.179 1
1 845 . 2 1 1 A 70 70 HIS H H 159 8.759 8.575 0.184 1
1 846 . 2 1 1 A 70 70 HIS HA H 159 3.947 4.327 -0.380 1
1 852 . 2 1 1 A 70 70 HIS CA C 159 56.250 55.208 1.042 1
1 853 . 2 1 1 A 70 70 HIS CB C 159 32.280 30.788 1.492 1
1 856 . 2 1 1 A 70 70 HIS N N 159 119.423 120.827 -1.404 1
1 857 . 2 1 1 A 71 71 PRO HA H 160 4.424 4.374 0.050 1
1 864 . 2 1 1 A 71 71 PRO C C 160 177.567 178.018 -0.451 1
1 865 . 2 1 1 A 71 71 PRO CA C 160 64.574 64.592 -0.018 1
1 866 . 2 1 1 A 71 71 PRO CB C 160 32.340 32.044 0.296 1
1 869 . 2 1 1 A 72 72 LEU H H 161 10.123 7.564 2.559 1
1 870 . 2 1 1 A 72 72 LEU HA H 161 4.778 4.287 0.491 1
1 880 . 2 1 1 A 72 72 LEU C C 161 178.721 177.602 1.119 1
1 881 . 2 1 1 A 72 72 LEU CA C 161 55.800 57.532 -1.732 1
1 882 . 2 1 1 A 72 72 LEU CB C 161 42.440 43.291 -0.851 1
1 886 . 2 1 1 A 72 72 LEU N N 161 117.374 117.007 0.367 1
1 887 . 2 1 1 A 73 73 THR H H 162 7.523 7.680 -0.157 1
1 888 . 2 1 1 A 73 73 THR HA H 162 4.291 4.676 -0.385 1
1 893 . 2 1 1 A 73 73 THR C C 162 175.557 174.467 1.090 1
1 894 . 2 1 1 A 73 73 THR CA C 162 61.440 62.129 -0.689 1
1 895 . 2 1 1 A 73 73 THR CB C 162 70.500 70.511 -0.011 1
1 897 . 2 1 1 A 73 73 THR N N 162 107.787 112.007 -4.220 1
1 898 . 2 1 1 A 74 74 ARG H H 163 8.361 8.066 0.295 1
1 899 . 2 1 1 A 74 74 ARG HA H 163 3.836 4.286 -0.450 1
1 906 . 2 1 1 A 74 74 ARG C C 163 174.701 175.081 -0.380 1
1 907 . 2 1 1 A 74 74 ARG CA C 163 57.980 57.324 0.656 1
1 908 . 2 1 1 A 74 74 ARG CB C 163 26.770 26.938 -0.168 1
1 911 . 2 1 1 A 74 74 ARG N N 163 115.130 119.335 -4.205 1
1 912 . 2 1 1 A 75 75 GLU H H 164 7.430 8.082 -0.652 1
1 913 . 2 1 1 A 75 75 GLU HA H 164 4.636 4.468 0.168 1
1 918 . 2 1 1 A 75 75 GLU CA C 164 53.699 54.839 -1.140 1
1 919 . 2 1 1 A 75 75 GLU CB C 164 29.550 28.650 0.900 1
1 921 . 2 1 1 A 75 75 GLU N N 164 120.076 118.957 1.119 1
1 922 . 2 1 1 A 76 76 PRO HA H 165 4.272 4.521 -0.249 1
1 929 . 2 1 1 A 76 76 PRO C C 165 176.649 176.969 -0.320 1
1 930 . 2 1 1 A 76 76 PRO CA C 165 63.204 63.130 0.074 1
1 931 . 2 1 1 A 76 76 PRO CB C 165 31.680 31.680 0.000 1
1 934 . 2 1 1 A 77 77 ILE H H 166 8.812 8.244 0.568 1
1 935 . 2 1 1 A 77 77 ILE HA H 166 3.838 4.362 -0.524 1
1 945 . 2 1 1 A 77 77 ILE C C 166 175.235 175.971 -0.736 1
1 946 . 2 1 1 A 77 77 ILE CA C 166 62.816 61.356 1.460 1
1 947 . 2 1 1 A 77 77 ILE CB C 166 37.750 38.757 -1.007 1
1 951 . 2 1 1 A 77 77 ILE N N 166 123.831 124.090 -0.259 1
1 952 . 2 1 1 A 78 78 THR H H 167 6.625 8.543 -1.918 1
1 953 . 2 1 1 A 78 78 THR HA H 167 4.632 5.018 -0.386 1
1 958 . 2 1 1 A 78 78 THR C C 167 174.143 174.056 0.087 1
1 959 . 2 1 1 A 78 78 THR CA C 167 58.750 60.326 -1.576 1
1 960 . 2 1 1 A 78 78 THR CB C 167 71.320 70.753 0.567 1
1 962 . 2 1 1 A 78 78 THR N N 167 115.293 117.379 -2.086 1
1 963 . 2 1 1 A 79 79 ALA H H 168 9.088 8.975 0.113 1
1 964 . 2 1 1 A 79 79 ALA HA H 168 3.916 4.121 -0.205 1
1 968 . 2 1 1 A 79 79 ALA C C 168 179.788 179.822 -0.034 1
1 969 . 2 1 1 A 79 79 ALA CA C 168 55.480 55.034 0.446 1
1 970 . 2 1 1 A 79 79 ALA CB C 168 17.630 18.468 -0.838 1
1 971 . 2 1 1 A 79 79 ALA N N 168 122.102 127.613 -5.511 1
1 972 . 2 1 1 A 80 80 SER H H 169 7.988 7.712 0.276 1
1 973 . 2 1 1 A 80 80 SER HA H 169 4.058 4.152 -0.094 1
1 976 . 2 1 1 A 80 80 SER C C 169 176.029 176.544 -0.515 1
1 977 . 2 1 1 A 80 80 SER CA C 169 60.750 62.296 -1.546 1
1 978 . 2 1 1 A 80 80 SER CB C 169 62.510 63.162 -0.652 1
1 979 . 2 1 1 A 80 80 SER N N 169 109.541 114.811 -5.270 1
1 980 . 2 1 1 A 81 81 ILE H H 170 6.968 7.591 -0.623 1
1 981 . 2 1 1 A 81 81 ILE HA H 170 4.315 4.348 -0.033 1
1 991 . 2 1 1 A 81 81 ILE C C 170 174.242 175.530 -1.288 1
1 992 . 2 1 1 A 81 81 ILE CA C 170 62.296 61.907 0.389 1
1 993 . 2 1 1 A 81 81 ILE CB C 170 37.686 38.284 -0.598 1
1 997 . 2 1 1 A 81 81 ILE N N 170 112.476 113.198 -0.722 1
1 998 . 2 1 1 A 82 82 ILE H H 171 7.345 7.448 -0.103 1
1 999 . 2 1 1 A 82 82 ILE HA H 171 4.339 4.640 -0.301 1
1 1009 . 2 1 1 A 82 82 ILE C C 171 174.999 174.740 0.259 1
1 1010 . 2 1 1 A 82 82 ILE CA C 171 61.150 60.346 0.804 1
1 1011 . 2 1 1 A 82 82 ILE CB C 171 37.230 40.504 -3.274 1
1 1015 . 2 1 1 A 82 82 ILE N N 171 124.260 124.646 -0.386 1
1 1016 . 2 1 1 A 83 83 VAL H H 172 7.923 9.181 -1.258 1
1 1017 . 2 1 1 A 83 83 VAL HA H 172 4.673 5.096 -0.423 1
1 1025 . 2 1 1 A 83 83 VAL C C 172 174.887 175.180 -0.293 1
1 1026 . 2 1 1 A 83 83 VAL CA C 172 59.340 59.051 0.289 1
1 1027 . 2 1 1 A 83 83 VAL CB C 172 34.840 36.152 -1.312 1
1 1030 . 2 1 1 A 83 83 VAL N N 172 120.931 121.979 -1.048 1
1 1031 . 2 1 1 A 84 84 LYS H H 173 8.406 8.351 0.055 1
1 1032 . 2 1 1 A 84 84 LYS HA H 173 4.410 4.842 -0.432 1
1 1041 . 2 1 1 A 84 84 LYS C C 173 178.734 178.389 0.345 1
1 1042 . 2 1 1 A 84 84 LYS CA C 173 56.360 54.879 1.481 1
1 1043 . 2 1 1 A 84 84 LYS CB C 173 33.100 34.078 -0.978 1
1 1047 . 2 1 1 A 84 84 LYS N N 173 121.251 120.976 0.275 1
1 1048 . 2 1 1 A 85 85 HIS H H 174 9.221 9.280 -0.059 1
1 1049 . 2 1 1 A 85 85 HIS HA H 174 4.024 4.070 -0.046 1
1 1053 . 2 1 1 A 85 85 HIS C C 174 177.183 177.233 -0.050 1
1 1054 . 2 1 1 A 85 85 HIS CA C 174 59.460 60.311 -0.851 1
1 1055 . 2 1 1 A 85 85 HIS CB C 174 27.920 30.140 -2.220 1
1 1057 . 2 1 1 A 85 85 HIS N N 174 121.545 123.083 -1.538 1
1 1058 . 2 1 1 A 86 86 GLU H H 175 8.699 8.267 0.432 1
1 1059 . 2 1 1 A 86 86 GLU HA H 175 3.900 3.995 -0.095 1
1 1064 . 2 1 1 A 86 86 GLU C C 175 177.220 178.424 -1.204 1
1 1065 . 2 1 1 A 86 86 GLU CA C 175 58.420 59.082 -0.662 1
1 1066 . 2 1 1 A 86 86 GLU CB C 175 28.690 29.225 -0.535 1
1 1068 . 2 1 1 A 86 86 GLU N N 175 118.011 119.613 -1.602 1
1 1069 . 2 1 1 A 87 87 GLU H H 176 7.621 7.865 -0.244 1
1 1070 . 2 1 1 A 87 87 GLU HA H 176 4.177 4.096 0.081 1
1 1075 . 2 1 1 A 87 87 GLU C C 176 175.222 176.056 -0.834 1
1 1076 . 2 1 1 A 87 87 GLU CA C 176 56.390 58.387 -1.997 1
1 1077 . 2 1 1 A 87 87 GLU CB C 176 30.430 30.007 0.423 1
1 1079 . 2 1 1 A 87 87 GLU N N 176 116.753 118.017 -1.264 1
1 1080 . 2 1 1 A 88 88 CYS H H 177 7.239 7.269 -0.030 1
1 1081 . 2 1 1 A 88 88 CYS HA H 177 5.148 4.883 0.265 1
1 1084 . 2 1 1 A 88 88 CYS C C 177 173.249 173.823 -0.574 1
1 1085 . 2 1 1 A 88 88 CYS CA C 177 57.240 56.738 0.502 1
1 1086 . 2 1 1 A 88 88 CYS CB C 177 31.020 30.751 0.269 1
1 1087 . 2 1 1 A 88 88 CYS N N 177 116.096 115.397 0.699 1
1 1088 . 2 1 1 A 89 89 ILE H H 178 8.912 8.593 0.319 1
1 1089 . 2 1 1 A 89 89 ILE HA H 178 4.580 4.897 -0.317 1
1 1099 . 2 1 1 A 89 89 ILE C C 178 173.386 174.207 -0.821 1
1 1100 . 2 1 1 A 89 89 ILE CA C 178 59.270 59.140 0.130 1
1 1101 . 2 1 1 A 89 89 ILE CB C 178 42.990 41.801 1.189 1
1 1105 . 2 1 1 A 89 89 ILE N N 178 119.490 117.621 1.869 1
1 1106 . 2 1 1 A 90 90 TYR H H 179 9.047 8.543 0.504 1
1 1107 . 2 1 1 A 90 90 TYR HA H 179 3.753 3.883 -0.130 1
1 1112 . 2 1 1 A 90 90 TYR C C 179 173.932 173.921 0.011 1
1 1113 . 2 1 1 A 90 90 TYR CA C 179 59.860 57.285 2.575 1
1 1114 . 2 1 1 A 90 90 TYR CB C 179 37.530 38.643 -1.113 1
1 1116 . 2 1 1 A 90 90 TYR N N 179 126.270 121.843 4.427 1
1 1117 . 2 1 1 A 91 91 ASP H H 180 7.462 8.183 -0.721 1
1 1118 . 2 1 1 A 91 91 ASP HA H 180 4.639 4.858 -0.219 1
1 1121 . 2 1 1 A 91 91 ASP C C 180 175.297 176.002 -0.705 1
1 1122 . 2 1 1 A 91 91 ASP CA C 180 52.496 52.298 0.198 1
1 1123 . 2 1 1 A 91 91 ASP CB C 180 43.380 42.501 0.879 1
1 1124 . 2 1 1 A 91 91 ASP N N 180 129.593 123.103 6.490 1
1 1125 . 2 1 1 A 92 92 ASP H H 181 8.719 8.948 -0.229 1
1 1126 . 2 1 1 A 92 92 ASP HA H 181 4.109 4.282 -0.173 1
1 1129 . 2 1 1 A 92 92 ASP C C 181 177.555 177.472 0.083 1
1 1130 . 2 1 1 A 92 92 ASP CA C 181 56.390 57.545 -1.155 1
1 1131 . 2 1 1 A 92 92 ASP CB C 181 41.330 40.764 0.566 1
1 1132 . 2 1 1 A 92 92 ASP N N 181 125.691 127.815 -2.124 1
1 1133 . 2 1 1 A 93 93 THR H H 182 8.271 7.894 0.377 1
1 1134 . 2 1 1 A 93 93 THR HA H 182 4.036 3.951 0.085 1
1 1139 . 2 1 1 A 93 93 THR C C 182 176.289 176.628 -0.339 1
1 1140 . 2 1 1 A 93 93 THR CA C 182 65.054 64.967 0.087 1
1 1141 . 2 1 1 A 93 93 THR CB C 182 68.560 68.904 -0.344 1
1 1143 . 2 1 1 A 93 93 THR N N 182 114.813 113.921 0.892 1
1 1144 . 2 1 1 A 94 94 ARG H H 183 7.753 7.522 0.231 1
1 1145 . 2 1 1 A 94 94 ARG HA H 183 4.139 4.211 -0.072 1
1 1152 . 2 1 1 A 94 94 ARG C C 183 176.897 176.953 -0.056 1
1 1153 . 2 1 1 A 94 94 ARG CA C 183 55.350 56.371 -1.021 1
1 1154 . 2 1 1 A 94 94 ARG CB C 183 30.930 30.648 0.282 1
1 1157 . 2 1 1 A 94 94 ARG N N 183 120.101 117.904 2.197 1
1 1158 . 2 1 1 A 95 95 GLY H H 184 8.112 8.780 -0.668 1
1 1159 . 2 1 1 A 95 95 GLY HA2 H 184 3.838 3.862 -0.024 1
1 1160 . 2 1 1 A 95 95 GLY HA3 H 184 3.670 3.870 -0.200 1
1 1161 . 2 1 1 A 95 95 GLY C C 184 173.659 173.454 0.205 1
1 1162 . 2 1 1 A 95 95 GLY CA C 184 46.040 45.602 0.438 1
1 1163 . 2 1 1 A 95 95 GLY N N 184 108.106 108.660 -0.554 1
1 1164 . 2 1 1 A 96 96 ASN H H 185 6.833 7.553 -0.720 1
1 1165 . 2 1 1 A 96 96 ASN HA H 185 4.944 5.363 -0.419 1
1 1170 . 2 1 1 A 96 96 ASN C C 185 174.267 174.068 0.199 1
1 1171 . 2 1 1 A 96 96 ASN CA C 185 52.560 51.275 1.285 1
1 1172 . 2 1 1 A 96 96 ASN CB C 185 45.890 42.664 3.226 1
1 1173 . 2 1 1 A 96 96 ASN N N 185 113.392 117.803 -4.411 1
1 1175 . 2 1 1 A 97 97 PHE H H 186 9.108 8.897 0.211 1
1 1176 . 2 1 1 A 97 97 PHE HA H 186 4.782 4.834 -0.052 1
1 1183 . 2 1 1 A 97 97 PHE C C 186 174.862 175.785 -0.923 1
1 1184 . 2 1 1 A 97 97 PHE CA C 186 60.056 59.229 0.827 1
1 1185 . 2 1 1 A 97 97 PHE CB C 186 40.180 39.775 0.405 1
1 1188 . 2 1 1 A 97 97 PHE N N 186 118.741 119.541 -0.800 1
1 1189 . 2 1 1 A 98 98 ILE H H 187 8.933 8.730 0.203 1
1 1190 . 2 1 1 A 98 98 ILE HA H 187 5.458 4.910 0.548 1
1 1200 . 2 1 1 A 98 98 ILE C C 187 176.041 174.991 1.050 1
1 1201 . 2 1 1 A 98 98 ILE CA C 187 57.610 59.121 -1.511 1
1 1202 . 2 1 1 A 98 98 ILE CB C 187 42.070 42.309 -0.239 1
1 1206 . 2 1 1 A 98 98 ILE N N 187 117.857 118.174 -0.317 1
1 1207 . 2 1 1 A 99 99 ILE H H 188 8.284 8.698 -0.414 1
1 1208 . 2 1 1 A 99 99 ILE HA H 188 4.341 4.210 0.131 1
1 1218 . 2 1 1 A 99 99 ILE C C 188 176.413 176.384 0.029 1
1 1219 . 2 1 1 A 99 99 ILE CA C 188 59.190 61.179 -1.989 1
1 1220 . 2 1 1 A 99 99 ILE CB C 188 37.940 38.258 -0.318 1
1 1224 . 2 1 1 A 99 99 ILE N N 188 121.796 122.819 -1.023 1
1 1225 . 2 1 1 A 100 100 LYS H H 189 8.463 8.144 0.319 1
1 1226 . 2 1 1 A 100 100 LYS HA H 189 4.040 4.202 -0.162 1
1 1235 . 2 1 1 A 100 100 LYS C C 189 176.848 177.678 -0.830 1
1 1236 . 2 1 1 A 100 100 LYS CA C 189 57.241 56.488 0.753 1
1 1237 . 2 1 1 A 100 100 LYS CB C 189 33.400 33.212 0.188 1
1 1241 . 2 1 1 A 100 100 LYS N N 189 127.995 124.800 3.195 1
1 1242 . 2 1 1 A 101 101 GLY H H 190 8.346 8.483 -0.137 1
1 1243 . 2 1 1 A 101 101 GLY HA2 H 190 3.947 3.972 -0.025 1
1 1244 . 2 1 1 A 101 101 GLY HA3 H 190 3.813 3.978 -0.165 1
1 1245 . 2 1 1 A 101 101 GLY C C 190 172.902 174.061 -1.159 1
1 1246 . 2 1 1 A 101 101 GLY CA C 190 44.920 45.291 -0.371 1
1 1247 . 2 1 1 A 101 101 GLY N N 190 110.882 112.456 -1.574 1
1 7 . 3 1 1 A 2 2 GLN H H 91 8.786 8.598 0.188 1
1 8 . 3 1 1 A 2 2 GLN HA H 91 4.005 3.981 0.024 1
1 15 . 3 1 1 A 2 2 GLN C C 91 177.270 178.101 -0.831 1
1 16 . 3 1 1 A 2 2 GLN CA C 91 58.220 59.404 -1.184 1
1 17 . 3 1 1 A 2 2 GLN CB C 91 28.650 28.628 0.022 1
1 19 . 3 1 1 A 2 2 GLN N N 91 121.993 125.994 -4.001 1
1 21 . 3 1 1 A 3 3 GLU H H 92 8.430 8.320 0.110 1
1 22 . 3 1 1 A 3 3 GLU HA H 92 4.007 4.102 -0.095 1
1 27 . 3 1 1 A 3 3 GLU C C 92 178.287 178.836 -0.549 1
1 28 . 3 1 1 A 3 3 GLU CA C 92 59.490 59.135 0.355 1
1 29 . 3 1 1 A 3 3 GLU CB C 92 29.506 29.056 0.450 1
1 31 . 3 1 1 A 3 3 GLU N N 92 120.195 118.789 1.406 1
1 32 . 3 1 1 A 4 4 SER H H 93 8.209 7.775 0.434 1
1 33 . 3 1 1 A 4 4 SER HA H 93 4.272 4.264 0.008 1
1 36 . 3 1 1 A 4 4 SER C C 93 177.369 177.560 -0.191 1
1 37 . 3 1 1 A 4 4 SER CA C 93 61.044 61.404 -0.360 1
1 38 . 3 1 1 A 4 4 SER CB C 93 62.950 62.801 0.149 1
1 39 . 3 1 1 A 4 4 SER N N 93 115.524 115.482 0.042 1
1 40 . 3 1 1 A 5 5 ILE H H 94 8.080 7.606 0.474 1
1 41 . 3 1 1 A 5 5 ILE HA H 94 3.530 3.614 -0.084 1
1 51 . 3 1 1 A 5 5 ILE C C 94 177.778 177.839 -0.061 1
1 52 . 3 1 1 A 5 5 ILE CA C 94 65.710 65.302 0.408 1
1 53 . 3 1 1 A 5 5 ILE CB C 94 37.800 37.531 0.269 1
1 57 . 3 1 1 A 5 5 ILE N N 94 124.148 121.871 2.277 1
1 58 . 3 1 1 A 6 6 GLN H H 95 8.374 8.334 0.040 1
1 59 . 3 1 1 A 6 6 GLN HA H 95 4.125 4.007 0.118 1
1 66 . 3 1 1 A 6 6 GLN C C 95 179.726 179.181 0.545 1
1 67 . 3 1 1 A 6 6 GLN CA C 95 59.190 59.154 0.036 1
1 68 . 3 1 1 A 6 6 GLN CB C 95 27.060 28.755 -1.695 1
1 70 . 3 1 1 A 6 6 GLN N N 95 118.257 118.684 -0.427 1
1 72 . 3 1 1 A 7 7 ASN H H 96 8.456 7.934 0.522 1
1 73 . 3 1 1 A 7 7 ASN HA H 96 4.446 4.544 -0.098 1
1 78 . 3 1 1 A 7 7 ASN C C 96 177.257 178.432 -1.175 1
1 79 . 3 1 1 A 7 7 ASN CA C 96 56.020 56.119 -0.099 1
1 80 . 3 1 1 A 7 7 ASN CB C 96 38.126 37.755 0.371 1
1 81 . 3 1 1 A 7 7 ASN N N 96 118.597 118.383 0.214 1
1 83 . 3 1 1 A 8 8 LYS H H 97 7.732 7.475 0.257 1
1 84 . 3 1 1 A 8 8 LYS HA H 97 4.129 4.087 0.042 1
1 93 . 3 1 1 A 8 8 LYS C C 97 179.143 179.741 -0.598 1
1 94 . 3 1 1 A 8 8 LYS CA C 97 59.126 59.572 -0.446 1
1 95 . 3 1 1 A 8 8 LYS CB C 97 32.070 32.207 -0.137 1
1 99 . 3 1 1 A 8 8 LYS N N 97 122.381 118.792 3.589 1
1 100 . 3 1 1 A 9 9 ILE H H 98 8.452 8.366 0.086 1
1 101 . 3 1 1 A 9 9 ILE HA H 98 3.480 3.709 -0.229 1
1 111 . 3 1 1 A 9 9 ILE C C 98 177.406 178.234 -0.828 1
1 112 . 3 1 1 A 9 9 ILE CA C 98 66.430 65.612 0.818 1
1 113 . 3 1 1 A 9 9 ILE CB C 98 37.980 37.824 0.156 1
1 117 . 3 1 1 A 9 9 ILE N N 98 119.950 121.163 -1.213 1
1 118 . 3 1 1 A 10 10 SER H H 99 7.924 8.084 -0.160 1
1 119 . 3 1 1 A 10 10 SER HA H 99 3.983 4.156 -0.173 1
1 122 . 3 1 1 A 10 10 SER C C 99 176.327 176.287 0.040 1
1 123 . 3 1 1 A 10 10 SER CA C 99 61.990 61.445 0.545 1
1 124 . 3 1 1 A 10 10 SER CB C 99 62.790 63.058 -0.268 1
1 125 . 3 1 1 A 10 10 SER N N 99 113.568 116.180 -2.612 1
1 126 . 3 1 1 A 11 11 GLN H H 100 7.832 7.540 0.292 1
1 127 . 3 1 1 A 11 11 GLN HA H 100 4.238 4.258 -0.020 1
1 134 . 3 1 1 A 11 11 GLN C C 100 178.088 176.744 1.344 1
1 135 . 3 1 1 A 11 11 GLN CA C 100 57.900 58.033 -0.133 1
1 136 . 3 1 1 A 11 11 GLN CB C 100 29.790 28.774 1.016 1
1 138 . 3 1 1 A 11 11 GLN N N 100 117.487 119.263 -1.776 1
1 140 . 3 1 1 A 12 12 CYS H H 101 7.920 7.923 -0.003 1
1 141 . 3 1 1 A 12 12 CYS HA H 101 4.657 4.595 0.062 1
1 144 . 3 1 1 A 12 12 CYS C C 101 175.446 174.900 0.546 1
1 145 . 3 1 1 A 12 12 CYS CA C 101 60.654 60.264 0.390 1
1 146 . 3 1 1 A 12 12 CYS CB C 101 29.310 28.849 0.461 1
1 147 . 3 1 1 A 12 12 CYS N N 101 114.221 117.039 -2.818 1
1 148 . 3 1 1 A 13 13 LYS H H 102 8.029 7.301 0.728 1
1 149 . 3 1 1 A 13 13 LYS HA H 102 5.069 4.818 0.251 1
1 158 . 3 1 1 A 13 13 LYS C C 102 174.800 176.385 -1.585 1
1 159 . 3 1 1 A 13 13 LYS CA C 102 56.394 56.113 0.281 1
1 160 . 3 1 1 A 13 13 LYS CB C 102 32.770 33.448 -0.678 1
1 164 . 3 1 1 A 13 13 LYS N N 102 124.129 119.347 4.782 1
1 165 . 3 1 1 A 14 14 PHE H H 103 8.737 8.646 0.091 1
1 166 . 3 1 1 A 14 14 PHE HA H 103 5.059 5.116 -0.057 1
1 174 . 3 1 1 A 14 14 PHE C C 103 173.560 172.198 1.362 1
1 175 . 3 1 1 A 14 14 PHE CA C 103 55.470 55.975 -0.505 1
1 176 . 3 1 1 A 14 14 PHE CB C 103 41.760 40.840 0.920 1
1 180 . 3 1 1 A 14 14 PHE N N 103 118.661 116.631 2.030 1
1 181 . 3 1 1 A 15 15 SER H H 104 8.826 8.634 0.192 1
1 182 . 3 1 1 A 15 15 SER HA H 104 4.602 4.433 0.169 1
1 185 . 3 1 1 A 15 15 SER C C 104 173.795 172.710 1.085 1
1 186 . 3 1 1 A 15 15 SER CA C 104 58.610 57.850 0.760 1
1 187 . 3 1 1 A 15 15 SER CB C 104 62.690 63.054 -0.364 1
1 188 . 3 1 1 A 15 15 SER N N 104 117.781 115.423 2.358 1
1 189 . 3 1 1 A 16 16 VAL H H 105 7.784 8.009 -0.225 1
1 190 . 3 1 1 A 16 16 VAL HA H 105 3.370 3.792 -0.422 1
1 198 . 3 1 1 A 16 16 VAL C C 105 174.987 175.260 -0.273 1
1 199 . 3 1 1 A 16 16 VAL CA C 105 63.580 62.673 0.907 1
1 200 . 3 1 1 A 16 16 VAL CB C 105 31.410 30.578 0.832 1
1 203 . 3 1 1 A 16 16 VAL N N 105 129.075 127.339 1.736 1
1 204 . 3 1 1 A 17 17 CYS H H 106 8.536 8.384 0.152 1
1 205 . 3 1 1 A 17 17 CYS HA H 106 5.011 4.926 0.085 1
1 208 . 3 1 1 A 17 17 CYS CA C 106 55.260 56.419 -1.159 1
1 209 . 3 1 1 A 17 17 CYS CB C 106 28.210 27.904 0.306 1
1 210 . 3 1 1 A 17 17 CYS N N 106 130.045 127.366 2.679 1
1 211 . 3 1 1 A 18 18 PRO HA H 107 3.991 4.321 -0.330 1
1 218 . 3 1 1 A 18 18 PRO C C 107 178.188 178.550 -0.362 1
1 219 . 3 1 1 A 18 18 PRO CA C 107 65.940 65.168 0.772 1
1 220 . 3 1 1 A 18 18 PRO CB C 107 32.000 31.919 0.081 1
1 223 . 3 1 1 A 19 19 GLU H H 108 9.260 9.112 0.148 1
1 224 . 3 1 1 A 19 19 GLU HA H 108 4.119 4.087 0.032 1
1 229 . 3 1 1 A 19 19 GLU C C 108 178.721 178.881 -0.160 1
1 230 . 3 1 1 A 19 19 GLU CA C 108 59.300 59.374 -0.074 1
1 231 . 3 1 1 A 19 19 GLU CB C 108 28.920 28.731 0.189 1
1 233 . 3 1 1 A 19 19 GLU N N 108 118.270 116.443 1.827 1
1 234 . 3 1 1 A 20 20 ARG H H 109 7.672 7.630 0.042 1
1 235 . 3 1 1 A 20 20 ARG HA H 109 4.331 4.127 0.204 1
1 242 . 3 1 1 A 20 20 ARG C C 109 177.977 178.944 -0.967 1
1 243 . 3 1 1 A 20 20 ARG CA C 109 57.350 58.868 -1.518 1
1 244 . 3 1 1 A 20 20 ARG CB C 109 30.820 30.081 0.739 1
1 247 . 3 1 1 A 20 20 ARG N N 109 118.357 119.143 -0.786 1
1 248 . 3 1 1 A 21 21 LEU H H 110 7.601 7.655 -0.054 1
1 249 . 3 1 1 A 21 21 LEU HA H 110 4.380 4.302 0.078 1
1 259 . 3 1 1 A 21 21 LEU C C 110 176.562 176.917 -0.355 1
1 260 . 3 1 1 A 21 21 LEU CA C 110 56.096 55.670 0.426 1
1 261 . 3 1 1 A 21 21 LEU CB C 110 44.016 42.403 1.613 1
1 265 . 3 1 1 A 21 21 LEU N N 110 118.626 118.943 -0.317 1
1 266 . 3 1 1 A 22 22 GLN H H 111 7.750 7.946 -0.196 1
1 267 . 3 1 1 A 22 22 GLN HA H 111 3.870 3.899 -0.029 1
1 274 . 3 1 1 A 22 22 GLN C C 111 173.336 175.298 -1.962 1
1 275 . 3 1 1 A 22 22 GLN CA C 111 56.510 58.294 -1.784 1
1 276 . 3 1 1 A 22 22 GLN CB C 111 26.800 26.484 0.316 1
1 278 . 3 1 1 A 22 22 GLN N N 111 113.926 115.119 -1.193 1
1 280 . 3 1 1 A 23 23 CYS H H 112 7.407 8.126 -0.719 1
1 281 . 3 1 1 A 23 23 CYS HA H 112 4.469 4.446 0.023 1
1 284 . 3 1 1 A 23 23 CYS CA C 112 52.650 58.698 -6.048 1
1 285 . 3 1 1 A 23 23 CYS CB C 112 29.750 27.927 1.823 1
1 286 . 3 1 1 A 23 23 CYS N N 112 112.681 121.404 -8.723 1
1 287 . 3 1 1 A 24 24 PRO HA H 113 4.408 4.499 -0.091 1
1 294 . 3 1 1 A 24 24 PRO C C 113 178.175 177.385 0.790 1
1 295 . 3 1 1 A 24 24 PRO CA C 113 62.040 62.569 -0.529 1
1 296 . 3 1 1 A 24 24 PRO CB C 113 31.920 32.934 -1.014 1
1 299 . 3 1 1 A 25 25 LEU H H 114 8.593 8.415 0.178 1
1 300 . 3 1 1 A 25 25 LEU HA H 114 3.765 3.927 -0.162 1
1 310 . 3 1 1 A 25 25 LEU C C 114 179.950 178.707 1.243 1
1 311 . 3 1 1 A 25 25 LEU CA C 114 57.674 57.937 -0.263 1
1 312 . 3 1 1 A 25 25 LEU CB C 114 40.690 41.312 -0.622 1
1 316 . 3 1 1 A 25 25 LEU N N 114 123.729 123.018 0.711 1
1 317 . 3 1 1 A 26 26 GLU H H 115 9.108 8.585 0.523 1
1 318 . 3 1 1 A 26 26 GLU HA H 115 3.876 4.040 -0.164 1
1 323 . 3 1 1 A 26 26 GLU C C 115 177.505 178.586 -1.081 1
1 324 . 3 1 1 A 26 26 GLU CA C 115 59.410 59.218 0.192 1
1 325 . 3 1 1 A 26 26 GLU CB C 115 28.460 29.488 -1.028 1
1 327 . 3 1 1 A 26 26 GLU N N 115 116.817 117.339 -0.522 1
1 328 . 3 1 1 A 27 27 ALA H H 116 7.360 7.746 -0.386 1
1 329 . 3 1 1 A 27 27 ALA HA H 116 4.408 4.121 0.287 1
1 333 . 3 1 1 A 27 27 ALA C C 116 177.046 177.985 -0.939 1
1 334 . 3 1 1 A 27 27 ALA CA C 116 52.970 54.339 -1.369 1
1 335 . 3 1 1 A 27 27 ALA CB C 116 19.916 18.377 1.539 1
1 336 . 3 1 1 A 27 27 ALA N N 116 118.966 121.040 -2.074 1
1 337 . 3 1 1 A 28 28 ILE H H 117 7.168 7.077 0.091 1
1 338 . 3 1 1 A 28 28 ILE HA H 117 4.432 4.506 -0.074 1
1 348 . 3 1 1 A 28 28 ILE C C 117 172.641 175.509 -2.868 1
1 349 . 3 1 1 A 28 28 ILE CA C 117 59.980 59.693 0.287 1
1 350 . 3 1 1 A 28 28 ILE CB C 117 37.350 37.975 -0.625 1
1 354 . 3 1 1 A 28 28 ILE N N 117 108.913 108.892 0.021 1
1 355 . 3 1 1 A 29 29 GLN H H 118 6.562 7.331 -0.769 1
1 356 . 3 1 1 A 29 29 GLN HA H 118 3.922 4.157 -0.235 1
1 363 . 3 1 1 A 29 29 GLN C C 118 175.049 175.580 -0.531 1
1 364 . 3 1 1 A 29 29 GLN CA C 118 54.596 56.007 -1.411 1
1 365 . 3 1 1 A 29 29 GLN CB C 118 29.570 28.983 0.587 1
1 367 . 3 1 1 A 29 29 GLN N N 118 116.455 123.348 -6.893 1
1 369 . 3 1 1 A 30 30 CYS H H 119 8.138 8.455 -0.317 1
1 370 . 3 1 1 A 30 30 CYS HA H 119 4.580 4.511 0.069 1
1 373 . 3 1 1 A 30 30 CYS CA C 119 57.810 57.296 0.514 1
1 374 . 3 1 1 A 30 30 CYS CB C 119 30.200 28.707 1.493 1
1 375 . 3 1 1 A 30 30 CYS N N 119 134.136 125.297 8.839 1
1 376 . 3 1 1 A 31 31 PRO HA H 120 4.424 4.437 -0.013 1
1 383 . 3 1 1 A 31 31 PRO C C 120 177.431 177.308 0.123 1
1 384 . 3 1 1 A 31 31 PRO CA C 120 64.060 63.972 0.088 1
1 385 . 3 1 1 A 31 31 PRO CB C 120 32.776 32.031 0.745 1
1 388 . 3 1 1 A 32 32 ILE H H 121 11.318 7.355 3.963 1
1 389 . 3 1 1 A 32 32 ILE HA H 121 4.038 4.014 0.024 1
1 399 . 3 1 1 A 32 32 ILE C C 121 178.485 177.839 0.646 1
1 400 . 3 1 1 A 32 32 ILE CA C 121 64.060 63.722 0.338 1
1 401 . 3 1 1 A 32 32 ILE CB C 121 39.340 38.460 0.880 1
1 405 . 3 1 1 A 32 32 ILE N N 121 124.500 117.124 7.376 1
1 406 . 3 1 1 A 33 33 THR H H 122 9.928 7.355 2.573 1
1 407 . 3 1 1 A 33 33 THR HA H 122 4.048 4.371 -0.323 1
1 412 . 3 1 1 A 33 33 THR C C 122 175.793 174.645 1.148 1
1 413 . 3 1 1 A 33 33 THR CA C 122 62.990 61.766 1.224 1
1 414 . 3 1 1 A 33 33 THR CB C 122 70.300 69.976 0.324 1
1 416 . 3 1 1 A 33 33 THR N N 122 115.136 109.185 5.951 1
1 417 . 3 1 1 A 34 34 LEU H H 123 8.439 7.686 0.753 1
1 418 . 3 1 1 A 34 34 LEU HA H 123 3.912 3.832 0.080 1
1 428 . 3 1 1 A 34 34 LEU C C 123 175.495 175.125 0.370 1
1 429 . 3 1 1 A 34 34 LEU CA C 123 56.290 56.241 0.049 1
1 430 . 3 1 1 A 34 34 LEU CB C 123 38.500 39.851 -1.351 1
1 434 . 3 1 1 A 34 34 LEU N N 123 117.230 119.156 -1.926 1
1 435 . 3 1 1 A 35 35 GLU H H 124 7.816 6.969 0.847 1
1 436 . 3 1 1 A 35 35 GLU HA H 124 4.634 4.792 -0.158 1
1 441 . 3 1 1 A 35 35 GLU C C 124 174.838 173.948 0.890 1
1 442 . 3 1 1 A 35 35 GLU CA C 124 53.780 54.768 -0.988 1
1 443 . 3 1 1 A 35 35 GLU CB C 124 33.710 32.394 1.316 1
1 445 . 3 1 1 A 35 35 GLU N N 124 116.577 114.301 2.276 1
1 446 . 3 1 1 A 36 36 GLN H H 125 8.532 8.422 0.110 1
1 447 . 3 1 1 A 36 36 GLN HA H 125 4.958 4.362 0.596 1
1 454 . 3 1 1 A 36 36 GLN CA C 125 53.350 53.511 -0.161 1
1 455 . 3 1 1 A 36 36 GLN CB C 125 29.950 29.341 0.609 1
1 457 . 3 1 1 A 36 36 GLN N N 125 123.034 123.532 -0.498 1
1 459 . 3 1 1 A 37 37 PRO HA H 126 4.458 4.662 -0.204 1
1 466 . 3 1 1 A 37 37 PRO C C 126 176.314 175.873 0.441 1
1 467 . 3 1 1 A 37 37 PRO CA C 126 62.816 62.667 0.149 1
1 468 . 3 1 1 A 37 37 PRO CB C 126 33.070 32.914 0.156 1
1 471 . 3 1 1 A 38 38 GLU H H 127 8.626 8.354 0.272 1
1 472 . 3 1 1 A 38 38 GLU HA H 127 4.274 4.334 -0.060 1
1 477 . 3 1 1 A 38 38 GLU C C 127 177.877 175.946 1.931 1
1 478 . 3 1 1 A 38 38 GLU CA C 127 58.730 56.456 2.274 1
1 479 . 3 1 1 A 38 38 GLU CB C 127 30.340 30.910 -0.570 1
1 481 . 3 1 1 A 38 38 GLU N N 127 120.691 117.379 3.312 1
1 482 . 3 1 1 A 39 39 LYS H H 128 7.861 7.808 0.053 1
1 483 . 3 1 1 A 39 39 LYS HA H 128 4.889 4.959 -0.070 1
1 492 . 3 1 1 A 39 39 LYS C C 128 175.446 175.040 0.406 1
1 493 . 3 1 1 A 39 39 LYS CA C 128 53.670 54.664 -0.994 1
1 494 . 3 1 1 A 39 39 LYS CB C 128 33.630 35.609 -1.979 1
1 498 . 3 1 1 A 39 39 LYS N N 128 117.878 117.353 0.525 1
1 499 . 3 1 1 A 40 40 GLY H H 129 8.426 7.911 0.515 1
1 500 . 3 1 1 A 40 40 GLY HA2 H 129 4.970 4.005 0.965 1
1 501 . 3 1 1 A 40 40 GLY HA3 H 129 2.458 4.142 -1.684 1
1 502 . 3 1 1 A 40 40 GLY C C 129 170.048 172.345 -2.297 1
1 503 . 3 1 1 A 40 40 GLY CA C 129 42.910 45.008 -2.098 1
1 504 . 3 1 1 A 40 40 GLY N N 129 112.604 106.958 5.646 1
1 505 . 3 1 1 A 41 41 ILE H H 130 8.596 8.987 -0.391 1
1 506 . 3 1 1 A 41 41 ILE HA H 130 4.636 5.044 -0.408 1
1 516 . 3 1 1 A 41 41 ILE C C 130 172.691 174.327 -1.636 1
1 517 . 3 1 1 A 41 41 ILE CA C 130 58.500 58.712 -0.212 1
1 518 . 3 1 1 A 41 41 ILE CB C 130 43.320 40.680 2.640 1
1 522 . 3 1 1 A 41 41 ILE N N 130 113.363 117.378 -4.015 1
1 523 . 3 1 1 A 42 42 PHE H H 131 8.994 8.909 0.085 1
1 524 . 3 1 1 A 42 42 PHE HA H 131 5.075 5.424 -0.349 1
1 532 . 3 1 1 A 42 42 PHE C C 131 175.111 174.973 0.138 1
1 533 . 3 1 1 A 42 42 PHE CA C 131 58.680 57.128 1.552 1
1 534 . 3 1 1 A 42 42 PHE CB C 131 42.220 40.407 1.813 1
1 538 . 3 1 1 A 42 42 PHE N N 131 125.156 121.927 3.229 1
1 539 . 3 1 1 A 43 43 VAL H H 132 8.399 9.397 -0.998 1
1 540 . 3 1 1 A 43 43 VAL HA H 132 4.920 4.728 0.192 1
1 548 . 3 1 1 A 43 43 VAL C C 132 178.175 175.355 2.820 1
1 549 . 3 1 1 A 43 43 VAL CA C 132 59.600 60.855 -1.255 1
1 550 . 3 1 1 A 43 43 VAL CB C 132 35.920 34.706 1.214 1
1 553 . 3 1 1 A 43 43 VAL N N 132 119.371 123.167 -3.796 1
1 554 . 3 1 1 A 44 44 LYS H H 133 10.041 8.429 1.612 1
1 555 . 3 1 1 A 44 44 LYS HA H 133 4.920 4.306 0.614 1
1 564 . 3 1 1 A 44 44 LYS C C 133 177.195 175.488 1.707 1
1 565 . 3 1 1 A 44 44 LYS CA C 133 57.310 56.475 0.835 1
1 566 . 3 1 1 A 44 44 LYS CB C 133 34.410 32.544 1.866 1
1 570 . 3 1 1 A 44 44 LYS N N 133 130.928 126.824 4.104 1
1 571 . 3 1 1 A 45 45 ASN H H 134 8.534 8.791 -0.257 1
1 572 . 3 1 1 A 45 45 ASN HA H 134 4.151 4.739 -0.588 1
1 577 . 3 1 1 A 45 45 ASN C C 134 174.217 175.291 -1.074 1
1 578 . 3 1 1 A 45 45 ASN CA C 134 55.290 52.486 2.804 1
1 579 . 3 1 1 A 45 45 ASN CB C 134 37.530 38.175 -0.645 1
1 580 . 3 1 1 A 45 45 ASN N N 134 119.452 124.309 -4.857 1
1 582 . 3 1 1 A 46 46 SER H H 135 7.570 8.031 -0.461 1
1 583 . 3 1 1 A 46 46 SER HA H 135 4.220 4.106 0.114 1
1 586 . 3 1 1 A 46 46 SER C C 135 174.490 176.673 -2.183 1
1 587 . 3 1 1 A 46 46 SER CA C 135 57.090 61.237 -4.147 1
1 588 . 3 1 1 A 46 46 SER CB C 135 64.126 63.156 0.970 1
1 589 . 3 1 1 A 46 46 SER N N 135 105.613 121.553 -15.940 1
1 590 . 3 1 1 A 47 47 ASP H H 136 9.113 7.983 1.130 1
1 591 . 3 1 1 A 47 47 ASP HA H 136 4.220 4.324 -0.104 1
1 594 . 3 1 1 A 47 47 ASP CA C 136 57.610 57.046 0.564 1
1 595 . 3 1 1 A 47 47 ASP CB C 136 40.810 40.401 0.409 1
1 596 . 3 1 1 A 47 47 ASP N N 136 120.995 121.286 -0.291 1
1 597 . 3 1 1 A 48 48 GLY H H 137 8.172 8.061 0.111 1
1 598 . 3 1 1 A 48 48 GLY HA2 H 137 4.096 3.847 0.249 1
1 599 . 3 1 1 A 48 48 GLY HA3 H 137 3.664 3.856 -0.192 1
1 600 . 3 1 1 A 48 48 GLY C C 137 173.990 175.482 -1.492 1
1 601 . 3 1 1 A 48 48 GLY CA C 137 45.130 47.523 -2.393 1
1 602 . 3 1 1 A 48 48 GLY N N 137 105.838 107.382 -1.544 1
1 603 . 3 1 1 A 49 49 SER H H 138 7.252 7.439 -0.187 1
1 604 . 3 1 1 A 49 49 SER HA H 138 4.503 4.726 -0.223 1
1 607 . 3 1 1 A 49 49 SER C C 138 173.857 173.308 0.549 1
1 608 . 3 1 1 A 49 49 SER CA C 138 57.340 57.396 -0.056 1
1 609 . 3 1 1 A 49 49 SER CB C 138 65.370 63.529 1.841 1
1 610 . 3 1 1 A 49 49 SER N N 138 114.942 111.775 3.167 1
1 611 . 3 1 1 A 50 50 ASP H H 139 8.276 7.932 0.344 1
1 612 . 3 1 1 A 50 50 ASP HA H 139 4.618 4.269 0.349 1
1 615 . 3 1 1 A 50 50 ASP C C 139 174.577 174.968 -0.391 1
1 616 . 3 1 1 A 50 50 ASP CA C 139 53.116 55.416 -2.300 1
1 617 . 3 1 1 A 50 50 ASP CB C 139 40.520 40.532 -0.012 1
1 618 . 3 1 1 A 50 50 ASP N N 139 122.088 120.530 1.558 1
1 619 . 3 1 1 A 51 51 VAL H H 140 8.192 7.541 0.651 1
1 620 . 3 1 1 A 51 51 VAL HA H 140 4.299 4.073 0.226 1
1 628 . 3 1 1 A 51 51 VAL C C 140 175.867 175.068 0.799 1
1 629 . 3 1 1 A 51 51 VAL CA C 140 62.950 62.752 0.198 1
1 630 . 3 1 1 A 51 51 VAL CB C 140 33.230 31.907 1.323 1
1 632 . 3 1 1 A 51 51 VAL N N 140 121.167 120.113 1.054 1
1 633 . 3 1 1 A 52 52 CYS H H 141 8.391 8.748 -0.357 1
1 634 . 3 1 1 A 52 52 CYS HA H 141 5.247 5.081 0.166 1
1 637 . 3 1 1 A 52 52 CYS C C 141 172.778 174.235 -1.457 1
1 638 . 3 1 1 A 52 52 CYS CA C 141 56.480 58.463 -1.983 1
1 639 . 3 1 1 A 52 52 CYS CB C 141 31.960 29.132 2.828 1
1 640 . 3 1 1 A 52 52 CYS N N 141 121.884 127.408 -5.524 1
1 641 . 3 1 1 A 53 53 THR H H 142 8.777 8.985 -0.208 1
1 642 . 3 1 1 A 53 53 THR HA H 142 4.489 5.092 -0.603 1
1 648 . 3 1 1 A 53 53 THR C C 142 171.885 173.003 -1.118 1
1 649 . 3 1 1 A 53 53 THR CA C 142 62.070 61.659 0.411 1
1 650 . 3 1 1 A 53 53 THR CB C 142 71.390 70.911 0.479 1
1 652 . 3 1 1 A 53 53 THR N N 142 118.132 121.005 -2.873 1
1 653 . 3 1 1 A 54 54 LEU H H 143 8.409 8.698 -0.289 1
1 654 . 3 1 1 A 54 54 LEU HA H 143 4.276 4.651 -0.375 1
1 664 . 3 1 1 A 54 54 LEU C C 143 174.366 174.493 -0.127 1
1 665 . 3 1 1 A 54 54 LEU CA C 143 54.330 53.309 1.021 1
1 666 . 3 1 1 A 54 54 LEU CB C 143 42.396 42.916 -0.520 1
1 670 . 3 1 1 A 54 54 LEU N N 143 127.980 129.325 -1.345 1
1 671 . 3 1 1 A 55 55 PHE H H 144 8.646 8.901 -0.255 1
1 672 . 3 1 1 A 55 55 PHE HA H 144 5.455 4.767 0.688 1
1 680 . 3 1 1 A 55 55 PHE C C 144 176.054 175.363 0.691 1
1 681 . 3 1 1 A 55 55 PHE CA C 144 55.250 57.276 -2.026 1
1 682 . 3 1 1 A 55 55 PHE CB C 144 44.100 41.222 2.878 1
1 686 . 3 1 1 A 55 55 PHE N N 144 122.010 126.891 -4.881 1
1 687 . 3 1 1 A 56 56 ASP H H 145 11.575 8.266 3.309 1
1 688 . 3 1 1 A 56 56 ASP HA H 145 4.416 4.507 -0.091 1
1 691 . 3 1 1 A 56 56 ASP C C 145 176.748 177.620 -0.872 1
1 692 . 3 1 1 A 56 56 ASP CA C 145 55.840 54.474 1.366 1
1 693 . 3 1 1 A 56 56 ASP CB C 145 44.390 42.748 1.642 1
1 694 . 3 1 1 A 56 56 ASP N N 145 121.936 122.690 -0.754 1
1 695 . 3 1 1 A 57 57 ALA H H 146 8.508 8.901 -0.393 1
1 696 . 3 1 1 A 57 57 ALA HA H 146 3.797 4.021 -0.224 1
1 700 . 3 1 1 A 57 57 ALA C C 146 178.696 179.653 -0.957 1
1 701 . 3 1 1 A 57 57 ALA CA C 146 55.990 55.298 0.692 1
1 702 . 3 1 1 A 57 57 ALA CB C 146 18.840 18.200 0.640 1
1 703 . 3 1 1 A 57 57 ALA N N 146 130.243 128.819 1.424 1
1 704 . 3 1 1 A 58 58 ALA H H 147 8.378 7.638 0.740 1
1 705 . 3 1 1 A 58 58 ALA HA H 147 4.078 4.199 -0.121 1
1 709 . 3 1 1 A 58 58 ALA C C 147 181.091 179.700 1.391 1
1 710 . 3 1 1 A 58 58 ALA CA C 147 54.770 54.713 0.057 1
1 711 . 3 1 1 A 58 58 ALA CB C 147 17.700 18.527 -0.827 1
1 712 . 3 1 1 A 58 58 ALA N N 147 121.997 119.528 2.469 1
1 713 . 3 1 1 A 59 59 ALA H H 148 9.138 7.986 1.152 1
1 714 . 3 1 1 A 59 59 ALA HA H 148 3.975 4.078 -0.103 1
1 718 . 3 1 1 A 59 59 ALA C C 148 180.508 179.599 0.909 1
1 719 . 3 1 1 A 59 59 ALA CA C 148 54.840 55.070 -0.230 1
1 720 . 3 1 1 A 59 59 ALA CB C 148 18.600 18.672 -0.072 1
1 721 . 3 1 1 A 59 59 ALA N N 148 123.595 120.186 3.409 1
1 722 . 3 1 1 A 60 60 PHE H H 149 8.814 8.030 0.784 1
1 723 . 3 1 1 A 60 60 PHE HA H 149 3.722 4.062 -0.340 1
1 731 . 3 1 1 A 60 60 PHE C C 149 176.773 177.432 -0.659 1
1 732 . 3 1 1 A 60 60 PHE CA C 149 62.030 61.486 0.544 1
1 733 . 3 1 1 A 60 60 PHE CB C 149 39.960 38.786 1.174 1
1 737 . 3 1 1 A 60 60 PHE N N 149 120.354 119.984 0.370 1
1 738 . 3 1 1 A 61 61 SER H H 150 8.276 8.165 0.111 1
1 739 . 3 1 1 A 61 61 SER HA H 150 3.880 4.060 -0.180 1
1 742 . 3 1 1 A 61 61 SER C C 150 177.691 177.387 0.304 1
1 743 . 3 1 1 A 61 61 SER CA C 150 62.190 61.535 0.655 1
1 744 . 3 1 1 A 61 61 SER CB C 150 63.016 63.037 -0.021 1
1 745 . 3 1 1 A 61 61 SER N N 150 112.086 113.708 -1.622 1
1 746 . 3 1 1 A 62 62 ARG H H 151 7.829 7.719 0.110 1
1 747 . 3 1 1 A 62 62 ARG HA H 151 3.971 4.000 -0.029 1
1 754 . 3 1 1 A 62 62 ARG C C 151 178.287 178.656 -0.369 1
1 755 . 3 1 1 A 62 62 ARG CA C 151 59.340 59.316 0.024 1
1 756 . 3 1 1 A 62 62 ARG CB C 151 29.760 29.889 -0.129 1
1 759 . 3 1 1 A 62 62 ARG N N 151 121.090 121.178 -0.088 1
1 760 . 3 1 1 A 63 63 LEU H H 152 7.390 7.684 -0.294 1
1 761 . 3 1 1 A 63 63 LEU HA H 152 3.791 3.917 -0.126 1
1 771 . 3 1 1 A 63 63 LEU C C 152 179.106 178.855 0.251 1
1 772 . 3 1 1 A 63 63 LEU CA C 152 58.900 57.866 1.034 1
1 773 . 3 1 1 A 63 63 LEU CB C 152 41.140 41.398 -0.258 1
1 777 . 3 1 1 A 63 63 LEU N N 152 121.129 119.421 1.708 1
1 778 . 3 1 1 A 64 64 VAL H H 153 7.552 7.970 -0.418 1
1 779 . 3 1 1 A 64 64 VAL HA H 153 3.411 3.475 -0.064 1
1 787 . 3 1 1 A 64 64 VAL C C 153 180.595 178.461 2.134 1
1 788 . 3 1 1 A 64 64 VAL CA C 153 65.644 66.517 -0.873 1
1 789 . 3 1 1 A 64 64 VAL CB C 153 31.410 31.392 0.018 1
1 792 . 3 1 1 A 64 64 VAL N N 153 118.280 119.008 -0.728 1
1 793 . 3 1 1 A 65 65 GLY H H 154 8.061 8.068 -0.007 1
1 794 . 3 1 1 A 65 65 GLY HA2 H 154 3.846 3.801 0.045 1
1 795 . 3 1 1 A 65 65 GLY HA3 H 154 3.809 3.802 0.007 1
1 796 . 3 1 1 A 65 65 GLY C C 154 175.235 175.717 -0.482 1
1 797 . 3 1 1 A 65 65 GLY CA C 154 46.630 46.813 -0.183 1
1 798 . 3 1 1 A 65 65 GLY N N 154 108.622 107.646 0.976 1
1 799 . 3 1 1 A 66 66 GLU H H 155 7.528 7.550 -0.022 1
1 800 . 3 1 1 A 66 66 GLU HA H 155 4.228 4.332 -0.104 1
1 805 . 3 1 1 A 66 66 GLU C C 155 176.761 176.877 -0.116 1
1 806 . 3 1 1 A 66 66 GLU CA C 155 56.590 56.331 0.259 1
1 807 . 3 1 1 A 66 66 GLU CB C 155 30.490 30.269 0.221 1
1 809 . 3 1 1 A 66 66 GLU N N 155 118.361 118.867 -0.506 1
1 810 . 3 1 1 A 67 67 GLY H H 156 7.884 7.856 0.028 1
1 811 . 3 1 1 A 67 67 GLY HA2 H 156 3.918 3.859 0.059 1
1 812 . 3 1 1 A 67 67 GLY HA3 H 156 3.747 3.869 -0.122 1
1 813 . 3 1 1 A 67 67 GLY C C 156 174.788 174.672 0.116 1
1 814 . 3 1 1 A 67 67 GLY CA C 156 45.890 45.723 0.167 1
1 815 . 3 1 1 A 67 67 GLY N N 156 108.465 109.127 -0.662 1
1 816 . 3 1 1 A 68 68 LEU H H 157 7.332 8.140 -0.808 1
1 817 . 3 1 1 A 68 68 LEU HA H 157 4.361 4.589 -0.228 1
1 827 . 3 1 1 A 68 68 LEU CA C 157 53.060 52.523 0.537 1
1 828 . 3 1 1 A 68 68 LEU CB C 157 41.100 41.267 -0.167 1
1 832 . 3 1 1 A 68 68 LEU N N 157 121.920 121.605 0.315 1
1 833 . 3 1 1 A 69 69 PRO HA H 158 4.485 4.587 -0.102 1
1 840 . 3 1 1 A 69 69 PRO C C 158 174.602 176.203 -1.601 1
1 841 . 3 1 1 A 69 69 PRO CA C 158 61.556 62.235 -0.679 1
1 842 . 3 1 1 A 69 69 PRO CB C 158 32.370 32.832 -0.462 1
1 845 . 3 1 1 A 70 70 HIS H H 159 8.759 8.678 0.081 1
1 846 . 3 1 1 A 70 70 HIS HA H 159 3.947 4.516 -0.569 1
1 852 . 3 1 1 A 70 70 HIS CA C 159 56.250 55.155 1.095 1
1 853 . 3 1 1 A 70 70 HIS CB C 159 32.280 31.089 1.191 1
1 856 . 3 1 1 A 70 70 HIS N N 159 119.423 120.554 -1.131 1
1 857 . 3 1 1 A 71 71 PRO HA H 160 4.424 4.303 0.121 1
1 864 . 3 1 1 A 71 71 PRO C C 160 177.567 178.291 -0.724 1
1 865 . 3 1 1 A 71 71 PRO CA C 160 64.574 64.762 -0.188 1
1 866 . 3 1 1 A 71 71 PRO CB C 160 32.340 32.022 0.318 1
1 869 . 3 1 1 A 72 72 LEU H H 161 10.123 7.683 2.440 1
1 870 . 3 1 1 A 72 72 LEU HA H 161 4.778 4.265 0.513 1
1 880 . 3 1 1 A 72 72 LEU C C 161 178.721 177.980 0.741 1
1 881 . 3 1 1 A 72 72 LEU CA C 161 55.800 56.962 -1.162 1
1 882 . 3 1 1 A 72 72 LEU CB C 161 42.440 42.513 -0.073 1
1 886 . 3 1 1 A 72 72 LEU N N 161 117.374 117.123 0.251 1
1 887 . 3 1 1 A 73 73 THR H H 162 7.523 7.903 -0.380 1
1 888 . 3 1 1 A 73 73 THR HA H 162 4.291 4.545 -0.254 1
1 893 . 3 1 1 A 73 73 THR C C 162 175.557 174.330 1.227 1
1 894 . 3 1 1 A 73 73 THR CA C 162 61.440 62.138 -0.698 1
1 895 . 3 1 1 A 73 73 THR CB C 162 70.500 69.584 0.916 1
1 897 . 3 1 1 A 73 73 THR N N 162 107.787 111.351 -3.564 1
1 898 . 3 1 1 A 74 74 ARG H H 163 8.361 7.967 0.394 1
1 899 . 3 1 1 A 74 74 ARG HA H 163 3.836 4.301 -0.465 1
1 906 . 3 1 1 A 74 74 ARG C C 163 174.701 175.102 -0.401 1
1 907 . 3 1 1 A 74 74 ARG CA C 163 57.980 57.518 0.462 1
1 908 . 3 1 1 A 74 74 ARG CB C 163 26.770 26.942 -0.172 1
1 911 . 3 1 1 A 74 74 ARG N N 163 115.130 118.390 -3.260 1
1 912 . 3 1 1 A 75 75 GLU H H 164 7.430 8.100 -0.670 1
1 913 . 3 1 1 A 75 75 GLU HA H 164 4.636 4.493 0.143 1
1 918 . 3 1 1 A 75 75 GLU CA C 164 53.699 54.783 -1.084 1
1 919 . 3 1 1 A 75 75 GLU CB C 164 29.550 28.827 0.723 1
1 921 . 3 1 1 A 75 75 GLU N N 164 120.076 118.970 1.106 1
1 922 . 3 1 1 A 76 76 PRO HA H 165 4.272 4.599 -0.327 1
1 929 . 3 1 1 A 76 76 PRO C C 165 176.649 177.046 -0.397 1
1 930 . 3 1 1 A 76 76 PRO CA C 165 63.204 62.953 0.251 1
1 931 . 3 1 1 A 76 76 PRO CB C 165 31.680 31.700 -0.020 1
1 934 . 3 1 1 A 77 77 ILE H H 166 8.812 8.238 0.574 1
1 935 . 3 1 1 A 77 77 ILE HA H 166 3.838 4.297 -0.459 1
1 945 . 3 1 1 A 77 77 ILE C C 166 175.235 176.268 -1.033 1
1 946 . 3 1 1 A 77 77 ILE CA C 166 62.816 61.361 1.455 1
1 947 . 3 1 1 A 77 77 ILE CB C 166 37.750 37.911 -0.161 1
1 951 . 3 1 1 A 77 77 ILE N N 166 123.831 124.157 -0.326 1
1 952 . 3 1 1 A 78 78 THR H H 167 6.625 8.592 -1.967 1
1 953 . 3 1 1 A 78 78 THR HA H 167 4.632 4.995 -0.363 1
1 958 . 3 1 1 A 78 78 THR C C 167 174.143 173.933 0.210 1
1 959 . 3 1 1 A 78 78 THR CA C 167 58.750 60.244 -1.494 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 167 115.293 117.994 -2.701 1
1 963 . 3 1 1 A 79 79 ALA H H 168 9.088 8.963 0.125 1
1 964 . 3 1 1 A 79 79 ALA HA H 168 3.916 4.153 -0.237 1
1 968 . 3 1 1 A 79 79 ALA C C 168 179.788 179.349 0.439 1
1 969 . 3 1 1 A 79 79 ALA CA C 168 55.480 54.772 0.708 1
1 970 . 3 1 1 A 79 79 ALA CB C 168 17.630 18.485 -0.855 1
1 971 . 3 1 1 A 79 79 ALA N N 168 122.102 127.561 -5.459 1
1 972 . 3 1 1 A 80 80 SER H H 169 7.988 7.463 0.525 1
1 973 . 3 1 1 A 80 80 SER HA H 169 4.058 4.203 -0.145 1
1 976 . 3 1 1 A 80 80 SER C C 169 176.029 176.626 -0.597 1
1 977 . 3 1 1 A 80 80 SER CA C 169 60.750 61.480 -0.730 1
1 978 . 3 1 1 A 80 80 SER CB C 169 62.510 62.896 -0.386 1
1 979 . 3 1 1 A 80 80 SER N N 169 109.541 112.876 -3.335 1
1 980 . 3 1 1 A 81 81 ILE H H 170 6.968 7.557 -0.589 1
1 981 . 3 1 1 A 81 81 ILE HA H 170 4.315 4.323 -0.008 1
1 991 . 3 1 1 A 81 81 ILE C C 170 174.242 175.215 -0.973 1
1 992 . 3 1 1 A 81 81 ILE CA C 170 62.296 61.705 0.591 1
1 993 . 3 1 1 A 81 81 ILE CB C 170 37.686 38.176 -0.490 1
1 997 . 3 1 1 A 81 81 ILE N N 170 112.476 112.761 -0.285 1
1 998 . 3 1 1 A 82 82 ILE H H 171 7.345 7.439 -0.094 1
1 999 . 3 1 1 A 82 82 ILE HA H 171 4.339 4.708 -0.369 1
1 1009 . 3 1 1 A 82 82 ILE C C 171 174.999 174.646 0.353 1
1 1010 . 3 1 1 A 82 82 ILE CA C 171 61.150 59.837 1.313 1
1 1011 . 3 1 1 A 82 82 ILE CB C 171 37.230 40.917 -3.687 1
1 1015 . 3 1 1 A 82 82 ILE N N 171 124.260 124.448 -0.188 1
1 1016 . 3 1 1 A 83 83 VAL H H 172 7.923 9.026 -1.103 1
1 1017 . 3 1 1 A 83 83 VAL HA H 172 4.673 4.971 -0.298 1
1 1025 . 3 1 1 A 83 83 VAL C C 172 174.887 175.383 -0.496 1
1 1026 . 3 1 1 A 83 83 VAL CA C 172 59.340 58.657 0.683 1
1 1027 . 3 1 1 A 83 83 VAL CB C 172 34.840 35.391 -0.551 1
1 1030 . 3 1 1 A 83 83 VAL N N 172 120.931 122.368 -1.437 1
1 1031 . 3 1 1 A 84 84 LYS H H 173 8.406 8.757 -0.351 1
1 1032 . 3 1 1 A 84 84 LYS HA H 173 4.410 4.298 0.112 1
1 1041 . 3 1 1 A 84 84 LYS C C 173 178.734 178.078 0.656 1
1 1042 . 3 1 1 A 84 84 LYS CA C 173 56.360 56.426 -0.066 1
1 1043 . 3 1 1 A 84 84 LYS CB C 173 33.100 32.433 0.667 1
1 1047 . 3 1 1 A 84 84 LYS N N 173 121.251 122.563 -1.312 1
1 1048 . 3 1 1 A 85 85 HIS H H 174 9.221 8.817 0.404 1
1 1049 . 3 1 1 A 85 85 HIS HA H 174 4.024 4.488 -0.464 1
1 1053 . 3 1 1 A 85 85 HIS C C 174 177.183 176.819 0.364 1
1 1054 . 3 1 1 A 85 85 HIS CA C 174 59.460 59.237 0.223 1
1 1055 . 3 1 1 A 85 85 HIS CB C 174 27.920 29.439 -1.519 1
1 1057 . 3 1 1 A 85 85 HIS N N 174 121.545 121.155 0.390 1
1 1058 . 3 1 1 A 86 86 GLU H H 175 8.699 8.619 0.080 1
1 1059 . 3 1 1 A 86 86 GLU HA H 175 3.900 3.982 -0.082 1
1 1064 . 3 1 1 A 86 86 GLU C C 175 177.220 177.507 -0.287 1
1 1065 . 3 1 1 A 86 86 GLU CA C 175 58.420 58.802 -0.382 1
1 1066 . 3 1 1 A 86 86 GLU CB C 175 28.690 28.597 0.093 1
1 1068 . 3 1 1 A 86 86 GLU N N 175 118.011 119.830 -1.819 1
1 1069 . 3 1 1 A 87 87 GLU H H 176 7.621 7.619 0.002 1
1 1070 . 3 1 1 A 87 87 GLU HA H 176 4.177 4.367 -0.190 1
1 1075 . 3 1 1 A 87 87 GLU C C 176 175.222 175.348 -0.126 1
1 1076 . 3 1 1 A 87 87 GLU CA C 176 56.390 56.452 -0.062 1
1 1077 . 3 1 1 A 87 87 GLU CB C 176 30.430 30.295 0.135 1
1 1079 . 3 1 1 A 87 87 GLU N N 176 116.753 117.534 -0.781 1
1 1080 . 3 1 1 A 88 88 CYS H H 177 7.239 7.655 -0.416 1
1 1081 . 3 1 1 A 88 88 CYS HA H 177 5.148 5.164 -0.016 1
1 1084 . 3 1 1 A 88 88 CYS C C 177 173.249 173.025 0.224 1
1 1085 . 3 1 1 A 88 88 CYS CA C 177 57.240 57.251 -0.011 1
1 1086 . 3 1 1 A 88 88 CYS CB C 177 31.020 30.945 0.075 1
1 1087 . 3 1 1 A 88 88 CYS N N 177 116.096 116.203 -0.107 1
1 1088 . 3 1 1 A 89 89 ILE H H 178 8.912 8.604 0.308 1
1 1089 . 3 1 1 A 89 89 ILE HA H 178 4.580 5.070 -0.490 1
1 1099 . 3 1 1 A 89 89 ILE C C 178 173.386 174.345 -0.959 1
1 1100 . 3 1 1 A 89 89 ILE CA C 178 59.270 59.109 0.161 1
1 1101 . 3 1 1 A 89 89 ILE CB C 178 42.990 41.819 1.171 1
1 1105 . 3 1 1 A 89 89 ILE N N 178 119.490 119.854 -0.364 1
1 1106 . 3 1 1 A 90 90 TYR H H 179 9.047 8.696 0.351 1
1 1107 . 3 1 1 A 90 90 TYR HA H 179 3.753 4.247 -0.494 1
1 1112 . 3 1 1 A 90 90 TYR C C 179 173.932 174.146 -0.214 1
1 1113 . 3 1 1 A 90 90 TYR CA C 179 59.860 57.308 2.552 1
1 1114 . 3 1 1 A 90 90 TYR CB C 179 37.530 38.674 -1.144 1
1 1116 . 3 1 1 A 90 90 TYR N N 179 126.270 122.311 3.959 1
1 1117 . 3 1 1 A 91 91 ASP H H 180 7.462 8.320 -0.858 1
1 1118 . 3 1 1 A 91 91 ASP HA H 180 4.639 4.898 -0.259 1
1 1121 . 3 1 1 A 91 91 ASP C C 180 175.297 176.197 -0.900 1
1 1122 . 3 1 1 A 91 91 ASP CA C 180 52.496 52.481 0.015 1
1 1123 . 3 1 1 A 91 91 ASP CB C 180 43.380 42.991 0.389 1
1 1124 . 3 1 1 A 91 91 ASP N N 180 129.593 122.622 6.971 1
1 1125 . 3 1 1 A 92 92 ASP H H 181 8.719 8.841 -0.122 1
1 1126 . 3 1 1 A 92 92 ASP HA H 181 4.109 4.247 -0.138 1
1 1129 . 3 1 1 A 92 92 ASP C C 181 177.555 177.574 -0.019 1
1 1130 . 3 1 1 A 92 92 ASP CA C 181 56.390 57.835 -1.445 1
1 1131 . 3 1 1 A 92 92 ASP CB C 181 41.330 41.014 0.316 1
1 1132 . 3 1 1 A 92 92 ASP N N 181 125.691 126.870 -1.179 1
1 1133 . 3 1 1 A 93 93 THR H H 182 8.271 7.728 0.543 1
1 1134 . 3 1 1 A 93 93 THR HA H 182 4.036 3.835 0.201 1
1 1139 . 3 1 1 A 93 93 THR C C 182 176.289 176.119 0.170 1
1 1140 . 3 1 1 A 93 93 THR CA C 182 65.054 67.163 -2.109 1
1 1141 . 3 1 1 A 93 93 THR CB C 182 68.560 68.424 0.136 1
1 1143 . 3 1 1 A 93 93 THR N N 182 114.813 115.646 -0.833 1
1 1144 . 3 1 1 A 94 94 ARG H H 183 7.753 7.579 0.174 1
1 1145 . 3 1 1 A 94 94 ARG HA H 183 4.139 4.308 -0.169 1
1 1152 . 3 1 1 A 94 94 ARG C C 183 176.897 176.940 -0.043 1
1 1153 . 3 1 1 A 94 94 ARG CA C 183 55.350 56.073 -0.723 1
1 1154 . 3 1 1 A 94 94 ARG CB C 183 30.930 31.059 -0.129 1
1 1157 . 3 1 1 A 94 94 ARG N N 183 120.101 118.466 1.635 1
1 1158 . 3 1 1 A 95 95 GLY H H 184 8.112 9.100 -0.988 1
1 1159 . 3 1 1 A 95 95 GLY HA2 H 184 3.838 3.877 -0.039 1
1 1160 . 3 1 1 A 95 95 GLY HA3 H 184 3.670 3.887 -0.217 1
1 1161 . 3 1 1 A 95 95 GLY C C 184 173.659 173.294 0.365 1
1 1162 . 3 1 1 A 95 95 GLY CA C 184 46.040 45.816 0.224 1
1 1163 . 3 1 1 A 95 95 GLY N N 184 108.106 109.549 -1.443 1
1 1164 . 3 1 1 A 96 96 ASN H H 185 6.833 7.335 -0.502 1
1 1165 . 3 1 1 A 96 96 ASN HA H 185 4.944 4.975 -0.031 1
1 1170 . 3 1 1 A 96 96 ASN C C 185 174.267 173.332 0.935 1
1 1171 . 3 1 1 A 96 96 ASN CA C 185 52.560 52.386 0.174 1
1 1172 . 3 1 1 A 96 96 ASN CB C 185 45.890 41.737 4.153 1
1 1173 . 3 1 1 A 96 96 ASN N N 185 113.392 116.778 -3.386 1
1 1175 . 3 1 1 A 97 97 PHE H H 186 9.108 8.497 0.611 1
1 1176 . 3 1 1 A 97 97 PHE HA H 186 4.782 4.806 -0.024 1
1 1183 . 3 1 1 A 97 97 PHE C C 186 174.862 175.660 -0.798 1
1 1184 . 3 1 1 A 97 97 PHE CA C 186 60.056 59.645 0.411 1
1 1185 . 3 1 1 A 97 97 PHE CB C 186 40.180 39.266 0.914 1
1 1188 . 3 1 1 A 97 97 PHE N N 186 118.741 119.366 -0.625 1
1 1189 . 3 1 1 A 98 98 ILE H H 187 8.933 8.770 0.163 1
1 1190 . 3 1 1 A 98 98 ILE HA H 187 5.458 4.892 0.566 1
1 1200 . 3 1 1 A 98 98 ILE C C 187 176.041 175.034 1.007 1
1 1201 . 3 1 1 A 98 98 ILE CA C 187 57.610 58.992 -1.382 1
1 1202 . 3 1 1 A 98 98 ILE CB C 187 42.070 41.912 0.158 1
1 1206 . 3 1 1 A 98 98 ILE N N 187 117.857 119.025 -1.168 1
1 1207 . 3 1 1 A 99 99 ILE H H 188 8.284 8.653 -0.369 1
1 1208 . 3 1 1 A 99 99 ILE HA H 188 4.341 4.214 0.127 1
1 1218 . 3 1 1 A 99 99 ILE C C 188 176.413 176.598 -0.185 1
1 1219 . 3 1 1 A 99 99 ILE CA C 188 59.190 61.849 -2.659 1
1 1220 . 3 1 1 A 99 99 ILE CB C 188 37.940 38.190 -0.250 1
1 1224 . 3 1 1 A 99 99 ILE N N 188 121.796 123.074 -1.278 1
1 1225 . 3 1 1 A 100 100 LYS H H 189 8.463 8.374 0.089 1
1 1226 . 3 1 1 A 100 100 LYS HA H 189 4.040 4.403 -0.363 1
1 1235 . 3 1 1 A 100 100 LYS C C 189 176.848 176.121 0.727 1
1 1236 . 3 1 1 A 100 100 LYS CA C 189 57.241 56.362 0.879 1
1 1237 . 3 1 1 A 100 100 LYS CB C 189 33.400 33.398 0.002 1
1 1241 . 3 1 1 A 100 100 LYS N N 189 127.995 124.270 3.725 1
1 1242 . 3 1 1 A 101 101 GLY H H 190 8.346 8.426 -0.080 1
1 1243 . 3 1 1 A 101 101 GLY HA2 H 190 3.947 4.089 -0.142 1
1 1244 . 3 1 1 A 101 101 GLY HA3 H 190 3.813 4.094 -0.281 1
1 1245 . 3 1 1 A 101 101 GLY C C 190 172.902 172.467 0.435 1
1 1246 . 3 1 1 A 101 101 GLY CA C 190 44.920 46.051 -1.131 1
1 1247 . 3 1 1 A 101 101 GLY N N 190 110.882 110.143 0.739 1
1 7 . 4 1 1 A 2 2 GLN H H 91 8.786 8.133 0.653 1
1 8 . 4 1 1 A 2 2 GLN HA H 91 4.005 3.923 0.082 1
1 15 . 4 1 1 A 2 2 GLN C C 91 177.270 177.896 -0.626 1
1 16 . 4 1 1 A 2 2 GLN CA C 91 58.220 59.066 -0.846 1
1 17 . 4 1 1 A 2 2 GLN CB C 91 28.650 28.199 0.451 1
1 19 . 4 1 1 A 2 2 GLN N N 91 121.993 122.993 -1.000 1
1 21 . 4 1 1 A 3 3 GLU H H 92 8.430 8.266 0.164 1
1 22 . 4 1 1 A 3 3 GLU HA H 92 4.007 4.109 -0.102 1
1 27 . 4 1 1 A 3 3 GLU C C 92 178.287 178.716 -0.429 1
1 28 . 4 1 1 A 3 3 GLU CA C 92 59.490 59.216 0.274 1
1 29 . 4 1 1 A 3 3 GLU CB C 92 29.506 29.392 0.114 1
1 31 . 4 1 1 A 3 3 GLU N N 92 120.195 118.524 1.671 1
1 32 . 4 1 1 A 4 4 SER H H 93 8.209 7.785 0.424 1
1 33 . 4 1 1 A 4 4 SER HA H 93 4.272 4.176 0.096 1
1 36 . 4 1 1 A 4 4 SER C C 93 177.369 176.744 0.625 1
1 37 . 4 1 1 A 4 4 SER CA C 93 61.044 62.497 -1.453 1
1 38 . 4 1 1 A 4 4 SER CB C 93 62.950 62.911 0.039 1
1 39 . 4 1 1 A 4 4 SER N N 93 115.524 116.377 -0.853 1
1 40 . 4 1 1 A 5 5 ILE H H 94 8.080 7.709 0.371 1
1 41 . 4 1 1 A 5 5 ILE HA H 94 3.530 3.639 -0.109 1
1 51 . 4 1 1 A 5 5 ILE C C 94 177.778 177.833 -0.055 1
1 52 . 4 1 1 A 5 5 ILE CA C 94 65.710 65.282 0.428 1
1 53 . 4 1 1 A 5 5 ILE CB C 94 37.800 37.504 0.296 1
1 57 . 4 1 1 A 5 5 ILE N N 94 124.148 121.594 2.554 1
1 58 . 4 1 1 A 6 6 GLN H H 95 8.374 8.328 0.046 1
1 59 . 4 1 1 A 6 6 GLN HA H 95 4.125 3.971 0.154 1
1 66 . 4 1 1 A 6 6 GLN C C 95 179.726 179.128 0.598 1
1 67 . 4 1 1 A 6 6 GLN CA C 95 59.190 59.162 0.028 1
1 68 . 4 1 1 A 6 6 GLN CB C 95 27.060 28.120 -1.060 1
1 70 . 4 1 1 A 6 6 GLN N N 95 118.257 118.565 -0.308 1
1 72 . 4 1 1 A 7 7 ASN H H 96 8.456 7.810 0.646 1
1 73 . 4 1 1 A 7 7 ASN HA H 96 4.446 4.440 0.006 1
1 78 . 4 1 1 A 7 7 ASN C C 96 177.257 178.274 -1.017 1
1 79 . 4 1 1 A 7 7 ASN CA C 96 56.020 56.367 -0.347 1
1 80 . 4 1 1 A 7 7 ASN CB C 96 38.126 38.094 0.032 1
1 81 . 4 1 1 A 7 7 ASN N N 96 118.597 118.279 0.318 1
1 83 . 4 1 1 A 8 8 LYS H H 97 7.732 7.727 0.005 1
1 84 . 4 1 1 A 8 8 LYS HA H 97 4.129 4.057 0.072 1
1 93 . 4 1 1 A 8 8 LYS C C 97 179.143 179.414 -0.271 1
1 94 . 4 1 1 A 8 8 LYS CA C 97 59.126 59.552 -0.426 1
1 95 . 4 1 1 A 8 8 LYS CB C 97 32.070 32.380 -0.310 1
1 99 . 4 1 1 A 8 8 LYS N N 97 122.381 117.474 4.907 1
1 100 . 4 1 1 A 9 9 ILE H H 98 8.452 8.113 0.339 1
1 101 . 4 1 1 A 9 9 ILE HA H 98 3.480 3.718 -0.238 1
1 111 . 4 1 1 A 9 9 ILE C C 98 177.406 178.256 -0.850 1
1 112 . 4 1 1 A 9 9 ILE CA C 98 66.430 65.153 1.277 1
1 113 . 4 1 1 A 9 9 ILE CB C 98 37.980 37.792 0.188 1
1 117 . 4 1 1 A 9 9 ILE N N 98 119.950 120.959 -1.009 1
1 118 . 4 1 1 A 10 10 SER H H 99 7.924 7.915 0.009 1
1 119 . 4 1 1 A 10 10 SER HA H 99 3.983 4.186 -0.203 1
1 122 . 4 1 1 A 10 10 SER C C 99 176.327 176.813 -0.486 1
1 123 . 4 1 1 A 10 10 SER CA C 99 61.990 61.239 0.751 1
1 124 . 4 1 1 A 10 10 SER CB C 99 62.790 63.133 -0.343 1
1 125 . 4 1 1 A 10 10 SER N N 99 113.568 115.910 -2.342 1
1 126 . 4 1 1 A 11 11 GLN H H 100 7.832 7.264 0.568 1
1 127 . 4 1 1 A 11 11 GLN HA H 100 4.238 4.159 0.079 1
1 134 . 4 1 1 A 11 11 GLN C C 100 178.088 178.320 -0.232 1
1 135 . 4 1 1 A 11 11 GLN CA C 100 57.900 58.173 -0.273 1
1 136 . 4 1 1 A 11 11 GLN CB C 100 29.790 28.764 1.026 1
1 138 . 4 1 1 A 11 11 GLN N N 100 117.487 120.863 -3.376 1
1 140 . 4 1 1 A 12 12 CYS H H 101 7.920 8.414 -0.494 1
1 141 . 4 1 1 A 12 12 CYS HA H 101 4.657 4.433 0.224 1
1 144 . 4 1 1 A 12 12 CYS C C 101 175.446 175.024 0.422 1
1 145 . 4 1 1 A 12 12 CYS CA C 101 60.654 62.762 -2.108 1
1 146 . 4 1 1 A 12 12 CYS CB C 101 29.310 26.806 2.504 1
1 147 . 4 1 1 A 12 12 CYS N N 101 114.221 118.481 -4.260 1
1 148 . 4 1 1 A 13 13 LYS H H 102 8.029 7.309 0.720 1
1 149 . 4 1 1 A 13 13 LYS HA H 102 5.069 4.782 0.287 1
1 158 . 4 1 1 A 13 13 LYS C C 102 174.800 176.286 -1.486 1
1 159 . 4 1 1 A 13 13 LYS CA C 102 56.394 56.033 0.361 1
1 160 . 4 1 1 A 13 13 LYS CB C 102 32.770 33.516 -0.746 1
1 164 . 4 1 1 A 13 13 LYS N N 102 124.129 119.026 5.103 1
1 165 . 4 1 1 A 14 14 PHE H H 103 8.737 8.762 -0.025 1
1 166 . 4 1 1 A 14 14 PHE HA H 103 5.059 5.029 0.030 1
1 174 . 4 1 1 A 14 14 PHE C C 103 173.560 172.876 0.684 1
1 175 . 4 1 1 A 14 14 PHE CA C 103 55.470 55.953 -0.483 1
1 176 . 4 1 1 A 14 14 PHE CB C 103 41.760 40.665 1.095 1
1 180 . 4 1 1 A 14 14 PHE N N 103 118.661 116.406 2.255 1
1 181 . 4 1 1 A 15 15 SER H H 104 8.826 8.773 0.053 1
1 182 . 4 1 1 A 15 15 SER HA H 104 4.602 4.407 0.195 1
1 185 . 4 1 1 A 15 15 SER C C 104 173.795 173.635 0.160 1
1 186 . 4 1 1 A 15 15 SER CA C 104 58.610 59.115 -0.505 1
1 187 . 4 1 1 A 15 15 SER CB C 104 62.690 62.681 0.009 1
1 188 . 4 1 1 A 15 15 SER N N 104 117.781 116.783 0.998 1
1 189 . 4 1 1 A 16 16 VAL H H 105 7.784 8.157 -0.373 1
1 190 . 4 1 1 A 16 16 VAL HA H 105 3.370 4.007 -0.637 1
1 198 . 4 1 1 A 16 16 VAL C C 105 174.987 175.349 -0.362 1
1 199 . 4 1 1 A 16 16 VAL CA C 105 63.580 62.725 0.855 1
1 200 . 4 1 1 A 16 16 VAL CB C 105 31.410 30.755 0.655 1
1 203 . 4 1 1 A 16 16 VAL N N 105 129.075 126.639 2.436 1
1 204 . 4 1 1 A 17 17 CYS H H 106 8.536 8.371 0.165 1
1 205 . 4 1 1 A 17 17 CYS HA H 106 5.011 4.968 0.043 1
1 208 . 4 1 1 A 17 17 CYS CA C 106 55.260 56.404 -1.144 1
1 209 . 4 1 1 A 17 17 CYS CB C 106 28.210 28.355 -0.145 1
1 210 . 4 1 1 A 17 17 CYS N N 106 130.045 127.424 2.621 1
1 211 . 4 1 1 A 18 18 PRO HA H 107 3.991 4.376 -0.385 1
1 218 . 4 1 1 A 18 18 PRO C C 107 178.188 178.225 -0.037 1
1 219 . 4 1 1 A 18 18 PRO CA C 107 65.940 64.958 0.982 1
1 220 . 4 1 1 A 18 18 PRO CB C 107 32.000 32.081 -0.081 1
1 223 . 4 1 1 A 19 19 GLU H H 108 9.260 8.990 0.270 1
1 224 . 4 1 1 A 19 19 GLU HA H 108 4.119 4.081 0.038 1
1 229 . 4 1 1 A 19 19 GLU C C 108 178.721 178.838 -0.117 1
1 230 . 4 1 1 A 19 19 GLU CA C 108 59.300 59.503 -0.203 1
1 231 . 4 1 1 A 19 19 GLU CB C 108 28.920 28.899 0.021 1
1 233 . 4 1 1 A 19 19 GLU N N 108 118.270 116.178 2.092 1
1 234 . 4 1 1 A 20 20 ARG H H 109 7.672 7.652 0.020 1
1 235 . 4 1 1 A 20 20 ARG HA H 109 4.331 4.194 0.137 1
1 242 . 4 1 1 A 20 20 ARG C C 109 177.977 178.773 -0.796 1
1 243 . 4 1 1 A 20 20 ARG CA C 109 57.350 58.587 -1.237 1
1 244 . 4 1 1 A 20 20 ARG CB C 109 30.820 30.043 0.777 1
1 247 . 4 1 1 A 20 20 ARG N N 109 118.357 120.032 -1.675 1
1 248 . 4 1 1 A 21 21 LEU H H 110 7.601 7.846 -0.245 1
1 249 . 4 1 1 A 21 21 LEU HA H 110 4.380 4.257 0.123 1
1 259 . 4 1 1 A 21 21 LEU C C 110 176.562 176.396 0.166 1
1 260 . 4 1 1 A 21 21 LEU CA C 110 56.096 55.618 0.478 1
1 261 . 4 1 1 A 21 21 LEU CB C 110 44.016 42.194 1.822 1
1 265 . 4 1 1 A 21 21 LEU N N 110 118.626 118.480 0.146 1
1 266 . 4 1 1 A 22 22 GLN H H 111 7.750 7.567 0.183 1
1 267 . 4 1 1 A 22 22 GLN HA H 111 3.870 3.948 -0.078 1
1 274 . 4 1 1 A 22 22 GLN C C 111 173.336 174.539 -1.203 1
1 275 . 4 1 1 A 22 22 GLN CA C 111 56.510 57.266 -0.756 1
1 276 . 4 1 1 A 22 22 GLN CB C 111 26.800 26.630 0.170 1
1 278 . 4 1 1 A 22 22 GLN N N 111 113.926 115.451 -1.525 1
1 280 . 4 1 1 A 23 23 CYS H H 112 7.407 7.788 -0.381 1
1 281 . 4 1 1 A 23 23 CYS HA H 112 4.469 4.735 -0.266 1
1 284 . 4 1 1 A 23 23 CYS CA C 112 52.650 57.327 -4.677 1
1 285 . 4 1 1 A 23 23 CYS CB C 112 29.750 28.477 1.273 1
1 286 . 4 1 1 A 23 23 CYS N N 112 112.681 118.054 -5.373 1
1 287 . 4 1 1 A 24 24 PRO HA H 113 4.408 4.531 -0.123 1
1 294 . 4 1 1 A 24 24 PRO C C 113 178.175 177.590 0.585 1
1 295 . 4 1 1 A 24 24 PRO CA C 113 62.040 62.854 -0.814 1
1 296 . 4 1 1 A 24 24 PRO CB C 113 31.920 32.599 -0.679 1
1 299 . 4 1 1 A 25 25 LEU H H 114 8.593 8.444 0.149 1
1 300 . 4 1 1 A 25 25 LEU HA H 114 3.765 3.913 -0.148 1
1 310 . 4 1 1 A 25 25 LEU C C 114 179.950 178.979 0.971 1
1 311 . 4 1 1 A 25 25 LEU CA C 114 57.674 57.901 -0.227 1
1 312 . 4 1 1 A 25 25 LEU CB C 114 40.690 41.487 -0.797 1
1 316 . 4 1 1 A 25 25 LEU N N 114 123.729 123.652 0.077 1
1 317 . 4 1 1 A 26 26 GLU H H 115 9.108 8.574 0.534 1
1 318 . 4 1 1 A 26 26 GLU HA H 115 3.876 4.026 -0.150 1
1 323 . 4 1 1 A 26 26 GLU C C 115 177.505 178.523 -1.018 1
1 324 . 4 1 1 A 26 26 GLU CA C 115 59.410 59.301 0.109 1
1 325 . 4 1 1 A 26 26 GLU CB C 115 28.460 29.102 -0.642 1
1 327 . 4 1 1 A 26 26 GLU N N 115 116.817 117.361 -0.544 1
1 328 . 4 1 1 A 27 27 ALA H H 116 7.360 7.584 -0.224 1
1 329 . 4 1 1 A 27 27 ALA HA H 116 4.408 4.139 0.269 1
1 333 . 4 1 1 A 27 27 ALA C C 116 177.046 177.998 -0.952 1
1 334 . 4 1 1 A 27 27 ALA CA C 116 52.970 54.627 -1.657 1
1 335 . 4 1 1 A 27 27 ALA CB C 116 19.916 18.336 1.580 1
1 336 . 4 1 1 A 27 27 ALA N N 116 118.966 121.681 -2.715 1
1 337 . 4 1 1 A 28 28 ILE H H 117 7.168 7.087 0.081 1
1 338 . 4 1 1 A 28 28 ILE HA H 117 4.432 4.426 0.006 1
1 348 . 4 1 1 A 28 28 ILE C C 117 172.641 175.664 -3.023 1
1 349 . 4 1 1 A 28 28 ILE CA C 117 59.980 59.914 0.066 1
1 350 . 4 1 1 A 28 28 ILE CB C 117 37.350 37.941 -0.591 1
1 354 . 4 1 1 A 28 28 ILE N N 117 108.913 108.639 0.274 1
1 355 . 4 1 1 A 29 29 GLN H H 118 6.562 7.496 -0.934 1
1 356 . 4 1 1 A 29 29 GLN HA H 118 3.922 4.047 -0.125 1
1 363 . 4 1 1 A 29 29 GLN C C 118 175.049 175.383 -0.334 1
1 364 . 4 1 1 A 29 29 GLN CA C 118 54.596 56.374 -1.778 1
1 365 . 4 1 1 A 29 29 GLN CB C 118 29.570 28.941 0.629 1
1 367 . 4 1 1 A 29 29 GLN N N 118 116.455 123.576 -7.121 1
1 369 . 4 1 1 A 30 30 CYS H H 119 8.138 8.621 -0.483 1
1 370 . 4 1 1 A 30 30 CYS HA H 119 4.580 4.626 -0.046 1
1 373 . 4 1 1 A 30 30 CYS CA C 119 57.810 57.282 0.528 1
1 374 . 4 1 1 A 30 30 CYS CB C 119 30.200 28.724 1.476 1
1 375 . 4 1 1 A 30 30 CYS N N 119 134.136 125.288 8.848 1
1 376 . 4 1 1 A 31 31 PRO HA H 120 4.424 4.462 -0.038 1
1 383 . 4 1 1 A 31 31 PRO C C 120 177.431 177.843 -0.412 1
1 384 . 4 1 1 A 31 31 PRO CA C 120 64.060 64.140 -0.080 1
1 385 . 4 1 1 A 31 31 PRO CB C 120 32.776 31.802 0.974 1
1 388 . 4 1 1 A 32 32 ILE H H 121 11.318 7.632 3.686 1
1 389 . 4 1 1 A 32 32 ILE HA H 121 4.038 3.983 0.055 1
1 399 . 4 1 1 A 32 32 ILE C C 121 178.485 177.661 0.824 1
1 400 . 4 1 1 A 32 32 ILE CA C 121 64.060 64.082 -0.022 1
1 401 . 4 1 1 A 32 32 ILE CB C 121 39.340 38.444 0.896 1
1 405 . 4 1 1 A 32 32 ILE N N 121 124.500 116.937 7.563 1
1 406 . 4 1 1 A 33 33 THR H H 122 9.928 7.313 2.615 1
1 407 . 4 1 1 A 33 33 THR HA H 122 4.048 4.379 -0.331 1
1 412 . 4 1 1 A 33 33 THR C C 122 175.793 174.782 1.011 1
1 413 . 4 1 1 A 33 33 THR CA C 122 62.990 61.676 1.314 1
1 414 . 4 1 1 A 33 33 THR CB C 122 70.300 69.900 0.400 1
1 416 . 4 1 1 A 33 33 THR N N 122 115.136 108.957 6.179 1
1 417 . 4 1 1 A 34 34 LEU H H 123 8.439 7.807 0.632 1
1 418 . 4 1 1 A 34 34 LEU HA H 123 3.912 3.810 0.102 1
1 428 . 4 1 1 A 34 34 LEU C C 123 175.495 174.964 0.531 1
1 429 . 4 1 1 A 34 34 LEU CA C 123 56.290 56.217 0.073 1
1 430 . 4 1 1 A 34 34 LEU CB C 123 38.500 39.731 -1.231 1
1 434 . 4 1 1 A 34 34 LEU N N 123 117.230 118.942 -1.712 1
1 435 . 4 1 1 A 35 35 GLU H H 124 7.816 7.621 0.195 1
1 436 . 4 1 1 A 35 35 GLU HA H 124 4.634 4.803 -0.169 1
1 441 . 4 1 1 A 35 35 GLU C C 124 174.838 174.389 0.449 1
1 442 . 4 1 1 A 35 35 GLU CA C 124 53.780 54.466 -0.686 1
1 443 . 4 1 1 A 35 35 GLU CB C 124 33.710 33.002 0.708 1
1 445 . 4 1 1 A 35 35 GLU N N 124 116.577 114.626 1.951 1
1 446 . 4 1 1 A 36 36 GLN H H 125 8.532 8.391 0.141 1
1 447 . 4 1 1 A 36 36 GLN HA H 125 4.958 4.352 0.606 1
1 454 . 4 1 1 A 36 36 GLN CA C 125 53.350 53.459 -0.109 1
1 455 . 4 1 1 A 36 36 GLN CB C 125 29.950 29.531 0.419 1
1 457 . 4 1 1 A 36 36 GLN N N 125 123.034 124.003 -0.969 1
1 459 . 4 1 1 A 37 37 PRO HA H 126 4.458 4.577 -0.119 1
1 466 . 4 1 1 A 37 37 PRO C C 126 176.314 177.110 -0.796 1
1 467 . 4 1 1 A 37 37 PRO CA C 126 62.816 62.704 0.112 1
1 468 . 4 1 1 A 37 37 PRO CB C 126 33.070 32.540 0.530 1
1 471 . 4 1 1 A 38 38 GLU H H 127 8.626 8.377 0.249 1
1 472 . 4 1 1 A 38 38 GLU HA H 127 4.274 4.146 0.128 1
1 477 . 4 1 1 A 38 38 GLU C C 127 177.877 176.449 1.428 1
1 478 . 4 1 1 A 38 38 GLU CA C 127 58.730 57.922 0.808 1
1 479 . 4 1 1 A 38 38 GLU CB C 127 30.340 30.217 0.123 1
1 481 . 4 1 1 A 38 38 GLU N N 127 120.691 119.035 1.656 1
1 482 . 4 1 1 A 39 39 LYS H H 128 7.861 7.516 0.345 1
1 483 . 4 1 1 A 39 39 LYS HA H 128 4.889 4.611 0.278 1
1 492 . 4 1 1 A 39 39 LYS C C 128 175.446 174.744 0.702 1
1 493 . 4 1 1 A 39 39 LYS CA C 128 53.670 54.837 -1.167 1
1 494 . 4 1 1 A 39 39 LYS CB C 128 33.630 35.666 -2.036 1
1 498 . 4 1 1 A 39 39 LYS N N 128 117.878 116.442 1.436 1
1 499 . 4 1 1 A 40 40 GLY H H 129 8.426 7.905 0.521 1
1 500 . 4 1 1 A 40 40 GLY HA2 H 129 4.970 4.039 0.931 1
1 501 . 4 1 1 A 40 40 GLY HA3 H 129 2.458 4.188 -1.730 1
1 502 . 4 1 1 A 40 40 GLY C C 129 170.048 172.230 -2.182 1
1 503 . 4 1 1 A 40 40 GLY CA C 129 42.910 45.199 -2.289 1
1 504 . 4 1 1 A 40 40 GLY N N 129 112.604 105.644 6.960 1
1 505 . 4 1 1 A 41 41 ILE H H 130 8.596 8.829 -0.233 1
1 506 . 4 1 1 A 41 41 ILE HA H 130 4.636 5.159 -0.523 1
1 516 . 4 1 1 A 41 41 ILE C C 130 172.691 174.366 -1.675 1
1 517 . 4 1 1 A 41 41 ILE CA C 130 58.500 58.703 -0.203 1
1 518 . 4 1 1 A 41 41 ILE CB C 130 43.320 42.077 1.243 1
1 522 . 4 1 1 A 41 41 ILE N N 130 113.363 116.174 -2.811 1
1 523 . 4 1 1 A 42 42 PHE H H 131 8.994 8.829 0.165 1
1 524 . 4 1 1 A 42 42 PHE HA H 131 5.075 5.573 -0.498 1
1 532 . 4 1 1 A 42 42 PHE C C 131 175.111 174.742 0.369 1
1 533 . 4 1 1 A 42 42 PHE CA C 131 58.680 56.851 1.829 1
1 534 . 4 1 1 A 42 42 PHE CB C 131 42.220 40.329 1.891 1
1 538 . 4 1 1 A 42 42 PHE N N 131 125.156 121.205 3.951 1
1 539 . 4 1 1 A 43 43 VAL H H 132 8.399 9.139 -0.740 1
1 540 . 4 1 1 A 43 43 VAL HA H 132 4.920 4.743 0.177 1
1 548 . 4 1 1 A 43 43 VAL C C 132 178.175 175.163 3.012 1
1 549 . 4 1 1 A 43 43 VAL CA C 132 59.600 61.054 -1.454 1
1 550 . 4 1 1 A 43 43 VAL CB C 132 35.920 34.180 1.740 1
1 553 . 4 1 1 A 43 43 VAL N N 132 119.371 123.364 -3.993 1
1 554 . 4 1 1 A 44 44 LYS H H 133 10.041 8.504 1.537 1
1 555 . 4 1 1 A 44 44 LYS HA H 133 4.920 4.396 0.524 1
1 564 . 4 1 1 A 44 44 LYS C C 133 177.195 175.512 1.683 1
1 565 . 4 1 1 A 44 44 LYS CA C 133 57.310 56.437 0.873 1
1 566 . 4 1 1 A 44 44 LYS CB C 133 34.410 32.441 1.969 1
1 570 . 4 1 1 A 44 44 LYS N N 133 130.928 126.584 4.344 1
1 571 . 4 1 1 A 45 45 ASN H H 134 8.534 8.916 -0.382 1
1 572 . 4 1 1 A 45 45 ASN HA H 134 4.151 4.634 -0.483 1
1 577 . 4 1 1 A 45 45 ASN C C 134 174.217 175.191 -0.974 1
1 578 . 4 1 1 A 45 45 ASN CA C 134 55.290 52.499 2.791 1
1 579 . 4 1 1 A 45 45 ASN CB C 134 37.530 38.226 -0.696 1
1 580 . 4 1 1 A 45 45 ASN N N 134 119.452 124.264 -4.812 1
1 582 . 4 1 1 A 46 46 SER H H 135 7.570 8.001 -0.431 1
1 583 . 4 1 1 A 46 46 SER HA H 135 4.220 4.088 0.132 1
1 586 . 4 1 1 A 46 46 SER C C 135 174.490 176.750 -2.260 1
1 587 . 4 1 1 A 46 46 SER CA C 135 57.090 61.480 -4.390 1
1 588 . 4 1 1 A 46 46 SER CB C 135 64.126 62.919 1.207 1
1 589 . 4 1 1 A 46 46 SER N N 135 105.613 121.635 -16.022 1
1 590 . 4 1 1 A 47 47 ASP H H 136 9.113 8.146 0.967 1
1 591 . 4 1 1 A 47 47 ASP HA H 136 4.220 4.323 -0.103 1
1 594 . 4 1 1 A 47 47 ASP CA C 136 57.610 57.043 0.567 1
1 595 . 4 1 1 A 47 47 ASP CB C 136 40.810 40.584 0.226 1
1 596 . 4 1 1 A 47 47 ASP N N 136 120.995 121.460 -0.465 1
1 597 . 4 1 1 A 48 48 GLY H H 137 8.172 7.784 0.388 1
1 598 . 4 1 1 A 48 48 GLY HA2 H 137 4.096 3.935 0.161 1
1 599 . 4 1 1 A 48 48 GLY HA3 H 137 3.664 3.944 -0.280 1
1 600 . 4 1 1 A 48 48 GLY C C 137 173.990 173.602 0.388 1
1 601 . 4 1 1 A 48 48 GLY CA C 137 45.130 45.324 -0.194 1
1 602 . 4 1 1 A 48 48 GLY N N 137 105.838 106.798 -0.960 1
1 603 . 4 1 1 A 49 49 SER H H 138 7.252 7.846 -0.594 1
1 604 . 4 1 1 A 49 49 SER HA H 138 4.503 4.207 0.296 1
1 607 . 4 1 1 A 49 49 SER C C 138 173.857 173.349 0.508 1
1 608 . 4 1 1 A 49 49 SER CA C 138 57.340 59.558 -2.218 1
1 609 . 4 1 1 A 49 49 SER CB C 138 65.370 61.683 3.687 1
1 610 . 4 1 1 A 49 49 SER N N 138 114.942 111.474 3.468 1
1 611 . 4 1 1 A 50 50 ASP H H 139 8.276 8.252 0.024 1
1 612 . 4 1 1 A 50 50 ASP HA H 139 4.618 4.217 0.401 1
1 615 . 4 1 1 A 50 50 ASP C C 139 174.577 175.494 -0.917 1
1 616 . 4 1 1 A 50 50 ASP CA C 139 53.116 55.768 -2.652 1
1 617 . 4 1 1 A 50 50 ASP CB C 139 40.520 39.339 1.181 1
1 618 . 4 1 1 A 50 50 ASP N N 139 122.088 111.559 10.529 1
1 619 . 4 1 1 A 51 51 VAL H H 140 8.192 7.529 0.663 1
1 620 . 4 1 1 A 51 51 VAL HA H 140 4.299 4.149 0.150 1
1 628 . 4 1 1 A 51 51 VAL C C 140 175.867 175.110 0.757 1
1 629 . 4 1 1 A 51 51 VAL CA C 140 62.950 62.839 0.111 1
1 630 . 4 1 1 A 51 51 VAL CB C 140 33.230 31.975 1.255 1
1 632 . 4 1 1 A 51 51 VAL N N 140 121.167 119.414 1.753 1
1 633 . 4 1 1 A 52 52 CYS H H 141 8.391 8.784 -0.393 1
1 634 . 4 1 1 A 52 52 CYS HA H 141 5.247 5.106 0.141 1
1 637 . 4 1 1 A 52 52 CYS C C 141 172.778 174.836 -2.058 1
1 638 . 4 1 1 A 52 52 CYS CA C 141 56.480 58.549 -2.069 1
1 639 . 4 1 1 A 52 52 CYS CB C 141 31.960 27.817 4.143 1
1 640 . 4 1 1 A 52 52 CYS N N 141 121.884 126.620 -4.736 1
1 641 . 4 1 1 A 53 53 THR H H 142 8.777 8.782 -0.005 1
1 642 . 4 1 1 A 53 53 THR HA H 142 4.489 4.977 -0.488 1
1 648 . 4 1 1 A 53 53 THR C C 142 171.885 172.287 -0.402 1
1 649 . 4 1 1 A 53 53 THR CA C 142 62.070 61.191 0.879 1
1 650 . 4 1 1 A 53 53 THR CB C 142 71.390 71.760 -0.370 1
1 652 . 4 1 1 A 53 53 THR N N 142 118.132 117.512 0.620 1
1 653 . 4 1 1 A 54 54 LEU H H 143 8.409 8.433 -0.024 1
1 654 . 4 1 1 A 54 54 LEU HA H 143 4.276 4.571 -0.295 1
1 664 . 4 1 1 A 54 54 LEU C C 143 174.366 174.112 0.254 1
1 665 . 4 1 1 A 54 54 LEU CA C 143 54.330 53.223 1.107 1
1 666 . 4 1 1 A 54 54 LEU CB C 143 42.396 42.872 -0.476 1
1 670 . 4 1 1 A 54 54 LEU N N 143 127.980 127.611 0.369 1
1 671 . 4 1 1 A 55 55 PHE H H 144 8.646 8.544 0.102 1
1 672 . 4 1 1 A 55 55 PHE HA H 144 5.455 4.846 0.609 1
1 680 . 4 1 1 A 55 55 PHE C C 144 176.054 175.090 0.964 1
1 681 . 4 1 1 A 55 55 PHE CA C 144 55.250 57.130 -1.880 1
1 682 . 4 1 1 A 55 55 PHE CB C 144 44.100 40.850 3.250 1
1 686 . 4 1 1 A 55 55 PHE N N 144 122.010 126.870 -4.860 1
1 687 . 4 1 1 A 56 56 ASP H H 145 11.575 8.273 3.302 1
1 688 . 4 1 1 A 56 56 ASP HA H 145 4.416 4.622 -0.206 1
1 691 . 4 1 1 A 56 56 ASP C C 145 176.748 177.420 -0.672 1
1 692 . 4 1 1 A 56 56 ASP CA C 145 55.840 54.768 1.072 1
1 693 . 4 1 1 A 56 56 ASP CB C 145 44.390 42.071 2.319 1
1 694 . 4 1 1 A 56 56 ASP N N 145 121.936 124.167 -2.231 1
1 695 . 4 1 1 A 57 57 ALA H H 146 8.508 8.740 -0.232 1
1 696 . 4 1 1 A 57 57 ALA HA H 146 3.797 4.020 -0.223 1
1 700 . 4 1 1 A 57 57 ALA C C 146 178.696 179.960 -1.264 1
1 701 . 4 1 1 A 57 57 ALA CA C 146 55.990 55.433 0.557 1
1 702 . 4 1 1 A 57 57 ALA CB C 146 18.840 18.087 0.753 1
1 703 . 4 1 1 A 57 57 ALA N N 146 130.243 129.502 0.741 1
1 704 . 4 1 1 A 58 58 ALA H H 147 8.378 7.477 0.901 1
1 705 . 4 1 1 A 58 58 ALA HA H 147 4.078 4.242 -0.164 1
1 709 . 4 1 1 A 58 58 ALA C C 147 181.091 179.312 1.779 1
1 710 . 4 1 1 A 58 58 ALA CA C 147 54.770 55.001 -0.231 1
1 711 . 4 1 1 A 58 58 ALA CB C 147 17.700 18.511 -0.811 1
1 712 . 4 1 1 A 58 58 ALA N N 147 121.997 119.336 2.661 1
1 713 . 4 1 1 A 59 59 ALA H H 148 9.138 7.908 1.230 1
1 714 . 4 1 1 A 59 59 ALA HA H 148 3.975 4.027 -0.052 1
1 718 . 4 1 1 A 59 59 ALA C C 148 180.508 179.901 0.607 1
1 719 . 4 1 1 A 59 59 ALA CA C 148 54.840 55.096 -0.256 1
1 720 . 4 1 1 A 59 59 ALA CB C 148 18.600 18.585 0.015 1
1 721 . 4 1 1 A 59 59 ALA N N 148 123.595 120.516 3.079 1
1 722 . 4 1 1 A 60 60 PHE H H 149 8.814 8.224 0.590 1
1 723 . 4 1 1 A 60 60 PHE HA H 149 3.722 4.007 -0.285 1
1 731 . 4 1 1 A 60 60 PHE C C 149 176.773 177.432 -0.659 1
1 732 . 4 1 1 A 60 60 PHE CA C 149 62.030 61.471 0.559 1
1 733 . 4 1 1 A 60 60 PHE CB C 149 39.960 38.785 1.175 1
1 737 . 4 1 1 A 60 60 PHE N N 149 120.354 119.939 0.415 1
1 738 . 4 1 1 A 61 61 SER H H 150 8.276 8.122 0.154 1
1 739 . 4 1 1 A 61 61 SER HA H 150 3.880 4.196 -0.316 1
1 742 . 4 1 1 A 61 61 SER C C 150 177.691 177.023 0.668 1
1 743 . 4 1 1 A 61 61 SER CA C 150 62.190 61.152 1.038 1
1 744 . 4 1 1 A 61 61 SER CB C 150 63.016 63.252 -0.236 1
1 745 . 4 1 1 A 61 61 SER N N 150 112.086 114.081 -1.995 1
1 746 . 4 1 1 A 62 62 ARG H H 151 7.829 7.711 0.118 1
1 747 . 4 1 1 A 62 62 ARG HA H 151 3.971 4.071 -0.100 1
1 754 . 4 1 1 A 62 62 ARG C C 151 178.287 178.809 -0.522 1
1 755 . 4 1 1 A 62 62 ARG CA C 151 59.340 59.042 0.298 1
1 756 . 4 1 1 A 62 62 ARG CB C 151 29.760 29.775 -0.015 1
1 759 . 4 1 1 A 62 62 ARG N N 151 121.090 121.708 -0.618 1
1 760 . 4 1 1 A 63 63 LEU H H 152 7.390 7.626 -0.236 1
1 761 . 4 1 1 A 63 63 LEU HA H 152 3.791 3.936 -0.145 1
1 771 . 4 1 1 A 63 63 LEU C C 152 179.106 178.870 0.236 1
1 772 . 4 1 1 A 63 63 LEU CA C 152 58.900 57.966 0.934 1
1 773 . 4 1 1 A 63 63 LEU CB C 152 41.140 41.470 -0.330 1
1 777 . 4 1 1 A 63 63 LEU N N 152 121.129 119.298 1.831 1
1 778 . 4 1 1 A 64 64 VAL H H 153 7.552 8.007 -0.455 1
1 779 . 4 1 1 A 64 64 VAL HA H 153 3.411 3.509 -0.098 1
1 787 . 4 1 1 A 64 64 VAL C C 153 180.595 178.581 2.014 1
1 788 . 4 1 1 A 64 64 VAL CA C 153 65.644 66.204 -0.560 1
1 789 . 4 1 1 A 64 64 VAL CB C 153 31.410 31.493 -0.083 1
1 792 . 4 1 1 A 64 64 VAL N N 153 118.280 119.263 -0.983 1
1 793 . 4 1 1 A 65 65 GLY H H 154 8.061 8.206 -0.145 1
1 794 . 4 1 1 A 65 65 GLY HA2 H 154 3.846 3.803 0.043 1
1 795 . 4 1 1 A 65 65 GLY HA3 H 154 3.809 3.805 0.004 1
1 796 . 4 1 1 A 65 65 GLY C C 154 175.235 176.266 -1.031 1
1 797 . 4 1 1 A 65 65 GLY CA C 154 46.630 46.829 -0.199 1
1 798 . 4 1 1 A 65 65 GLY N N 154 108.622 107.658 0.964 1
1 799 . 4 1 1 A 66 66 GLU H H 155 7.528 7.560 -0.032 1
1 800 . 4 1 1 A 66 66 GLU HA H 155 4.228 4.327 -0.099 1
1 805 . 4 1 1 A 66 66 GLU C C 155 176.761 176.937 -0.176 1
1 806 . 4 1 1 A 66 66 GLU CA C 155 56.590 56.377 0.213 1
1 807 . 4 1 1 A 66 66 GLU CB C 155 30.490 30.429 0.061 1
1 809 . 4 1 1 A 66 66 GLU N N 155 118.361 119.059 -0.698 1
1 810 . 4 1 1 A 67 67 GLY H H 156 7.884 7.798 0.086 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 3.878 -0.131 1
1 813 . 4 1 1 A 67 67 GLY C C 156 174.788 174.743 0.045 1
1 814 . 4 1 1 A 67 67 GLY CA C 156 45.890 45.615 0.275 1
1 815 . 4 1 1 A 67 67 GLY N N 156 108.465 108.419 0.046 1
1 816 . 4 1 1 A 68 68 LEU H H 157 7.332 7.933 -0.601 1
1 817 . 4 1 1 A 68 68 LEU HA H 157 4.361 4.407 -0.046 1
1 827 . 4 1 1 A 68 68 LEU CA C 157 53.060 52.780 0.280 1
1 828 . 4 1 1 A 68 68 LEU CB C 157 41.100 41.452 -0.352 1
1 832 . 4 1 1 A 68 68 LEU N N 157 121.920 121.827 0.093 1
1 833 . 4 1 1 A 69 69 PRO HA H 158 4.485 4.543 -0.058 1
1 840 . 4 1 1 A 69 69 PRO C C 158 174.602 176.294 -1.692 1
1 841 . 4 1 1 A 69 69 PRO CA C 158 61.556 62.282 -0.726 1
1 842 . 4 1 1 A 69 69 PRO CB C 158 32.370 32.433 -0.063 1
1 845 . 4 1 1 A 70 70 HIS H H 159 8.759 8.623 0.136 1
1 846 . 4 1 1 A 70 70 HIS HA H 159 3.947 4.387 -0.440 1
1 852 . 4 1 1 A 70 70 HIS CA C 159 56.250 55.211 1.039 1
1 853 . 4 1 1 A 70 70 HIS CB C 159 32.280 30.952 1.328 1
1 856 . 4 1 1 A 70 70 HIS N N 159 119.423 120.854 -1.431 1
1 857 . 4 1 1 A 71 71 PRO HA H 160 4.424 4.308 0.116 1
1 864 . 4 1 1 A 71 71 PRO C C 160 177.567 177.969 -0.402 1
1 865 . 4 1 1 A 71 71 PRO CA C 160 64.574 64.969 -0.395 1
1 866 . 4 1 1 A 71 71 PRO CB C 160 32.340 31.912 0.428 1
1 869 . 4 1 1 A 72 72 LEU H H 161 10.123 7.754 2.369 1
1 870 . 4 1 1 A 72 72 LEU HA H 161 4.778 4.408 0.370 1
1 880 . 4 1 1 A 72 72 LEU C C 161 178.721 177.988 0.733 1
1 881 . 4 1 1 A 72 72 LEU CA C 161 55.800 56.856 -1.056 1
1 882 . 4 1 1 A 72 72 LEU CB C 161 42.440 43.732 -1.292 1
1 886 . 4 1 1 A 72 72 LEU N N 161 117.374 117.495 -0.121 1
1 887 . 4 1 1 A 73 73 THR H H 162 7.523 8.042 -0.519 1
1 888 . 4 1 1 A 73 73 THR HA H 162 4.291 4.500 -0.209 1
1 893 . 4 1 1 A 73 73 THR C C 162 175.557 174.434 1.123 1
1 894 . 4 1 1 A 73 73 THR CA C 162 61.440 62.484 -1.044 1
1 895 . 4 1 1 A 73 73 THR CB C 162 70.500 69.762 0.738 1
1 897 . 4 1 1 A 73 73 THR N N 162 107.787 112.957 -5.170 1
1 898 . 4 1 1 A 74 74 ARG H H 163 8.361 7.962 0.399 1
1 899 . 4 1 1 A 74 74 ARG HA H 163 3.836 4.268 -0.432 1
1 906 . 4 1 1 A 74 74 ARG C C 163 174.701 175.206 -0.505 1
1 907 . 4 1 1 A 74 74 ARG CA C 163 57.980 57.599 0.381 1
1 908 . 4 1 1 A 74 74 ARG CB C 163 26.770 27.105 -0.335 1
1 911 . 4 1 1 A 74 74 ARG N N 163 115.130 118.433 -3.303 1
1 912 . 4 1 1 A 75 75 GLU H H 164 7.430 8.083 -0.653 1
1 913 . 4 1 1 A 75 75 GLU HA H 164 4.636 4.479 0.157 1
1 918 . 4 1 1 A 75 75 GLU CA C 164 53.699 55.011 -1.312 1
1 919 . 4 1 1 A 75 75 GLU CB C 164 29.550 28.514 1.036 1
1 921 . 4 1 1 A 75 75 GLU N N 164 120.076 119.041 1.035 1
1 922 . 4 1 1 A 76 76 PRO HA H 165 4.272 4.434 -0.162 1
1 929 . 4 1 1 A 76 76 PRO C C 165 176.649 176.988 -0.339 1
1 930 . 4 1 1 A 76 76 PRO CA C 165 63.204 63.202 0.002 1
1 931 . 4 1 1 A 76 76 PRO CB C 165 31.680 31.665 0.015 1
1 934 . 4 1 1 A 77 77 ILE H H 166 8.812 8.256 0.556 1
1 935 . 4 1 1 A 77 77 ILE HA H 166 3.838 4.291 -0.453 1
1 945 . 4 1 1 A 77 77 ILE C C 166 175.235 176.208 -0.973 1
1 946 . 4 1 1 A 77 77 ILE CA C 166 62.816 61.243 1.573 1
1 947 . 4 1 1 A 77 77 ILE CB C 166 37.750 37.834 -0.084 1
1 951 . 4 1 1 A 77 77 ILE N N 166 123.831 124.175 -0.344 1
1 952 . 4 1 1 A 78 78 THR H H 167 6.625 8.600 -1.975 1
1 953 . 4 1 1 A 78 78 THR HA H 167 4.632 5.007 -0.375 1
1 958 . 4 1 1 A 78 78 THR C C 167 174.143 173.972 0.171 1
1 959 . 4 1 1 A 78 78 THR CA C 167 58.750 60.283 -1.533 1
1 960 . 4 1 1 A 78 78 THR CB C 167 71.320 70.502 0.818 1
1 962 . 4 1 1 A 78 78 THR N N 167 115.293 118.638 -3.345 1
1 963 . 4 1 1 A 79 79 ALA H H 168 9.088 8.951 0.137 1
1 964 . 4 1 1 A 79 79 ALA HA H 168 3.916 4.114 -0.198 1
1 968 . 4 1 1 A 79 79 ALA C C 168 179.788 179.430 0.358 1
1 969 . 4 1 1 A 79 79 ALA CA C 168 55.480 54.974 0.506 1
1 970 . 4 1 1 A 79 79 ALA CB C 168 17.630 18.536 -0.906 1
1 971 . 4 1 1 A 79 79 ALA N N 168 122.102 127.641 -5.539 1
1 972 . 4 1 1 A 80 80 SER H H 169 7.988 7.673 0.315 1
1 973 . 4 1 1 A 80 80 SER HA H 169 4.058 4.197 -0.139 1
1 976 . 4 1 1 A 80 80 SER C C 169 176.029 176.426 -0.397 1
1 977 . 4 1 1 A 80 80 SER CA C 169 60.750 61.512 -0.762 1
1 978 . 4 1 1 A 80 80 SER CB C 169 62.510 63.031 -0.521 1
1 979 . 4 1 1 A 80 80 SER N N 169 109.541 112.952 -3.411 1
1 980 . 4 1 1 A 81 81 ILE H H 170 6.968 7.508 -0.540 1
1 981 . 4 1 1 A 81 81 ILE HA H 170 4.315 4.397 -0.082 1
1 991 . 4 1 1 A 81 81 ILE C C 170 174.242 175.209 -0.967 1
1 992 . 4 1 1 A 81 81 ILE CA C 170 62.296 61.296 1.000 1
1 993 . 4 1 1 A 81 81 ILE CB C 170 37.686 38.111 -0.425 1
1 997 . 4 1 1 A 81 81 ILE N N 170 112.476 113.513 -1.037 1
1 998 . 4 1 1 A 82 82 ILE H H 171 7.345 7.436 -0.091 1
1 999 . 4 1 1 A 82 82 ILE HA H 171 4.339 4.686 -0.347 1
1 1009 . 4 1 1 A 82 82 ILE C C 171 174.999 174.612 0.387 1
1 1010 . 4 1 1 A 82 82 ILE CA C 171 61.150 59.804 1.346 1
1 1011 . 4 1 1 A 82 82 ILE CB C 171 37.230 41.037 -3.807 1
1 1015 . 4 1 1 A 82 82 ILE N N 171 124.260 124.942 -0.682 1
1 1016 . 4 1 1 A 83 83 VAL H H 172 7.923 8.869 -0.946 1
1 1017 . 4 1 1 A 83 83 VAL HA H 172 4.673 5.021 -0.348 1
1 1025 . 4 1 1 A 83 83 VAL C C 172 174.887 175.407 -0.520 1
1 1026 . 4 1 1 A 83 83 VAL CA C 172 59.340 58.858 0.482 1
1 1027 . 4 1 1 A 83 83 VAL CB C 172 34.840 35.537 -0.697 1
1 1030 . 4 1 1 A 83 83 VAL N N 172 120.931 122.067 -1.136 1
1 1031 . 4 1 1 A 84 84 LYS H H 173 8.406 8.705 -0.299 1
1 1032 . 4 1 1 A 84 84 LYS HA H 173 4.410 4.468 -0.058 1
1 1041 . 4 1 1 A 84 84 LYS C C 173 178.734 178.020 0.714 1
1 1042 . 4 1 1 A 84 84 LYS CA C 173 56.360 55.660 0.700 1
1 1043 . 4 1 1 A 84 84 LYS CB C 173 33.100 32.812 0.288 1
1 1047 . 4 1 1 A 84 84 LYS N N 173 121.251 121.197 0.054 1
1 1048 . 4 1 1 A 85 85 HIS H H 174 9.221 8.547 0.674 1
1 1049 . 4 1 1 A 85 85 HIS HA H 174 4.024 4.493 -0.469 1
1 1053 . 4 1 1 A 85 85 HIS C C 174 177.183 176.852 0.331 1
1 1054 . 4 1 1 A 85 85 HIS CA C 174 59.460 59.043 0.417 1
1 1055 . 4 1 1 A 85 85 HIS CB C 174 27.920 29.308 -1.388 1
1 1057 . 4 1 1 A 85 85 HIS N N 174 121.545 121.047 0.498 1
1 1058 . 4 1 1 A 86 86 GLU H H 175 8.699 7.802 0.897 1
1 1059 . 4 1 1 A 86 86 GLU HA H 175 3.900 3.983 -0.083 1
1 1064 . 4 1 1 A 86 86 GLU C C 175 177.220 178.379 -1.159 1
1 1065 . 4 1 1 A 86 86 GLU CA C 175 58.420 58.864 -0.444 1
1 1066 . 4 1 1 A 86 86 GLU CB C 175 28.690 29.390 -0.700 1
1 1068 . 4 1 1 A 86 86 GLU N N 175 118.011 120.059 -2.048 1
1 1069 . 4 1 1 A 87 87 GLU H H 176 7.621 7.607 0.014 1
1 1070 . 4 1 1 A 87 87 GLU HA H 176 4.177 4.070 0.107 1
1 1075 . 4 1 1 A 87 87 GLU C C 176 175.222 176.005 -0.783 1
1 1076 . 4 1 1 A 87 87 GLU CA C 176 56.390 58.279 -1.889 1
1 1077 . 4 1 1 A 87 87 GLU CB C 176 30.430 29.869 0.561 1
1 1079 . 4 1 1 A 87 87 GLU N N 176 116.753 117.914 -1.161 1
1 1080 . 4 1 1 A 88 88 CYS H H 177 7.239 7.669 -0.430 1
1 1081 . 4 1 1 A 88 88 CYS HA H 177 5.148 5.155 -0.007 1
1 1084 . 4 1 1 A 88 88 CYS C C 177 173.249 172.632 0.617 1
1 1085 . 4 1 1 A 88 88 CYS CA C 177 57.240 56.568 0.672 1
1 1086 . 4 1 1 A 88 88 CYS CB C 177 31.020 31.137 -0.117 1
1 1087 . 4 1 1 A 88 88 CYS N N 177 116.096 115.429 0.667 1
1 1088 . 4 1 1 A 89 89 ILE H H 178 8.912 8.513 0.399 1
1 1089 . 4 1 1 A 89 89 ILE HA H 178 4.580 4.996 -0.416 1
1 1099 . 4 1 1 A 89 89 ILE C C 178 173.386 174.134 -0.748 1
1 1100 . 4 1 1 A 89 89 ILE CA C 178 59.270 58.999 0.271 1
1 1101 . 4 1 1 A 89 89 ILE CB C 178 42.990 41.853 1.137 1
1 1105 . 4 1 1 A 89 89 ILE N N 178 119.490 117.035 2.455 1
1 1106 . 4 1 1 A 90 90 TYR H H 179 9.047 8.790 0.257 1
1 1107 . 4 1 1 A 90 90 TYR HA H 179 3.753 4.321 -0.568 1
1 1112 . 4 1 1 A 90 90 TYR C C 179 173.932 173.984 -0.052 1
1 1113 . 4 1 1 A 90 90 TYR CA C 179 59.860 56.977 2.883 1
1 1114 . 4 1 1 A 90 90 TYR CB C 179 37.530 38.931 -1.401 1
1 1116 . 4 1 1 A 90 90 TYR N N 179 126.270 121.690 4.580 1
1 1117 . 4 1 1 A 91 91 ASP H H 180 7.462 8.482 -1.020 1
1 1118 . 4 1 1 A 91 91 ASP HA H 180 4.639 4.687 -0.048 1
1 1121 . 4 1 1 A 91 91 ASP C C 180 175.297 176.510 -1.213 1
1 1122 . 4 1 1 A 91 91 ASP CA C 180 52.496 52.562 -0.066 1
1 1123 . 4 1 1 A 91 91 ASP CB C 180 43.380 42.402 0.978 1
1 1124 . 4 1 1 A 91 91 ASP N N 180 129.593 124.879 4.714 1
1 1125 . 4 1 1 A 92 92 ASP H H 181 8.719 8.951 -0.232 1
1 1126 . 4 1 1 A 92 92 ASP HA H 181 4.109 4.318 -0.209 1
1 1129 . 4 1 1 A 92 92 ASP C C 181 177.555 178.325 -0.770 1
1 1130 . 4 1 1 A 92 92 ASP CA C 181 56.390 56.907 -0.517 1
1 1131 . 4 1 1 A 92 92 ASP CB C 181 41.330 39.726 1.604 1
1 1132 . 4 1 1 A 92 92 ASP N N 181 125.691 125.855 -0.164 1
1 1133 . 4 1 1 A 93 93 THR H H 182 8.271 7.528 0.743 1
1 1134 . 4 1 1 A 93 93 THR HA H 182 4.036 3.986 0.050 1
1 1139 . 4 1 1 A 93 93 THR C C 182 176.289 176.337 -0.048 1
1 1140 . 4 1 1 A 93 93 THR CA C 182 65.054 64.814 0.240 1
1 1141 . 4 1 1 A 93 93 THR CB C 182 68.560 68.893 -0.333 1
1 1143 . 4 1 1 A 93 93 THR N N 182 114.813 114.576 0.237 1
1 1144 . 4 1 1 A 94 94 ARG H H 183 7.753 7.188 0.565 1
1 1145 . 4 1 1 A 94 94 ARG HA H 183 4.139 4.268 -0.129 1
1 1152 . 4 1 1 A 94 94 ARG C C 183 176.897 177.117 -0.220 1
1 1153 . 4 1 1 A 94 94 ARG CA C 183 55.350 56.256 -0.906 1
1 1154 . 4 1 1 A 94 94 ARG CB C 183 30.930 30.821 0.109 1
1 1157 . 4 1 1 A 94 94 ARG N N 183 120.101 117.890 2.211 1
1 1158 . 4 1 1 A 95 95 GLY H H 184 8.112 8.682 -0.570 1
1 1159 . 4 1 1 A 95 95 GLY HA2 H 184 3.838 3.875 -0.037 1
1 1160 . 4 1 1 A 95 95 GLY HA3 H 184 3.670 3.884 -0.214 1
1 1161 . 4 1 1 A 95 95 GLY C C 184 173.659 173.398 0.261 1
1 1162 . 4 1 1 A 95 95 GLY CA C 184 46.040 46.007 0.033 1
1 1163 . 4 1 1 A 95 95 GLY N N 184 108.106 109.036 -0.930 1
1 1164 . 4 1 1 A 96 96 ASN H H 185 6.833 7.466 -0.633 1
1 1165 . 4 1 1 A 96 96 ASN HA H 185 4.944 5.295 -0.351 1
1 1170 . 4 1 1 A 96 96 ASN C C 185 174.267 174.056 0.211 1
1 1171 . 4 1 1 A 96 96 ASN CA C 185 52.560 51.776 0.784 1
1 1172 . 4 1 1 A 96 96 ASN CB C 185 45.890 42.619 3.271 1
1 1173 . 4 1 1 A 96 96 ASN N N 185 113.392 117.371 -3.979 1
1 1175 . 4 1 1 A 97 97 PHE H H 186 9.108 8.828 0.280 1
1 1176 . 4 1 1 A 97 97 PHE HA H 186 4.782 4.849 -0.067 1
1 1183 . 4 1 1 A 97 97 PHE C C 186 174.862 175.831 -0.969 1
1 1184 . 4 1 1 A 97 97 PHE CA C 186 60.056 58.789 1.267 1
1 1185 . 4 1 1 A 97 97 PHE CB C 186 40.180 39.826 0.354 1
1 1188 . 4 1 1 A 97 97 PHE N N 186 118.741 119.364 -0.623 1
1 1189 . 4 1 1 A 98 98 ILE H H 187 8.933 8.822 0.111 1
1 1190 . 4 1 1 A 98 98 ILE HA H 187 5.458 4.937 0.521 1
1 1200 . 4 1 1 A 98 98 ILE C C 187 176.041 175.017 1.024 1
1 1201 . 4 1 1 A 98 98 ILE CA C 187 57.610 59.148 -1.538 1
1 1202 . 4 1 1 A 98 98 ILE CB C 187 42.070 42.048 0.022 1
1 1206 . 4 1 1 A 98 98 ILE N N 187 117.857 118.184 -0.327 1
1 1207 . 4 1 1 A 99 99 ILE H H 188 8.284 8.716 -0.432 1
1 1208 . 4 1 1 A 99 99 ILE HA H 188 4.341 4.121 0.220 1
1 1218 . 4 1 1 A 99 99 ILE C C 188 176.413 176.377 0.036 1
1 1219 . 4 1 1 A 99 99 ILE CA C 188 59.190 61.500 -2.310 1
1 1220 . 4 1 1 A 99 99 ILE CB C 188 37.940 38.174 -0.234 1
1 1224 . 4 1 1 A 99 99 ILE N N 188 121.796 122.704 -0.908 1
1 1225 . 4 1 1 A 100 100 LYS H H 189 8.463 8.238 0.225 1
1 1226 . 4 1 1 A 100 100 LYS HA H 189 4.040 4.280 -0.240 1
1 1235 . 4 1 1 A 100 100 LYS C C 189 176.848 177.553 -0.705 1
1 1236 . 4 1 1 A 100 100 LYS CA C 189 57.241 56.293 0.948 1
1 1237 . 4 1 1 A 100 100 LYS CB C 189 33.400 32.967 0.433 1
1 1241 . 4 1 1 A 100 100 LYS N N 189 127.995 124.994 3.001 1
1 1242 . 4 1 1 A 101 101 GLY H H 190 8.346 8.743 -0.397 1
1 1243 . 4 1 1 A 101 101 GLY HA2 H 190 3.947 3.940 0.007 1
1 1244 . 4 1 1 A 101 101 GLY HA3 H 190 3.813 3.944 -0.131 1
1 1245 . 4 1 1 A 101 101 GLY C C 190 172.902 174.253 -1.351 1
1 1246 . 4 1 1 A 101 101 GLY CA C 190 44.920 46.807 -1.887 1
1 1247 . 4 1 1 A 101 101 GLY N N 190 110.882 110.387 0.495 1
1 7 . 5 1 1 A 2 2 GLN H H 91 8.786 7.909 0.877 1
1 8 . 5 1 1 A 2 2 GLN HA H 91 4.005 3.973 0.032 1
1 15 . 5 1 1 A 2 2 GLN C C 91 177.270 178.315 -1.045 1
1 16 . 5 1 1 A 2 2 GLN CA C 91 58.220 59.161 -0.941 1
1 17 . 5 1 1 A 2 2 GLN CB C 91 28.650 28.119 0.531 1
1 19 . 5 1 1 A 2 2 GLN N N 91 121.993 121.063 0.930 1
1 21 . 5 1 1 A 3 3 GLU H H 92 8.430 8.362 0.068 1
1 22 . 5 1 1 A 3 3 GLU HA H 92 4.007 4.100 -0.093 1
1 27 . 5 1 1 A 3 3 GLU C C 92 178.287 178.767 -0.480 1
1 28 . 5 1 1 A 3 3 GLU CA C 92 59.490 59.192 0.298 1
1 29 . 5 1 1 A 3 3 GLU CB C 92 29.506 29.536 -0.030 1
1 31 . 5 1 1 A 3 3 GLU N N 92 120.195 118.480 1.715 1
1 32 . 5 1 1 A 4 4 SER H H 93 8.209 7.788 0.421 1
1 33 . 5 1 1 A 4 4 SER HA H 93 4.272 4.291 -0.019 1
1 36 . 5 1 1 A 4 4 SER C C 93 177.369 177.423 -0.054 1
1 37 . 5 1 1 A 4 4 SER CA C 93 61.044 61.315 -0.271 1
1 38 . 5 1 1 A 4 4 SER CB C 93 62.950 62.845 0.105 1
1 39 . 5 1 1 A 4 4 SER N N 93 115.524 115.403 0.121 1
1 40 . 5 1 1 A 5 5 ILE H H 94 8.080 7.668 0.412 1
1 41 . 5 1 1 A 5 5 ILE HA H 94 3.530 3.618 -0.088 1
1 51 . 5 1 1 A 5 5 ILE C C 94 177.778 178.177 -0.399 1
1 52 . 5 1 1 A 5 5 ILE CA C 94 65.710 65.495 0.215 1
1 53 . 5 1 1 A 5 5 ILE CB C 94 37.800 37.959 -0.159 1
1 57 . 5 1 1 A 5 5 ILE N N 94 124.148 121.920 2.228 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 4.212 -0.087 1
1 66 . 5 1 1 A 6 6 GLN C C 95 179.726 179.127 0.599 1
1 67 . 5 1 1 A 6 6 GLN CA C 95 59.190 58.610 0.580 1
1 68 . 5 1 1 A 6 6 GLN CB C 95 27.060 27.726 -0.666 1
1 70 . 5 1 1 A 6 6 GLN N N 95 118.257 118.277 -0.020 1
1 72 . 5 1 1 A 7 7 ASN H H 96 8.456 8.054 0.402 1
1 73 . 5 1 1 A 7 7 ASN HA H 96 4.446 4.515 -0.069 1
1 78 . 5 1 1 A 7 7 ASN C C 96 177.257 178.559 -1.302 1
1 79 . 5 1 1 A 7 7 ASN CA C 96 56.020 56.130 -0.110 1
1 80 . 5 1 1 A 7 7 ASN CB C 96 38.126 37.920 0.206 1
1 81 . 5 1 1 A 7 7 ASN N N 96 118.597 118.484 0.113 1
1 83 . 5 1 1 A 8 8 LYS H H 97 7.732 7.635 0.097 1
1 84 . 5 1 1 A 8 8 LYS HA H 97 4.129 4.077 0.052 1
1 93 . 5 1 1 A 8 8 LYS C C 97 179.143 179.650 -0.507 1
1 94 . 5 1 1 A 8 8 LYS CA C 97 59.126 59.659 -0.533 1
1 95 . 5 1 1 A 8 8 LYS CB C 97 32.070 32.672 -0.602 1
1 99 . 5 1 1 A 8 8 LYS N N 97 122.381 120.244 2.137 1
1 100 . 5 1 1 A 9 9 ILE H H 98 8.452 8.072 0.380 1
1 101 . 5 1 1 A 9 9 ILE HA H 98 3.480 3.809 -0.329 1
1 111 . 5 1 1 A 9 9 ILE C C 98 177.406 178.344 -0.938 1
1 112 . 5 1 1 A 9 9 ILE CA C 98 66.430 65.113 1.317 1
1 113 . 5 1 1 A 9 9 ILE CB C 98 37.980 37.441 0.539 1
1 117 . 5 1 1 A 9 9 ILE N N 98 119.950 120.945 -0.995 1
1 118 . 5 1 1 A 10 10 SER H H 99 7.924 7.979 -0.055 1
1 119 . 5 1 1 A 10 10 SER HA H 99 3.983 4.125 -0.142 1
1 122 . 5 1 1 A 10 10 SER C C 99 176.327 176.498 -0.171 1
1 123 . 5 1 1 A 10 10 SER CA C 99 61.990 61.434 0.556 1
1 124 . 5 1 1 A 10 10 SER CB C 99 62.790 63.055 -0.265 1
1 125 . 5 1 1 A 10 10 SER N N 99 113.568 116.593 -3.025 1
1 126 . 5 1 1 A 11 11 GLN H H 100 7.832 7.268 0.564 1
1 127 . 5 1 1 A 11 11 GLN HA H 100 4.238 4.249 -0.011 1
1 134 . 5 1 1 A 11 11 GLN C C 100 178.088 178.076 0.012 1
1 135 . 5 1 1 A 11 11 GLN CA C 100 57.900 57.946 -0.046 1
1 136 . 5 1 1 A 11 11 GLN CB C 100 29.790 29.386 0.404 1
1 138 . 5 1 1 A 11 11 GLN N N 100 117.487 120.172 -2.685 1
1 140 . 5 1 1 A 12 12 CYS H H 101 7.920 8.221 -0.301 1
1 141 . 5 1 1 A 12 12 CYS HA H 101 4.657 4.554 0.103 1
1 144 . 5 1 1 A 12 12 CYS C C 101 175.446 174.869 0.577 1
1 145 . 5 1 1 A 12 12 CYS CA C 101 60.654 60.727 -0.073 1
1 146 . 5 1 1 A 12 12 CYS CB C 101 29.310 27.790 1.520 1
1 147 . 5 1 1 A 12 12 CYS N N 101 114.221 116.738 -2.517 1
1 148 . 5 1 1 A 13 13 LYS H H 102 8.029 7.201 0.828 1
1 149 . 5 1 1 A 13 13 LYS HA H 102 5.069 4.878 0.191 1
1 158 . 5 1 1 A 13 13 LYS C C 102 174.800 176.428 -1.628 1
1 159 . 5 1 1 A 13 13 LYS CA C 102 56.394 56.396 -0.002 1
1 160 . 5 1 1 A 13 13 LYS CB C 102 32.770 33.425 -0.655 1
1 164 . 5 1 1 A 13 13 LYS N N 102 124.129 119.280 4.849 1
1 165 . 5 1 1 A 14 14 PHE H H 103 8.737 8.574 0.163 1
1 166 . 5 1 1 A 14 14 PHE HA H 103 5.059 5.138 -0.079 1
1 174 . 5 1 1 A 14 14 PHE C C 103 173.560 173.482 0.078 1
1 175 . 5 1 1 A 14 14 PHE CA C 103 55.470 55.795 -0.325 1
1 176 . 5 1 1 A 14 14 PHE CB C 103 41.760 41.513 0.247 1
1 180 . 5 1 1 A 14 14 PHE N N 103 118.661 116.654 2.007 1
1 181 . 5 1 1 A 15 15 SER H H 104 8.826 8.765 0.061 1
1 182 . 5 1 1 A 15 15 SER HA H 104 4.602 4.480 0.122 1
1 185 . 5 1 1 A 15 15 SER C C 104 173.795 173.595 0.200 1
1 186 . 5 1 1 A 15 15 SER CA C 104 58.610 59.210 -0.600 1
1 187 . 5 1 1 A 15 15 SER CB C 104 62.690 62.215 0.475 1
1 188 . 5 1 1 A 15 15 SER N N 104 117.781 116.627 1.154 1
1 189 . 5 1 1 A 16 16 VAL H H 105 7.784 8.102 -0.318 1
1 190 . 5 1 1 A 16 16 VAL HA H 105 3.370 4.169 -0.799 1
1 198 . 5 1 1 A 16 16 VAL C C 105 174.987 175.242 -0.255 1
1 199 . 5 1 1 A 16 16 VAL CA C 105 63.580 62.622 0.958 1
1 200 . 5 1 1 A 16 16 VAL CB C 105 31.410 30.398 1.012 1
1 203 . 5 1 1 A 16 16 VAL N N 105 129.075 126.446 2.629 1
1 204 . 5 1 1 A 17 17 CYS H H 106 8.536 8.625 -0.089 1
1 205 . 5 1 1 A 17 17 CYS HA H 106 5.011 4.932 0.079 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 29.117 -0.907 1
1 210 . 5 1 1 A 17 17 CYS N N 106 130.045 127.179 2.866 1
1 211 . 5 1 1 A 18 18 PRO HA H 107 3.991 4.299 -0.308 1
1 218 . 5 1 1 A 18 18 PRO C C 107 178.188 177.831 0.357 1
1 219 . 5 1 1 A 18 18 PRO CA C 107 65.940 64.461 1.479 1
1 220 . 5 1 1 A 18 18 PRO CB C 107 32.000 31.986 0.014 1
1 223 . 5 1 1 A 19 19 GLU H H 108 9.260 8.951 0.309 1
1 224 . 5 1 1 A 19 19 GLU HA H 108 4.119 4.105 0.014 1
1 229 . 5 1 1 A 19 19 GLU C C 108 178.721 179.095 -0.374 1
1 230 . 5 1 1 A 19 19 GLU CA C 108 59.300 58.857 0.443 1
1 231 . 5 1 1 A 19 19 GLU CB C 108 28.920 29.056 -0.136 1
1 233 . 5 1 1 A 19 19 GLU N N 108 118.270 115.821 2.449 1
1 234 . 5 1 1 A 20 20 ARG H H 109 7.672 7.615 0.057 1
1 235 . 5 1 1 A 20 20 ARG HA H 109 4.331 4.090 0.241 1
1 242 . 5 1 1 A 20 20 ARG C C 109 177.977 178.692 -0.715 1
1 243 . 5 1 1 A 20 20 ARG CA C 109 57.350 59.172 -1.822 1
1 244 . 5 1 1 A 20 20 ARG CB C 109 30.820 30.742 0.078 1
1 247 . 5 1 1 A 20 20 ARG N N 109 118.357 119.359 -1.002 1
1 248 . 5 1 1 A 21 21 LEU H H 110 7.601 7.792 -0.191 1
1 249 . 5 1 1 A 21 21 LEU HA H 110 4.380 4.233 0.147 1
1 259 . 5 1 1 A 21 21 LEU C C 110 176.562 176.463 0.099 1
1 260 . 5 1 1 A 21 21 LEU CA C 110 56.096 55.770 0.326 1
1 261 . 5 1 1 A 21 21 LEU CB C 110 44.016 42.149 1.867 1
1 265 . 5 1 1 A 21 21 LEU N N 110 118.626 118.922 -0.296 1
1 266 . 5 1 1 A 22 22 GLN H H 111 7.750 7.829 -0.079 1
1 267 . 5 1 1 A 22 22 GLN HA H 111 3.870 3.970 -0.100 1
1 274 . 5 1 1 A 22 22 GLN C C 111 173.336 174.738 -1.402 1
1 275 . 5 1 1 A 22 22 GLN CA C 111 56.510 57.164 -0.654 1
1 276 . 5 1 1 A 22 22 GLN CB C 111 26.800 26.617 0.183 1
1 278 . 5 1 1 A 22 22 GLN N N 111 113.926 115.448 -1.522 1
1 280 . 5 1 1 A 23 23 CYS H H 112 7.407 7.826 -0.419 1
1 281 . 5 1 1 A 23 23 CYS HA H 112 4.469 4.689 -0.220 1
1 284 . 5 1 1 A 23 23 CYS CA C 112 52.650 58.032 -5.382 1
1 285 . 5 1 1 A 23 23 CYS CB C 112 29.750 28.305 1.445 1
1 286 . 5 1 1 A 23 23 CYS N N 112 112.681 118.448 -5.767 1
1 287 . 5 1 1 A 24 24 PRO HA H 113 4.408 4.594 -0.186 1
1 294 . 5 1 1 A 24 24 PRO C C 113 178.175 177.586 0.589 1
1 295 . 5 1 1 A 24 24 PRO CA C 113 62.040 62.793 -0.753 1
1 296 . 5 1 1 A 24 24 PRO CB C 113 31.920 32.662 -0.742 1
1 299 . 5 1 1 A 25 25 LEU H H 114 8.593 8.442 0.151 1
1 300 . 5 1 1 A 25 25 LEU HA H 114 3.765 3.906 -0.141 1
1 310 . 5 1 1 A 25 25 LEU C C 114 179.950 178.956 0.994 1
1 311 . 5 1 1 A 25 25 LEU CA C 114 57.674 57.751 -0.077 1
1 312 . 5 1 1 A 25 25 LEU CB C 114 40.690 41.554 -0.864 1
1 316 . 5 1 1 A 25 25 LEU N N 114 123.729 123.662 0.067 1
1 317 . 5 1 1 A 26 26 GLU H H 115 9.108 8.607 0.501 1
1 318 . 5 1 1 A 26 26 GLU HA H 115 3.876 4.027 -0.151 1
1 323 . 5 1 1 A 26 26 GLU C C 115 177.505 178.531 -1.026 1
1 324 . 5 1 1 A 26 26 GLU CA C 115 59.410 59.331 0.079 1
1 325 . 5 1 1 A 26 26 GLU CB C 115 28.460 29.359 -0.899 1
1 327 . 5 1 1 A 26 26 GLU N N 115 116.817 117.614 -0.797 1
1 328 . 5 1 1 A 27 27 ALA H H 116 7.360 7.669 -0.309 1
1 329 . 5 1 1 A 27 27 ALA HA H 116 4.408 4.111 0.297 1
1 333 . 5 1 1 A 27 27 ALA C C 116 177.046 177.890 -0.844 1
1 334 . 5 1 1 A 27 27 ALA CA C 116 52.970 54.543 -1.573 1
1 335 . 5 1 1 A 27 27 ALA CB C 116 19.916 18.337 1.579 1
1 336 . 5 1 1 A 27 27 ALA N N 116 118.966 120.729 -1.763 1
1 337 . 5 1 1 A 28 28 ILE H H 117 7.168 6.971 0.197 1
1 338 . 5 1 1 A 28 28 ILE HA H 117 4.432 4.428 0.004 1
1 348 . 5 1 1 A 28 28 ILE C C 117 172.641 175.547 -2.906 1
1 349 . 5 1 1 A 28 28 ILE CA C 117 59.980 59.470 0.510 1
1 350 . 5 1 1 A 28 28 ILE CB C 117 37.350 37.306 0.044 1
1 354 . 5 1 1 A 28 28 ILE N N 117 108.913 108.925 -0.012 1
1 355 . 5 1 1 A 29 29 GLN H H 118 6.562 7.307 -0.745 1
1 356 . 5 1 1 A 29 29 GLN HA H 118 3.922 4.233 -0.311 1
1 363 . 5 1 1 A 29 29 GLN C C 118 175.049 175.470 -0.421 1
1 364 . 5 1 1 A 29 29 GLN CA C 118 54.596 56.019 -1.423 1
1 365 . 5 1 1 A 29 29 GLN CB C 118 29.570 29.099 0.471 1
1 367 . 5 1 1 A 29 29 GLN N N 118 116.455 122.985 -6.530 1
1 369 . 5 1 1 A 30 30 CYS H H 119 8.138 8.349 -0.211 1
1 370 . 5 1 1 A 30 30 CYS HA H 119 4.580 4.552 0.028 1
1 373 . 5 1 1 A 30 30 CYS CA C 119 57.810 56.891 0.919 1
1 374 . 5 1 1 A 30 30 CYS CB C 119 30.200 28.731 1.469 1
1 375 . 5 1 1 A 30 30 CYS N N 119 134.136 125.381 8.755 1
1 376 . 5 1 1 A 31 31 PRO HA H 120 4.424 4.476 -0.052 1
1 383 . 5 1 1 A 31 31 PRO C C 120 177.431 177.837 -0.406 1
1 384 . 5 1 1 A 31 31 PRO CA C 120 64.060 64.078 -0.018 1
1 385 . 5 1 1 A 31 31 PRO CB C 120 32.776 31.834 0.942 1
1 388 . 5 1 1 A 32 32 ILE H H 121 11.318 7.602 3.716 1
1 389 . 5 1 1 A 32 32 ILE HA H 121 4.038 3.948 0.090 1
1 399 . 5 1 1 A 32 32 ILE C C 121 178.485 177.877 0.608 1
1 400 . 5 1 1 A 32 32 ILE CA C 121 64.060 64.220 -0.160 1
1 401 . 5 1 1 A 32 32 ILE CB C 121 39.340 38.242 1.098 1
1 405 . 5 1 1 A 32 32 ILE N N 121 124.500 117.134 7.366 1
1 406 . 5 1 1 A 33 33 THR H H 122 9.928 7.814 2.114 1
1 407 . 5 1 1 A 33 33 THR HA H 122 4.048 4.346 -0.298 1
1 412 . 5 1 1 A 33 33 THR C C 122 175.793 175.017 0.776 1
1 413 . 5 1 1 A 33 33 THR CA C 122 62.990 61.989 1.001 1
1 414 . 5 1 1 A 33 33 THR CB C 122 70.300 70.034 0.266 1
1 416 . 5 1 1 A 33 33 THR N N 122 115.136 109.332 5.804 1
1 417 . 5 1 1 A 34 34 LEU H H 123 8.439 7.726 0.713 1
1 418 . 5 1 1 A 34 34 LEU HA H 123 3.912 3.833 0.079 1
1 428 . 5 1 1 A 34 34 LEU C C 123 175.495 175.129 0.366 1
1 429 . 5 1 1 A 34 34 LEU CA C 123 56.290 56.242 0.048 1
1 430 . 5 1 1 A 34 34 LEU CB C 123 38.500 39.758 -1.258 1
1 434 . 5 1 1 A 34 34 LEU N N 123 117.230 118.786 -1.556 1
1 435 . 5 1 1 A 35 35 GLU H H 124 7.816 7.006 0.810 1
1 436 . 5 1 1 A 35 35 GLU HA H 124 4.634 4.820 -0.186 1
1 441 . 5 1 1 A 35 35 GLU C C 124 174.838 173.902 0.936 1
1 442 . 5 1 1 A 35 35 GLU CA C 124 53.780 54.751 -0.971 1
1 443 . 5 1 1 A 35 35 GLU CB C 124 33.710 32.459 1.251 1
1 445 . 5 1 1 A 35 35 GLU N N 124 116.577 114.158 2.419 1
1 446 . 5 1 1 A 36 36 GLN H H 125 8.532 8.441 0.091 1
1 447 . 5 1 1 A 36 36 GLN HA H 125 4.958 4.403 0.555 1
1 454 . 5 1 1 A 36 36 GLN CA C 125 53.350 53.278 0.072 1
1 455 . 5 1 1 A 36 36 GLN CB C 125 29.950 29.180 0.770 1
1 457 . 5 1 1 A 36 36 GLN N N 125 123.034 123.659 -0.625 1
1 459 . 5 1 1 A 37 37 PRO HA H 126 4.458 4.709 -0.251 1
1 466 . 5 1 1 A 37 37 PRO C C 126 176.314 176.635 -0.321 1
1 467 . 5 1 1 A 37 37 PRO CA C 126 62.816 62.502 0.314 1
1 468 . 5 1 1 A 37 37 PRO CB C 126 33.070 32.934 0.136 1
1 471 . 5 1 1 A 38 38 GLU H H 127 8.626 8.365 0.261 1
1 472 . 5 1 1 A 38 38 GLU HA H 127 4.274 4.193 0.081 1
1 477 . 5 1 1 A 38 38 GLU C C 127 177.877 175.935 1.942 1
1 478 . 5 1 1 A 38 38 GLU CA C 127 58.730 57.165 1.565 1
1 479 . 5 1 1 A 38 38 GLU CB C 127 30.340 30.331 0.009 1
1 481 . 5 1 1 A 38 38 GLU N N 127 120.691 119.183 1.508 1
1 482 . 5 1 1 A 39 39 LYS H H 128 7.861 7.820 0.041 1
1 483 . 5 1 1 A 39 39 LYS HA H 128 4.889 4.880 0.009 1
1 492 . 5 1 1 A 39 39 LYS C C 128 175.446 174.840 0.606 1
1 493 . 5 1 1 A 39 39 LYS CA C 128 53.670 54.665 -0.995 1
1 494 . 5 1 1 A 39 39 LYS CB C 128 33.630 35.608 -1.978 1
1 498 . 5 1 1 A 39 39 LYS N N 128 117.878 117.089 0.789 1
1 499 . 5 1 1 A 40 40 GLY H H 129 8.426 7.769 0.657 1
1 500 . 5 1 1 A 40 40 GLY HA2 H 129 4.970 4.012 0.958 1
1 501 . 5 1 1 A 40 40 GLY HA3 H 129 2.458 4.155 -1.697 1
1 502 . 5 1 1 A 40 40 GLY C C 129 170.048 172.248 -2.200 1
1 503 . 5 1 1 A 40 40 GLY CA C 129 42.910 44.920 -2.010 1
1 504 . 5 1 1 A 40 40 GLY N N 129 112.604 106.628 5.976 1
1 505 . 5 1 1 A 41 41 ILE H H 130 8.596 9.008 -0.412 1
1 506 . 5 1 1 A 41 41 ILE HA H 130 4.636 5.087 -0.451 1
1 516 . 5 1 1 A 41 41 ILE C C 130 172.691 174.224 -1.533 1
1 517 . 5 1 1 A 41 41 ILE CA C 130 58.500 58.644 -0.144 1
1 518 . 5 1 1 A 41 41 ILE CB C 130 43.320 41.763 1.557 1
1 522 . 5 1 1 A 41 41 ILE N N 130 113.363 116.547 -3.184 1
1 523 . 5 1 1 A 42 42 PHE H H 131 8.994 8.958 0.036 1
1 524 . 5 1 1 A 42 42 PHE HA H 131 5.075 5.234 -0.159 1
1 532 . 5 1 1 A 42 42 PHE C C 131 175.111 175.199 -0.088 1
1 533 . 5 1 1 A 42 42 PHE CA C 131 58.680 57.168 1.512 1
1 534 . 5 1 1 A 42 42 PHE CB C 131 42.220 40.369 1.851 1
1 538 . 5 1 1 A 42 42 PHE N N 131 125.156 122.324 2.832 1
1 539 . 5 1 1 A 43 43 VAL H H 132 8.399 9.204 -0.805 1
1 540 . 5 1 1 A 43 43 VAL HA H 132 4.920 4.813 0.107 1
1 548 . 5 1 1 A 43 43 VAL C C 132 178.175 175.324 2.851 1
1 549 . 5 1 1 A 43 43 VAL CA C 132 59.600 60.769 -1.169 1
1 550 . 5 1 1 A 43 43 VAL CB C 132 35.920 34.992 0.928 1
1 553 . 5 1 1 A 43 43 VAL N N 132 119.371 123.289 -3.918 1
1 554 . 5 1 1 A 44 44 LYS H H 133 10.041 8.554 1.487 1
1 555 . 5 1 1 A 44 44 LYS HA H 133 4.920 4.299 0.621 1
1 564 . 5 1 1 A 44 44 LYS C C 133 177.195 175.799 1.396 1
1 565 . 5 1 1 A 44 44 LYS CA C 133 57.310 56.608 0.702 1
1 566 . 5 1 1 A 44 44 LYS CB C 133 34.410 32.664 1.746 1
1 570 . 5 1 1 A 44 44 LYS N N 133 130.928 126.800 4.128 1
1 571 . 5 1 1 A 45 45 ASN H H 134 8.534 8.737 -0.203 1
1 572 . 5 1 1 A 45 45 ASN HA H 134 4.151 4.619 -0.468 1
1 577 . 5 1 1 A 45 45 ASN C C 134 174.217 175.119 -0.902 1
1 578 . 5 1 1 A 45 45 ASN CA C 134 55.290 52.466 2.824 1
1 579 . 5 1 1 A 45 45 ASN CB C 134 37.530 38.175 -0.645 1
1 580 . 5 1 1 A 45 45 ASN N N 134 119.452 124.312 -4.860 1
1 582 . 5 1 1 A 46 46 SER H H 135 7.570 7.879 -0.309 1
1 583 . 5 1 1 A 46 46 SER HA H 135 4.220 4.070 0.150 1
1 586 . 5 1 1 A 46 46 SER C C 135 174.490 176.750 -2.260 1
1 587 . 5 1 1 A 46 46 SER CA C 135 57.090 61.428 -4.338 1
1 588 . 5 1 1 A 46 46 SER CB C 135 64.126 63.035 1.091 1
1 589 . 5 1 1 A 46 46 SER N N 135 105.613 121.541 -15.928 1
1 590 . 5 1 1 A 47 47 ASP H H 136 9.113 8.234 0.879 1
1 591 . 5 1 1 A 47 47 ASP HA H 136 4.220 4.330 -0.110 1
1 594 . 5 1 1 A 47 47 ASP CA C 136 57.610 57.003 0.607 1
1 595 . 5 1 1 A 47 47 ASP CB C 136 40.810 40.409 0.401 1
1 596 . 5 1 1 A 47 47 ASP N N 136 120.995 120.887 0.108 1
1 597 . 5 1 1 A 48 48 GLY H H 137 8.172 7.804 0.368 1
1 598 . 5 1 1 A 48 48 GLY HA2 H 137 4.096 3.717 0.379 1
1 599 . 5 1 1 A 48 48 GLY HA3 H 137 3.664 3.724 -0.060 1
1 600 . 5 1 1 A 48 48 GLY C C 137 173.990 174.935 -0.945 1
1 601 . 5 1 1 A 48 48 GLY CA C 137 45.130 47.238 -2.108 1
1 602 . 5 1 1 A 48 48 GLY N N 137 105.838 107.268 -1.430 1
1 603 . 5 1 1 A 49 49 SER H H 138 7.252 7.384 -0.132 1
1 604 . 5 1 1 A 49 49 SER HA H 138 4.503 4.674 -0.171 1
1 607 . 5 1 1 A 49 49 SER C C 138 173.857 173.978 -0.121 1
1 608 . 5 1 1 A 49 49 SER CA C 138 57.340 57.460 -0.120 1
1 609 . 5 1 1 A 49 49 SER CB C 138 65.370 64.639 0.731 1
1 610 . 5 1 1 A 49 49 SER N N 138 114.942 111.895 3.047 1
1 611 . 5 1 1 A 50 50 ASP H H 139 8.276 8.006 0.270 1
1 612 . 5 1 1 A 50 50 ASP HA H 139 4.618 4.243 0.375 1
1 615 . 5 1 1 A 50 50 ASP C C 139 174.577 174.634 -0.057 1
1 616 . 5 1 1 A 50 50 ASP CA C 139 53.116 55.514 -2.398 1
1 617 . 5 1 1 A 50 50 ASP CB C 139 40.520 40.271 0.249 1
1 618 . 5 1 1 A 50 50 ASP N N 139 122.088 120.373 1.715 1
1 619 . 5 1 1 A 51 51 VAL H H 140 8.192 7.351 0.841 1
1 620 . 5 1 1 A 51 51 VAL HA H 140 4.299 4.422 -0.123 1
1 628 . 5 1 1 A 51 51 VAL C C 140 175.867 175.685 0.182 1
1 629 . 5 1 1 A 51 51 VAL CA C 140 62.950 61.139 1.811 1
1 630 . 5 1 1 A 51 51 VAL CB C 140 33.230 33.484 -0.254 1
1 632 . 5 1 1 A 51 51 VAL N N 140 121.167 118.839 2.328 1
1 633 . 5 1 1 A 52 52 CYS H H 141 8.391 8.452 -0.061 1
1 634 . 5 1 1 A 52 52 CYS HA H 141 5.247 5.163 0.084 1
1 637 . 5 1 1 A 52 52 CYS C C 141 172.778 174.289 -1.511 1
1 638 . 5 1 1 A 52 52 CYS CA C 141 56.480 58.138 -1.658 1
1 639 . 5 1 1 A 52 52 CYS CB C 141 31.960 29.173 2.787 1
1 640 . 5 1 1 A 52 52 CYS N N 141 121.884 125.767 -3.883 1
1 641 . 5 1 1 A 53 53 THR H H 142 8.777 8.925 -0.148 1
1 642 . 5 1 1 A 53 53 THR HA H 142 4.489 5.066 -0.577 1
1 648 . 5 1 1 A 53 53 THR C C 142 171.885 172.669 -0.784 1
1 649 . 5 1 1 A 53 53 THR CA C 142 62.070 61.232 0.838 1
1 650 . 5 1 1 A 53 53 THR CB C 142 71.390 71.946 -0.556 1
1 652 . 5 1 1 A 53 53 THR N N 142 118.132 117.106 1.026 1
1 653 . 5 1 1 A 54 54 LEU H H 143 8.409 8.472 -0.063 1
1 654 . 5 1 1 A 54 54 LEU HA H 143 4.276 4.880 -0.604 1
1 664 . 5 1 1 A 54 54 LEU C C 143 174.366 174.143 0.223 1
1 665 . 5 1 1 A 54 54 LEU CA C 143 54.330 53.462 0.868 1
1 666 . 5 1 1 A 54 54 LEU CB C 143 42.396 43.612 -1.216 1
1 670 . 5 1 1 A 54 54 LEU N N 143 127.980 128.104 -0.124 1
1 671 . 5 1 1 A 55 55 PHE H H 144 8.646 8.725 -0.079 1
1 672 . 5 1 1 A 55 55 PHE HA H 144 5.455 4.805 0.650 1
1 680 . 5 1 1 A 55 55 PHE C C 144 176.054 174.579 1.475 1
1 681 . 5 1 1 A 55 55 PHE CA C 144 55.250 56.167 -0.917 1
1 682 . 5 1 1 A 55 55 PHE CB C 144 44.100 42.171 1.929 1
1 686 . 5 1 1 A 55 55 PHE N N 144 122.010 126.150 -4.140 1
1 687 . 5 1 1 A 56 56 ASP H H 145 11.575 8.350 3.225 1
1 688 . 5 1 1 A 56 56 ASP HA H 145 4.416 4.511 -0.095 1
1 691 . 5 1 1 A 56 56 ASP C C 145 176.748 177.433 -0.685 1
1 692 . 5 1 1 A 56 56 ASP CA C 145 55.840 54.820 1.020 1
1 693 . 5 1 1 A 56 56 ASP CB C 145 44.390 42.007 2.383 1
1 694 . 5 1 1 A 56 56 ASP N N 145 121.936 124.146 -2.210 1
1 695 . 5 1 1 A 57 57 ALA H H 146 8.508 8.595 -0.087 1
1 696 . 5 1 1 A 57 57 ALA HA H 146 3.797 4.020 -0.223 1
1 700 . 5 1 1 A 57 57 ALA C C 146 178.696 180.004 -1.308 1
1 701 . 5 1 1 A 57 57 ALA CA C 146 55.990 55.632 0.358 1
1 702 . 5 1 1 A 57 57 ALA CB C 146 18.840 18.096 0.744 1
1 703 . 5 1 1 A 57 57 ALA N N 146 130.243 129.540 0.703 1
1 704 . 5 1 1 A 58 58 ALA H H 147 8.378 7.876 0.502 1
1 705 . 5 1 1 A 58 58 ALA HA H 147 4.078 4.227 -0.149 1
1 709 . 5 1 1 A 58 58 ALA C C 147 181.091 179.523 1.568 1
1 710 . 5 1 1 A 58 58 ALA CA C 147 54.770 54.927 -0.157 1
1 711 . 5 1 1 A 58 58 ALA CB C 147 17.700 18.444 -0.744 1
1 712 . 5 1 1 A 58 58 ALA N N 147 121.997 119.400 2.597 1
1 713 . 5 1 1 A 59 59 ALA H H 148 9.138 7.912 1.226 1
1 714 . 5 1 1 A 59 59 ALA HA H 148 3.975 4.039 -0.064 1
1 718 . 5 1 1 A 59 59 ALA C C 148 180.508 179.844 0.664 1
1 719 . 5 1 1 A 59 59 ALA CA C 148 54.840 55.209 -0.369 1
1 720 . 5 1 1 A 59 59 ALA CB C 148 18.600 18.643 -0.043 1
1 721 . 5 1 1 A 59 59 ALA N N 148 123.595 120.552 3.043 1
1 722 . 5 1 1 A 60 60 PHE H H 149 8.814 8.199 0.615 1
1 723 . 5 1 1 A 60 60 PHE HA H 149 3.722 4.027 -0.305 1
1 731 . 5 1 1 A 60 60 PHE C C 149 176.773 177.581 -0.808 1
1 732 . 5 1 1 A 60 60 PHE CA C 149 62.030 61.524 0.506 1
1 733 . 5 1 1 A 60 60 PHE CB C 149 39.960 39.072 0.888 1
1 737 . 5 1 1 A 60 60 PHE N N 149 120.354 119.673 0.681 1
1 738 . 5 1 1 A 61 61 SER H H 150 8.276 8.214 0.062 1
1 739 . 5 1 1 A 61 61 SER HA H 150 3.880 4.192 -0.312 1
1 742 . 5 1 1 A 61 61 SER C C 150 177.691 177.157 0.534 1
1 743 . 5 1 1 A 61 61 SER CA C 150 62.190 61.175 1.015 1
1 744 . 5 1 1 A 61 61 SER CB C 150 63.016 63.228 -0.212 1
1 745 . 5 1 1 A 61 61 SER N N 150 112.086 114.177 -2.091 1
1 746 . 5 1 1 A 62 62 ARG H H 151 7.829 7.688 0.141 1
1 747 . 5 1 1 A 62 62 ARG HA H 151 3.971 4.063 -0.092 1
1 754 . 5 1 1 A 62 62 ARG C C 151 178.287 178.717 -0.430 1
1 755 . 5 1 1 A 62 62 ARG CA C 151 59.340 59.054 0.286 1
1 756 . 5 1 1 A 62 62 ARG CB C 151 29.760 29.753 0.007 1
1 759 . 5 1 1 A 62 62 ARG N N 151 121.090 121.717 -0.627 1
1 760 . 5 1 1 A 63 63 LEU H H 152 7.390 7.692 -0.302 1
1 761 . 5 1 1 A 63 63 LEU HA H 152 3.791 3.950 -0.159 1
1 771 . 5 1 1 A 63 63 LEU C C 152 179.106 178.995 0.111 1
1 772 . 5 1 1 A 63 63 LEU CA C 152 58.900 57.862 1.038 1
1 773 . 5 1 1 A 63 63 LEU CB C 152 41.140 41.505 -0.365 1
1 777 . 5 1 1 A 63 63 LEU N N 152 121.129 119.378 1.751 1
1 778 . 5 1 1 A 64 64 VAL H H 153 7.552 7.961 -0.409 1
1 779 . 5 1 1 A 64 64 VAL HA H 153 3.411 3.536 -0.125 1
1 787 . 5 1 1 A 64 64 VAL C C 153 180.595 178.488 2.107 1
1 788 . 5 1 1 A 64 64 VAL CA C 153 65.644 66.200 -0.556 1
1 789 . 5 1 1 A 64 64 VAL CB C 153 31.410 31.515 -0.105 1
1 792 . 5 1 1 A 64 64 VAL N N 153 118.280 119.162 -0.882 1
1 793 . 5 1 1 A 65 65 GLY H H 154 8.061 8.194 -0.133 1
1 794 . 5 1 1 A 65 65 GLY HA2 H 154 3.846 3.825 0.021 1
1 795 . 5 1 1 A 65 65 GLY HA3 H 154 3.809 3.828 -0.019 1
1 796 . 5 1 1 A 65 65 GLY C C 154 175.235 176.572 -1.337 1
1 797 . 5 1 1 A 65 65 GLY CA C 154 46.630 46.843 -0.213 1
1 798 . 5 1 1 A 65 65 GLY N N 154 108.622 107.904 0.718 1
1 799 . 5 1 1 A 66 66 GLU H H 155 7.528 7.554 -0.026 1
1 800 . 5 1 1 A 66 66 GLU HA H 155 4.228 4.302 -0.074 1
1 805 . 5 1 1 A 66 66 GLU C C 155 176.761 177.148 -0.387 1
1 806 . 5 1 1 A 66 66 GLU CA C 155 56.590 56.465 0.125 1
1 807 . 5 1 1 A 66 66 GLU CB C 155 30.490 30.424 0.066 1
1 809 . 5 1 1 A 66 66 GLU N N 155 118.361 119.186 -0.825 1
1 810 . 5 1 1 A 67 67 GLY H H 156 7.884 7.807 0.077 1
1 811 . 5 1 1 A 67 67 GLY HA2 H 156 3.918 3.856 0.062 1
1 812 . 5 1 1 A 67 67 GLY HA3 H 156 3.747 3.868 -0.121 1
1 813 . 5 1 1 A 67 67 GLY C C 156 174.788 174.610 0.178 1
1 814 . 5 1 1 A 67 67 GLY CA C 156 45.890 45.742 0.148 1
1 815 . 5 1 1 A 67 67 GLY N N 156 108.465 108.128 0.337 1
1 816 . 5 1 1 A 68 68 LEU H H 157 7.332 8.114 -0.782 1
1 817 . 5 1 1 A 68 68 LEU HA H 157 4.361 4.551 -0.190 1
1 827 . 5 1 1 A 68 68 LEU CA C 157 53.060 51.943 1.117 1
1 828 . 5 1 1 A 68 68 LEU CB C 157 41.100 41.678 -0.578 1
1 832 . 5 1 1 A 68 68 LEU N N 157 121.920 121.903 0.017 1
1 833 . 5 1 1 A 69 69 PRO HA H 158 4.485 4.576 -0.091 1
1 840 . 5 1 1 A 69 69 PRO C C 158 174.602 176.211 -1.609 1
1 841 . 5 1 1 A 69 69 PRO CA C 158 61.556 62.235 -0.679 1
1 842 . 5 1 1 A 69 69 PRO CB C 158 32.370 32.756 -0.386 1
1 845 . 5 1 1 A 70 70 HIS H H 159 8.759 8.689 0.070 1
1 846 . 5 1 1 A 70 70 HIS HA H 159 3.947 4.361 -0.414 1
1 852 . 5 1 1 A 70 70 HIS CA C 159 56.250 55.189 1.061 1
1 853 . 5 1 1 A 70 70 HIS CB C 159 32.280 30.945 1.335 1
1 856 . 5 1 1 A 70 70 HIS N N 159 119.423 120.547 -1.124 1
1 857 . 5 1 1 A 71 71 PRO HA H 160 4.424 4.271 0.153 1
1 864 . 5 1 1 A 71 71 PRO C C 160 177.567 178.060 -0.493 1
1 865 . 5 1 1 A 71 71 PRO CA C 160 64.574 65.023 -0.449 1
1 866 . 5 1 1 A 71 71 PRO CB C 160 32.340 31.963 0.377 1
1 869 . 5 1 1 A 72 72 LEU H H 161 10.123 7.744 2.379 1
1 870 . 5 1 1 A 72 72 LEU HA H 161 4.778 4.370 0.408 1
1 880 . 5 1 1 A 72 72 LEU C C 161 178.721 178.110 0.611 1
1 881 . 5 1 1 A 72 72 LEU CA C 161 55.800 56.797 -0.997 1
1 882 . 5 1 1 A 72 72 LEU CB C 161 42.440 43.485 -1.045 1
1 886 . 5 1 1 A 72 72 LEU N N 161 117.374 117.417 -0.043 1
1 887 . 5 1 1 A 73 73 THR H H 162 7.523 8.047 -0.524 1
1 888 . 5 1 1 A 73 73 THR HA H 162 4.291 4.523 -0.232 1
1 893 . 5 1 1 A 73 73 THR C C 162 175.557 174.380 1.177 1
1 894 . 5 1 1 A 73 73 THR CA C 162 61.440 62.500 -1.060 1
1 895 . 5 1 1 A 73 73 THR CB C 162 70.500 69.740 0.760 1
1 897 . 5 1 1 A 73 73 THR N N 162 107.787 112.480 -4.693 1
1 898 . 5 1 1 A 74 74 ARG H H 163 8.361 7.844 0.517 1
1 899 . 5 1 1 A 74 74 ARG HA H 163 3.836 4.330 -0.494 1
1 906 . 5 1 1 A 74 74 ARG C C 163 174.701 175.247 -0.546 1
1 907 . 5 1 1 A 74 74 ARG CA C 163 57.980 57.566 0.414 1
1 908 . 5 1 1 A 74 74 ARG CB C 163 26.770 26.999 -0.229 1
1 911 . 5 1 1 A 74 74 ARG N N 163 115.130 118.408 -3.278 1
1 912 . 5 1 1 A 75 75 GLU H H 164 7.430 8.093 -0.663 1
1 913 . 5 1 1 A 75 75 GLU HA H 164 4.636 4.440 0.196 1
1 918 . 5 1 1 A 75 75 GLU CA C 164 53.699 55.128 -1.429 1
1 919 . 5 1 1 A 75 75 GLU CB C 164 29.550 28.552 0.998 1
1 921 . 5 1 1 A 75 75 GLU N N 164 120.076 119.116 0.960 1
1 922 . 5 1 1 A 76 76 PRO HA H 165 4.272 4.594 -0.322 1
1 929 . 5 1 1 A 76 76 PRO C C 165 176.649 177.039 -0.390 1
1 930 . 5 1 1 A 76 76 PRO CA C 165 63.204 62.916 0.288 1
1 931 . 5 1 1 A 76 76 PRO CB C 165 31.680 31.668 0.012 1
1 934 . 5 1 1 A 77 77 ILE H H 166 8.812 8.239 0.573 1
1 935 . 5 1 1 A 77 77 ILE HA H 166 3.838 4.323 -0.485 1
1 945 . 5 1 1 A 77 77 ILE C C 166 175.235 176.013 -0.778 1
1 946 . 5 1 1 A 77 77 ILE CA C 166 62.816 61.325 1.491 1
1 947 . 5 1 1 A 77 77 ILE CB C 166 37.750 38.370 -0.620 1
1 951 . 5 1 1 A 77 77 ILE N N 166 123.831 124.094 -0.263 1
1 952 . 5 1 1 A 78 78 THR H H 167 6.625 8.520 -1.895 1
1 953 . 5 1 1 A 78 78 THR HA H 167 4.632 5.020 -0.388 1
1 958 . 5 1 1 A 78 78 THR C C 167 174.143 174.275 -0.132 1
1 959 . 5 1 1 A 78 78 THR CA C 167 58.750 60.175 -1.425 1
1 960 . 5 1 1 A 78 78 THR CB C 167 71.320 70.788 0.532 1
1 962 . 5 1 1 A 78 78 THR N N 167 115.293 117.778 -2.485 1
1 963 . 5 1 1 A 79 79 ALA H H 168 9.088 8.976 0.112 1
1 964 . 5 1 1 A 79 79 ALA HA H 168 3.916 4.159 -0.243 1
1 968 . 5 1 1 A 79 79 ALA C C 168 179.788 179.336 0.452 1
1 969 . 5 1 1 A 79 79 ALA CA C 168 55.480 54.750 0.730 1
1 970 . 5 1 1 A 79 79 ALA CB C 168 17.630 18.493 -0.863 1
1 971 . 5 1 1 A 79 79 ALA N N 168 122.102 127.621 -5.519 1
1 972 . 5 1 1 A 80 80 SER H H 169 7.988 7.682 0.306 1
1 973 . 5 1 1 A 80 80 SER HA H 169 4.058 4.210 -0.152 1
1 976 . 5 1 1 A 80 80 SER C C 169 176.029 176.721 -0.692 1
1 977 . 5 1 1 A 80 80 SER CA C 169 60.750 61.496 -0.746 1
1 978 . 5 1 1 A 80 80 SER CB C 169 62.510 62.880 -0.370 1
1 979 . 5 1 1 A 80 80 SER N N 169 109.541 112.838 -3.297 1
1 980 . 5 1 1 A 81 81 ILE H H 170 6.968 7.583 -0.615 1
1 981 . 5 1 1 A 81 81 ILE HA H 170 4.315 4.350 -0.035 1
1 991 . 5 1 1 A 81 81 ILE C C 170 174.242 175.569 -1.327 1
1 992 . 5 1 1 A 81 81 ILE CA C 170 62.296 61.977 0.319 1
1 993 . 5 1 1 A 81 81 ILE CB C 170 37.686 38.265 -0.579 1
1 997 . 5 1 1 A 81 81 ILE N N 170 112.476 112.594 -0.118 1
1 998 . 5 1 1 A 82 82 ILE H H 171 7.345 7.420 -0.075 1
1 999 . 5 1 1 A 82 82 ILE HA H 171 4.339 4.688 -0.349 1
1 1009 . 5 1 1 A 82 82 ILE C C 171 174.999 174.650 0.349 1
1 1010 . 5 1 1 A 82 82 ILE CA C 171 61.150 60.012 1.138 1
1 1011 . 5 1 1 A 82 82 ILE CB C 171 37.230 40.691 -3.461 1
1 1015 . 5 1 1 A 82 82 ILE N N 171 124.260 124.628 -0.368 1
1 1016 . 5 1 1 A 83 83 VAL H H 172 7.923 9.147 -1.224 1
1 1017 . 5 1 1 A 83 83 VAL HA H 172 4.673 5.084 -0.411 1
1 1025 . 5 1 1 A 83 83 VAL C C 172 174.887 175.348 -0.461 1
1 1026 . 5 1 1 A 83 83 VAL CA C 172 59.340 59.086 0.254 1
1 1027 . 5 1 1 A 83 83 VAL CB C 172 34.840 35.818 -0.978 1
1 1030 . 5 1 1 A 83 83 VAL N N 172 120.931 122.291 -1.360 1
1 1031 . 5 1 1 A 84 84 LYS H H 173 8.406 8.647 -0.241 1
1 1032 . 5 1 1 A 84 84 LYS HA H 173 4.410 4.684 -0.274 1
1 1041 . 5 1 1 A 84 84 LYS C C 173 178.734 177.923 0.811 1
1 1042 . 5 1 1 A 84 84 LYS CA C 173 56.360 55.020 1.340 1
1 1043 . 5 1 1 A 84 84 LYS CB C 173 33.100 33.441 -0.341 1
1 1047 . 5 1 1 A 84 84 LYS N N 173 121.251 120.867 0.384 1
1 1048 . 5 1 1 A 85 85 HIS H H 174 9.221 9.149 0.072 1
1 1049 . 5 1 1 A 85 85 HIS HA H 174 4.024 4.258 -0.234 1
1 1053 . 5 1 1 A 85 85 HIS C C 174 177.183 175.766 1.417 1
1 1054 . 5 1 1 A 85 85 HIS CA C 174 59.460 59.369 0.091 1
1 1055 . 5 1 1 A 85 85 HIS CB C 174 27.920 29.219 -1.299 1
1 1057 . 5 1 1 A 85 85 HIS N N 174 121.545 120.927 0.618 1
1 1058 . 5 1 1 A 86 86 GLU H H 175 8.699 7.566 1.133 1
1 1059 . 5 1 1 A 86 86 GLU HA H 175 3.900 3.912 -0.012 1
1 1064 . 5 1 1 A 86 86 GLU C C 175 177.220 178.603 -1.383 1
1 1065 . 5 1 1 A 86 86 GLU CA C 175 58.420 57.355 1.065 1
1 1066 . 5 1 1 A 86 86 GLU CB C 175 28.690 29.193 -0.503 1
1 1068 . 5 1 1 A 86 86 GLU N N 175 118.011 118.167 -0.156 1
1 1069 . 5 1 1 A 87 87 GLU H H 176 7.621 7.815 -0.194 1
1 1070 . 5 1 1 A 87 87 GLU HA H 176 4.177 4.074 0.103 1
1 1075 . 5 1 1 A 87 87 GLU C C 176 175.222 175.968 -0.746 1
1 1076 . 5 1 1 A 87 87 GLU CA C 176 56.390 58.245 -1.855 1
1 1077 . 5 1 1 A 87 87 GLU CB C 176 30.430 30.172 0.258 1
1 1079 . 5 1 1 A 87 87 GLU N N 176 116.753 119.400 -2.647 1
1 1080 . 5 1 1 A 88 88 CYS H H 177 7.239 7.183 0.056 1
1 1081 . 5 1 1 A 88 88 CYS HA H 177 5.148 4.783 0.365 1
1 1084 . 5 1 1 A 88 88 CYS C C 177 173.249 174.124 -0.875 1
1 1085 . 5 1 1 A 88 88 CYS CA C 177 57.240 57.267 -0.027 1
1 1086 . 5 1 1 A 88 88 CYS CB C 177 31.020 30.106 0.914 1
1 1087 . 5 1 1 A 88 88 CYS N N 177 116.096 115.779 0.317 1
1 1088 . 5 1 1 A 89 89 ILE H H 178 8.912 8.864 0.048 1
1 1089 . 5 1 1 A 89 89 ILE HA H 178 4.580 5.038 -0.458 1
1 1099 . 5 1 1 A 89 89 ILE C C 178 173.386 174.195 -0.809 1
1 1100 . 5 1 1 A 89 89 ILE CA C 178 59.270 59.088 0.182 1
1 1101 . 5 1 1 A 89 89 ILE CB C 178 42.990 41.776 1.214 1
1 1105 . 5 1 1 A 89 89 ILE N N 178 119.490 119.956 -0.466 1
1 1106 . 5 1 1 A 90 90 TYR H H 179 9.047 8.647 0.400 1
1 1107 . 5 1 1 A 90 90 TYR HA H 179 3.753 4.163 -0.410 1
1 1112 . 5 1 1 A 90 90 TYR C C 179 173.932 173.976 -0.044 1
1 1113 . 5 1 1 A 90 90 TYR CA C 179 59.860 57.256 2.604 1
1 1114 . 5 1 1 A 90 90 TYR CB C 179 37.530 38.709 -1.179 1
1 1116 . 5 1 1 A 90 90 TYR N N 179 126.270 122.002 4.268 1
1 1117 . 5 1 1 A 91 91 ASP H H 180 7.462 8.407 -0.945 1
1 1118 . 5 1 1 A 91 91 ASP HA H 180 4.639 4.659 -0.020 1
1 1121 . 5 1 1 A 91 91 ASP C C 180 175.297 176.809 -1.512 1
1 1122 . 5 1 1 A 91 91 ASP CA C 180 52.496 52.868 -0.372 1
1 1123 . 5 1 1 A 91 91 ASP CB C 180 43.380 42.627 0.753 1
1 1124 . 5 1 1 A 91 91 ASP N N 180 129.593 124.474 5.119 1
1 1125 . 5 1 1 A 92 92 ASP H H 181 8.719 8.841 -0.122 1
1 1126 . 5 1 1 A 92 92 ASP HA H 181 4.109 4.354 -0.245 1
1 1129 . 5 1 1 A 92 92 ASP C C 181 177.555 178.273 -0.718 1
1 1130 . 5 1 1 A 92 92 ASP CA C 181 56.390 56.777 -0.387 1
1 1131 . 5 1 1 A 92 92 ASP CB C 181 41.330 39.593 1.737 1
1 1132 . 5 1 1 A 92 92 ASP N N 181 125.691 125.932 -0.241 1
1 1133 . 5 1 1 A 93 93 THR H H 182 8.271 7.610 0.661 1
1 1134 . 5 1 1 A 93 93 THR HA H 182 4.036 3.971 0.065 1
1 1139 . 5 1 1 A 93 93 THR C C 182 176.289 176.447 -0.158 1
1 1140 . 5 1 1 A 93 93 THR CA C 182 65.054 64.957 0.097 1
1 1141 . 5 1 1 A 93 93 THR CB C 182 68.560 68.875 -0.315 1
1 1143 . 5 1 1 A 93 93 THR N N 182 114.813 114.788 0.025 1
1 1144 . 5 1 1 A 94 94 ARG H H 183 7.753 7.639 0.114 1
1 1145 . 5 1 1 A 94 94 ARG HA H 183 4.139 4.273 -0.134 1
1 1152 . 5 1 1 A 94 94 ARG C C 183 176.897 177.207 -0.310 1
1 1153 . 5 1 1 A 94 94 ARG CA C 183 55.350 56.292 -0.942 1
1 1154 . 5 1 1 A 94 94 ARG CB C 183 30.930 30.909 0.021 1
1 1157 . 5 1 1 A 94 94 ARG N N 183 120.101 117.752 2.349 1
1 1158 . 5 1 1 A 95 95 GLY H H 184 8.112 8.989 -0.877 1
1 1159 . 5 1 1 A 95 95 GLY HA2 H 184 3.838 3.887 -0.049 1
1 1160 . 5 1 1 A 95 95 GLY HA3 H 184 3.670 3.889 -0.219 1
1 1161 . 5 1 1 A 95 95 GLY C C 184 173.659 173.319 0.340 1
1 1162 . 5 1 1 A 95 95 GLY CA C 184 46.040 45.939 0.101 1
1 1163 . 5 1 1 A 95 95 GLY N N 184 108.106 108.729 -0.623 1
1 1164 . 5 1 1 A 96 96 ASN H H 185 6.833 7.358 -0.525 1
1 1165 . 5 1 1 A 96 96 ASN HA H 185 4.944 5.103 -0.159 1
1 1170 . 5 1 1 A 96 96 ASN C C 185 174.267 173.362 0.905 1
1 1171 . 5 1 1 A 96 96 ASN CA C 185 52.560 52.404 0.156 1
1 1172 . 5 1 1 A 96 96 ASN CB C 185 45.890 41.566 4.324 1
1 1173 . 5 1 1 A 96 96 ASN N N 185 113.392 116.596 -3.204 1
1 1175 . 5 1 1 A 97 97 PHE H H 186 9.108 8.753 0.355 1
1 1176 . 5 1 1 A 97 97 PHE HA H 186 4.782 4.800 -0.018 1
1 1183 . 5 1 1 A 97 97 PHE C C 186 174.862 175.680 -0.818 1
1 1184 . 5 1 1 A 97 97 PHE CA C 186 60.056 59.488 0.568 1
1 1185 . 5 1 1 A 97 97 PHE CB C 186 40.180 39.217 0.963 1
1 1188 . 5 1 1 A 97 97 PHE N N 186 118.741 119.486 -0.745 1
1 1189 . 5 1 1 A 98 98 ILE H H 187 8.933 8.782 0.151 1
1 1190 . 5 1 1 A 98 98 ILE HA H 187 5.458 4.979 0.479 1
1 1200 . 5 1 1 A 98 98 ILE C C 187 176.041 175.223 0.818 1
1 1201 . 5 1 1 A 98 98 ILE CA C 187 57.610 59.090 -1.480 1
1 1202 . 5 1 1 A 98 98 ILE CB C 187 42.070 41.796 0.274 1
1 1206 . 5 1 1 A 98 98 ILE N N 187 117.857 118.924 -1.067 1
1 1207 . 5 1 1 A 99 99 ILE H H 188 8.284 8.573 -0.289 1
1 1208 . 5 1 1 A 99 99 ILE HA H 188 4.341 4.261 0.080 1
1 1218 . 5 1 1 A 99 99 ILE C C 188 176.413 176.506 -0.093 1
1 1219 . 5 1 1 A 99 99 ILE CA C 188 59.190 60.379 -1.189 1
1 1220 . 5 1 1 A 99 99 ILE CB C 188 37.940 38.385 -0.445 1
1 1224 . 5 1 1 A 99 99 ILE N N 188 121.796 122.256 -0.460 1
1 1225 . 5 1 1 A 100 100 LYS H H 189 8.463 8.372 0.091 1
1 1226 . 5 1 1 A 100 100 LYS HA H 189 4.040 4.190 -0.150 1
1 1235 . 5 1 1 A 100 100 LYS C C 189 176.848 177.736 -0.888 1
1 1236 . 5 1 1 A 100 100 LYS CA C 189 57.241 56.435 0.806 1
1 1237 . 5 1 1 A 100 100 LYS CB C 189 33.400 32.960 0.440 1
1 1241 . 5 1 1 A 100 100 LYS N N 189 127.995 123.789 4.206 1
1 1242 . 5 1 1 A 101 101 GLY H H 190 8.346 8.645 -0.299 1
1 1243 . 5 1 1 A 101 101 GLY HA2 H 190 3.947 3.884 0.063 1
1 1244 . 5 1 1 A 101 101 GLY HA3 H 190 3.813 3.890 -0.077 1
1 1245 . 5 1 1 A 101 101 GLY C C 190 172.902 174.377 -1.475 1
1 1246 . 5 1 1 A 101 101 GLY CA C 190 44.920 45.653 -0.733 1
1 1247 . 5 1 1 A 101 101 GLY N N 190 110.882 112.491 -1.609 1
1 7 . 6 1 1 A 2 2 GLN H H 91 8.786 8.171 0.615 1
1 8 . 6 1 1 A 2 2 GLN HA H 91 4.005 4.042 -0.037 1
1 15 . 6 1 1 A 2 2 GLN C C 91 177.270 178.595 -1.325 1
1 16 . 6 1 1 A 2 2 GLN CA C 91 58.220 58.837 -0.617 1
1 17 . 6 1 1 A 2 2 GLN CB C 91 28.650 28.673 -0.023 1
1 19 . 6 1 1 A 2 2 GLN N N 91 121.993 121.706 0.287 1
1 21 . 6 1 1 A 3 3 GLU H H 92 8.430 8.335 0.095 1
1 22 . 6 1 1 A 3 3 GLU HA H 92 4.007 4.113 -0.106 1
1 27 . 6 1 1 A 3 3 GLU C C 92 178.287 178.881 -0.594 1
1 28 . 6 1 1 A 3 3 GLU CA C 92 59.490 59.199 0.291 1
1 29 . 6 1 1 A 3 3 GLU CB C 92 29.506 29.565 -0.059 1
1 31 . 6 1 1 A 3 3 GLU N N 92 120.195 118.683 1.512 1
1 32 . 6 1 1 A 4 4 SER H H 93 8.209 8.020 0.189 1
1 33 . 6 1 1 A 4 4 SER HA H 93 4.272 4.212 0.060 1
1 36 . 6 1 1 A 4 4 SER C C 93 177.369 176.777 0.592 1
1 37 . 6 1 1 A 4 4 SER CA C 93 61.044 62.498 -1.454 1
1 38 . 6 1 1 A 4 4 SER CB C 93 62.950 62.906 0.044 1
1 39 . 6 1 1 A 4 4 SER N N 93 115.524 117.309 -1.785 1
1 40 . 6 1 1 A 5 5 ILE H H 94 8.080 7.506 0.574 1
1 41 . 6 1 1 A 5 5 ILE HA H 94 3.530 3.613 -0.083 1
1 51 . 6 1 1 A 5 5 ILE C C 94 177.778 177.615 0.163 1
1 52 . 6 1 1 A 5 5 ILE CA C 94 65.710 65.392 0.318 1
1 53 . 6 1 1 A 5 5 ILE CB C 94 37.800 37.484 0.316 1
1 57 . 6 1 1 A 5 5 ILE N N 94 124.148 121.464 2.684 1
1 58 . 6 1 1 A 6 6 GLN H H 95 8.374 8.368 0.006 1
1 59 . 6 1 1 A 6 6 GLN HA H 95 4.125 3.983 0.142 1
1 66 . 6 1 1 A 6 6 GLN C C 95 179.726 179.271 0.455 1
1 67 . 6 1 1 A 6 6 GLN CA C 95 59.190 59.163 0.027 1
1 68 . 6 1 1 A 6 6 GLN CB C 95 27.060 28.583 -1.523 1
1 70 . 6 1 1 A 6 6 GLN N N 95 118.257 118.757 -0.500 1
1 72 . 6 1 1 A 7 7 ASN H H 96 8.456 7.889 0.567 1
1 73 . 6 1 1 A 7 7 ASN HA H 96 4.446 4.525 -0.079 1
1 78 . 6 1 1 A 7 7 ASN C C 96 177.257 178.426 -1.169 1
1 79 . 6 1 1 A 7 7 ASN CA C 96 56.020 56.212 -0.192 1
1 80 . 6 1 1 A 7 7 ASN CB C 96 38.126 37.861 0.265 1
1 81 . 6 1 1 A 7 7 ASN N N 96 118.597 118.459 0.138 1
1 83 . 6 1 1 A 8 8 LYS H H 97 7.732 7.569 0.163 1
1 84 . 6 1 1 A 8 8 LYS HA H 97 4.129 4.086 0.043 1
1 93 . 6 1 1 A 8 8 LYS C C 97 179.143 179.548 -0.405 1
1 94 . 6 1 1 A 8 8 LYS CA C 97 59.126 59.857 -0.731 1
1 95 . 6 1 1 A 8 8 LYS CB C 97 32.070 32.519 -0.449 1
1 99 . 6 1 1 A 8 8 LYS N N 97 122.381 118.475 3.906 1
1 100 . 6 1 1 A 9 9 ILE H H 98 8.452 8.012 0.440 1
1 101 . 6 1 1 A 9 9 ILE HA H 98 3.480 3.821 -0.341 1
1 111 . 6 1 1 A 9 9 ILE C C 98 177.406 178.444 -1.038 1
1 112 . 6 1 1 A 9 9 ILE CA C 98 66.430 65.058 1.372 1
1 113 . 6 1 1 A 9 9 ILE CB C 98 37.980 37.435 0.545 1
1 117 . 6 1 1 A 9 9 ILE N N 98 119.950 120.805 -0.855 1
1 118 . 6 1 1 A 10 10 SER H H 99 7.924 7.884 0.040 1
1 119 . 6 1 1 A 10 10 SER HA H 99 3.983 4.115 -0.132 1
1 122 . 6 1 1 A 10 10 SER C C 99 176.327 177.005 -0.678 1
1 123 . 6 1 1 A 10 10 SER CA C 99 61.990 61.507 0.483 1
1 124 . 6 1 1 A 10 10 SER CB C 99 62.790 62.962 -0.172 1
1 125 . 6 1 1 A 10 10 SER N N 99 113.568 116.748 -3.180 1
1 126 . 6 1 1 A 11 11 GLN H H 100 7.832 7.745 0.087 1
1 127 . 6 1 1 A 11 11 GLN HA H 100 4.238 4.218 0.020 1
1 134 . 6 1 1 A 11 11 GLN C C 100 178.088 177.107 0.981 1
1 135 . 6 1 1 A 11 11 GLN CA C 100 57.900 58.176 -0.276 1
1 136 . 6 1 1 A 11 11 GLN CB C 100 29.790 28.186 1.604 1
1 138 . 6 1 1 A 11 11 GLN N N 100 117.487 120.436 -2.949 1
1 140 . 6 1 1 A 12 12 CYS H H 101 7.920 7.757 0.163 1
1 141 . 6 1 1 A 12 12 CYS HA H 101 4.657 4.732 -0.075 1
1 144 . 6 1 1 A 12 12 CYS C C 101 175.446 174.653 0.793 1
1 145 . 6 1 1 A 12 12 CYS CA C 101 60.654 58.289 2.365 1
1 146 . 6 1 1 A 12 12 CYS CB C 101 29.310 28.010 1.300 1
1 147 . 6 1 1 A 12 12 CYS N N 101 114.221 116.362 -2.141 1
1 148 . 6 1 1 A 13 13 LYS H H 102 8.029 7.388 0.641 1
1 149 . 6 1 1 A 13 13 LYS HA H 102 5.069 4.908 0.161 1
1 158 . 6 1 1 A 13 13 LYS C C 102 174.800 176.343 -1.543 1
1 159 . 6 1 1 A 13 13 LYS CA C 102 56.394 56.304 0.090 1
1 160 . 6 1 1 A 13 13 LYS CB C 102 32.770 33.546 -0.776 1
1 164 . 6 1 1 A 13 13 LYS N N 102 124.129 119.473 4.656 1
1 165 . 6 1 1 A 14 14 PHE H H 103 8.737 8.864 -0.127 1
1 166 . 6 1 1 A 14 14 PHE HA H 103 5.059 5.182 -0.123 1
1 174 . 6 1 1 A 14 14 PHE C C 103 173.560 172.398 1.162 1
1 175 . 6 1 1 A 14 14 PHE CA C 103 55.470 56.003 -0.533 1
1 176 . 6 1 1 A 14 14 PHE CB C 103 41.760 41.468 0.292 1
1 180 . 6 1 1 A 14 14 PHE N N 103 118.661 116.622 2.039 1
1 181 . 6 1 1 A 15 15 SER H H 104 8.826 8.684 0.142 1
1 182 . 6 1 1 A 15 15 SER HA H 104 4.602 4.364 0.238 1
1 185 . 6 1 1 A 15 15 SER C C 104 173.795 173.059 0.736 1
1 186 . 6 1 1 A 15 15 SER CA C 104 58.610 57.968 0.642 1
1 187 . 6 1 1 A 15 15 SER CB C 104 62.690 63.077 -0.387 1
1 188 . 6 1 1 A 15 15 SER N N 104 117.781 115.579 2.202 1
1 189 . 6 1 1 A 16 16 VAL H H 105 7.784 7.948 -0.164 1
1 190 . 6 1 1 A 16 16 VAL HA H 105 3.370 3.831 -0.461 1
1 198 . 6 1 1 A 16 16 VAL C C 105 174.987 175.131 -0.144 1
1 199 . 6 1 1 A 16 16 VAL CA C 105 63.580 62.860 0.720 1
1 200 . 6 1 1 A 16 16 VAL CB C 105 31.410 30.779 0.631 1
1 203 . 6 1 1 A 16 16 VAL N N 105 129.075 127.214 1.861 1
1 204 . 6 1 1 A 17 17 CYS H H 106 8.536 8.456 0.080 1
1 205 . 6 1 1 A 17 17 CYS HA H 106 5.011 5.056 -0.045 1
1 208 . 6 1 1 A 17 17 CYS CA C 106 55.260 56.201 -0.941 1
1 209 . 6 1 1 A 17 17 CYS CB C 106 28.210 28.050 0.160 1
1 210 . 6 1 1 A 17 17 CYS N N 106 130.045 127.956 2.089 1
1 211 . 6 1 1 A 18 18 PRO HA H 107 3.991 4.362 -0.371 1
1 218 . 6 1 1 A 18 18 PRO C C 107 178.188 178.625 -0.437 1
1 219 . 6 1 1 A 18 18 PRO CA C 107 65.940 65.539 0.401 1
1 220 . 6 1 1 A 18 18 PRO CB C 107 32.000 31.874 0.126 1
1 223 . 6 1 1 A 19 19 GLU H H 108 9.260 9.107 0.153 1
1 224 . 6 1 1 A 19 19 GLU HA H 108 4.119 4.136 -0.017 1
1 229 . 6 1 1 A 19 19 GLU C C 108 178.721 178.667 0.054 1
1 230 . 6 1 1 A 19 19 GLU CA C 108 59.300 58.457 0.843 1
1 231 . 6 1 1 A 19 19 GLU CB C 108 28.920 28.234 0.686 1
1 233 . 6 1 1 A 19 19 GLU N N 108 118.270 116.458 1.812 1
1 234 . 6 1 1 A 20 20 ARG H H 109 7.672 7.821 -0.149 1
1 235 . 6 1 1 A 20 20 ARG HA H 109 4.331 4.184 0.147 1
1 242 . 6 1 1 A 20 20 ARG C C 109 177.977 178.765 -0.788 1
1 243 . 6 1 1 A 20 20 ARG CA C 109 57.350 58.413 -1.063 1
1 244 . 6 1 1 A 20 20 ARG CB C 109 30.820 30.169 0.651 1
1 247 . 6 1 1 A 20 20 ARG N N 109 118.357 120.171 -1.814 1
1 248 . 6 1 1 A 21 21 LEU H H 110 7.601 7.857 -0.256 1
1 249 . 6 1 1 A 21 21 LEU HA H 110 4.380 4.224 0.156 1
1 259 . 6 1 1 A 21 21 LEU C C 110 176.562 176.372 0.190 1
1 260 . 6 1 1 A 21 21 LEU CA C 110 56.096 55.507 0.589 1
1 261 . 6 1 1 A 21 21 LEU CB C 110 44.016 42.020 1.996 1
1 265 . 6 1 1 A 21 21 LEU N N 110 118.626 118.305 0.321 1
1 266 . 6 1 1 A 22 22 GLN H H 111 7.750 7.520 0.230 1
1 267 . 6 1 1 A 22 22 GLN HA H 111 3.870 3.953 -0.083 1
1 274 . 6 1 1 A 22 22 GLN C C 111 173.336 174.497 -1.161 1
1 275 . 6 1 1 A 22 22 GLN CA C 111 56.510 57.265 -0.755 1
1 276 . 6 1 1 A 22 22 GLN CB C 111 26.800 26.509 0.291 1
1 278 . 6 1 1 A 22 22 GLN N N 111 113.926 115.497 -1.571 1
1 280 . 6 1 1 A 23 23 CYS H H 112 7.407 7.355 0.052 1
1 281 . 6 1 1 A 23 23 CYS HA H 112 4.469 4.849 -0.380 1
1 284 . 6 1 1 A 23 23 CYS CA C 112 52.650 57.370 -4.720 1
1 285 . 6 1 1 A 23 23 CYS CB C 112 29.750 28.434 1.316 1
1 286 . 6 1 1 A 23 23 CYS N N 112 112.681 118.049 -5.368 1
1 287 . 6 1 1 A 24 24 PRO HA H 113 4.408 4.583 -0.175 1
1 294 . 6 1 1 A 24 24 PRO C C 113 178.175 177.373 0.802 1
1 295 . 6 1 1 A 24 24 PRO CA C 113 62.040 62.702 -0.662 1
1 296 . 6 1 1 A 24 24 PRO CB C 113 31.920 32.581 -0.661 1
1 299 . 6 1 1 A 25 25 LEU H H 114 8.593 8.402 0.191 1
1 300 . 6 1 1 A 25 25 LEU HA H 114 3.765 3.934 -0.169 1
1 310 . 6 1 1 A 25 25 LEU C C 114 179.950 178.928 1.022 1
1 311 . 6 1 1 A 25 25 LEU CA C 114 57.674 57.658 0.016 1
1 312 . 6 1 1 A 25 25 LEU CB C 114 40.690 41.546 -0.856 1
1 316 . 6 1 1 A 25 25 LEU N N 114 123.729 123.467 0.262 1
1 317 . 6 1 1 A 26 26 GLU H H 115 9.108 8.599 0.509 1
1 318 . 6 1 1 A 26 26 GLU HA H 115 3.876 4.013 -0.137 1
1 323 . 6 1 1 A 26 26 GLU C C 115 177.505 178.606 -1.101 1
1 324 . 6 1 1 A 26 26 GLU CA C 115 59.410 59.315 0.095 1
1 325 . 6 1 1 A 26 26 GLU CB C 115 28.460 29.323 -0.863 1
1 327 . 6 1 1 A 26 26 GLU N N 115 116.817 117.572 -0.755 1
1 328 . 6 1 1 A 27 27 ALA H H 116 7.360 7.745 -0.385 1
1 329 . 6 1 1 A 27 27 ALA HA H 116 4.408 4.089 0.319 1
1 333 . 6 1 1 A 27 27 ALA C C 116 177.046 177.709 -0.663 1
1 334 . 6 1 1 A 27 27 ALA CA C 116 52.970 54.225 -1.255 1
1 335 . 6 1 1 A 27 27 ALA CB C 116 19.916 18.409 1.507 1
1 336 . 6 1 1 A 27 27 ALA N N 116 118.966 120.770 -1.804 1
1 337 . 6 1 1 A 28 28 ILE H H 117 7.168 7.006 0.162 1
1 338 . 6 1 1 A 28 28 ILE HA H 117 4.432 4.268 0.164 1
1 348 . 6 1 1 A 28 28 ILE C C 117 172.641 175.525 -2.884 1
1 349 . 6 1 1 A 28 28 ILE CA C 117 59.980 59.670 0.310 1
1 350 . 6 1 1 A 28 28 ILE CB C 117 37.350 37.711 -0.361 1
1 354 . 6 1 1 A 28 28 ILE N N 117 108.913 108.809 0.104 1
1 355 . 6 1 1 A 29 29 GLN H H 118 6.562 7.187 -0.625 1
1 356 . 6 1 1 A 29 29 GLN HA H 118 3.922 4.111 -0.189 1
1 363 . 6 1 1 A 29 29 GLN C C 118 175.049 175.394 -0.345 1
1 364 . 6 1 1 A 29 29 GLN CA C 118 54.596 56.336 -1.740 1
1 365 . 6 1 1 A 29 29 GLN CB C 118 29.570 28.745 0.825 1
1 367 . 6 1 1 A 29 29 GLN N N 118 116.455 123.218 -6.763 1
1 369 . 6 1 1 A 30 30 CYS H H 119 8.138 8.300 -0.162 1
1 370 . 6 1 1 A 30 30 CYS HA H 119 4.580 4.462 0.118 1
1 373 . 6 1 1 A 30 30 CYS CA C 119 57.810 57.020 0.790 1
1 374 . 6 1 1 A 30 30 CYS CB C 119 30.200 28.738 1.462 1
1 375 . 6 1 1 A 30 30 CYS N N 119 134.136 125.332 8.804 1
1 376 . 6 1 1 A 31 31 PRO HA H 120 4.424 4.435 -0.011 1
1 383 . 6 1 1 A 31 31 PRO C C 120 177.431 177.642 -0.211 1
1 384 . 6 1 1 A 31 31 PRO CA C 120 64.060 64.045 0.015 1
1 385 . 6 1 1 A 31 31 PRO CB C 120 32.776 31.852 0.924 1
1 388 . 6 1 1 A 32 32 ILE H H 121 11.318 7.770 3.548 1
1 389 . 6 1 1 A 32 32 ILE HA H 121 4.038 4.004 0.034 1
1 399 . 6 1 1 A 32 32 ILE C C 121 178.485 178.166 0.319 1
1 400 . 6 1 1 A 32 32 ILE CA C 121 64.060 63.631 0.429 1
1 401 . 6 1 1 A 32 32 ILE CB C 121 39.340 38.204 1.136 1
1 405 . 6 1 1 A 32 32 ILE N N 121 124.500 117.122 7.378 1
1 406 . 6 1 1 A 33 33 THR H H 122 9.928 7.486 2.442 1
1 407 . 6 1 1 A 33 33 THR HA H 122 4.048 4.302 -0.254 1
1 412 . 6 1 1 A 33 33 THR C C 122 175.793 174.967 0.826 1
1 413 . 6 1 1 A 33 33 THR CA C 122 62.990 62.116 0.874 1
1 414 . 6 1 1 A 33 33 THR CB C 122 70.300 70.102 0.198 1
1 416 . 6 1 1 A 33 33 THR N N 122 115.136 109.498 5.638 1
1 417 . 6 1 1 A 34 34 LEU H H 123 8.439 7.770 0.669 1
1 418 . 6 1 1 A 34 34 LEU HA H 123 3.912 3.789 0.123 1
1 428 . 6 1 1 A 34 34 LEU C C 123 175.495 174.978 0.517 1
1 429 . 6 1 1 A 34 34 LEU CA C 123 56.290 56.210 0.080 1
1 430 . 6 1 1 A 34 34 LEU CB C 123 38.500 39.736 -1.236 1
1 434 . 6 1 1 A 34 34 LEU N N 123 117.230 118.737 -1.507 1
1 435 . 6 1 1 A 35 35 GLU H H 124 7.816 7.546 0.270 1
1 436 . 6 1 1 A 35 35 GLU HA H 124 4.634 4.766 -0.132 1
1 441 . 6 1 1 A 35 35 GLU C C 124 174.838 174.018 0.820 1
1 442 . 6 1 1 A 35 35 GLU CA C 124 53.780 54.473 -0.693 1
1 443 . 6 1 1 A 35 35 GLU CB C 124 33.710 32.803 0.907 1
1 445 . 6 1 1 A 35 35 GLU N N 124 116.577 114.499 2.078 1
1 446 . 6 1 1 A 36 36 GLN H H 125 8.532 8.426 0.106 1
1 447 . 6 1 1 A 36 36 GLN HA H 125 4.958 4.384 0.574 1
1 454 . 6 1 1 A 36 36 GLN CA C 125 53.350 53.097 0.253 1
1 455 . 6 1 1 A 36 36 GLN CB C 125 29.950 29.313 0.637 1
1 457 . 6 1 1 A 36 36 GLN N N 125 123.034 123.693 -0.659 1
1 459 . 6 1 1 A 37 37 PRO HA H 126 4.458 4.576 -0.118 1
1 466 . 6 1 1 A 37 37 PRO C C 126 176.314 177.327 -1.013 1
1 467 . 6 1 1 A 37 37 PRO CA C 126 62.816 62.678 0.138 1
1 468 . 6 1 1 A 37 37 PRO CB C 126 33.070 32.646 0.424 1
1 471 . 6 1 1 A 38 38 GLU H H 127 8.626 8.394 0.232 1
1 472 . 6 1 1 A 38 38 GLU HA H 127 4.274 4.133 0.141 1
1 477 . 6 1 1 A 38 38 GLU C C 127 177.877 176.540 1.337 1
1 478 . 6 1 1 A 38 38 GLU CA C 127 58.730 58.343 0.387 1
1 479 . 6 1 1 A 38 38 GLU CB C 127 30.340 30.049 0.291 1
1 481 . 6 1 1 A 38 38 GLU N N 127 120.691 119.140 1.551 1
1 482 . 6 1 1 A 39 39 LYS H H 128 7.861 7.773 0.088 1
1 483 . 6 1 1 A 39 39 LYS HA H 128 4.889 4.992 -0.103 1
1 492 . 6 1 1 A 39 39 LYS C C 128 175.446 175.145 0.301 1
1 493 . 6 1 1 A 39 39 LYS CA C 128 53.670 54.591 -0.921 1
1 494 . 6 1 1 A 39 39 LYS CB C 128 33.630 35.705 -2.075 1
1 498 . 6 1 1 A 39 39 LYS N N 128 117.878 116.796 1.082 1
1 499 . 6 1 1 A 40 40 GLY H H 129 8.426 7.987 0.439 1
1 500 . 6 1 1 A 40 40 GLY HA2 H 129 4.970 4.121 0.849 1
1 501 . 6 1 1 A 40 40 GLY HA3 H 129 2.458 4.231 -1.773 1
1 502 . 6 1 1 A 40 40 GLY C C 129 170.048 172.473 -2.425 1
1 503 . 6 1 1 A 40 40 GLY CA C 129 42.910 45.044 -2.134 1
1 504 . 6 1 1 A 40 40 GLY N N 129 112.604 106.161 6.443 1
1 505 . 6 1 1 A 41 41 ILE H H 130 8.596 9.162 -0.566 1
1 506 . 6 1 1 A 41 41 ILE HA H 130 4.636 5.335 -0.699 1
1 516 . 6 1 1 A 41 41 ILE C C 130 172.691 174.386 -1.695 1
1 517 . 6 1 1 A 41 41 ILE CA C 130 58.500 58.791 -0.291 1
1 518 . 6 1 1 A 41 41 ILE CB C 130 43.320 41.595 1.725 1
1 522 . 6 1 1 A 41 41 ILE N N 130 113.363 116.301 -2.938 1
1 523 . 6 1 1 A 42 42 PHE H H 131 8.994 9.048 -0.054 1
1 524 . 6 1 1 A 42 42 PHE HA H 131 5.075 5.453 -0.378 1
1 532 . 6 1 1 A 42 42 PHE C C 131 175.111 175.201 -0.090 1
1 533 . 6 1 1 A 42 42 PHE CA C 131 58.680 57.111 1.569 1
1 534 . 6 1 1 A 42 42 PHE CB C 131 42.220 40.669 1.551 1
1 538 . 6 1 1 A 42 42 PHE N N 131 125.156 122.133 3.023 1
1 539 . 6 1 1 A 43 43 VAL H H 132 8.399 9.252 -0.853 1
1 540 . 6 1 1 A 43 43 VAL HA H 132 4.920 4.805 0.115 1
1 548 . 6 1 1 A 43 43 VAL C C 132 178.175 175.196 2.979 1
1 549 . 6 1 1 A 43 43 VAL CA C 132 59.600 60.778 -1.178 1
1 550 . 6 1 1 A 43 43 VAL CB C 132 35.920 34.964 0.956 1
1 553 . 6 1 1 A 43 43 VAL N N 132 119.371 122.892 -3.521 1
1 554 . 6 1 1 A 44 44 LYS H H 133 10.041 8.535 1.506 1
1 555 . 6 1 1 A 44 44 LYS HA H 133 4.920 4.335 0.585 1
1 564 . 6 1 1 A 44 44 LYS C C 133 177.195 175.595 1.600 1
1 565 . 6 1 1 A 44 44 LYS CA C 133 57.310 56.510 0.800 1
1 566 . 6 1 1 A 44 44 LYS CB C 133 34.410 32.531 1.879 1
1 570 . 6 1 1 A 44 44 LYS N N 133 130.928 126.682 4.246 1
1 571 . 6 1 1 A 45 45 ASN H H 134 8.534 8.870 -0.336 1
1 572 . 6 1 1 A 45 45 ASN HA H 134 4.151 4.697 -0.546 1
1 577 . 6 1 1 A 45 45 ASN C C 134 174.217 175.307 -1.090 1
1 578 . 6 1 1 A 45 45 ASN CA C 134 55.290 52.449 2.841 1
1 579 . 6 1 1 A 45 45 ASN CB C 134 37.530 38.090 -0.560 1
1 580 . 6 1 1 A 45 45 ASN N N 134 119.452 124.135 -4.683 1
1 582 . 6 1 1 A 46 46 SER H H 135 7.570 8.255 -0.685 1
1 583 . 6 1 1 A 46 46 SER HA H 135 4.220 4.145 0.075 1
1 586 . 6 1 1 A 46 46 SER C C 135 174.490 176.606 -2.116 1
1 587 . 6 1 1 A 46 46 SER CA C 135 57.090 61.170 -4.080 1
1 588 . 6 1 1 A 46 46 SER CB C 135 64.126 62.986 1.140 1
1 589 . 6 1 1 A 46 46 SER N N 135 105.613 121.468 -15.855 1
1 590 . 6 1 1 A 47 47 ASP H H 136 9.113 8.067 1.046 1
1 591 . 6 1 1 A 47 47 ASP HA H 136 4.220 4.307 -0.087 1
1 594 . 6 1 1 A 47 47 ASP CA C 136 57.610 57.029 0.581 1
1 595 . 6 1 1 A 47 47 ASP CB C 136 40.810 40.253 0.557 1
1 596 . 6 1 1 A 47 47 ASP N N 136 120.995 121.451 -0.456 1
1 597 . 6 1 1 A 48 48 GLY H H 137 8.172 8.104 0.068 1
1 598 . 6 1 1 A 48 48 GLY HA2 H 137 4.096 3.793 0.303 1
1 599 . 6 1 1 A 48 48 GLY HA3 H 137 3.664 3.801 -0.137 1
1 600 . 6 1 1 A 48 48 GLY C C 137 173.990 175.439 -1.449 1
1 601 . 6 1 1 A 48 48 GLY CA C 137 45.130 47.434 -2.304 1
1 602 . 6 1 1 A 48 48 GLY N N 137 105.838 107.215 -1.377 1
1 603 . 6 1 1 A 49 49 SER H H 138 7.252 7.789 -0.537 1
1 604 . 6 1 1 A 49 49 SER HA H 138 4.503 4.757 -0.254 1
1 607 . 6 1 1 A 49 49 SER C C 138 173.857 173.631 0.226 1
1 608 . 6 1 1 A 49 49 SER CA C 138 57.340 57.288 0.052 1
1 609 . 6 1 1 A 49 49 SER CB C 138 65.370 63.735 1.635 1
1 610 . 6 1 1 A 49 49 SER N N 138 114.942 112.202 2.740 1
1 611 . 6 1 1 A 50 50 ASP H H 139 8.276 7.934 0.342 1
1 612 . 6 1 1 A 50 50 ASP HA H 139 4.618 4.247 0.371 1
1 615 . 6 1 1 A 50 50 ASP C C 139 174.577 175.353 -0.776 1
1 616 . 6 1 1 A 50 50 ASP CA C 139 53.116 55.552 -2.436 1
1 617 . 6 1 1 A 50 50 ASP CB C 139 40.520 39.499 1.021 1
1 618 . 6 1 1 A 50 50 ASP N N 139 122.088 116.213 5.875 1
1 619 . 6 1 1 A 51 51 VAL H H 140 8.192 7.535 0.657 1
1 620 . 6 1 1 A 51 51 VAL HA H 140 4.299 4.253 0.046 1
1 628 . 6 1 1 A 51 51 VAL C C 140 175.867 175.292 0.575 1
1 629 . 6 1 1 A 51 51 VAL CA C 140 62.950 62.678 0.272 1
1 630 . 6 1 1 A 51 51 VAL CB C 140 33.230 31.865 1.365 1
1 632 . 6 1 1 A 51 51 VAL N N 140 121.167 119.474 1.693 1
1 633 . 6 1 1 A 52 52 CYS H H 141 8.391 8.744 -0.353 1
1 634 . 6 1 1 A 52 52 CYS HA H 141 5.247 5.162 0.085 1
1 637 . 6 1 1 A 52 52 CYS C C 141 172.778 174.406 -1.628 1
1 638 . 6 1 1 A 52 52 CYS CA C 141 56.480 58.343 -1.863 1
1 639 . 6 1 1 A 52 52 CYS CB C 141 31.960 29.159 2.801 1
1 640 . 6 1 1 A 52 52 CYS N N 141 121.884 127.528 -5.644 1
1 641 . 6 1 1 A 53 53 THR H H 142 8.777 8.812 -0.035 1
1 642 . 6 1 1 A 53 53 THR HA H 142 4.489 4.807 -0.318 1
1 648 . 6 1 1 A 53 53 THR C C 142 171.885 172.278 -0.393 1
1 649 . 6 1 1 A 53 53 THR CA C 142 62.070 61.269 0.801 1
1 650 . 6 1 1 A 53 53 THR CB C 142 71.390 71.694 -0.304 1
1 652 . 6 1 1 A 53 53 THR N N 142 118.132 117.110 1.022 1
1 653 . 6 1 1 A 54 54 LEU H H 143 8.409 8.195 0.214 1
1 654 . 6 1 1 A 54 54 LEU HA H 143 4.276 4.314 -0.038 1
1 664 . 6 1 1 A 54 54 LEU C C 143 174.366 174.056 0.310 1
1 665 . 6 1 1 A 54 54 LEU CA C 143 54.330 53.104 1.226 1
1 666 . 6 1 1 A 54 54 LEU CB C 143 42.396 42.572 -0.176 1
1 670 . 6 1 1 A 54 54 LEU N N 143 127.980 128.202 -0.222 1
1 671 . 6 1 1 A 55 55 PHE H H 144 8.646 8.610 0.036 1
1 672 . 6 1 1 A 55 55 PHE HA H 144 5.455 4.835 0.620 1
1 680 . 6 1 1 A 55 55 PHE C C 144 176.054 175.129 0.925 1
1 681 . 6 1 1 A 55 55 PHE CA C 144 55.250 56.848 -1.598 1
1 682 . 6 1 1 A 55 55 PHE CB C 144 44.100 41.095 3.005 1
1 686 . 6 1 1 A 55 55 PHE N N 144 122.010 126.912 -4.902 1
1 687 . 6 1 1 A 56 56 ASP H H 145 11.575 8.295 3.280 1
1 688 . 6 1 1 A 56 56 ASP HA H 145 4.416 4.470 -0.054 1
1 691 . 6 1 1 A 56 56 ASP C C 145 176.748 177.470 -0.722 1
1 692 . 6 1 1 A 56 56 ASP CA C 145 55.840 54.795 1.045 1
1 693 . 6 1 1 A 56 56 ASP CB C 145 44.390 42.241 2.149 1
1 694 . 6 1 1 A 56 56 ASP N N 145 121.936 124.239 -2.303 1
1 695 . 6 1 1 A 57 57 ALA H H 146 8.508 8.872 -0.364 1
1 696 . 6 1 1 A 57 57 ALA HA H 146 3.797 4.051 -0.254 1
1 700 . 6 1 1 A 57 57 ALA C C 146 178.696 180.072 -1.376 1
1 701 . 6 1 1 A 57 57 ALA CA C 146 55.990 55.495 0.495 1
1 702 . 6 1 1 A 57 57 ALA CB C 146 18.840 18.097 0.743 1
1 703 . 6 1 1 A 57 57 ALA N N 146 130.243 129.278 0.965 1
1 704 . 6 1 1 A 58 58 ALA H H 147 8.378 7.489 0.889 1
1 705 . 6 1 1 A 58 58 ALA HA H 147 4.078 4.260 -0.182 1
1 709 . 6 1 1 A 58 58 ALA C C 147 181.091 179.409 1.682 1
1 710 . 6 1 1 A 58 58 ALA CA C 147 54.770 55.007 -0.237 1
1 711 . 6 1 1 A 58 58 ALA CB C 147 17.700 18.571 -0.871 1
1 712 . 6 1 1 A 58 58 ALA N N 147 121.997 119.316 2.681 1
1 713 . 6 1 1 A 59 59 ALA H H 148 9.138 7.941 1.197 1
1 714 . 6 1 1 A 59 59 ALA HA H 148 3.975 4.032 -0.057 1
1 718 . 6 1 1 A 59 59 ALA C C 148 180.508 179.592 0.916 1
1 719 . 6 1 1 A 59 59 ALA CA C 148 54.840 54.993 -0.153 1
1 720 . 6 1 1 A 59 59 ALA CB C 148 18.600 18.358 0.242 1
1 721 . 6 1 1 A 59 59 ALA N N 148 123.595 120.711 2.884 1
1 722 . 6 1 1 A 60 60 PHE H H 149 8.814 8.340 0.474 1
1 723 . 6 1 1 A 60 60 PHE HA H 149 3.722 4.009 -0.287 1
1 731 . 6 1 1 A 60 60 PHE C C 149 176.773 177.482 -0.709 1
1 732 . 6 1 1 A 60 60 PHE CA C 149 62.030 61.602 0.428 1
1 733 . 6 1 1 A 60 60 PHE CB C 149 39.960 38.916 1.044 1
1 737 . 6 1 1 A 60 60 PHE N N 149 120.354 119.985 0.369 1
1 738 . 6 1 1 A 61 61 SER H H 150 8.276 8.076 0.200 1
1 739 . 6 1 1 A 61 61 SER HA H 150 3.880 4.164 -0.284 1
1 742 . 6 1 1 A 61 61 SER C C 150 177.691 177.270 0.421 1
1 743 . 6 1 1 A 61 61 SER CA C 150 62.190 61.268 0.922 1
1 744 . 6 1 1 A 61 61 SER CB C 150 63.016 63.208 -0.192 1
1 745 . 6 1 1 A 61 61 SER N N 150 112.086 114.171 -2.085 1
1 746 . 6 1 1 A 62 62 ARG H H 151 7.829 7.568 0.261 1
1 747 . 6 1 1 A 62 62 ARG HA H 151 3.971 4.086 -0.115 1
1 754 . 6 1 1 A 62 62 ARG C C 151 178.287 178.800 -0.513 1
1 755 . 6 1 1 A 62 62 ARG CA C 151 59.340 58.971 0.369 1
1 756 . 6 1 1 A 62 62 ARG CB C 151 29.760 29.876 -0.116 1
1 759 . 6 1 1 A 62 62 ARG N N 151 121.090 121.753 -0.663 1
1 760 . 6 1 1 A 63 63 LEU H H 152 7.390 7.837 -0.447 1
1 761 . 6 1 1 A 63 63 LEU HA H 152 3.791 3.941 -0.150 1
1 771 . 6 1 1 A 63 63 LEU C C 152 179.106 178.755 0.351 1
1 772 . 6 1 1 A 63 63 LEU CA C 152 58.900 57.911 0.989 1
1 773 . 6 1 1 A 63 63 LEU CB C 152 41.140 41.510 -0.370 1
1 777 . 6 1 1 A 63 63 LEU N N 152 121.129 119.449 1.680 1
1 778 . 6 1 1 A 64 64 VAL H H 153 7.552 7.985 -0.433 1
1 779 . 6 1 1 A 64 64 VAL HA H 153 3.411 3.456 -0.045 1
1 787 . 6 1 1 A 64 64 VAL C C 153 180.595 178.127 2.468 1
1 788 . 6 1 1 A 64 64 VAL CA C 153 65.644 66.484 -0.840 1
1 789 . 6 1 1 A 64 64 VAL CB C 153 31.410 31.407 0.003 1
1 792 . 6 1 1 A 64 64 VAL N N 153 118.280 118.695 -0.415 1
1 793 . 6 1 1 A 65 65 GLY H H 154 8.061 8.177 -0.116 1
1 794 . 6 1 1 A 65 65 GLY HA2 H 154 3.846 3.781 0.065 1
1 795 . 6 1 1 A 65 65 GLY HA3 H 154 3.809 3.783 0.026 1
1 796 . 6 1 1 A 65 65 GLY C C 154 175.235 175.263 -0.028 1
1 797 . 6 1 1 A 65 65 GLY CA C 154 46.630 47.028 -0.398 1
1 798 . 6 1 1 A 65 65 GLY N N 154 108.622 107.925 0.697 1
1 799 . 6 1 1 A 66 66 GLU H H 155 7.528 7.552 -0.024 1
1 800 . 6 1 1 A 66 66 GLU HA H 155 4.228 4.365 -0.137 1
1 805 . 6 1 1 A 66 66 GLU C C 155 176.761 176.974 -0.213 1
1 806 . 6 1 1 A 66 66 GLU CA C 155 56.590 56.247 0.343 1
1 807 . 6 1 1 A 66 66 GLU CB C 155 30.490 30.349 0.141 1
1 809 . 6 1 1 A 66 66 GLU N N 155 118.361 118.779 -0.418 1
1 810 . 6 1 1 A 67 67 GLY H H 156 7.884 7.863 0.021 1
1 811 . 6 1 1 A 67 67 GLY HA2 H 156 3.918 3.886 0.032 1
1 812 . 6 1 1 A 67 67 GLY HA3 H 156 3.747 3.900 -0.153 1
1 813 . 6 1 1 A 67 67 GLY C C 156 174.788 174.739 0.049 1
1 814 . 6 1 1 A 67 67 GLY CA C 156 45.890 46.347 -0.457 1
1 815 . 6 1 1 A 67 67 GLY N N 156 108.465 109.848 -1.383 1
1 816 . 6 1 1 A 68 68 LEU H H 157 7.332 8.100 -0.768 1
1 817 . 6 1 1 A 68 68 LEU HA H 157 4.361 4.589 -0.228 1
1 827 . 6 1 1 A 68 68 LEU CA C 157 53.060 52.147 0.913 1
1 828 . 6 1 1 A 68 68 LEU CB C 157 41.100 41.579 -0.479 1
1 832 . 6 1 1 A 68 68 LEU N N 157 121.920 121.583 0.337 1
1 833 . 6 1 1 A 69 69 PRO HA H 158 4.485 4.570 -0.085 1
1 840 . 6 1 1 A 69 69 PRO C C 158 174.602 176.202 -1.600 1
1 841 . 6 1 1 A 69 69 PRO CA C 158 61.556 62.266 -0.710 1
1 842 . 6 1 1 A 69 69 PRO CB C 158 32.370 32.749 -0.379 1
1 845 . 6 1 1 A 70 70 HIS H H 159 8.759 8.604 0.155 1
1 846 . 6 1 1 A 70 70 HIS HA H 159 3.947 4.403 -0.456 1
1 852 . 6 1 1 A 70 70 HIS CA C 159 56.250 55.183 1.067 1
1 853 . 6 1 1 A 70 70 HIS CB C 159 32.280 30.947 1.333 1
1 856 . 6 1 1 A 70 70 HIS N N 159 119.423 120.514 -1.091 1
1 857 . 6 1 1 A 71 71 PRO HA H 160 4.424 4.362 0.062 1
1 864 . 6 1 1 A 71 71 PRO C C 160 177.567 177.283 0.284 1
1 865 . 6 1 1 A 71 71 PRO CA C 160 64.574 64.248 0.326 1
1 866 . 6 1 1 A 71 71 PRO CB C 160 32.340 31.525 0.815 1
1 869 . 6 1 1 A 72 72 LEU H H 161 10.123 7.676 2.447 1
1 870 . 6 1 1 A 72 72 LEU HA H 161 4.778 4.434 0.344 1
1 880 . 6 1 1 A 72 72 LEU C C 161 178.721 177.985 0.736 1
1 881 . 6 1 1 A 72 72 LEU CA C 161 55.800 56.190 -0.390 1
1 882 . 6 1 1 A 72 72 LEU CB C 161 42.440 43.223 -0.783 1
1 886 . 6 1 1 A 72 72 LEU N N 161 117.374 117.298 0.076 1
1 887 . 6 1 1 A 73 73 THR H H 162 7.523 8.082 -0.559 1
1 888 . 6 1 1 A 73 73 THR HA H 162 4.291 4.531 -0.240 1
1 893 . 6 1 1 A 73 73 THR C C 162 175.557 174.229 1.328 1
1 894 . 6 1 1 A 73 73 THR CA C 162 61.440 62.636 -1.196 1
1 895 . 6 1 1 A 73 73 THR CB C 162 70.500 69.425 1.075 1
1 897 . 6 1 1 A 73 73 THR N N 162 107.787 111.979 -4.192 1
1 898 . 6 1 1 A 74 74 ARG H H 163 8.361 7.952 0.409 1
1 899 . 6 1 1 A 74 74 ARG HA H 163 3.836 4.182 -0.346 1
1 906 . 6 1 1 A 74 74 ARG C C 163 174.701 175.121 -0.420 1
1 907 . 6 1 1 A 74 74 ARG CA C 163 57.980 57.594 0.386 1
1 908 . 6 1 1 A 74 74 ARG CB C 163 26.770 27.138 -0.368 1
1 911 . 6 1 1 A 74 74 ARG N N 163 115.130 118.344 -3.214 1
1 912 . 6 1 1 A 75 75 GLU H H 164 7.430 8.052 -0.622 1
1 913 . 6 1 1 A 75 75 GLU HA H 164 4.636 4.507 0.129 1
1 918 . 6 1 1 A 75 75 GLU CA C 164 53.699 54.798 -1.099 1
1 919 . 6 1 1 A 75 75 GLU CB C 164 29.550 28.733 0.817 1
1 921 . 6 1 1 A 75 75 GLU N N 164 120.076 119.048 1.028 1
1 922 . 6 1 1 A 76 76 PRO HA H 165 4.272 4.483 -0.211 1
1 929 . 6 1 1 A 76 76 PRO C C 165 176.649 176.994 -0.345 1
1 930 . 6 1 1 A 76 76 PRO CA C 165 63.204 63.119 0.085 1
1 931 . 6 1 1 A 76 76 PRO CB C 165 31.680 31.642 0.038 1
1 934 . 6 1 1 A 77 77 ILE H H 166 8.812 8.211 0.601 1
1 935 . 6 1 1 A 77 77 ILE HA H 166 3.838 4.271 -0.433 1
1 945 . 6 1 1 A 77 77 ILE C C 166 175.235 175.929 -0.694 1
1 946 . 6 1 1 A 77 77 ILE CA C 166 62.816 61.147 1.669 1
1 947 . 6 1 1 A 77 77 ILE CB C 166 37.750 37.662 0.088 1
1 951 . 6 1 1 A 77 77 ILE N N 166 123.831 124.077 -0.246 1
1 952 . 6 1 1 A 78 78 THR H H 167 6.625 8.586 -1.961 1
1 953 . 6 1 1 A 78 78 THR HA H 167 4.632 5.076 -0.444 1
1 958 . 6 1 1 A 78 78 THR C C 167 174.143 174.590 -0.447 1
1 959 . 6 1 1 A 78 78 THR CA C 167 58.750 60.022 -1.272 1
1 960 . 6 1 1 A 78 78 THR CB C 167 71.320 71.331 -0.011 1
1 962 . 6 1 1 A 78 78 THR N N 167 115.293 118.101 -2.808 1
1 963 . 6 1 1 A 79 79 ALA H H 168 9.088 9.018 0.070 1
1 964 . 6 1 1 A 79 79 ALA HA H 168 3.916 4.114 -0.198 1
1 968 . 6 1 1 A 79 79 ALA C C 168 179.788 179.834 -0.046 1
1 969 . 6 1 1 A 79 79 ALA CA C 168 55.480 55.017 0.463 1
1 970 . 6 1 1 A 79 79 ALA CB C 168 17.630 18.503 -0.873 1
1 971 . 6 1 1 A 79 79 ALA N N 168 122.102 127.755 -5.653 1
1 972 . 6 1 1 A 80 80 SER H H 169 7.988 7.745 0.243 1
1 973 . 6 1 1 A 80 80 SER HA H 169 4.058 4.136 -0.078 1
1 976 . 6 1 1 A 80 80 SER C C 169 176.029 176.394 -0.365 1
1 977 . 6 1 1 A 80 80 SER CA C 169 60.750 62.233 -1.483 1
1 978 . 6 1 1 A 80 80 SER CB C 169 62.510 63.020 -0.510 1
1 979 . 6 1 1 A 80 80 SER N N 169 109.541 114.958 -5.417 1
1 980 . 6 1 1 A 81 81 ILE H H 170 6.968 7.645 -0.677 1
1 981 . 6 1 1 A 81 81 ILE HA H 170 4.315 4.346 -0.031 1
1 991 . 6 1 1 A 81 81 ILE C C 170 174.242 175.526 -1.284 1
1 992 . 6 1 1 A 81 81 ILE CA C 170 62.296 61.850 0.446 1
1 993 . 6 1 1 A 81 81 ILE CB C 170 37.686 38.253 -0.567 1
1 997 . 6 1 1 A 81 81 ILE N N 170 112.476 112.911 -0.435 1
1 998 . 6 1 1 A 82 82 ILE H H 171 7.345 7.451 -0.106 1
1 999 . 6 1 1 A 82 82 ILE HA H 171 4.339 4.620 -0.281 1
1 1009 . 6 1 1 A 82 82 ILE C C 171 174.999 174.694 0.305 1
1 1010 . 6 1 1 A 82 82 ILE CA C 171 61.150 60.484 0.666 1
1 1011 . 6 1 1 A 82 82 ILE CB C 171 37.230 40.350 -3.120 1
1 1015 . 6 1 1 A 82 82 ILE N N 171 124.260 124.931 -0.671 1
1 1016 . 6 1 1 A 83 83 VAL H H 172 7.923 9.187 -1.264 1
1 1017 . 6 1 1 A 83 83 VAL HA H 172 4.673 5.175 -0.502 1
1 1025 . 6 1 1 A 83 83 VAL C C 172 174.887 175.152 -0.265 1
1 1026 . 6 1 1 A 83 83 VAL CA C 172 59.340 59.211 0.129 1
1 1027 . 6 1 1 A 83 83 VAL CB C 172 34.840 36.133 -1.293 1
1 1030 . 6 1 1 A 83 83 VAL N N 172 120.931 122.170 -1.239 1
1 1031 . 6 1 1 A 84 84 LYS H H 173 8.406 8.213 0.193 1
1 1032 . 6 1 1 A 84 84 LYS HA H 173 4.410 4.707 -0.297 1
1 1041 . 6 1 1 A 84 84 LYS C C 173 178.734 177.797 0.937 1
1 1042 . 6 1 1 A 84 84 LYS CA C 173 56.360 54.544 1.816 1
1 1043 . 6 1 1 A 84 84 LYS CB C 173 33.100 34.145 -1.045 1
1 1047 . 6 1 1 A 84 84 LYS N N 173 121.251 120.318 0.933 1
1 1048 . 6 1 1 A 85 85 HIS H H 174 9.221 8.869 0.352 1
1 1049 . 6 1 1 A 85 85 HIS HA H 174 4.024 3.763 0.261 1
1 1053 . 6 1 1 A 85 85 HIS C C 174 177.183 176.709 0.474 1
1 1054 . 6 1 1 A 85 85 HIS CA C 174 59.460 58.964 0.496 1
1 1055 . 6 1 1 A 85 85 HIS CB C 174 27.920 28.656 -0.736 1
1 1057 . 6 1 1 A 85 85 HIS N N 174 121.545 120.567 0.978 1
1 1058 . 6 1 1 A 86 86 GLU H H 175 8.699 7.412 1.287 1
1 1059 . 6 1 1 A 86 86 GLU HA H 175 3.900 3.895 0.005 1
1 1064 . 6 1 1 A 86 86 GLU C C 175 177.220 178.529 -1.309 1
1 1065 . 6 1 1 A 86 86 GLU CA C 175 58.420 58.619 -0.199 1
1 1066 . 6 1 1 A 86 86 GLU CB C 175 28.690 29.259 -0.569 1
1 1068 . 6 1 1 A 86 86 GLU N N 175 118.011 120.190 -2.179 1
1 1069 . 6 1 1 A 87 87 GLU H H 176 7.621 7.746 -0.125 1
1 1070 . 6 1 1 A 87 87 GLU HA H 176 4.177 4.026 0.151 1
1 1075 . 6 1 1 A 87 87 GLU C C 176 175.222 175.953 -0.731 1
1 1076 . 6 1 1 A 87 87 GLU CA C 176 56.390 58.604 -2.214 1
1 1077 . 6 1 1 A 87 87 GLU CB C 176 30.430 29.896 0.534 1
1 1079 . 6 1 1 A 87 87 GLU N N 176 116.753 118.007 -1.254 1
1 1080 . 6 1 1 A 88 88 CYS H H 177 7.239 7.280 -0.041 1
1 1081 . 6 1 1 A 88 88 CYS HA H 177 5.148 4.886 0.262 1
1 1084 . 6 1 1 A 88 88 CYS C C 177 173.249 173.640 -0.391 1
1 1085 . 6 1 1 A 88 88 CYS CA C 177 57.240 56.913 0.327 1
1 1086 . 6 1 1 A 88 88 CYS CB C 177 31.020 30.895 0.125 1
1 1087 . 6 1 1 A 88 88 CYS N N 177 116.096 115.374 0.722 1
1 1088 . 6 1 1 A 89 89 ILE H H 178 8.912 8.705 0.207 1
1 1089 . 6 1 1 A 89 89 ILE HA H 178 4.580 4.930 -0.350 1
1 1099 . 6 1 1 A 89 89 ILE C C 178 173.386 174.319 -0.933 1
1 1100 . 6 1 1 A 89 89 ILE CA C 178 59.270 59.047 0.223 1
1 1101 . 6 1 1 A 89 89 ILE CB C 178 42.990 41.810 1.180 1
1 1105 . 6 1 1 A 89 89 ILE N N 178 119.490 116.428 3.062 1
1 1106 . 6 1 1 A 90 90 TYR H H 179 9.047 8.626 0.421 1
1 1107 . 6 1 1 A 90 90 TYR HA H 179 3.753 3.965 -0.212 1
1 1112 . 6 1 1 A 90 90 TYR C C 179 173.932 174.037 -0.105 1
1 1113 . 6 1 1 A 90 90 TYR CA C 179 59.860 57.347 2.513 1
1 1114 . 6 1 1 A 90 90 TYR CB C 179 37.530 38.657 -1.127 1
1 1116 . 6 1 1 A 90 90 TYR N N 179 126.270 121.720 4.550 1
1 1117 . 6 1 1 A 91 91 ASP H H 180 7.462 8.220 -0.758 1
1 1118 . 6 1 1 A 91 91 ASP HA H 180 4.639 4.882 -0.243 1
1 1121 . 6 1 1 A 91 91 ASP C C 180 175.297 176.039 -0.742 1
1 1122 . 6 1 1 A 91 91 ASP CA C 180 52.496 52.453 0.043 1
1 1123 . 6 1 1 A 91 91 ASP CB C 180 43.380 43.061 0.319 1
1 1124 . 6 1 1 A 91 91 ASP N N 180 129.593 123.049 6.544 1
1 1125 . 6 1 1 A 92 92 ASP H H 181 8.719 8.967 -0.248 1
1 1126 . 6 1 1 A 92 92 ASP HA H 181 4.109 4.330 -0.221 1
1 1129 . 6 1 1 A 92 92 ASP C C 181 177.555 177.410 0.145 1
1 1130 . 6 1 1 A 92 92 ASP CA C 181 56.390 57.413 -1.023 1
1 1131 . 6 1 1 A 92 92 ASP CB C 181 41.330 40.774 0.556 1
1 1132 . 6 1 1 A 92 92 ASP N N 181 125.691 127.585 -1.894 1
1 1133 . 6 1 1 A 93 93 THR H H 182 8.271 7.549 0.722 1
1 1134 . 6 1 1 A 93 93 THR HA H 182 4.036 4.033 0.003 1
1 1139 . 6 1 1 A 93 93 THR C C 182 176.289 176.874 -0.585 1
1 1140 . 6 1 1 A 93 93 THR CA C 182 65.054 64.934 0.120 1
1 1141 . 6 1 1 A 93 93 THR CB C 182 68.560 68.832 -0.272 1
1 1143 . 6 1 1 A 93 93 THR N N 182 114.813 113.683 1.130 1
1 1144 . 6 1 1 A 94 94 ARG H H 183 7.753 7.487 0.266 1
1 1145 . 6 1 1 A 94 94 ARG HA H 183 4.139 4.154 -0.015 1
1 1152 . 6 1 1 A 94 94 ARG C C 183 176.897 177.035 -0.138 1
1 1153 . 6 1 1 A 94 94 ARG CA C 183 55.350 56.744 -1.394 1
1 1154 . 6 1 1 A 94 94 ARG CB C 183 30.930 30.457 0.473 1
1 1157 . 6 1 1 A 94 94 ARG N N 183 120.101 117.941 2.160 1
1 1158 . 6 1 1 A 95 95 GLY H H 184 8.112 8.731 -0.619 1
1 1159 . 6 1 1 A 95 95 GLY HA2 H 184 3.838 3.869 -0.031 1
1 1160 . 6 1 1 A 95 95 GLY HA3 H 184 3.670 3.874 -0.204 1
1 1161 . 6 1 1 A 95 95 GLY C C 184 173.659 173.432 0.227 1
1 1162 . 6 1 1 A 95 95 GLY CA C 184 46.040 45.689 0.351 1
1 1163 . 6 1 1 A 95 95 GLY N N 184 108.106 108.846 -0.740 1
1 1164 . 6 1 1 A 96 96 ASN H H 185 6.833 7.575 -0.742 1
1 1165 . 6 1 1 A 96 96 ASN HA H 185 4.944 5.396 -0.452 1
1 1170 . 6 1 1 A 96 96 ASN C C 185 174.267 174.268 -0.001 1
1 1171 . 6 1 1 A 96 96 ASN CA C 185 52.560 51.296 1.264 1
1 1172 . 6 1 1 A 96 96 ASN CB C 185 45.890 42.563 3.327 1
1 1173 . 6 1 1 A 96 96 ASN N N 185 113.392 117.602 -4.210 1
1 1175 . 6 1 1 A 97 97 PHE H H 186 9.108 9.052 0.056 1
1 1176 . 6 1 1 A 97 97 PHE HA H 186 4.782 4.741 0.041 1
1 1183 . 6 1 1 A 97 97 PHE C C 186 174.862 175.748 -0.886 1
1 1184 . 6 1 1 A 97 97 PHE CA C 186 60.056 59.577 0.479 1
1 1185 . 6 1 1 A 97 97 PHE CB C 186 40.180 39.431 0.749 1
1 1188 . 6 1 1 A 97 97 PHE N N 186 118.741 120.109 -1.368 1
1 1189 . 6 1 1 A 98 98 ILE H H 187 8.933 8.748 0.185 1
1 1190 . 6 1 1 A 98 98 ILE HA H 187 5.458 5.005 0.453 1
1 1200 . 6 1 1 A 98 98 ILE C C 187 176.041 175.217 0.824 1
1 1201 . 6 1 1 A 98 98 ILE CA C 187 57.610 59.093 -1.483 1
1 1202 . 6 1 1 A 98 98 ILE CB C 187 42.070 41.987 0.083 1
1 1206 . 6 1 1 A 98 98 ILE N N 187 117.857 118.964 -1.107 1
1 1207 . 6 1 1 A 99 99 ILE H H 188 8.284 8.714 -0.430 1
1 1208 . 6 1 1 A 99 99 ILE HA H 188 4.341 4.310 0.031 1
1 1218 . 6 1 1 A 99 99 ILE C C 188 176.413 176.492 -0.079 1
1 1219 . 6 1 1 A 99 99 ILE CA C 188 59.190 60.421 -1.231 1
1 1220 . 6 1 1 A 99 99 ILE CB C 188 37.940 38.160 -0.220 1
1 1224 . 6 1 1 A 99 99 ILE N N 188 121.796 122.462 -0.666 1
1 1225 . 6 1 1 A 100 100 LYS H H 189 8.463 8.214 0.249 1
1 1226 . 6 1 1 A 100 100 LYS HA H 189 4.040 4.233 -0.193 1
1 1235 . 6 1 1 A 100 100 LYS C C 189 176.848 177.198 -0.350 1
1 1236 . 6 1 1 A 100 100 LYS CA C 189 57.241 56.395 0.846 1
1 1237 . 6 1 1 A 100 100 LYS CB C 189 33.400 32.976 0.424 1
1 1241 . 6 1 1 A 100 100 LYS N N 189 127.995 124.386 3.609 1
1 1242 . 6 1 1 A 101 101 GLY H H 190 8.346 8.439 -0.093 1
1 1243 . 6 1 1 A 101 101 GLY HA2 H 190 3.947 3.951 -0.004 1
1 1244 . 6 1 1 A 101 101 GLY HA3 H 190 3.813 3.956 -0.143 1
1 1245 . 6 1 1 A 101 101 GLY C C 190 172.902 174.105 -1.203 1
1 1246 . 6 1 1 A 101 101 GLY CA C 190 44.920 46.087 -1.167 1
1 1247 . 6 1 1 A 101 101 GLY N N 190 110.882 112.505 -1.623 1
1 7 . 7 1 1 A 2 2 GLN H H 91 8.786 8.450 0.336 1
1 8 . 7 1 1 A 2 2 GLN HA H 91 4.005 4.079 -0.074 1
1 15 . 7 1 1 A 2 2 GLN C C 91 177.270 178.482 -1.212 1
1 16 . 7 1 1 A 2 2 GLN CA C 91 58.220 58.779 -0.559 1
1 17 . 7 1 1 A 2 2 GLN CB C 91 28.650 28.406 0.244 1
1 19 . 7 1 1 A 2 2 GLN N N 91 121.993 124.169 -2.176 1
1 21 . 7 1 1 A 3 3 GLU H H 92 8.430 8.214 0.216 1
1 22 . 7 1 1 A 3 3 GLU HA H 92 4.007 4.115 -0.108 1
1 27 . 7 1 1 A 3 3 GLU C C 92 178.287 178.848 -0.561 1
1 28 . 7 1 1 A 3 3 GLU CA C 92 59.490 59.286 0.204 1
1 29 . 7 1 1 A 3 3 GLU CB C 92 29.506 29.397 0.109 1
1 31 . 7 1 1 A 3 3 GLU N N 92 120.195 118.689 1.506 1
1 32 . 7 1 1 A 4 4 SER H H 93 8.209 7.776 0.433 1
1 33 . 7 1 1 A 4 4 SER HA H 93 4.272 4.260 0.012 1
1 36 . 7 1 1 A 4 4 SER C C 93 177.369 177.588 -0.219 1
1 37 . 7 1 1 A 4 4 SER CA C 93 61.044 61.459 -0.415 1
1 38 . 7 1 1 A 4 4 SER CB C 93 62.950 62.974 -0.024 1
1 39 . 7 1 1 A 4 4 SER N N 93 115.524 115.281 0.243 1
1 40 . 7 1 1 A 5 5 ILE H H 94 8.080 7.565 0.515 1
1 41 . 7 1 1 A 5 5 ILE HA H 94 3.530 3.626 -0.096 1
1 51 . 7 1 1 A 5 5 ILE C C 94 177.778 177.855 -0.077 1
1 52 . 7 1 1 A 5 5 ILE CA C 94 65.710 65.341 0.369 1
1 53 . 7 1 1 A 5 5 ILE CB C 94 37.800 37.601 0.199 1
1 57 . 7 1 1 A 5 5 ILE N N 94 124.148 121.476 2.672 1
1 58 . 7 1 1 A 6 6 GLN H H 95 8.374 8.253 0.121 1
1 59 . 7 1 1 A 6 6 GLN HA H 95 4.125 3.981 0.144 1
1 66 . 7 1 1 A 6 6 GLN C C 95 179.726 179.245 0.481 1
1 67 . 7 1 1 A 6 6 GLN CA C 95 59.190 59.097 0.093 1
1 68 . 7 1 1 A 6 6 GLN CB C 95 27.060 28.723 -1.663 1
1 70 . 7 1 1 A 6 6 GLN N N 95 118.257 118.533 -0.276 1
1 72 . 7 1 1 A 7 7 ASN H H 96 8.456 7.880 0.576 1
1 73 . 7 1 1 A 7 7 ASN HA H 96 4.446 4.549 -0.103 1
1 78 . 7 1 1 A 7 7 ASN C C 96 177.257 178.499 -1.242 1
1 79 . 7 1 1 A 7 7 ASN CA C 96 56.020 56.086 -0.066 1
1 80 . 7 1 1 A 7 7 ASN CB C 96 38.126 37.839 0.287 1
1 81 . 7 1 1 A 7 7 ASN N N 96 118.597 118.424 0.173 1
1 83 . 7 1 1 A 8 8 LYS H H 97 7.732 7.780 -0.048 1
1 84 . 7 1 1 A 8 8 LYS HA H 97 4.129 4.057 0.072 1
1 93 . 7 1 1 A 8 8 LYS C C 97 179.143 179.256 -0.113 1
1 94 . 7 1 1 A 8 8 LYS CA C 97 59.126 58.617 0.509 1
1 95 . 7 1 1 A 8 8 LYS CB C 97 32.070 31.750 0.320 1
1 99 . 7 1 1 A 8 8 LYS N N 97 122.381 118.783 3.598 1
1 100 . 7 1 1 A 9 9 ILE H H 98 8.452 8.012 0.440 1
1 101 . 7 1 1 A 9 9 ILE HA H 98 3.480 3.871 -0.391 1
1 111 . 7 1 1 A 9 9 ILE C C 98 177.406 178.180 -0.774 1
1 112 . 7 1 1 A 9 9 ILE CA C 98 66.430 64.637 1.793 1
1 113 . 7 1 1 A 9 9 ILE CB C 98 37.980 37.508 0.472 1
1 117 . 7 1 1 A 9 9 ILE N N 98 119.950 121.216 -1.266 1
1 118 . 7 1 1 A 10 10 SER H H 99 7.924 7.917 0.007 1
1 119 . 7 1 1 A 10 10 SER HA H 99 3.983 4.182 -0.199 1
1 122 . 7 1 1 A 10 10 SER C C 99 176.327 177.053 -0.726 1
1 123 . 7 1 1 A 10 10 SER CA C 99 61.990 61.168 0.822 1
1 124 . 7 1 1 A 10 10 SER CB C 99 62.790 63.244 -0.454 1
1 125 . 7 1 1 A 10 10 SER N N 99 113.568 116.328 -2.760 1
1 126 . 7 1 1 A 11 11 GLN H H 100 7.832 7.292 0.540 1
1 127 . 7 1 1 A 11 11 GLN HA H 100 4.238 4.160 0.078 1
1 134 . 7 1 1 A 11 11 GLN C C 100 178.088 178.049 0.039 1
1 135 . 7 1 1 A 11 11 GLN CA C 100 57.900 58.344 -0.444 1
1 136 . 7 1 1 A 11 11 GLN CB C 100 29.790 28.591 1.199 1
1 138 . 7 1 1 A 11 11 GLN N N 100 117.487 121.053 -3.566 1
1 140 . 7 1 1 A 12 12 CYS H H 101 7.920 7.938 -0.018 1
1 141 . 7 1 1 A 12 12 CYS HA H 101 4.657 4.567 0.090 1
1 144 . 7 1 1 A 12 12 CYS C C 101 175.446 174.828 0.618 1
1 145 . 7 1 1 A 12 12 CYS CA C 101 60.654 60.192 0.462 1
1 146 . 7 1 1 A 12 12 CYS CB C 101 29.310 28.285 1.025 1
1 147 . 7 1 1 A 12 12 CYS N N 101 114.221 116.832 -2.611 1
1 148 . 7 1 1 A 13 13 LYS H H 102 8.029 7.221 0.808 1
1 149 . 7 1 1 A 13 13 LYS HA H 102 5.069 4.717 0.352 1
1 158 . 7 1 1 A 13 13 LYS C C 102 174.800 176.272 -1.472 1
1 159 . 7 1 1 A 13 13 LYS CA C 102 56.394 55.997 0.397 1
1 160 . 7 1 1 A 13 13 LYS CB C 102 32.770 33.417 -0.647 1
1 164 . 7 1 1 A 13 13 LYS N N 102 124.129 119.306 4.823 1
1 165 . 7 1 1 A 14 14 PHE H H 103 8.737 8.530 0.207 1
1 166 . 7 1 1 A 14 14 PHE HA H 103 5.059 5.093 -0.034 1
1 174 . 7 1 1 A 14 14 PHE C C 103 173.560 173.300 0.260 1
1 175 . 7 1 1 A 14 14 PHE CA C 103 55.470 55.992 -0.522 1
1 176 . 7 1 1 A 14 14 PHE CB C 103 41.760 41.153 0.607 1
1 180 . 7 1 1 A 14 14 PHE N N 103 118.661 116.591 2.070 1
1 181 . 7 1 1 A 15 15 SER H H 104 8.826 8.829 -0.003 1
1 182 . 7 1 1 A 15 15 SER HA H 104 4.602 4.465 0.137 1
1 185 . 7 1 1 A 15 15 SER C C 104 173.795 173.749 0.046 1
1 186 . 7 1 1 A 15 15 SER CA C 104 58.610 59.224 -0.614 1
1 187 . 7 1 1 A 15 15 SER CB C 104 62.690 62.770 -0.080 1
1 188 . 7 1 1 A 15 15 SER N N 104 117.781 116.758 1.023 1
1 189 . 7 1 1 A 16 16 VAL H H 105 7.784 8.262 -0.478 1
1 190 . 7 1 1 A 16 16 VAL HA H 105 3.370 4.282 -0.912 1
1 198 . 7 1 1 A 16 16 VAL C C 105 174.987 175.264 -0.277 1
1 199 . 7 1 1 A 16 16 VAL CA C 105 63.580 62.667 0.913 1
1 200 . 7 1 1 A 16 16 VAL CB C 105 31.410 30.758 0.652 1
1 203 . 7 1 1 A 16 16 VAL N N 105 129.075 126.937 2.138 1
1 204 . 7 1 1 A 17 17 CYS H H 106 8.536 8.801 -0.265 1
1 205 . 7 1 1 A 17 17 CYS HA H 106 5.011 4.955 0.056 1
1 208 . 7 1 1 A 17 17 CYS CA C 106 55.260 56.421 -1.161 1
1 209 . 7 1 1 A 17 17 CYS CB C 106 28.210 28.913 -0.703 1
1 210 . 7 1 1 A 17 17 CYS N N 106 130.045 127.141 2.904 1
1 211 . 7 1 1 A 18 18 PRO HA H 107 3.991 4.356 -0.365 1
1 218 . 7 1 1 A 18 18 PRO C C 107 178.188 178.008 0.180 1
1 219 . 7 1 1 A 18 18 PRO CA C 107 65.940 64.453 1.487 1
1 220 . 7 1 1 A 18 18 PRO CB C 107 32.000 32.050 -0.050 1
1 223 . 7 1 1 A 19 19 GLU H H 108 9.260 9.011 0.249 1
1 224 . 7 1 1 A 19 19 GLU HA H 108 4.119 4.085 0.034 1
1 229 . 7 1 1 A 19 19 GLU C C 108 178.721 178.886 -0.165 1
1 230 . 7 1 1 A 19 19 GLU CA C 108 59.300 59.484 -0.184 1
1 231 . 7 1 1 A 19 19 GLU CB C 108 28.920 28.846 0.074 1
1 233 . 7 1 1 A 19 19 GLU N N 108 118.270 116.016 2.254 1
1 234 . 7 1 1 A 20 20 ARG H H 109 7.672 7.641 0.031 1
1 235 . 7 1 1 A 20 20 ARG HA H 109 4.331 4.127 0.204 1
1 242 . 7 1 1 A 20 20 ARG C C 109 177.977 178.802 -0.825 1
1 243 . 7 1 1 A 20 20 ARG CA C 109 57.350 58.585 -1.235 1
1 244 . 7 1 1 A 20 20 ARG CB C 109 30.820 30.161 0.659 1
1 247 . 7 1 1 A 20 20 ARG N N 109 118.357 120.160 -1.803 1
1 248 . 7 1 1 A 21 21 LEU H H 110 7.601 7.783 -0.182 1
1 249 . 7 1 1 A 21 21 LEU HA H 110 4.380 4.279 0.101 1
1 259 . 7 1 1 A 21 21 LEU C C 110 176.562 176.610 -0.048 1
1 260 . 7 1 1 A 21 21 LEU CA C 110 56.096 56.174 -0.078 1
1 261 . 7 1 1 A 21 21 LEU CB C 110 44.016 42.251 1.765 1
1 265 . 7 1 1 A 21 21 LEU N N 110 118.626 118.642 -0.016 1
1 266 . 7 1 1 A 22 22 GLN H H 111 7.750 7.440 0.310 1
1 267 . 7 1 1 A 22 22 GLN HA H 111 3.870 3.963 -0.093 1
1 274 . 7 1 1 A 22 22 GLN C C 111 173.336 174.296 -0.960 1
1 275 . 7 1 1 A 22 22 GLN CA C 111 56.510 57.246 -0.736 1
1 276 . 7 1 1 A 22 22 GLN CB C 111 26.800 26.475 0.325 1
1 278 . 7 1 1 A 22 22 GLN N N 111 113.926 115.463 -1.537 1
1 280 . 7 1 1 A 23 23 CYS H H 112 7.407 7.782 -0.375 1
1 281 . 7 1 1 A 23 23 CYS HA H 112 4.469 4.868 -0.399 1
1 284 . 7 1 1 A 23 23 CYS CA C 112 52.650 57.159 -4.509 1
1 285 . 7 1 1 A 23 23 CYS CB C 112 29.750 28.646 1.104 1
1 286 . 7 1 1 A 23 23 CYS N N 112 112.681 117.951 -5.270 1
1 287 . 7 1 1 A 24 24 PRO HA H 113 4.408 4.572 -0.164 1
1 294 . 7 1 1 A 24 24 PRO C C 113 178.175 177.496 0.679 1
1 295 . 7 1 1 A 24 24 PRO CA C 113 62.040 62.878 -0.838 1
1 296 . 7 1 1 A 24 24 PRO CB C 113 31.920 32.611 -0.691 1
1 299 . 7 1 1 A 25 25 LEU H H 114 8.593 8.436 0.157 1
1 300 . 7 1 1 A 25 25 LEU HA H 114 3.765 3.907 -0.142 1
1 310 . 7 1 1 A 25 25 LEU C C 114 179.950 178.637 1.313 1
1 311 . 7 1 1 A 25 25 LEU CA C 114 57.674 57.914 -0.240 1
1 312 . 7 1 1 A 25 25 LEU CB C 114 40.690 41.401 -0.711 1
1 316 . 7 1 1 A 25 25 LEU N N 114 123.729 123.653 0.076 1
1 317 . 7 1 1 A 26 26 GLU H H 115 9.108 8.572 0.536 1
1 318 . 7 1 1 A 26 26 GLU HA H 115 3.876 4.037 -0.161 1
1 323 . 7 1 1 A 26 26 GLU C C 115 177.505 178.590 -1.085 1
1 324 . 7 1 1 A 26 26 GLU CA C 115 59.410 59.129 0.281 1
1 325 . 7 1 1 A 26 26 GLU CB C 115 28.460 29.492 -1.032 1
1 327 . 7 1 1 A 26 26 GLU N N 115 116.817 117.529 -0.712 1
1 328 . 7 1 1 A 27 27 ALA H H 116 7.360 7.599 -0.239 1
1 329 . 7 1 1 A 27 27 ALA HA H 116 4.408 4.042 0.366 1
1 333 . 7 1 1 A 27 27 ALA C C 116 177.046 177.800 -0.754 1
1 334 . 7 1 1 A 27 27 ALA CA C 116 52.970 54.330 -1.360 1
1 335 . 7 1 1 A 27 27 ALA CB C 116 19.916 18.278 1.638 1
1 336 . 7 1 1 A 27 27 ALA N N 116 118.966 120.999 -2.033 1
1 337 . 7 1 1 A 28 28 ILE H H 117 7.168 6.956 0.212 1
1 338 . 7 1 1 A 28 28 ILE HA H 117 4.432 4.332 0.100 1
1 348 . 7 1 1 A 28 28 ILE C C 117 172.641 175.411 -2.770 1
1 349 . 7 1 1 A 28 28 ILE CA C 117 59.980 59.722 0.258 1
1 350 . 7 1 1 A 28 28 ILE CB C 117 37.350 37.888 -0.538 1
1 354 . 7 1 1 A 28 28 ILE N N 117 108.913 108.622 0.291 1
1 355 . 7 1 1 A 29 29 GLN H H 118 6.562 7.233 -0.671 1
1 356 . 7 1 1 A 29 29 GLN HA H 118 3.922 4.089 -0.167 1
1 363 . 7 1 1 A 29 29 GLN C C 118 175.049 175.307 -0.258 1
1 364 . 7 1 1 A 29 29 GLN CA C 118 54.596 56.076 -1.480 1
1 365 . 7 1 1 A 29 29 GLN CB C 118 29.570 28.815 0.755 1
1 367 . 7 1 1 A 29 29 GLN N N 118 116.455 123.428 -6.973 1
1 369 . 7 1 1 A 30 30 CYS H H 119 8.138 8.404 -0.266 1
1 370 . 7 1 1 A 30 30 CYS HA H 119 4.580 4.531 0.049 1
1 373 . 7 1 1 A 30 30 CYS CA C 119 57.810 57.171 0.639 1
1 374 . 7 1 1 A 30 30 CYS CB C 119 30.200 28.722 1.478 1
1 375 . 7 1 1 A 30 30 CYS N N 119 134.136 125.263 8.873 1
1 376 . 7 1 1 A 31 31 PRO HA H 120 4.424 4.423 0.001 1
1 383 . 7 1 1 A 31 31 PRO C C 120 177.431 177.329 0.102 1
1 384 . 7 1 1 A 31 31 PRO CA C 120 64.060 64.009 0.051 1
1 385 . 7 1 1 A 31 31 PRO CB C 120 32.776 31.838 0.938 1
1 388 . 7 1 1 A 32 32 ILE H H 121 11.318 7.808 3.510 1
1 389 . 7 1 1 A 32 32 ILE HA H 121 4.038 4.000 0.038 1
1 399 . 7 1 1 A 32 32 ILE C C 121 178.485 177.844 0.641 1
1 400 . 7 1 1 A 32 32 ILE CA C 121 64.060 63.861 0.199 1
1 401 . 7 1 1 A 32 32 ILE CB C 121 39.340 38.576 0.764 1
1 405 . 7 1 1 A 32 32 ILE N N 121 124.500 117.082 7.418 1
1 406 . 7 1 1 A 33 33 THR H H 122 9.928 7.354 2.574 1
1 407 . 7 1 1 A 33 33 THR HA H 122 4.048 4.361 -0.313 1
1 412 . 7 1 1 A 33 33 THR C C 122 175.793 174.820 0.973 1
1 413 . 7 1 1 A 33 33 THR CA C 122 62.990 61.720 1.270 1
1 414 . 7 1 1 A 33 33 THR CB C 122 70.300 70.034 0.266 1
1 416 . 7 1 1 A 33 33 THR N N 122 115.136 109.120 6.016 1
1 417 . 7 1 1 A 34 34 LEU H H 123 8.439 7.754 0.685 1
1 418 . 7 1 1 A 34 34 LEU HA H 123 3.912 3.824 0.088 1
1 428 . 7 1 1 A 34 34 LEU C C 123 175.495 175.068 0.427 1
1 429 . 7 1 1 A 34 34 LEU CA C 123 56.290 56.231 0.059 1
1 430 . 7 1 1 A 34 34 LEU CB C 123 38.500 39.754 -1.254 1
1 434 . 7 1 1 A 34 34 LEU N N 123 117.230 119.113 -1.883 1
1 435 . 7 1 1 A 35 35 GLU H H 124 7.816 7.010 0.806 1
1 436 . 7 1 1 A 35 35 GLU HA H 124 4.634 4.818 -0.184 1
1 441 . 7 1 1 A 35 35 GLU C C 124 174.838 174.042 0.796 1
1 442 . 7 1 1 A 35 35 GLU CA C 124 53.780 54.627 -0.847 1
1 443 . 7 1 1 A 35 35 GLU CB C 124 33.710 32.698 1.012 1
1 445 . 7 1 1 A 35 35 GLU N N 124 116.577 114.190 2.387 1
1 446 . 7 1 1 A 36 36 GLN H H 125 8.532 8.412 0.120 1
1 447 . 7 1 1 A 36 36 GLN HA H 125 4.958 4.343 0.615 1
1 454 . 7 1 1 A 36 36 GLN CA C 125 53.350 53.507 -0.157 1
1 455 . 7 1 1 A 36 36 GLN CB C 125 29.950 29.334 0.616 1
1 457 . 7 1 1 A 36 36 GLN N N 125 123.034 123.950 -0.916 1
1 459 . 7 1 1 A 37 37 PRO HA H 126 4.458 4.677 -0.219 1
1 466 . 7 1 1 A 37 37 PRO C C 126 176.314 176.897 -0.583 1
1 467 . 7 1 1 A 37 37 PRO CA C 126 62.816 62.612 0.204 1
1 468 . 7 1 1 A 37 37 PRO CB C 126 33.070 32.927 0.143 1
1 471 . 7 1 1 A 38 38 GLU H H 127 8.626 8.387 0.239 1
1 472 . 7 1 1 A 38 38 GLU HA H 127 4.274 4.166 0.108 1
1 477 . 7 1 1 A 38 38 GLU C C 127 177.877 176.577 1.300 1
1 478 . 7 1 1 A 38 38 GLU CA C 127 58.730 57.966 0.764 1
1 479 . 7 1 1 A 38 38 GLU CB C 127 30.340 30.214 0.126 1
1 481 . 7 1 1 A 38 38 GLU N N 127 120.691 119.328 1.363 1
1 482 . 7 1 1 A 39 39 LYS H H 128 7.861 7.676 0.185 1
1 483 . 7 1 1 A 39 39 LYS HA H 128 4.889 4.829 0.060 1
1 492 . 7 1 1 A 39 39 LYS C C 128 175.446 174.848 0.598 1
1 493 . 7 1 1 A 39 39 LYS CA C 128 53.670 54.617 -0.947 1
1 494 . 7 1 1 A 39 39 LYS CB C 128 33.630 35.942 -2.312 1
1 498 . 7 1 1 A 39 39 LYS N N 128 117.878 116.694 1.184 1
1 499 . 7 1 1 A 40 40 GLY H H 129 8.426 7.900 0.526 1
1 500 . 7 1 1 A 40 40 GLY HA2 H 129 4.970 3.957 1.013 1
1 501 . 7 1 1 A 40 40 GLY HA3 H 129 2.458 4.112 -1.654 1
1 502 . 7 1 1 A 40 40 GLY C C 129 170.048 172.297 -2.249 1
1 503 . 7 1 1 A 40 40 GLY CA C 129 42.910 44.930 -2.020 1
1 504 . 7 1 1 A 40 40 GLY N N 129 112.604 105.616 6.988 1
1 505 . 7 1 1 A 41 41 ILE H H 130 8.596 9.093 -0.497 1
1 506 . 7 1 1 A 41 41 ILE HA H 130 4.636 5.050 -0.414 1
1 516 . 7 1 1 A 41 41 ILE C C 130 172.691 174.410 -1.719 1
1 517 . 7 1 1 A 41 41 ILE CA C 130 58.500 58.740 -0.240 1
1 518 . 7 1 1 A 41 41 ILE CB C 130 43.320 40.587 2.733 1
1 522 . 7 1 1 A 41 41 ILE N N 130 113.363 116.959 -3.596 1
1 523 . 7 1 1 A 42 42 PHE H H 131 8.994 9.072 -0.078 1
1 524 . 7 1 1 A 42 42 PHE HA H 131 5.075 5.418 -0.343 1
1 532 . 7 1 1 A 42 42 PHE C C 131 175.111 175.290 -0.179 1
1 533 . 7 1 1 A 42 42 PHE CA C 131 58.680 57.227 1.453 1
1 534 . 7 1 1 A 42 42 PHE CB C 131 42.220 40.422 1.798 1
1 538 . 7 1 1 A 42 42 PHE N N 131 125.156 122.549 2.607 1
1 539 . 7 1 1 A 43 43 VAL H H 132 8.399 9.292 -0.893 1
1 540 . 7 1 1 A 43 43 VAL HA H 132 4.920 4.779 0.141 1
1 548 . 7 1 1 A 43 43 VAL C C 132 178.175 175.432 2.743 1
1 549 . 7 1 1 A 43 43 VAL CA C 132 59.600 60.972 -1.372 1
1 550 . 7 1 1 A 43 43 VAL CB C 132 35.920 34.329 1.591 1
1 553 . 7 1 1 A 43 43 VAL N N 132 119.371 123.160 -3.789 1
1 554 . 7 1 1 A 44 44 LYS H H 133 10.041 8.538 1.503 1
1 555 . 7 1 1 A 44 44 LYS HA H 133 4.920 4.339 0.581 1
1 564 . 7 1 1 A 44 44 LYS C C 133 177.195 175.656 1.539 1
1 565 . 7 1 1 A 44 44 LYS CA C 133 57.310 56.511 0.799 1
1 566 . 7 1 1 A 44 44 LYS CB C 133 34.410 32.515 1.895 1
1 570 . 7 1 1 A 44 44 LYS N N 133 130.928 127.078 3.850 1
1 571 . 7 1 1 A 45 45 ASN H H 134 8.534 8.874 -0.340 1
1 572 . 7 1 1 A 45 45 ASN HA H 134 4.151 4.586 -0.435 1
1 577 . 7 1 1 A 45 45 ASN C C 134 174.217 175.130 -0.913 1
1 578 . 7 1 1 A 45 45 ASN CA C 134 55.290 52.459 2.831 1
1 579 . 7 1 1 A 45 45 ASN CB C 134 37.530 37.998 -0.468 1
1 580 . 7 1 1 A 45 45 ASN N N 134 119.452 124.089 -4.637 1
1 582 . 7 1 1 A 46 46 SER H H 135 7.570 7.962 -0.392 1
1 583 . 7 1 1 A 46 46 SER HA H 135 4.220 4.073 0.147 1
1 586 . 7 1 1 A 46 46 SER C C 135 174.490 176.813 -2.323 1
1 587 . 7 1 1 A 46 46 SER CA C 135 57.090 61.436 -4.346 1
1 588 . 7 1 1 A 46 46 SER CB C 135 64.126 63.045 1.081 1
1 589 . 7 1 1 A 46 46 SER N N 135 105.613 121.571 -15.958 1
1 590 . 7 1 1 A 47 47 ASP H H 136 9.113 8.283 0.830 1
1 591 . 7 1 1 A 47 47 ASP HA H 136 4.220 4.316 -0.096 1
1 594 . 7 1 1 A 47 47 ASP CA C 136 57.610 57.078 0.532 1
1 595 . 7 1 1 A 47 47 ASP CB C 136 40.810 40.791 0.019 1
1 596 . 7 1 1 A 47 47 ASP N N 136 120.995 120.866 0.129 1
1 597 . 7 1 1 A 48 48 GLY H H 137 8.172 7.792 0.380 1
1 598 . 7 1 1 A 48 48 GLY HA2 H 137 4.096 3.741 0.355 1
1 599 . 7 1 1 A 48 48 GLY HA3 H 137 3.664 3.744 -0.080 1
1 600 . 7 1 1 A 48 48 GLY C C 137 173.990 175.071 -1.081 1
1 601 . 7 1 1 A 48 48 GLY CA C 137 45.130 47.218 -2.088 1
1 602 . 7 1 1 A 48 48 GLY N N 137 105.838 106.697 -0.859 1
1 603 . 7 1 1 A 49 49 SER H H 138 7.252 7.479 -0.227 1
1 604 . 7 1 1 A 49 49 SER HA H 138 4.503 4.687 -0.184 1
1 607 . 7 1 1 A 49 49 SER C C 138 173.857 174.014 -0.157 1
1 608 . 7 1 1 A 49 49 SER CA C 138 57.340 57.538 -0.198 1
1 609 . 7 1 1 A 49 49 SER CB C 138 65.370 64.626 0.744 1
1 610 . 7 1 1 A 49 49 SER N N 138 114.942 112.177 2.765 1
1 611 . 7 1 1 A 50 50 ASP H H 139 8.276 8.061 0.215 1
1 612 . 7 1 1 A 50 50 ASP HA H 139 4.618 4.242 0.376 1
1 615 . 7 1 1 A 50 50 ASP C C 139 174.577 174.818 -0.241 1
1 616 . 7 1 1 A 50 50 ASP CA C 139 53.116 55.513 -2.397 1
1 617 . 7 1 1 A 50 50 ASP CB C 139 40.520 40.517 0.003 1
1 618 . 7 1 1 A 50 50 ASP N N 139 122.088 120.207 1.881 1
1 619 . 7 1 1 A 51 51 VAL H H 140 8.192 7.505 0.687 1
1 620 . 7 1 1 A 51 51 VAL HA H 140 4.299 4.219 0.080 1
1 628 . 7 1 1 A 51 51 VAL C C 140 175.867 175.361 0.506 1
1 629 . 7 1 1 A 51 51 VAL CA C 140 62.950 62.468 0.482 1
1 630 . 7 1 1 A 51 51 VAL CB C 140 33.230 32.206 1.024 1
1 632 . 7 1 1 A 51 51 VAL N N 140 121.167 119.823 1.344 1
1 633 . 7 1 1 A 52 52 CYS H H 141 8.391 8.801 -0.410 1
1 634 . 7 1 1 A 52 52 CYS HA H 141 5.247 5.151 0.096 1
1 637 . 7 1 1 A 52 52 CYS C C 141 172.778 174.230 -1.452 1
1 638 . 7 1 1 A 52 52 CYS CA C 141 56.480 58.204 -1.724 1
1 639 . 7 1 1 A 52 52 CYS CB C 141 31.960 28.976 2.984 1
1 640 . 7 1 1 A 52 52 CYS N N 141 121.884 127.107 -5.223 1
1 641 . 7 1 1 A 53 53 THR H H 142 8.777 8.935 -0.158 1
1 642 . 7 1 1 A 53 53 THR HA H 142 4.489 4.960 -0.471 1
1 648 . 7 1 1 A 53 53 THR C C 142 171.885 172.428 -0.543 1
1 649 . 7 1 1 A 53 53 THR CA C 142 62.070 61.313 0.757 1
1 650 . 7 1 1 A 53 53 THR CB C 142 71.390 71.592 -0.202 1
1 652 . 7 1 1 A 53 53 THR N N 142 118.132 118.789 -0.657 1
1 653 . 7 1 1 A 54 54 LEU H H 143 8.409 8.519 -0.110 1
1 654 . 7 1 1 A 54 54 LEU HA H 143 4.276 4.579 -0.303 1
1 664 . 7 1 1 A 54 54 LEU C C 143 174.366 174.241 0.125 1
1 665 . 7 1 1 A 54 54 LEU CA C 143 54.330 53.084 1.246 1
1 666 . 7 1 1 A 54 54 LEU CB C 143 42.396 42.920 -0.524 1
1 670 . 7 1 1 A 54 54 LEU N N 143 127.980 127.874 0.106 1
1 671 . 7 1 1 A 55 55 PHE H H 144 8.646 8.665 -0.019 1
1 672 . 7 1 1 A 55 55 PHE HA H 144 5.455 4.833 0.622 1
1 680 . 7 1 1 A 55 55 PHE C C 144 176.054 175.366 0.688 1
1 681 . 7 1 1 A 55 55 PHE CA C 144 55.250 57.065 -1.815 1
1 682 . 7 1 1 A 55 55 PHE CB C 144 44.100 40.589 3.511 1
1 686 . 7 1 1 A 55 55 PHE N N 144 122.010 126.878 -4.868 1
1 687 . 7 1 1 A 56 56 ASP H H 145 11.575 8.230 3.345 1
1 688 . 7 1 1 A 56 56 ASP HA H 145 4.416 4.515 -0.099 1
1 691 . 7 1 1 A 56 56 ASP C C 145 176.748 177.571 -0.823 1
1 692 . 7 1 1 A 56 56 ASP CA C 145 55.840 54.769 1.071 1
1 693 . 7 1 1 A 56 56 ASP CB C 145 44.390 42.452 1.938 1
1 694 . 7 1 1 A 56 56 ASP N N 145 121.936 124.260 -2.324 1
1 695 . 7 1 1 A 57 57 ALA H H 146 8.508 8.854 -0.346 1
1 696 . 7 1 1 A 57 57 ALA HA H 146 3.797 4.071 -0.274 1
1 700 . 7 1 1 A 57 57 ALA C C 146 178.696 180.088 -1.392 1
1 701 . 7 1 1 A 57 57 ALA CA C 146 55.990 55.548 0.442 1
1 702 . 7 1 1 A 57 57 ALA CB C 146 18.840 18.098 0.742 1
1 703 . 7 1 1 A 57 57 ALA N N 146 130.243 128.859 1.384 1
1 704 . 7 1 1 A 58 58 ALA H H 147 8.378 7.706 0.672 1
1 705 . 7 1 1 A 58 58 ALA HA H 147 4.078 4.219 -0.141 1
1 709 . 7 1 1 A 58 58 ALA C C 147 181.091 179.415 1.676 1
1 710 . 7 1 1 A 58 58 ALA CA C 147 54.770 54.934 -0.164 1
1 711 . 7 1 1 A 58 58 ALA CB C 147 17.700 18.495 -0.795 1
1 712 . 7 1 1 A 58 58 ALA N N 147 121.997 119.847 2.150 1
1 713 . 7 1 1 A 59 59 ALA H H 148 9.138 7.997 1.141 1
1 714 . 7 1 1 A 59 59 ALA HA H 148 3.975 4.029 -0.054 1
1 718 . 7 1 1 A 59 59 ALA C C 148 180.508 179.695 0.813 1
1 719 . 7 1 1 A 59 59 ALA CA C 148 54.840 55.020 -0.180 1
1 720 . 7 1 1 A 59 59 ALA CB C 148 18.600 18.375 0.225 1
1 721 . 7 1 1 A 59 59 ALA N N 148 123.595 120.641 2.954 1
1 722 . 7 1 1 A 60 60 PHE H H 149 8.814 8.165 0.649 1
1 723 . 7 1 1 A 60 60 PHE HA H 149 3.722 4.042 -0.320 1
1 731 . 7 1 1 A 60 60 PHE C C 149 176.773 177.488 -0.715 1
1 732 . 7 1 1 A 60 60 PHE CA C 149 62.030 61.579 0.451 1
1 733 . 7 1 1 A 60 60 PHE CB C 149 39.960 39.004 0.956 1
1 737 . 7 1 1 A 60 60 PHE N N 149 120.354 119.977 0.377 1
1 738 . 7 1 1 A 61 61 SER H H 150 8.276 8.154 0.122 1
1 739 . 7 1 1 A 61 61 SER HA H 150 3.880 4.134 -0.254 1
1 742 . 7 1 1 A 61 61 SER C C 150 177.691 177.368 0.323 1
1 743 . 7 1 1 A 61 61 SER CA C 150 62.190 61.364 0.826 1
1 744 . 7 1 1 A 61 61 SER CB C 150 63.016 63.134 -0.118 1
1 745 . 7 1 1 A 61 61 SER N N 150 112.086 113.820 -1.734 1
1 746 . 7 1 1 A 62 62 ARG H H 151 7.829 7.650 0.179 1
1 747 . 7 1 1 A 62 62 ARG HA H 151 3.971 4.054 -0.083 1
1 754 . 7 1 1 A 62 62 ARG C C 151 178.287 178.671 -0.384 1
1 755 . 7 1 1 A 62 62 ARG CA C 151 59.340 59.083 0.257 1
1 756 . 7 1 1 A 62 62 ARG CB C 151 29.760 29.796 -0.036 1
1 759 . 7 1 1 A 62 62 ARG N N 151 121.090 121.575 -0.485 1
1 760 . 7 1 1 A 63 63 LEU H H 152 7.390 7.788 -0.398 1
1 761 . 7 1 1 A 63 63 LEU HA H 152 3.791 3.915 -0.124 1
1 771 . 7 1 1 A 63 63 LEU C C 152 179.106 178.943 0.163 1
1 772 . 7 1 1 A 63 63 LEU CA C 152 58.900 57.882 1.018 1
1 773 . 7 1 1 A 63 63 LEU CB C 152 41.140 41.338 -0.198 1
1 777 . 7 1 1 A 63 63 LEU N N 152 121.129 119.294 1.835 1
1 778 . 7 1 1 A 64 64 VAL H H 153 7.552 7.891 -0.339 1
1 779 . 7 1 1 A 64 64 VAL HA H 153 3.411 3.478 -0.067 1
1 787 . 7 1 1 A 64 64 VAL C C 153 180.595 178.664 1.931 1
1 788 . 7 1 1 A 64 64 VAL CA C 153 65.644 66.377 -0.733 1
1 789 . 7 1 1 A 64 64 VAL CB C 153 31.410 31.422 -0.012 1
1 792 . 7 1 1 A 64 64 VAL N N 153 118.280 118.445 -0.165 1
1 793 . 7 1 1 A 65 65 GLY H H 154 8.061 8.078 -0.017 1
1 794 . 7 1 1 A 65 65 GLY HA2 H 154 3.846 3.865 -0.019 1
1 795 . 7 1 1 A 65 65 GLY HA3 H 154 3.809 3.866 -0.057 1
1 796 . 7 1 1 A 65 65 GLY C C 154 175.235 175.524 -0.289 1
1 797 . 7 1 1 A 65 65 GLY CA C 154 46.630 46.688 -0.058 1
1 798 . 7 1 1 A 65 65 GLY N N 154 108.622 107.504 1.118 1
1 799 . 7 1 1 A 66 66 GLU H H 155 7.528 7.573 -0.045 1
1 800 . 7 1 1 A 66 66 GLU HA H 155 4.228 4.369 -0.141 1
1 805 . 7 1 1 A 66 66 GLU C C 155 176.761 176.904 -0.143 1
1 806 . 7 1 1 A 66 66 GLU CA C 155 56.590 56.308 0.282 1
1 807 . 7 1 1 A 66 66 GLU CB C 155 30.490 30.495 -0.005 1
1 809 . 7 1 1 A 66 66 GLU N N 155 118.361 118.366 -0.005 1
1 810 . 7 1 1 A 67 67 GLY H H 156 7.884 7.893 -0.009 1
1 811 . 7 1 1 A 67 67 GLY HA2 H 156 3.918 3.903 0.015 1
1 812 . 7 1 1 A 67 67 GLY HA3 H 156 3.747 3.915 -0.168 1
1 813 . 7 1 1 A 67 67 GLY C C 156 174.788 174.371 0.417 1
1 814 . 7 1 1 A 67 67 GLY CA C 156 45.890 45.593 0.297 1
1 815 . 7 1 1 A 67 67 GLY N N 156 108.465 108.325 0.140 1
1 816 . 7 1 1 A 68 68 LEU H H 157 7.332 8.034 -0.702 1
1 817 . 7 1 1 A 68 68 LEU HA H 157 4.361 4.590 -0.229 1
1 827 . 7 1 1 A 68 68 LEU CA C 157 53.060 52.120 0.940 1
1 828 . 7 1 1 A 68 68 LEU CB C 157 41.100 41.724 -0.624 1
1 832 . 7 1 1 A 68 68 LEU N N 157 121.920 121.746 0.174 1
1 833 . 7 1 1 A 69 69 PRO HA H 158 4.485 4.580 -0.095 1
1 840 . 7 1 1 A 69 69 PRO C C 158 174.602 176.233 -1.631 1
1 841 . 7 1 1 A 69 69 PRO CA C 158 61.556 62.220 -0.664 1
1 842 . 7 1 1 A 69 69 PRO CB C 158 32.370 32.997 -0.627 1
1 845 . 7 1 1 A 70 70 HIS H H 159 8.759 8.690 0.069 1
1 846 . 7 1 1 A 70 70 HIS HA H 159 3.947 4.539 -0.592 1
1 852 . 7 1 1 A 70 70 HIS CA C 159 56.250 55.148 1.102 1
1 853 . 7 1 1 A 70 70 HIS CB C 159 32.280 31.085 1.195 1
1 856 . 7 1 1 A 70 70 HIS N N 159 119.423 120.466 -1.043 1
1 857 . 7 1 1 A 71 71 PRO HA H 160 4.424 4.414 0.010 1
1 864 . 7 1 1 A 71 71 PRO C C 160 177.567 177.777 -0.210 1
1 865 . 7 1 1 A 71 71 PRO CA C 160 64.574 64.361 0.213 1
1 866 . 7 1 1 A 71 71 PRO CB C 160 32.340 31.729 0.611 1
1 869 . 7 1 1 A 72 72 LEU H H 161 10.123 7.622 2.501 1
1 870 . 7 1 1 A 72 72 LEU HA H 161 4.778 4.375 0.403 1
1 880 . 7 1 1 A 72 72 LEU C C 161 178.721 178.092 0.629 1
1 881 . 7 1 1 A 72 72 LEU CA C 161 55.800 56.564 -0.764 1
1 882 . 7 1 1 A 72 72 LEU CB C 161 42.440 43.069 -0.629 1
1 886 . 7 1 1 A 72 72 LEU N N 161 117.374 117.388 -0.014 1
1 887 . 7 1 1 A 73 73 THR H H 162 7.523 7.916 -0.393 1
1 888 . 7 1 1 A 73 73 THR HA H 162 4.291 4.530 -0.239 1
1 893 . 7 1 1 A 73 73 THR C C 162 175.557 174.229 1.328 1
1 894 . 7 1 1 A 73 73 THR CA C 162 61.440 62.641 -1.201 1
1 895 . 7 1 1 A 73 73 THR CB C 162 70.500 69.425 1.075 1
1 897 . 7 1 1 A 73 73 THR N N 162 107.787 111.704 -3.917 1
1 898 . 7 1 1 A 74 74 ARG H H 163 8.361 7.933 0.428 1
1 899 . 7 1 1 A 74 74 ARG HA H 163 3.836 4.188 -0.352 1
1 906 . 7 1 1 A 74 74 ARG C C 163 174.701 175.104 -0.403 1
1 907 . 7 1 1 A 74 74 ARG CA C 163 57.980 57.597 0.383 1
1 908 . 7 1 1 A 74 74 ARG CB C 163 26.770 27.111 -0.341 1
1 911 . 7 1 1 A 74 74 ARG N N 163 115.130 118.340 -3.210 1
1 912 . 7 1 1 A 75 75 GLU H H 164 7.430 8.061 -0.631 1
1 913 . 7 1 1 A 75 75 GLU HA H 164 4.636 4.510 0.126 1
1 918 . 7 1 1 A 75 75 GLU CA C 164 53.699 54.710 -1.011 1
1 919 . 7 1 1 A 75 75 GLU CB C 164 29.550 28.696 0.854 1
1 921 . 7 1 1 A 75 75 GLU N N 164 120.076 119.033 1.043 1
1 922 . 7 1 1 A 76 76 PRO HA H 165 4.272 4.508 -0.236 1
1 929 . 7 1 1 A 76 76 PRO C C 165 176.649 176.950 -0.301 1
1 930 . 7 1 1 A 76 76 PRO CA C 165 63.204 63.163 0.041 1
1 931 . 7 1 1 A 76 76 PRO CB C 165 31.680 31.625 0.055 1
1 934 . 7 1 1 A 77 77 ILE H H 166 8.812 8.227 0.585 1
1 935 . 7 1 1 A 77 77 ILE HA H 166 3.838 4.313 -0.475 1
1 945 . 7 1 1 A 77 77 ILE C C 166 175.235 176.000 -0.765 1
1 946 . 7 1 1 A 77 77 ILE CA C 166 62.816 61.291 1.525 1
1 947 . 7 1 1 A 77 77 ILE CB C 166 37.750 38.369 -0.619 1
1 951 . 7 1 1 A 77 77 ILE N N 166 123.831 124.131 -0.300 1
1 952 . 7 1 1 A 78 78 THR H H 167 6.625 8.534 -1.909 1
1 953 . 7 1 1 A 78 78 THR HA H 167 4.632 5.030 -0.398 1
1 958 . 7 1 1 A 78 78 THR C C 167 174.143 174.158 -0.015 1
1 959 . 7 1 1 A 78 78 THR CA C 167 58.750 60.101 -1.351 1
1 960 . 7 1 1 A 78 78 THR CB C 167 71.320 70.808 0.512 1
1 962 . 7 1 1 A 78 78 THR N N 167 115.293 117.666 -2.373 1
1 963 . 7 1 1 A 79 79 ALA H H 168 9.088 8.977 0.111 1
1 964 . 7 1 1 A 79 79 ALA HA H 168 3.916 4.111 -0.195 1
1 968 . 7 1 1 A 79 79 ALA C C 168 179.788 179.771 0.017 1
1 969 . 7 1 1 A 79 79 ALA CA C 168 55.480 55.049 0.431 1
1 970 . 7 1 1 A 79 79 ALA CB C 168 17.630 18.456 -0.826 1
1 971 . 7 1 1 A 79 79 ALA N N 168 122.102 127.622 -5.520 1
1 972 . 7 1 1 A 80 80 SER H H 169 7.988 7.687 0.301 1
1 973 . 7 1 1 A 80 80 SER HA H 169 4.058 4.121 -0.063 1
1 976 . 7 1 1 A 80 80 SER C C 169 176.029 176.515 -0.486 1
1 977 . 7 1 1 A 80 80 SER CA C 169 60.750 62.260 -1.510 1
1 978 . 7 1 1 A 80 80 SER CB C 169 62.510 63.153 -0.643 1
1 979 . 7 1 1 A 80 80 SER N N 169 109.541 114.653 -5.112 1
1 980 . 7 1 1 A 81 81 ILE H H 170 6.968 7.676 -0.708 1
1 981 . 7 1 1 A 81 81 ILE HA H 170 4.315 4.284 0.031 1
1 991 . 7 1 1 A 81 81 ILE C C 170 174.242 175.593 -1.351 1
1 992 . 7 1 1 A 81 81 ILE CA C 170 62.296 62.254 0.042 1
1 993 . 7 1 1 A 81 81 ILE CB C 170 37.686 38.144 -0.458 1
1 997 . 7 1 1 A 81 81 ILE N N 170 112.476 113.785 -1.309 1
1 998 . 7 1 1 A 82 82 ILE H H 171 7.345 7.438 -0.093 1
1 999 . 7 1 1 A 82 82 ILE HA H 171 4.339 4.658 -0.319 1
1 1009 . 7 1 1 A 82 82 ILE C C 171 174.999 174.628 0.371 1
1 1010 . 7 1 1 A 82 82 ILE CA C 171 61.150 60.235 0.915 1
1 1011 . 7 1 1 A 82 82 ILE CB C 171 37.230 40.184 -2.954 1
1 1015 . 7 1 1 A 82 82 ILE N N 171 124.260 124.666 -0.406 1
1 1016 . 7 1 1 A 83 83 VAL H H 172 7.923 9.224 -1.301 1
1 1017 . 7 1 1 A 83 83 VAL HA H 172 4.673 5.106 -0.433 1
1 1025 . 7 1 1 A 83 83 VAL C C 172 174.887 175.141 -0.254 1
1 1026 . 7 1 1 A 83 83 VAL CA C 172 59.340 59.034 0.306 1
1 1027 . 7 1 1 A 83 83 VAL CB C 172 34.840 36.024 -1.184 1
1 1030 . 7 1 1 A 83 83 VAL N N 172 120.931 122.320 -1.389 1
1 1031 . 7 1 1 A 84 84 LYS H H 173 8.406 8.645 -0.239 1
1 1032 . 7 1 1 A 84 84 LYS HA H 173 4.410 4.831 -0.421 1
1 1041 . 7 1 1 A 84 84 LYS C C 173 178.734 178.474 0.260 1
1 1042 . 7 1 1 A 84 84 LYS CA C 173 56.360 54.809 1.551 1
1 1043 . 7 1 1 A 84 84 LYS CB C 173 33.100 34.350 -1.250 1
1 1047 . 7 1 1 A 84 84 LYS N N 173 121.251 120.909 0.342 1
1 1048 . 7 1 1 A 85 85 HIS H H 174 9.221 9.199 0.022 1
1 1049 . 7 1 1 A 85 85 HIS HA H 174 4.024 4.021 0.003 1
1 1053 . 7 1 1 A 85 85 HIS C C 174 177.183 176.923 0.260 1
1 1054 . 7 1 1 A 85 85 HIS CA C 174 59.460 60.460 -1.000 1
1 1055 . 7 1 1 A 85 85 HIS CB C 174 27.920 29.824 -1.904 1
1 1057 . 7 1 1 A 85 85 HIS N N 174 121.545 122.825 -1.280 1
1 1058 . 7 1 1 A 86 86 GLU H H 175 8.699 8.291 0.408 1
1 1059 . 7 1 1 A 86 86 GLU HA H 175 3.900 4.067 -0.167 1
1 1064 . 7 1 1 A 86 86 GLU C C 175 177.220 178.292 -1.072 1
1 1065 . 7 1 1 A 86 86 GLU CA C 175 58.420 59.111 -0.691 1
1 1066 . 7 1 1 A 86 86 GLU CB C 175 28.690 29.471 -0.781 1
1 1068 . 7 1 1 A 86 86 GLU N N 175 118.011 118.896 -0.885 1
1 1069 . 7 1 1 A 87 87 GLU H H 176 7.621 7.471 0.150 1
1 1070 . 7 1 1 A 87 87 GLU HA H 176 4.177 4.120 0.057 1
1 1075 . 7 1 1 A 87 87 GLU C C 176 175.222 176.071 -0.849 1
1 1076 . 7 1 1 A 87 87 GLU CA C 176 56.390 58.331 -1.941 1
1 1077 . 7 1 1 A 87 87 GLU CB C 176 30.430 29.882 0.548 1
1 1079 . 7 1 1 A 87 87 GLU N N 176 116.753 118.474 -1.721 1
1 1080 . 7 1 1 A 88 88 CYS H H 177 7.239 7.127 0.112 1
1 1081 . 7 1 1 A 88 88 CYS HA H 177 5.148 5.018 0.130 1
1 1084 . 7 1 1 A 88 88 CYS C C 177 173.249 173.338 -0.089 1
1 1085 . 7 1 1 A 88 88 CYS CA C 177 57.240 56.745 0.495 1
1 1086 . 7 1 1 A 88 88 CYS CB C 177 31.020 30.669 0.351 1
1 1087 . 7 1 1 A 88 88 CYS N N 177 116.096 115.590 0.506 1
1 1088 . 7 1 1 A 89 89 ILE H H 178 8.912 8.630 0.282 1
1 1089 . 7 1 1 A 89 89 ILE HA H 178 4.580 4.792 -0.212 1
1 1099 . 7 1 1 A 89 89 ILE C C 178 173.386 174.219 -0.833 1
1 1100 . 7 1 1 A 89 89 ILE CA C 178 59.270 59.124 0.146 1
1 1101 . 7 1 1 A 89 89 ILE CB C 178 42.990 41.979 1.011 1
1 1105 . 7 1 1 A 89 89 ILE N N 178 119.490 119.251 0.239 1
1 1106 . 7 1 1 A 90 90 TYR H H 179 9.047 8.552 0.495 1
1 1107 . 7 1 1 A 90 90 TYR HA H 179 3.753 4.018 -0.265 1
1 1112 . 7 1 1 A 90 90 TYR C C 179 173.932 173.879 0.053 1
1 1113 . 7 1 1 A 90 90 TYR CA C 179 59.860 57.070 2.790 1
1 1114 . 7 1 1 A 90 90 TYR CB C 179 37.530 38.315 -0.785 1
1 1116 . 7 1 1 A 90 90 TYR N N 179 126.270 122.109 4.161 1
1 1117 . 7 1 1 A 91 91 ASP H H 180 7.462 8.196 -0.734 1
1 1118 . 7 1 1 A 91 91 ASP HA H 180 4.639 4.945 -0.306 1
1 1121 . 7 1 1 A 91 91 ASP C C 180 175.297 176.145 -0.848 1
1 1122 . 7 1 1 A 91 91 ASP CA C 180 52.496 52.350 0.146 1
1 1123 . 7 1 1 A 91 91 ASP CB C 180 43.380 42.938 0.442 1
1 1124 . 7 1 1 A 91 91 ASP N N 180 129.593 122.793 6.800 1
1 1125 . 7 1 1 A 92 92 ASP H H 181 8.719 9.002 -0.283 1
1 1126 . 7 1 1 A 92 92 ASP HA H 181 4.109 4.318 -0.209 1
1 1129 . 7 1 1 A 92 92 ASP C C 181 177.555 177.547 0.008 1
1 1130 . 7 1 1 A 92 92 ASP CA C 181 56.390 57.711 -1.321 1
1 1131 . 7 1 1 A 92 92 ASP CB C 181 41.330 40.983 0.347 1
1 1132 . 7 1 1 A 92 92 ASP N N 181 125.691 126.721 -1.030 1
1 1133 . 7 1 1 A 93 93 THR H H 182 8.271 7.550 0.721 1
1 1134 . 7 1 1 A 93 93 THR HA H 182 4.036 3.974 0.062 1
1 1139 . 7 1 1 A 93 93 THR C C 182 176.289 176.386 -0.097 1
1 1140 . 7 1 1 A 93 93 THR CA C 182 65.054 64.901 0.153 1
1 1141 . 7 1 1 A 93 93 THR CB C 182 68.560 68.831 -0.271 1
1 1143 . 7 1 1 A 93 93 THR N N 182 114.813 113.506 1.307 1
1 1144 . 7 1 1 A 94 94 ARG H H 183 7.753 7.517 0.236 1
1 1145 . 7 1 1 A 94 94 ARG HA H 183 4.139 4.308 -0.169 1
1 1152 . 7 1 1 A 94 94 ARG C C 183 176.897 177.287 -0.390 1
1 1153 . 7 1 1 A 94 94 ARG CA C 183 55.350 56.391 -1.041 1
1 1154 . 7 1 1 A 94 94 ARG CB C 183 30.930 31.085 -0.155 1
1 1157 . 7 1 1 A 94 94 ARG N N 183 120.101 117.768 2.333 1
1 1158 . 7 1 1 A 95 95 GLY H H 184 8.112 8.684 -0.572 1
1 1159 . 7 1 1 A 95 95 GLY HA2 H 184 3.838 3.936 -0.098 1
1 1160 . 7 1 1 A 95 95 GLY HA3 H 184 3.670 3.944 -0.274 1
1 1161 . 7 1 1 A 95 95 GLY C C 184 173.659 173.562 0.097 1
1 1162 . 7 1 1 A 95 95 GLY CA C 184 46.040 46.166 -0.126 1
1 1163 . 7 1 1 A 95 95 GLY N N 184 108.106 108.620 -0.514 1
1 1164 . 7 1 1 A 96 96 ASN H H 185 6.833 7.511 -0.678 1
1 1165 . 7 1 1 A 96 96 ASN HA H 185 4.944 5.316 -0.372 1
1 1170 . 7 1 1 A 96 96 ASN C C 185 174.267 174.103 0.164 1
1 1171 . 7 1 1 A 96 96 ASN CA C 185 52.560 51.623 0.937 1
1 1172 . 7 1 1 A 96 96 ASN CB C 185 45.890 42.661 3.229 1
1 1173 . 7 1 1 A 96 96 ASN N N 185 113.392 117.371 -3.979 1
1 1175 . 7 1 1 A 97 97 PHE H H 186 9.108 9.000 0.108 1
1 1176 . 7 1 1 A 97 97 PHE HA H 186 4.782 4.728 0.054 1
1 1183 . 7 1 1 A 97 97 PHE C C 186 174.862 175.573 -0.711 1
1 1184 . 7 1 1 A 97 97 PHE CA C 186 60.056 59.130 0.926 1
1 1185 . 7 1 1 A 97 97 PHE CB C 186 40.180 39.153 1.027 1
1 1188 . 7 1 1 A 97 97 PHE N N 186 118.741 120.724 -1.983 1
1 1189 . 7 1 1 A 98 98 ILE H H 187 8.933 8.753 0.180 1
1 1190 . 7 1 1 A 98 98 ILE HA H 187 5.458 5.058 0.400 1
1 1200 . 7 1 1 A 98 98 ILE C C 187 176.041 175.262 0.779 1
1 1201 . 7 1 1 A 98 98 ILE CA C 187 57.610 59.114 -1.504 1
1 1202 . 7 1 1 A 98 98 ILE CB C 187 42.070 41.552 0.518 1
1 1206 . 7 1 1 A 98 98 ILE N N 187 117.857 119.186 -1.329 1
1 1207 . 7 1 1 A 99 99 ILE H H 188 8.284 8.499 -0.215 1
1 1208 . 7 1 1 A 99 99 ILE HA H 188 4.341 4.235 0.106 1
1 1218 . 7 1 1 A 99 99 ILE C C 188 176.413 176.416 -0.003 1
1 1219 . 7 1 1 A 99 99 ILE CA C 188 59.190 60.338 -1.148 1
1 1220 . 7 1 1 A 99 99 ILE CB C 188 37.940 38.368 -0.428 1
1 1224 . 7 1 1 A 99 99 ILE N N 188 121.796 122.164 -0.368 1
1 1225 . 7 1 1 A 100 100 LYS H H 189 8.463 8.638 -0.175 1
1 1226 . 7 1 1 A 100 100 LYS HA H 189 4.040 4.299 -0.259 1
1 1235 . 7 1 1 A 100 100 LYS C C 189 176.848 176.481 0.367 1
1 1236 . 7 1 1 A 100 100 LYS CA C 189 57.241 57.375 -0.134 1
1 1237 . 7 1 1 A 100 100 LYS CB C 189 33.400 33.378 0.022 1
1 1241 . 7 1 1 A 100 100 LYS N N 189 127.995 125.090 2.905 1
1 1242 . 7 1 1 A 101 101 GLY H H 190 8.346 8.456 -0.110 1
1 1243 . 7 1 1 A 101 101 GLY HA2 H 190 3.947 4.206 -0.259 1
1 1244 . 7 1 1 A 101 101 GLY HA3 H 190 3.813 4.206 -0.393 1
1 1245 . 7 1 1 A 101 101 GLY C C 190 172.902 174.187 -1.285 1
1 1246 . 7 1 1 A 101 101 GLY CA C 190 44.920 45.565 -0.645 1
1 1247 . 7 1 1 A 101 101 GLY N N 190 110.882 109.361 1.521 1
1 7 . 8 1 1 A 2 2 GLN H H 91 8.786 7.926 0.860 1
1 8 . 8 1 1 A 2 2 GLN HA H 91 4.005 4.089 -0.084 1
1 15 . 8 1 1 A 2 2 GLN C C 91 177.270 178.496 -1.226 1
1 16 . 8 1 1 A 2 2 GLN CA C 91 58.220 58.859 -0.639 1
1 17 . 8 1 1 A 2 2 GLN CB C 91 28.650 28.361 0.289 1
1 19 . 8 1 1 A 2 2 GLN N N 91 121.993 119.990 2.003 1
1 21 . 8 1 1 A 3 3 GLU H H 92 8.430 8.279 0.151 1
1 22 . 8 1 1 A 3 3 GLU HA H 92 4.007 4.119 -0.112 1
1 27 . 8 1 1 A 3 3 GLU C C 92 178.287 178.692 -0.405 1
1 28 . 8 1 1 A 3 3 GLU CA C 92 59.490 59.146 0.344 1
1 29 . 8 1 1 A 3 3 GLU CB C 92 29.506 29.510 -0.004 1
1 31 . 8 1 1 A 3 3 GLU N N 92 120.195 118.645 1.550 1
1 32 . 8 1 1 A 4 4 SER H H 93 8.209 7.849 0.360 1
1 33 . 8 1 1 A 4 4 SER HA H 93 4.272 4.282 -0.010 1
1 36 . 8 1 1 A 4 4 SER C C 93 177.369 177.437 -0.068 1
1 37 . 8 1 1 A 4 4 SER CA C 93 61.044 61.291 -0.247 1
1 38 . 8 1 1 A 4 4 SER CB C 93 62.950 62.759 0.191 1
1 39 . 8 1 1 A 4 4 SER N N 93 115.524 114.799 0.725 1
1 40 . 8 1 1 A 5 5 ILE H H 94 8.080 7.898 0.182 1
1 41 . 8 1 1 A 5 5 ILE HA H 94 3.530 3.591 -0.061 1
1 51 . 8 1 1 A 5 5 ILE C C 94 177.778 177.858 -0.080 1
1 52 . 8 1 1 A 5 5 ILE CA C 94 65.710 65.428 0.282 1
1 53 . 8 1 1 A 5 5 ILE CB C 94 37.800 37.737 0.063 1
1 57 . 8 1 1 A 5 5 ILE N N 94 124.148 122.060 2.088 1
1 58 . 8 1 1 A 6 6 GLN H H 95 8.374 8.227 0.147 1
1 59 . 8 1 1 A 6 6 GLN HA H 95 4.125 4.130 -0.005 1
1 66 . 8 1 1 A 6 6 GLN C C 95 179.726 179.060 0.666 1
1 67 . 8 1 1 A 6 6 GLN CA C 95 59.190 59.204 -0.014 1
1 68 . 8 1 1 A 6 6 GLN CB C 95 27.060 27.953 -0.893 1
1 70 . 8 1 1 A 6 6 GLN N N 95 118.257 118.233 0.024 1
1 72 . 8 1 1 A 7 7 ASN H H 96 8.456 7.925 0.531 1
1 73 . 8 1 1 A 7 7 ASN HA H 96 4.446 4.523 -0.077 1
1 78 . 8 1 1 A 7 7 ASN C C 96 177.257 178.279 -1.022 1
1 79 . 8 1 1 A 7 7 ASN CA C 96 56.020 56.114 -0.094 1
1 80 . 8 1 1 A 7 7 ASN CB C 96 38.126 37.760 0.366 1
1 81 . 8 1 1 A 7 7 ASN N N 96 118.597 118.814 -0.217 1
1 83 . 8 1 1 A 8 8 LYS H H 97 7.732 7.735 -0.003 1
1 84 . 8 1 1 A 8 8 LYS HA H 97 4.129 4.122 0.007 1
1 93 . 8 1 1 A 8 8 LYS C C 97 179.143 179.494 -0.351 1
1 94 . 8 1 1 A 8 8 LYS CA C 97 59.126 59.854 -0.728 1
1 95 . 8 1 1 A 8 8 LYS CB C 97 32.070 32.571 -0.501 1
1 99 . 8 1 1 A 8 8 LYS N N 97 122.381 118.450 3.931 1
1 100 . 8 1 1 A 9 9 ILE H H 98 8.452 8.011 0.441 1
1 101 . 8 1 1 A 9 9 ILE HA H 98 3.480 3.772 -0.292 1
1 111 . 8 1 1 A 9 9 ILE C C 98 177.406 178.387 -0.981 1
1 112 . 8 1 1 A 9 9 ILE CA C 98 66.430 65.447 0.983 1
1 113 . 8 1 1 A 9 9 ILE CB C 98 37.980 37.675 0.305 1
1 117 . 8 1 1 A 9 9 ILE N N 98 119.950 121.006 -1.056 1
1 118 . 8 1 1 A 10 10 SER H H 99 7.924 7.886 0.038 1
1 119 . 8 1 1 A 10 10 SER HA H 99 3.983 4.333 -0.350 1
1 122 . 8 1 1 A 10 10 SER C C 99 176.327 175.562 0.765 1
1 123 . 8 1 1 A 10 10 SER CA C 99 61.990 61.295 0.695 1
1 124 . 8 1 1 A 10 10 SER CB C 99 62.790 63.125 -0.335 1
1 125 . 8 1 1 A 10 10 SER N N 99 113.568 116.886 -3.318 1
1 126 . 8 1 1 A 11 11 GLN H H 100 7.832 7.220 0.612 1
1 127 . 8 1 1 A 11 11 GLN HA H 100 4.238 4.214 0.024 1
1 134 . 8 1 1 A 11 11 GLN C C 100 178.088 177.903 0.185 1
1 135 . 8 1 1 A 11 11 GLN CA C 100 57.900 57.938 -0.038 1
1 136 . 8 1 1 A 11 11 GLN CB C 100 29.790 28.836 0.954 1
1 138 . 8 1 1 A 11 11 GLN N N 100 117.487 120.241 -2.754 1
1 140 . 8 1 1 A 12 12 CYS H H 101 7.920 8.021 -0.101 1
1 141 . 8 1 1 A 12 12 CYS HA H 101 4.657 4.538 0.119 1
1 144 . 8 1 1 A 12 12 CYS C C 101 175.446 174.837 0.609 1
1 145 . 8 1 1 A 12 12 CYS CA C 101 60.654 61.055 -0.401 1
1 146 . 8 1 1 A 12 12 CYS CB C 101 29.310 28.390 0.920 1
1 147 . 8 1 1 A 12 12 CYS N N 101 114.221 116.844 -2.623 1
1 148 . 8 1 1 A 13 13 LYS H H 102 8.029 7.278 0.751 1
1 149 . 8 1 1 A 13 13 LYS HA H 102 5.069 4.805 0.264 1
1 158 . 8 1 1 A 13 13 LYS C C 102 174.800 176.430 -1.630 1
1 159 . 8 1 1 A 13 13 LYS CA C 102 56.394 56.210 0.184 1
1 160 . 8 1 1 A 13 13 LYS CB C 102 32.770 33.376 -0.606 1
1 164 . 8 1 1 A 13 13 LYS N N 102 124.129 119.238 4.891 1
1 165 . 8 1 1 A 14 14 PHE H H 103 8.737 8.739 -0.002 1
1 166 . 8 1 1 A 14 14 PHE HA H 103 5.059 5.165 -0.106 1
1 174 . 8 1 1 A 14 14 PHE C C 103 173.560 173.555 0.005 1
1 175 . 8 1 1 A 14 14 PHE CA C 103 55.470 55.766 -0.296 1
1 176 . 8 1 1 A 14 14 PHE CB C 103 41.760 41.616 0.144 1
1 180 . 8 1 1 A 14 14 PHE N N 103 118.661 116.572 2.089 1
1 181 . 8 1 1 A 15 15 SER H H 104 8.826 8.516 0.310 1
1 182 . 8 1 1 A 15 15 SER HA H 104 4.602 4.703 -0.101 1
1 185 . 8 1 1 A 15 15 SER C C 104 173.795 173.937 -0.142 1
1 186 . 8 1 1 A 15 15 SER CA C 104 58.610 57.903 0.707 1
1 187 . 8 1 1 A 15 15 SER CB C 104 62.690 62.437 0.253 1
1 188 . 8 1 1 A 15 15 SER N N 104 117.781 115.064 2.717 1
1 189 . 8 1 1 A 16 16 VAL H H 105 7.784 8.033 -0.249 1
1 190 . 8 1 1 A 16 16 VAL HA H 105 3.370 3.910 -0.540 1
1 198 . 8 1 1 A 16 16 VAL C C 105 174.987 175.365 -0.378 1
1 199 . 8 1 1 A 16 16 VAL CA C 105 63.580 62.827 0.753 1
1 200 . 8 1 1 A 16 16 VAL CB C 105 31.410 30.726 0.684 1
1 203 . 8 1 1 A 16 16 VAL N N 105 129.075 126.082 2.993 1
1 204 . 8 1 1 A 17 17 CYS H H 106 8.536 8.196 0.340 1
1 205 . 8 1 1 A 17 17 CYS HA H 106 5.011 4.961 0.050 1
1 208 . 8 1 1 A 17 17 CYS CA C 106 55.260 56.295 -1.035 1
1 209 . 8 1 1 A 17 17 CYS CB C 106 28.210 28.548 -0.338 1
1 210 . 8 1 1 A 17 17 CYS N N 106 130.045 127.314 2.731 1
1 211 . 8 1 1 A 18 18 PRO HA H 107 3.991 4.342 -0.351 1
1 218 . 8 1 1 A 18 18 PRO C C 107 178.188 178.358 -0.170 1
1 219 . 8 1 1 A 18 18 PRO CA C 107 65.940 65.058 0.882 1
1 220 . 8 1 1 A 18 18 PRO CB C 107 32.000 32.105 -0.105 1
1 223 . 8 1 1 A 19 19 GLU H H 108 9.260 9.070 0.190 1
1 224 . 8 1 1 A 19 19 GLU HA H 108 4.119 4.071 0.048 1
1 229 . 8 1 1 A 19 19 GLU C C 108 178.721 178.764 -0.043 1
1 230 . 8 1 1 A 19 19 GLU CA C 108 59.300 59.451 -0.151 1
1 231 . 8 1 1 A 19 19 GLU CB C 108 28.920 28.808 0.112 1
1 233 . 8 1 1 A 19 19 GLU N N 108 118.270 116.231 2.039 1
1 234 . 8 1 1 A 20 20 ARG H H 109 7.672 7.704 -0.032 1
1 235 . 8 1 1 A 20 20 ARG HA H 109 4.331 4.316 0.015 1
1 242 . 8 1 1 A 20 20 ARG C C 109 177.977 178.214 -0.237 1
1 243 . 8 1 1 A 20 20 ARG CA C 109 57.350 57.923 -0.573 1
1 244 . 8 1 1 A 20 20 ARG CB C 109 30.820 30.772 0.048 1
1 247 . 8 1 1 A 20 20 ARG N N 109 118.357 119.036 -0.679 1
1 248 . 8 1 1 A 21 21 LEU H H 110 7.601 7.704 -0.103 1
1 249 . 8 1 1 A 21 21 LEU HA H 110 4.380 4.247 0.133 1
1 259 . 8 1 1 A 21 21 LEU C C 110 176.562 176.387 0.175 1
1 260 . 8 1 1 A 21 21 LEU CA C 110 56.096 55.450 0.646 1
1 261 . 8 1 1 A 21 21 LEU CB C 110 44.016 42.089 1.927 1
1 265 . 8 1 1 A 21 21 LEU N N 110 118.626 118.673 -0.047 1
1 266 . 8 1 1 A 22 22 GLN H H 111 7.750 7.829 -0.079 1
1 267 . 8 1 1 A 22 22 GLN HA H 111 3.870 3.965 -0.095 1
1 274 . 8 1 1 A 22 22 GLN C C 111 173.336 174.341 -1.005 1
1 275 . 8 1 1 A 22 22 GLN CA C 111 56.510 57.330 -0.820 1
1 276 . 8 1 1 A 22 22 GLN CB C 111 26.800 26.419 0.381 1
1 278 . 8 1 1 A 22 22 GLN N N 111 113.926 115.778 -1.852 1
1 280 . 8 1 1 A 23 23 CYS H H 112 7.407 7.778 -0.371 1
1 281 . 8 1 1 A 23 23 CYS HA H 112 4.469 4.807 -0.338 1
1 284 . 8 1 1 A 23 23 CYS CA C 112 52.650 56.853 -4.203 1
1 285 . 8 1 1 A 23 23 CYS CB C 112 29.750 28.781 0.969 1
1 286 . 8 1 1 A 23 23 CYS N N 112 112.681 117.885 -5.204 1
1 287 . 8 1 1 A 24 24 PRO HA H 113 4.408 4.560 -0.152 1
1 294 . 8 1 1 A 24 24 PRO C C 113 178.175 177.262 0.913 1
1 295 . 8 1 1 A 24 24 PRO CA C 113 62.040 62.552 -0.512 1
1 296 . 8 1 1 A 24 24 PRO CB C 113 31.920 32.962 -1.042 1
1 299 . 8 1 1 A 25 25 LEU H H 114 8.593 8.419 0.174 1
1 300 . 8 1 1 A 25 25 LEU HA H 114 3.765 3.920 -0.155 1
1 310 . 8 1 1 A 25 25 LEU C C 114 179.950 178.798 1.152 1
1 311 . 8 1 1 A 25 25 LEU CA C 114 57.674 57.821 -0.147 1
1 312 . 8 1 1 A 25 25 LEU CB C 114 40.690 41.377 -0.687 1
1 316 . 8 1 1 A 25 25 LEU N N 114 123.729 122.988 0.741 1
1 317 . 8 1 1 A 26 26 GLU H H 115 9.108 8.567 0.541 1
1 318 . 8 1 1 A 26 26 GLU HA H 115 3.876 4.086 -0.210 1
1 323 . 8 1 1 A 26 26 GLU C C 115 177.505 178.495 -0.990 1
1 324 . 8 1 1 A 26 26 GLU CA C 115 59.410 59.065 0.345 1
1 325 . 8 1 1 A 26 26 GLU CB C 115 28.460 29.394 -0.934 1
1 327 . 8 1 1 A 26 26 GLU N N 115 116.817 117.371 -0.554 1
1 328 . 8 1 1 A 27 27 ALA H H 116 7.360 7.662 -0.302 1
1 329 . 8 1 1 A 27 27 ALA HA H 116 4.408 4.137 0.271 1
1 333 . 8 1 1 A 27 27 ALA C C 116 177.046 177.907 -0.861 1
1 334 . 8 1 1 A 27 27 ALA CA C 116 52.970 54.488 -1.518 1
1 335 . 8 1 1 A 27 27 ALA CB C 116 19.916 18.400 1.516 1
1 336 . 8 1 1 A 27 27 ALA N N 116 118.966 120.795 -1.829 1
1 337 . 8 1 1 A 28 28 ILE H H 117 7.168 7.069 0.099 1
1 338 . 8 1 1 A 28 28 ILE HA H 117 4.432 4.476 -0.044 1
1 348 . 8 1 1 A 28 28 ILE C C 117 172.641 175.643 -3.002 1
1 349 . 8 1 1 A 28 28 ILE CA C 117 59.980 59.676 0.304 1
1 350 . 8 1 1 A 28 28 ILE CB C 117 37.350 37.606 -0.256 1
1 354 . 8 1 1 A 28 28 ILE N N 117 108.913 108.870 0.043 1
1 355 . 8 1 1 A 29 29 GLN H H 118 6.562 7.232 -0.670 1
1 356 . 8 1 1 A 29 29 GLN HA H 118 3.922 4.340 -0.418 1
1 363 . 8 1 1 A 29 29 GLN C C 118 175.049 175.567 -0.518 1
1 364 . 8 1 1 A 29 29 GLN CA C 118 54.596 55.836 -1.240 1
1 365 . 8 1 1 A 29 29 GLN CB C 118 29.570 29.430 0.140 1
1 367 . 8 1 1 A 29 29 GLN N N 118 116.455 123.293 -6.838 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 4.500 0.080 1
1 373 . 8 1 1 A 30 30 CYS CA C 119 57.810 57.088 0.722 1
1 374 . 8 1 1 A 30 30 CYS CB C 119 30.200 28.761 1.439 1
1 375 . 8 1 1 A 30 30 CYS N N 119 134.136 125.609 8.527 1
1 376 . 8 1 1 A 31 31 PRO HA H 120 4.424 4.462 -0.038 1
1 383 . 8 1 1 A 31 31 PRO C C 120 177.431 177.931 -0.500 1
1 384 . 8 1 1 A 31 31 PRO CA C 120 64.060 64.119 -0.059 1
1 385 . 8 1 1 A 31 31 PRO CB C 120 32.776 31.813 0.963 1
1 388 . 8 1 1 A 32 32 ILE H H 121 11.318 7.594 3.724 1
1 389 . 8 1 1 A 32 32 ILE HA H 121 4.038 3.947 0.091 1
1 399 . 8 1 1 A 32 32 ILE C C 121 178.485 177.684 0.801 1
1 400 . 8 1 1 A 32 32 ILE CA C 121 64.060 64.174 -0.114 1
1 401 . 8 1 1 A 32 32 ILE CB C 121 39.340 38.490 0.850 1
1 405 . 8 1 1 A 32 32 ILE N N 121 124.500 117.002 7.498 1
1 406 . 8 1 1 A 33 33 THR H H 122 9.928 7.798 2.130 1
1 407 . 8 1 1 A 33 33 THR HA H 122 4.048 4.381 -0.333 1
1 412 . 8 1 1 A 33 33 THR C C 122 175.793 174.968 0.825 1
1 413 . 8 1 1 A 33 33 THR CA C 122 62.990 62.102 0.888 1
1 414 . 8 1 1 A 33 33 THR CB C 122 70.300 70.339 -0.039 1
1 416 . 8 1 1 A 33 33 THR N N 122 115.136 109.194 5.942 1
1 417 . 8 1 1 A 34 34 LEU H H 123 8.439 7.937 0.502 1
1 418 . 8 1 1 A 34 34 LEU HA H 123 3.912 3.785 0.127 1
1 428 . 8 1 1 A 34 34 LEU C C 123 175.495 175.110 0.385 1
1 429 . 8 1 1 A 34 34 LEU CA C 123 56.290 56.272 0.018 1
1 430 . 8 1 1 A 34 34 LEU CB C 123 38.500 39.771 -1.271 1
1 434 . 8 1 1 A 34 34 LEU N N 123 117.230 119.242 -2.012 1
1 435 . 8 1 1 A 35 35 GLU H H 124 7.816 7.483 0.333 1
1 436 . 8 1 1 A 35 35 GLU HA H 124 4.634 4.799 -0.165 1
1 441 . 8 1 1 A 35 35 GLU C C 124 174.838 173.903 0.935 1
1 442 . 8 1 1 A 35 35 GLU CA C 124 53.780 54.706 -0.926 1
1 443 . 8 1 1 A 35 35 GLU CB C 124 33.710 32.520 1.190 1
1 445 . 8 1 1 A 35 35 GLU N N 124 116.577 114.393 2.184 1
1 446 . 8 1 1 A 36 36 GLN H H 125 8.532 8.444 0.088 1
1 447 . 8 1 1 A 36 36 GLN HA H 125 4.958 4.413 0.545 1
1 454 . 8 1 1 A 36 36 GLN CA C 125 53.350 53.194 0.156 1
1 455 . 8 1 1 A 36 36 GLN CB C 125 29.950 29.242 0.708 1
1 457 . 8 1 1 A 36 36 GLN N N 125 123.034 123.683 -0.649 1
1 459 . 8 1 1 A 37 37 PRO HA H 126 4.458 4.725 -0.267 1
1 466 . 8 1 1 A 37 37 PRO C C 126 176.314 176.610 -0.296 1
1 467 . 8 1 1 A 37 37 PRO CA C 126 62.816 62.376 0.440 1
1 468 . 8 1 1 A 37 37 PRO CB C 126 33.070 33.010 0.060 1
1 471 . 8 1 1 A 38 38 GLU H H 127 8.626 8.393 0.233 1
1 472 . 8 1 1 A 38 38 GLU HA H 127 4.274 4.197 0.077 1
1 477 . 8 1 1 A 38 38 GLU C C 127 177.877 175.957 1.920 1
1 478 . 8 1 1 A 38 38 GLU CA C 127 58.730 57.362 1.368 1
1 479 . 8 1 1 A 38 38 GLU CB C 127 30.340 30.252 0.088 1
1 481 . 8 1 1 A 38 38 GLU N N 127 120.691 119.176 1.515 1
1 482 . 8 1 1 A 39 39 LYS H H 128 7.861 7.819 0.042 1
1 483 . 8 1 1 A 39 39 LYS HA H 128 4.889 4.946 -0.057 1
1 492 . 8 1 1 A 39 39 LYS C C 128 175.446 175.091 0.355 1
1 493 . 8 1 1 A 39 39 LYS CA C 128 53.670 54.645 -0.975 1
1 494 . 8 1 1 A 39 39 LYS CB C 128 33.630 35.911 -2.281 1
1 498 . 8 1 1 A 39 39 LYS N N 128 117.878 117.288 0.590 1
1 499 . 8 1 1 A 40 40 GLY H H 129 8.426 7.854 0.572 1
1 500 . 8 1 1 A 40 40 GLY HA2 H 129 4.970 3.995 0.975 1
1 501 . 8 1 1 A 40 40 GLY HA3 H 129 2.458 4.126 -1.668 1
1 502 . 8 1 1 A 40 40 GLY C C 129 170.048 172.268 -2.220 1
1 503 . 8 1 1 A 40 40 GLY CA C 129 42.910 45.004 -2.094 1
1 504 . 8 1 1 A 40 40 GLY N N 129 112.604 106.008 6.596 1
1 505 . 8 1 1 A 41 41 ILE H H 130 8.596 9.151 -0.555 1
1 506 . 8 1 1 A 41 41 ILE HA H 130 4.636 5.152 -0.516 1
1 516 . 8 1 1 A 41 41 ILE C C 130 172.691 174.247 -1.556 1
1 517 . 8 1 1 A 41 41 ILE CA C 130 58.500 58.964 -0.464 1
1 518 . 8 1 1 A 41 41 ILE CB C 130 43.320 40.765 2.555 1
1 522 . 8 1 1 A 41 41 ILE N N 130 113.363 117.447 -4.084 1
1 523 . 8 1 1 A 42 42 PHE H H 131 8.994 8.970 0.024 1
1 524 . 8 1 1 A 42 42 PHE HA H 131 5.075 5.589 -0.514 1
1 532 . 8 1 1 A 42 42 PHE C C 131 175.111 174.511 0.600 1
1 533 . 8 1 1 A 42 42 PHE CA C 131 58.680 56.928 1.752 1
1 534 . 8 1 1 A 42 42 PHE CB C 131 42.220 40.327 1.893 1
1 538 . 8 1 1 A 42 42 PHE N N 131 125.156 121.220 3.936 1
1 539 . 8 1 1 A 43 43 VAL H H 132 8.399 9.185 -0.786 1
1 540 . 8 1 1 A 43 43 VAL HA H 132 4.920 4.694 0.226 1
1 548 . 8 1 1 A 43 43 VAL C C 132 178.175 175.270 2.905 1
1 549 . 8 1 1 A 43 43 VAL CA C 132 59.600 61.105 -1.505 1
1 550 . 8 1 1 A 43 43 VAL CB C 132 35.920 34.296 1.624 1
1 553 . 8 1 1 A 43 43 VAL N N 132 119.371 123.327 -3.956 1
1 554 . 8 1 1 A 44 44 LYS H H 133 10.041 8.493 1.548 1
1 555 . 8 1 1 A 44 44 LYS HA H 133 4.920 4.405 0.515 1
1 564 . 8 1 1 A 44 44 LYS C C 133 177.195 175.485 1.710 1
1 565 . 8 1 1 A 44 44 LYS CA C 133 57.310 56.378 0.932 1
1 566 . 8 1 1 A 44 44 LYS CB C 133 34.410 32.438 1.972 1
1 570 . 8 1 1 A 44 44 LYS N N 133 130.928 126.598 4.330 1
1 571 . 8 1 1 A 45 45 ASN H H 134 8.534 8.881 -0.347 1
1 572 . 8 1 1 A 45 45 ASN HA H 134 4.151 4.638 -0.487 1
1 577 . 8 1 1 A 45 45 ASN C C 134 174.217 175.218 -1.001 1
1 578 . 8 1 1 A 45 45 ASN CA C 134 55.290 52.451 2.839 1
1 579 . 8 1 1 A 45 45 ASN CB C 134 37.530 37.813 -0.283 1
1 580 . 8 1 1 A 45 45 ASN N N 134 119.452 124.301 -4.849 1
1 582 . 8 1 1 A 46 46 SER H H 135 7.570 8.018 -0.448 1
1 583 . 8 1 1 A 46 46 SER HA H 135 4.220 4.081 0.139 1
1 586 . 8 1 1 A 46 46 SER C C 135 174.490 176.783 -2.293 1
1 587 . 8 1 1 A 46 46 SER CA C 135 57.090 61.506 -4.416 1
1 588 . 8 1 1 A 46 46 SER CB C 135 64.126 62.985 1.141 1
1 589 . 8 1 1 A 46 46 SER N N 135 105.613 121.587 -15.974 1
1 590 . 8 1 1 A 47 47 ASP H H 136 9.113 8.208 0.905 1
1 591 . 8 1 1 A 47 47 ASP HA H 136 4.220 4.325 -0.105 1
1 594 . 8 1 1 A 47 47 ASP CA C 136 57.610 57.097 0.513 1
1 595 . 8 1 1 A 47 47 ASP CB C 136 40.810 40.937 -0.127 1
1 596 . 8 1 1 A 47 47 ASP N N 136 120.995 120.861 0.134 1
1 597 . 8 1 1 A 48 48 GLY H H 137 8.172 8.014 0.158 1
1 598 . 8 1 1 A 48 48 GLY HA2 H 137 4.096 3.762 0.334 1
1 599 . 8 1 1 A 48 48 GLY HA3 H 137 3.664 3.770 -0.106 1
1 600 . 8 1 1 A 48 48 GLY C C 137 173.990 175.116 -1.126 1
1 601 . 8 1 1 A 48 48 GLY CA C 137 45.130 47.346 -2.216 1
1 602 . 8 1 1 A 48 48 GLY N N 137 105.838 107.005 -1.167 1
1 603 . 8 1 1 A 49 49 SER H H 138 7.252 7.554 -0.302 1
1 604 . 8 1 1 A 49 49 SER HA H 138 4.503 4.658 -0.155 1
1 607 . 8 1 1 A 49 49 SER C C 138 173.857 173.898 -0.041 1
1 608 . 8 1 1 A 49 49 SER CA C 138 57.340 57.202 0.138 1
1 609 . 8 1 1 A 49 49 SER CB C 138 65.370 64.212 1.158 1
1 610 . 8 1 1 A 49 49 SER N N 138 114.942 112.242 2.700 1
1 611 . 8 1 1 A 50 50 ASP H H 139 8.276 7.937 0.339 1
1 612 . 8 1 1 A 50 50 ASP HA H 139 4.618 4.252 0.366 1
1 615 . 8 1 1 A 50 50 ASP C C 139 174.577 174.694 -0.117 1
1 616 . 8 1 1 A 50 50 ASP CA C 139 53.116 55.520 -2.404 1
1 617 . 8 1 1 A 50 50 ASP CB C 139 40.520 40.290 0.230 1
1 618 . 8 1 1 A 50 50 ASP N N 139 122.088 120.136 1.952 1
1 619 . 8 1 1 A 51 51 VAL H H 140 8.192 7.486 0.706 1
1 620 . 8 1 1 A 51 51 VAL HA H 140 4.299 4.226 0.073 1
1 628 . 8 1 1 A 51 51 VAL C C 140 175.867 175.033 0.834 1
1 629 . 8 1 1 A 51 51 VAL CA C 140 62.950 61.867 1.083 1
1 630 . 8 1 1 A 51 51 VAL CB C 140 33.230 32.778 0.452 1
1 632 . 8 1 1 A 51 51 VAL N N 140 121.167 118.882 2.285 1
1 633 . 8 1 1 A 52 52 CYS H H 141 8.391 9.004 -0.613 1
1 634 . 8 1 1 A 52 52 CYS HA H 141 5.247 5.248 -0.001 1
1 637 . 8 1 1 A 52 52 CYS C C 141 172.778 174.849 -2.071 1
1 638 . 8 1 1 A 52 52 CYS CA C 141 56.480 58.378 -1.898 1
1 639 . 8 1 1 A 52 52 CYS CB C 141 31.960 29.083 2.877 1
1 640 . 8 1 1 A 52 52 CYS N N 141 121.884 125.627 -3.743 1
1 641 . 8 1 1 A 53 53 THR H H 142 8.777 8.823 -0.046 1
1 642 . 8 1 1 A 53 53 THR HA H 142 4.489 4.971 -0.482 1
1 648 . 8 1 1 A 53 53 THR C C 142 171.885 172.126 -0.241 1
1 649 . 8 1 1 A 53 53 THR CA C 142 62.070 61.024 1.046 1
1 650 . 8 1 1 A 53 53 THR CB C 142 71.390 71.857 -0.467 1
1 652 . 8 1 1 A 53 53 THR N N 142 118.132 117.710 0.422 1
1 653 . 8 1 1 A 54 54 LEU H H 143 8.409 8.195 0.214 1
1 654 . 8 1 1 A 54 54 LEU HA H 143 4.276 4.211 0.065 1
1 664 . 8 1 1 A 54 54 LEU C C 143 174.366 173.984 0.382 1
1 665 . 8 1 1 A 54 54 LEU CA C 143 54.330 53.194 1.136 1
1 666 . 8 1 1 A 54 54 LEU CB C 143 42.396 42.480 -0.084 1
1 670 . 8 1 1 A 54 54 LEU N N 143 127.980 127.602 0.378 1
1 671 . 8 1 1 A 55 55 PHE H H 144 8.646 8.562 0.084 1
1 672 . 8 1 1 A 55 55 PHE HA H 144 5.455 4.815 0.640 1
1 680 . 8 1 1 A 55 55 PHE C C 144 176.054 174.921 1.133 1
1 681 . 8 1 1 A 55 55 PHE CA C 144 55.250 56.403 -1.153 1
1 682 . 8 1 1 A 55 55 PHE CB C 144 44.100 41.445 2.655 1
1 686 . 8 1 1 A 55 55 PHE N N 144 122.010 126.852 -4.842 1
1 687 . 8 1 1 A 56 56 ASP H H 145 11.575 8.306 3.269 1
1 688 . 8 1 1 A 56 56 ASP HA H 145 4.416 4.423 -0.007 1
1 691 . 8 1 1 A 56 56 ASP C C 145 176.748 177.528 -0.780 1
1 692 . 8 1 1 A 56 56 ASP CA C 145 55.840 54.789 1.051 1
1 693 . 8 1 1 A 56 56 ASP CB C 145 44.390 42.301 2.089 1
1 694 . 8 1 1 A 56 56 ASP N N 145 121.936 124.259 -2.323 1
1 695 . 8 1 1 A 57 57 ALA H H 146 8.508 8.617 -0.109 1
1 696 . 8 1 1 A 57 57 ALA HA H 146 3.797 4.019 -0.222 1
1 700 . 8 1 1 A 57 57 ALA C C 146 178.696 180.037 -1.341 1
1 701 . 8 1 1 A 57 57 ALA CA C 146 55.990 55.577 0.413 1
1 702 . 8 1 1 A 57 57 ALA CB C 146 18.840 18.069 0.771 1
1 703 . 8 1 1 A 57 57 ALA N N 146 130.243 129.217 1.026 1
1 704 . 8 1 1 A 58 58 ALA H H 147 8.378 7.481 0.897 1
1 705 . 8 1 1 A 58 58 ALA HA H 147 4.078 4.231 -0.153 1
1 709 . 8 1 1 A 58 58 ALA C C 147 181.091 179.340 1.751 1
1 710 . 8 1 1 A 58 58 ALA CA C 147 54.770 55.001 -0.231 1
1 711 . 8 1 1 A 58 58 ALA CB C 147 17.700 18.455 -0.755 1
1 712 . 8 1 1 A 58 58 ALA N N 147 121.997 119.380 2.617 1
1 713 . 8 1 1 A 59 59 ALA H H 148 9.138 8.117 1.021 1
1 714 . 8 1 1 A 59 59 ALA HA H 148 3.975 4.042 -0.067 1
1 718 . 8 1 1 A 59 59 ALA C C 148 180.508 179.756 0.752 1
1 719 . 8 1 1 A 59 59 ALA CA C 148 54.840 55.176 -0.336 1
1 720 . 8 1 1 A 59 59 ALA CB C 148 18.600 18.635 -0.035 1
1 721 . 8 1 1 A 59 59 ALA N N 148 123.595 120.582 3.013 1
1 722 . 8 1 1 A 60 60 PHE H H 149 8.814 8.167 0.647 1
1 723 . 8 1 1 A 60 60 PHE HA H 149 3.722 4.029 -0.307 1
1 731 . 8 1 1 A 60 60 PHE C C 149 176.773 177.482 -0.709 1
1 732 . 8 1 1 A 60 60 PHE CA C 149 62.030 61.544 0.486 1
1 733 . 8 1 1 A 60 60 PHE CB C 149 39.960 39.070 0.890 1
1 737 . 8 1 1 A 60 60 PHE N N 149 120.354 119.673 0.681 1
1 738 . 8 1 1 A 61 61 SER H H 150 8.276 8.054 0.222 1
1 739 . 8 1 1 A 61 61 SER HA H 150 3.880 4.100 -0.220 1
1 742 . 8 1 1 A 61 61 SER C C 150 177.691 177.275 0.416 1
1 743 . 8 1 1 A 61 61 SER CA C 150 62.190 61.410 0.780 1
1 744 . 8 1 1 A 61 61 SER CB C 150 63.016 62.971 0.045 1
1 745 . 8 1 1 A 61 61 SER N N 150 112.086 114.033 -1.947 1
1 746 . 8 1 1 A 62 62 ARG H H 151 7.829 7.857 -0.028 1
1 747 . 8 1 1 A 62 62 ARG HA H 151 3.971 4.017 -0.046 1
1 754 . 8 1 1 A 62 62 ARG C C 151 178.287 178.817 -0.530 1
1 755 . 8 1 1 A 62 62 ARG CA C 151 59.340 59.247 0.093 1
1 756 . 8 1 1 A 62 62 ARG CB C 151 29.760 29.791 -0.031 1
1 759 . 8 1 1 A 62 62 ARG N N 151 121.090 120.867 0.223 1
1 760 . 8 1 1 A 63 63 LEU H H 152 7.390 7.599 -0.209 1
1 761 . 8 1 1 A 63 63 LEU HA H 152 3.791 3.934 -0.143 1
1 771 . 8 1 1 A 63 63 LEU C C 152 179.106 178.858 0.248 1
1 772 . 8 1 1 A 63 63 LEU CA C 152 58.900 57.952 0.948 1
1 773 . 8 1 1 A 63 63 LEU CB C 152 41.140 41.570 -0.430 1
1 777 . 8 1 1 A 63 63 LEU N N 152 121.129 119.378 1.751 1
1 778 . 8 1 1 A 64 64 VAL H H 153 7.552 7.898 -0.346 1
1 779 . 8 1 1 A 64 64 VAL HA H 153 3.411 3.494 -0.083 1
1 787 . 8 1 1 A 64 64 VAL C C 153 180.595 177.936 2.659 1
1 788 . 8 1 1 A 64 64 VAL CA C 153 65.644 66.437 -0.793 1
1 789 . 8 1 1 A 64 64 VAL CB C 153 31.410 31.466 -0.056 1
1 792 . 8 1 1 A 64 64 VAL N N 153 118.280 119.251 -0.971 1
1 793 . 8 1 1 A 65 65 GLY H H 154 8.061 8.121 -0.060 1
1 794 . 8 1 1 A 65 65 GLY HA2 H 154 3.846 3.736 0.110 1
1 795 . 8 1 1 A 65 65 GLY HA3 H 154 3.809 3.738 0.071 1
1 796 . 8 1 1 A 65 65 GLY C C 154 175.235 176.350 -1.115 1
1 797 . 8 1 1 A 65 65 GLY CA C 154 46.630 47.210 -0.580 1
1 798 . 8 1 1 A 65 65 GLY N N 154 108.622 107.798 0.824 1
1 799 . 8 1 1 A 66 66 GLU H H 155 7.528 7.595 -0.067 1
1 800 . 8 1 1 A 66 66 GLU HA H 155 4.228 4.286 -0.058 1
1 805 . 8 1 1 A 66 66 GLU C C 155 176.761 176.898 -0.137 1
1 806 . 8 1 1 A 66 66 GLU CA C 155 56.590 56.415 0.175 1
1 807 . 8 1 1 A 66 66 GLU CB C 155 30.490 30.178 0.312 1
1 809 . 8 1 1 A 66 66 GLU N N 155 118.361 119.936 -1.575 1
1 810 . 8 1 1 A 67 67 GLY H H 156 7.884 7.767 0.117 1
1 811 . 8 1 1 A 67 67 GLY HA2 H 156 3.918 3.884 0.034 1
1 812 . 8 1 1 A 67 67 GLY HA3 H 156 3.747 3.897 -0.150 1
1 813 . 8 1 1 A 67 67 GLY C C 156 174.788 174.501 0.287 1
1 814 . 8 1 1 A 67 67 GLY CA C 156 45.890 45.606 0.284 1
1 815 . 8 1 1 A 67 67 GLY N N 156 108.465 108.535 -0.070 1
1 816 . 8 1 1 A 68 68 LEU H H 157 7.332 7.998 -0.666 1
1 817 . 8 1 1 A 68 68 LEU HA H 157 4.361 4.510 -0.149 1
1 827 . 8 1 1 A 68 68 LEU CA C 157 53.060 52.317 0.743 1
1 828 . 8 1 1 A 68 68 LEU CB C 157 41.100 41.446 -0.346 1
1 832 . 8 1 1 A 68 68 LEU N N 157 121.920 121.777 0.143 1
1 833 . 8 1 1 A 69 69 PRO HA H 158 4.485 4.584 -0.099 1
1 840 . 8 1 1 A 69 69 PRO C C 158 174.602 176.204 -1.602 1
1 841 . 8 1 1 A 69 69 PRO CA C 158 61.556 62.214 -0.658 1
1 842 . 8 1 1 A 69 69 PRO CB C 158 32.370 32.932 -0.562 1
1 845 . 8 1 1 A 70 70 HIS H H 159 8.759 8.626 0.133 1
1 846 . 8 1 1 A 70 70 HIS HA H 159 3.947 4.476 -0.529 1
1 852 . 8 1 1 A 70 70 HIS CA C 159 56.250 55.110 1.140 1
1 853 . 8 1 1 A 70 70 HIS CB C 159 32.280 31.059 1.221 1
1 856 . 8 1 1 A 70 70 HIS N N 159 119.423 120.449 -1.026 1
1 857 . 8 1 1 A 71 71 PRO HA H 160 4.424 4.393 0.031 1
1 864 . 8 1 1 A 71 71 PRO C C 160 177.567 178.118 -0.551 1
1 865 . 8 1 1 A 71 71 PRO CA C 160 64.574 64.491 0.083 1
1 866 . 8 1 1 A 71 71 PRO CB C 160 32.340 31.824 0.516 1
1 869 . 8 1 1 A 72 72 LEU H H 161 10.123 7.470 2.653 1
1 870 . 8 1 1 A 72 72 LEU HA H 161 4.778 4.332 0.446 1
1 880 . 8 1 1 A 72 72 LEU C C 161 178.721 178.545 0.176 1
1 881 . 8 1 1 A 72 72 LEU CA C 161 55.800 56.721 -0.921 1
1 882 . 8 1 1 A 72 72 LEU CB C 161 42.440 42.728 -0.288 1
1 886 . 8 1 1 A 72 72 LEU N N 161 117.374 117.337 0.037 1
1 887 . 8 1 1 A 73 73 THR H H 162 7.523 8.116 -0.593 1
1 888 . 8 1 1 A 73 73 THR HA H 162 4.291 4.491 -0.200 1
1 893 . 8 1 1 A 73 73 THR C C 162 175.557 174.252 1.305 1
1 894 . 8 1 1 A 73 73 THR CA C 162 61.440 63.196 -1.756 1
1 895 . 8 1 1 A 73 73 THR CB C 162 70.500 69.465 1.035 1
1 897 . 8 1 1 A 73 73 THR N N 162 107.787 112.328 -4.541 1
1 898 . 8 1 1 A 74 74 ARG H H 163 8.361 7.895 0.466 1
1 899 . 8 1 1 A 74 74 ARG HA H 163 3.836 4.253 -0.417 1
1 906 . 8 1 1 A 74 74 ARG C C 163 174.701 175.151 -0.450 1
1 907 . 8 1 1 A 74 74 ARG CA C 163 57.980 57.662 0.318 1
1 908 . 8 1 1 A 74 74 ARG CB C 163 26.770 27.134 -0.364 1
1 911 . 8 1 1 A 74 74 ARG N N 163 115.130 118.329 -3.199 1
1 912 . 8 1 1 A 75 75 GLU H H 164 7.430 8.057 -0.627 1
1 913 . 8 1 1 A 75 75 GLU HA H 164 4.636 4.507 0.129 1
1 918 . 8 1 1 A 75 75 GLU CA C 164 53.699 54.605 -0.906 1
1 919 . 8 1 1 A 75 75 GLU CB C 164 29.550 29.153 0.397 1
1 921 . 8 1 1 A 75 75 GLU N N 164 120.076 118.979 1.097 1
1 922 . 8 1 1 A 76 76 PRO HA H 165 4.272 4.391 -0.119 1
1 929 . 8 1 1 A 76 76 PRO C C 165 176.649 176.892 -0.243 1
1 930 . 8 1 1 A 76 76 PRO CA C 165 63.204 63.167 0.037 1
1 931 . 8 1 1 A 76 76 PRO CB C 165 31.680 31.774 -0.094 1
1 934 . 8 1 1 A 77 77 ILE H H 166 8.812 8.202 0.610 1
1 935 . 8 1 1 A 77 77 ILE HA H 166 3.838 4.249 -0.411 1
1 945 . 8 1 1 A 77 77 ILE C C 166 175.235 175.957 -0.722 1
1 946 . 8 1 1 A 77 77 ILE CA C 166 62.816 61.214 1.602 1
1 947 . 8 1 1 A 77 77 ILE CB C 166 37.750 37.821 -0.071 1
1 951 . 8 1 1 A 77 77 ILE N N 166 123.831 123.866 -0.035 1
1 952 . 8 1 1 A 78 78 THR H H 167 6.625 8.575 -1.950 1
1 953 . 8 1 1 A 78 78 THR HA H 167 4.632 5.075 -0.443 1
1 958 . 8 1 1 A 78 78 THR C C 167 174.143 174.422 -0.279 1
1 959 . 8 1 1 A 78 78 THR CA C 167 58.750 60.212 -1.462 1
1 960 . 8 1 1 A 78 78 THR CB C 167 71.320 71.233 0.087 1
1 962 . 8 1 1 A 78 78 THR N N 167 115.293 117.828 -2.535 1
1 963 . 8 1 1 A 79 79 ALA H H 168 9.088 8.982 0.106 1
1 964 . 8 1 1 A 79 79 ALA HA H 168 3.916 4.100 -0.184 1
1 968 . 8 1 1 A 79 79 ALA C C 168 179.788 179.610 0.178 1
1 969 . 8 1 1 A 79 79 ALA CA C 168 55.480 55.043 0.437 1
1 970 . 8 1 1 A 79 79 ALA CB C 168 17.630 18.488 -0.858 1
1 971 . 8 1 1 A 79 79 ALA N N 168 122.102 127.700 -5.598 1
1 972 . 8 1 1 A 80 80 SER H H 169 7.988 7.724 0.264 1
1 973 . 8 1 1 A 80 80 SER HA H 169 4.058 4.235 -0.177 1
1 976 . 8 1 1 A 80 80 SER C C 169 176.029 175.710 0.319 1
1 977 . 8 1 1 A 80 80 SER CA C 169 60.750 61.658 -0.908 1
1 978 . 8 1 1 A 80 80 SER CB C 169 62.510 63.243 -0.733 1
1 979 . 8 1 1 A 80 80 SER N N 169 109.541 114.952 -5.411 1
1 980 . 8 1 1 A 81 81 ILE H H 170 6.968 7.069 -0.101 1
1 981 . 8 1 1 A 81 81 ILE HA H 170 4.315 4.560 -0.245 1
1 991 . 8 1 1 A 81 81 ILE C C 170 174.242 174.936 -0.694 1
1 992 . 8 1 1 A 81 81 ILE CA C 170 62.296 60.593 1.703 1
1 993 . 8 1 1 A 81 81 ILE CB C 170 37.686 38.382 -0.696 1
1 997 . 8 1 1 A 81 81 ILE N N 170 112.476 112.297 0.179 1
1 998 . 8 1 1 A 82 82 ILE H H 171 7.345 7.472 -0.127 1
1 999 . 8 1 1 A 82 82 ILE HA H 171 4.339 4.714 -0.375 1
1 1009 . 8 1 1 A 82 82 ILE C C 171 174.999 174.526 0.473 1
1 1010 . 8 1 1 A 82 82 ILE CA C 171 61.150 60.204 0.946 1
1 1011 . 8 1 1 A 82 82 ILE CB C 171 37.230 40.754 -3.524 1
1 1015 . 8 1 1 A 82 82 ILE N N 171 124.260 124.748 -0.488 1
1 1016 . 8 1 1 A 83 83 VAL H H 172 7.923 9.037 -1.114 1
1 1017 . 8 1 1 A 83 83 VAL HA H 172 4.673 5.012 -0.339 1
1 1025 . 8 1 1 A 83 83 VAL C C 172 174.887 175.006 -0.119 1
1 1026 . 8 1 1 A 83 83 VAL CA C 172 59.340 59.081 0.259 1
1 1027 . 8 1 1 A 83 83 VAL CB C 172 34.840 36.316 -1.476 1
1 1030 . 8 1 1 A 83 83 VAL N N 172 120.931 121.662 -0.731 1
1 1031 . 8 1 1 A 84 84 LYS H H 173 8.406 8.662 -0.256 1
1 1032 . 8 1 1 A 84 84 LYS HA H 173 4.410 4.742 -0.332 1
1 1041 . 8 1 1 A 84 84 LYS C C 173 178.734 178.347 0.387 1
1 1042 . 8 1 1 A 84 84 LYS CA C 173 56.360 54.862 1.498 1
1 1043 . 8 1 1 A 84 84 LYS CB C 173 33.100 33.967 -0.867 1
1 1047 . 8 1 1 A 84 84 LYS N N 173 121.251 120.132 1.119 1
1 1048 . 8 1 1 A 85 85 HIS H H 174 9.221 9.028 0.193 1
1 1049 . 8 1 1 A 85 85 HIS HA H 174 4.024 3.842 0.182 1
1 1053 . 8 1 1 A 85 85 HIS C C 174 177.183 177.229 -0.046 1
1 1054 . 8 1 1 A 85 85 HIS CA C 174 59.460 59.629 -0.169 1
1 1055 . 8 1 1 A 85 85 HIS CB C 174 27.920 29.563 -1.643 1
1 1057 . 8 1 1 A 85 85 HIS N N 174 121.545 122.519 -0.974 1
1 1058 . 8 1 1 A 86 86 GLU H H 175 8.699 8.170 0.529 1
1 1059 . 8 1 1 A 86 86 GLU HA H 175 3.900 3.870 0.030 1
1 1064 . 8 1 1 A 86 86 GLU C C 175 177.220 178.298 -1.078 1
1 1065 . 8 1 1 A 86 86 GLU CA C 175 58.420 58.922 -0.502 1
1 1066 . 8 1 1 A 86 86 GLU CB C 175 28.690 29.373 -0.683 1
1 1068 . 8 1 1 A 86 86 GLU N N 175 118.011 118.624 -0.613 1
1 1069 . 8 1 1 A 87 87 GLU H H 176 7.621 7.877 -0.256 1
1 1070 . 8 1 1 A 87 87 GLU HA H 176 4.177 4.111 0.066 1
1 1075 . 8 1 1 A 87 87 GLU C C 176 175.222 176.061 -0.839 1
1 1076 . 8 1 1 A 87 87 GLU CA C 176 56.390 58.306 -1.916 1
1 1077 . 8 1 1 A 87 87 GLU CB C 176 30.430 29.996 0.434 1
1 1079 . 8 1 1 A 87 87 GLU N N 176 116.753 118.029 -1.276 1
1 1080 . 8 1 1 A 88 88 CYS H H 177 7.239 7.236 0.003 1
1 1081 . 8 1 1 A 88 88 CYS HA H 177 5.148 5.131 0.017 1
1 1084 . 8 1 1 A 88 88 CYS C C 177 173.249 174.109 -0.860 1
1 1085 . 8 1 1 A 88 88 CYS CA C 177 57.240 57.244 -0.004 1
1 1086 . 8 1 1 A 88 88 CYS CB C 177 31.020 30.409 0.611 1
1 1087 . 8 1 1 A 88 88 CYS N N 177 116.096 115.815 0.281 1
1 1088 . 8 1 1 A 89 89 ILE H H 178 8.912 8.753 0.159 1
1 1089 . 8 1 1 A 89 89 ILE HA H 178 4.580 4.890 -0.310 1
1 1099 . 8 1 1 A 89 89 ILE C C 178 173.386 174.002 -0.616 1
1 1100 . 8 1 1 A 89 89 ILE CA C 178 59.270 59.095 0.175 1
1 1101 . 8 1 1 A 89 89 ILE CB C 178 42.990 41.348 1.642 1
1 1105 . 8 1 1 A 89 89 ILE N N 178 119.490 119.598 -0.108 1
1 1106 . 8 1 1 A 90 90 TYR H H 179 9.047 8.637 0.410 1
1 1107 . 8 1 1 A 90 90 TYR HA H 179 3.753 3.973 -0.220 1
1 1112 . 8 1 1 A 90 90 TYR C C 179 173.932 174.348 -0.416 1
1 1113 . 8 1 1 A 90 90 TYR CA C 179 59.860 57.126 2.734 1
1 1114 . 8 1 1 A 90 90 TYR CB C 179 37.530 37.687 -0.157 1
1 1116 . 8 1 1 A 90 90 TYR N N 179 126.270 122.970 3.300 1
1 1117 . 8 1 1 A 91 91 ASP H H 180 7.462 8.473 -1.011 1
1 1118 . 8 1 1 A 91 91 ASP HA H 180 4.639 4.465 0.174 1
1 1121 . 8 1 1 A 91 91 ASP C C 180 175.297 177.065 -1.768 1
1 1122 . 8 1 1 A 91 91 ASP CA C 180 52.496 54.248 -1.752 1
1 1123 . 8 1 1 A 91 91 ASP CB C 180 43.380 41.769 1.611 1
1 1124 . 8 1 1 A 91 91 ASP N N 180 129.593 125.871 3.722 1
1 1125 . 8 1 1 A 92 92 ASP H H 181 8.719 8.885 -0.166 1
1 1126 . 8 1 1 A 92 92 ASP HA H 181 4.109 4.286 -0.177 1
1 1129 . 8 1 1 A 92 92 ASP C C 181 177.555 178.156 -0.601 1
1 1130 . 8 1 1 A 92 92 ASP CA C 181 56.390 56.693 -0.303 1
1 1131 . 8 1 1 A 92 92 ASP CB C 181 41.330 39.791 1.539 1
1 1132 . 8 1 1 A 92 92 ASP N N 181 125.691 126.647 -0.956 1
1 1133 . 8 1 1 A 93 93 THR H H 182 8.271 7.642 0.629 1
1 1134 . 8 1 1 A 93 93 THR HA H 182 4.036 4.001 0.035 1
1 1139 . 8 1 1 A 93 93 THR C C 182 176.289 175.739 0.550 1
1 1140 . 8 1 1 A 93 93 THR CA C 182 65.054 64.648 0.406 1
1 1141 . 8 1 1 A 93 93 THR CB C 182 68.560 69.004 -0.444 1
1 1143 . 8 1 1 A 93 93 THR N N 182 114.813 114.470 0.343 1
1 1144 . 8 1 1 A 94 94 ARG H H 183 7.753 7.672 0.081 1
1 1145 . 8 1 1 A 94 94 ARG HA H 183 4.139 4.385 -0.246 1
1 1152 . 8 1 1 A 94 94 ARG C C 183 176.897 176.828 0.069 1
1 1153 . 8 1 1 A 94 94 ARG CA C 183 55.350 55.759 -0.409 1
1 1154 . 8 1 1 A 94 94 ARG CB C 183 30.930 31.246 -0.316 1
1 1157 . 8 1 1 A 94 94 ARG N N 183 120.101 118.186 1.915 1
1 1158 . 8 1 1 A 95 95 GLY H H 184 8.112 9.278 -1.166 1
1 1159 . 8 1 1 A 95 95 GLY HA2 H 184 3.838 3.863 -0.025 1
1 1160 . 8 1 1 A 95 95 GLY HA3 H 184 3.670 3.869 -0.199 1
1 1161 . 8 1 1 A 95 95 GLY C C 184 173.659 173.343 0.316 1
1 1162 . 8 1 1 A 95 95 GLY CA C 184 46.040 45.798 0.242 1
1 1163 . 8 1 1 A 95 95 GLY N N 184 108.106 110.069 -1.963 1
1 1164 . 8 1 1 A 96 96 ASN H H 185 6.833 7.364 -0.531 1
1 1165 . 8 1 1 A 96 96 ASN HA H 185 4.944 5.067 -0.123 1
1 1170 . 8 1 1 A 96 96 ASN C C 185 174.267 173.362 0.905 1
1 1171 . 8 1 1 A 96 96 ASN CA C 185 52.560 52.420 0.140 1
1 1172 . 8 1 1 A 96 96 ASN CB C 185 45.890 41.629 4.261 1
1 1173 . 8 1 1 A 96 96 ASN N N 185 113.392 116.850 -3.458 1
1 1175 . 8 1 1 A 97 97 PHE H H 186 9.108 8.672 0.436 1
1 1176 . 8 1 1 A 97 97 PHE HA H 186 4.782 4.801 -0.019 1
1 1183 . 8 1 1 A 97 97 PHE C C 186 174.862 175.684 -0.822 1
1 1184 . 8 1 1 A 97 97 PHE CA C 186 60.056 59.647 0.409 1
1 1185 . 8 1 1 A 97 97 PHE CB C 186 40.180 39.260 0.920 1
1 1188 . 8 1 1 A 97 97 PHE N N 186 118.741 119.448 -0.707 1
1 1189 . 8 1 1 A 98 98 ILE H H 187 8.933 8.639 0.294 1
1 1190 . 8 1 1 A 98 98 ILE HA H 187 5.458 4.905 0.553 1
1 1200 . 8 1 1 A 98 98 ILE C C 187 176.041 175.038 1.003 1
1 1201 . 8 1 1 A 98 98 ILE CA C 187 57.610 58.959 -1.349 1
1 1202 . 8 1 1 A 98 98 ILE CB C 187 42.070 41.974 0.096 1
1 1206 . 8 1 1 A 98 98 ILE N N 187 117.857 118.516 -0.659 1
1 1207 . 8 1 1 A 99 99 ILE H H 188 8.284 8.671 -0.387 1
1 1208 . 8 1 1 A 99 99 ILE HA H 188 4.341 4.022 0.319 1
1 1218 . 8 1 1 A 99 99 ILE C C 188 176.413 176.457 -0.044 1
1 1219 . 8 1 1 A 99 99 ILE CA C 188 59.190 62.119 -2.929 1
1 1220 . 8 1 1 A 99 99 ILE CB C 188 37.940 38.195 -0.255 1
1 1224 . 8 1 1 A 99 99 ILE N N 188 121.796 123.419 -1.623 1
1 1225 . 8 1 1 A 100 100 LYS H H 189 8.463 8.245 0.218 1
1 1226 . 8 1 1 A 100 100 LYS HA H 189 4.040 4.302 -0.262 1
1 1235 . 8 1 1 A 100 100 LYS C C 189 176.848 177.978 -1.130 1
1 1236 . 8 1 1 A 100 100 LYS CA C 189 57.241 56.067 1.174 1
1 1237 . 8 1 1 A 100 100 LYS CB C 189 33.400 33.323 0.077 1
1 1241 . 8 1 1 A 100 100 LYS N N 189 127.995 124.930 3.065 1
1 1242 . 8 1 1 A 101 101 GLY H H 190 8.346 8.490 -0.144 1
1 1243 . 8 1 1 A 101 101 GLY HA2 H 190 3.947 3.880 0.067 1
1 1244 . 8 1 1 A 101 101 GLY HA3 H 190 3.813 3.885 -0.072 1
1 1245 . 8 1 1 A 101 101 GLY C C 190 172.902 174.029 -1.127 1
1 1246 . 8 1 1 A 101 101 GLY CA C 190 44.920 45.865 -0.945 1
1 1247 . 8 1 1 A 101 101 GLY N N 190 110.882 111.592 -0.710 1
1 7 . 9 1 1 A 2 2 GLN H H 91 8.786 8.204 0.582 1
1 8 . 9 1 1 A 2 2 GLN HA H 91 4.005 4.204 -0.199 1
1 15 . 9 1 1 A 2 2 GLN C C 91 177.270 178.448 -1.178 1
1 16 . 9 1 1 A 2 2 GLN CA C 91 58.220 58.295 -0.075 1
1 17 . 9 1 1 A 2 2 GLN CB C 91 28.650 28.429 0.221 1
1 19 . 9 1 1 A 2 2 GLN N N 91 121.993 121.550 0.443 1
1 21 . 9 1 1 A 3 3 GLU H H 92 8.430 8.269 0.161 1
1 22 . 9 1 1 A 3 3 GLU HA H 92 4.007 4.119 -0.112 1
1 27 . 9 1 1 A 3 3 GLU C C 92 178.287 178.499 -0.212 1
1 28 . 9 1 1 A 3 3 GLU CA C 92 59.490 59.207 0.283 1
1 29 . 9 1 1 A 3 3 GLU CB C 92 29.506 29.406 0.100 1
1 31 . 9 1 1 A 3 3 GLU N N 92 120.195 119.272 0.923 1
1 32 . 9 1 1 A 4 4 SER H H 93 8.209 7.877 0.332 1
1 33 . 9 1 1 A 4 4 SER HA H 93 4.272 4.255 0.017 1
1 36 . 9 1 1 A 4 4 SER C C 93 177.369 177.364 0.005 1
1 37 . 9 1 1 A 4 4 SER CA C 93 61.044 61.189 -0.145 1
1 38 . 9 1 1 A 4 4 SER CB C 93 62.950 62.908 0.042 1
1 39 . 9 1 1 A 4 4 SER N N 93 115.524 114.675 0.849 1
1 40 . 9 1 1 A 5 5 ILE H H 94 8.080 7.737 0.343 1
1 41 . 9 1 1 A 5 5 ILE HA H 94 3.530 3.627 -0.097 1
1 51 . 9 1 1 A 5 5 ILE C C 94 177.778 177.646 0.132 1
1 52 . 9 1 1 A 5 5 ILE CA C 94 65.710 65.440 0.270 1
1 53 . 9 1 1 A 5 5 ILE CB C 94 37.800 37.673 0.127 1
1 57 . 9 1 1 A 5 5 ILE N N 94 124.148 122.006 2.142 1
1 58 . 9 1 1 A 6 6 GLN H H 95 8.374 8.407 -0.033 1
1 59 . 9 1 1 A 6 6 GLN HA H 95 4.125 3.953 0.172 1
1 66 . 9 1 1 A 6 6 GLN C C 95 179.726 179.351 0.375 1
1 67 . 9 1 1 A 6 6 GLN CA C 95 59.190 59.077 0.113 1
1 68 . 9 1 1 A 6 6 GLN CB C 95 27.060 28.721 -1.661 1
1 70 . 9 1 1 A 6 6 GLN N N 95 118.257 118.765 -0.508 1
1 72 . 9 1 1 A 7 7 ASN H H 96 8.456 7.878 0.578 1
1 73 . 9 1 1 A 7 7 ASN HA H 96 4.446 4.512 -0.066 1
1 78 . 9 1 1 A 7 7 ASN C C 96 177.257 178.446 -1.189 1
1 79 . 9 1 1 A 7 7 ASN CA C 96 56.020 56.239 -0.219 1
1 80 . 9 1 1 A 7 7 ASN CB C 96 38.126 37.852 0.274 1
1 81 . 9 1 1 A 7 7 ASN N N 96 118.597 118.275 0.322 1
1 83 . 9 1 1 A 8 8 LYS H H 97 7.732 7.581 0.151 1
1 84 . 9 1 1 A 8 8 LYS HA H 97 4.129 4.061 0.068 1
1 93 . 9 1 1 A 8 8 LYS C C 97 179.143 179.452 -0.309 1
1 94 . 9 1 1 A 8 8 LYS CA C 97 59.126 59.352 -0.226 1
1 95 . 9 1 1 A 8 8 LYS CB C 97 32.070 32.312 -0.242 1
1 99 . 9 1 1 A 8 8 LYS N N 97 122.381 118.633 3.748 1
1 100 . 9 1 1 A 9 9 ILE H H 98 8.452 8.117 0.335 1
1 101 . 9 1 1 A 9 9 ILE HA H 98 3.480 3.755 -0.275 1
1 111 . 9 1 1 A 9 9 ILE C C 98 177.406 178.204 -0.798 1
1 112 . 9 1 1 A 9 9 ILE CA C 98 66.430 65.143 1.287 1
1 113 . 9 1 1 A 9 9 ILE CB C 98 37.980 37.734 0.246 1
1 117 . 9 1 1 A 9 9 ILE N N 98 119.950 121.072 -1.122 1
1 118 . 9 1 1 A 10 10 SER H H 99 7.924 7.934 -0.010 1
1 119 . 9 1 1 A 10 10 SER HA H 99 3.983 4.177 -0.194 1
1 122 . 9 1 1 A 10 10 SER C C 99 176.327 176.912 -0.585 1
1 123 . 9 1 1 A 10 10 SER CA C 99 61.990 61.191 0.799 1
1 124 . 9 1 1 A 10 10 SER CB C 99 62.790 63.198 -0.408 1
1 125 . 9 1 1 A 10 10 SER N N 99 113.568 115.972 -2.404 1
1 126 . 9 1 1 A 11 11 GLN H H 100 7.832 7.044 0.788 1
1 127 . 9 1 1 A 11 11 GLN HA H 100 4.238 4.171 0.067 1
1 134 . 9 1 1 A 11 11 GLN C C 100 178.088 178.239 -0.151 1
1 135 . 9 1 1 A 11 11 GLN CA C 100 57.900 58.169 -0.269 1
1 136 . 9 1 1 A 11 11 GLN CB C 100 29.790 28.322 1.468 1
1 138 . 9 1 1 A 11 11 GLN N N 100 117.487 120.933 -3.446 1
1 140 . 9 1 1 A 12 12 CYS H H 101 7.920 8.255 -0.335 1
1 141 . 9 1 1 A 12 12 CYS HA H 101 4.657 4.534 0.123 1
1 144 . 9 1 1 A 12 12 CYS C C 101 175.446 174.928 0.518 1
1 145 . 9 1 1 A 12 12 CYS CA C 101 60.654 61.329 -0.675 1
1 146 . 9 1 1 A 12 12 CYS CB C 101 29.310 27.442 1.868 1
1 147 . 9 1 1 A 12 12 CYS N N 101 114.221 117.452 -3.231 1
1 148 . 9 1 1 A 13 13 LYS H H 102 8.029 7.254 0.775 1
1 149 . 9 1 1 A 13 13 LYS HA H 102 5.069 4.810 0.259 1
1 158 . 9 1 1 A 13 13 LYS C C 102 174.800 176.313 -1.513 1
1 159 . 9 1 1 A 13 13 LYS CA C 102 56.394 56.029 0.365 1
1 160 . 9 1 1 A 13 13 LYS CB C 102 32.770 33.430 -0.660 1
1 164 . 9 1 1 A 13 13 LYS N N 102 124.129 119.122 5.007 1
1 165 . 9 1 1 A 14 14 PHE H H 103 8.737 8.703 0.034 1
1 166 . 9 1 1 A 14 14 PHE HA H 103 5.059 5.108 -0.049 1
1 174 . 9 1 1 A 14 14 PHE C C 103 173.560 173.068 0.492 1
1 175 . 9 1 1 A 14 14 PHE CA C 103 55.470 56.044 -0.574 1
1 176 . 9 1 1 A 14 14 PHE CB C 103 41.760 41.097 0.663 1
1 180 . 9 1 1 A 14 14 PHE N N 103 118.661 116.433 2.228 1
1 181 . 9 1 1 A 15 15 SER H H 104 8.826 8.844 -0.018 1
1 182 . 9 1 1 A 15 15 SER HA H 104 4.602 4.506 0.096 1
1 185 . 9 1 1 A 15 15 SER C C 104 173.795 173.602 0.193 1
1 186 . 9 1 1 A 15 15 SER CA C 104 58.610 58.889 -0.279 1
1 187 . 9 1 1 A 15 15 SER CB C 104 62.690 62.494 0.196 1
1 188 . 9 1 1 A 15 15 SER N N 104 117.781 116.902 0.879 1
1 189 . 9 1 1 A 16 16 VAL H H 105 7.784 7.871 -0.087 1
1 190 . 9 1 1 A 16 16 VAL HA H 105 3.370 3.852 -0.482 1
1 198 . 9 1 1 A 16 16 VAL C C 105 174.987 175.421 -0.434 1
1 199 . 9 1 1 A 16 16 VAL CA C 105 63.580 62.903 0.677 1
1 200 . 9 1 1 A 16 16 VAL CB C 105 31.410 30.892 0.518 1
1 203 . 9 1 1 A 16 16 VAL N N 105 129.075 126.066 3.009 1
1 204 . 9 1 1 A 17 17 CYS H H 106 8.536 8.370 0.166 1
1 205 . 9 1 1 A 17 17 CYS HA H 106 5.011 4.963 0.048 1
1 208 . 9 1 1 A 17 17 CYS CA C 106 55.260 56.248 -0.988 1
1 209 . 9 1 1 A 17 17 CYS CB C 106 28.210 29.108 -0.898 1
1 210 . 9 1 1 A 17 17 CYS N N 106 130.045 127.322 2.723 1
1 211 . 9 1 1 A 18 18 PRO HA H 107 3.991 4.384 -0.393 1
1 218 . 9 1 1 A 18 18 PRO C C 107 178.188 178.293 -0.105 1
1 219 . 9 1 1 A 18 18 PRO CA C 107 65.940 64.672 1.268 1
1 220 . 9 1 1 A 18 18 PRO CB C 107 32.000 31.942 0.058 1
1 223 . 9 1 1 A 19 19 GLU H H 108 9.260 8.998 0.262 1
1 224 . 9 1 1 A 19 19 GLU HA H 108 4.119 4.094 0.025 1
1 229 . 9 1 1 A 19 19 GLU C C 108 178.721 178.489 0.232 1
1 230 . 9 1 1 A 19 19 GLU CA C 108 59.300 59.301 -0.001 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 108 118.270 115.998 2.272 1
1 234 . 9 1 1 A 20 20 ARG H H 109 7.672 7.807 -0.135 1
1 235 . 9 1 1 A 20 20 ARG HA H 109 4.331 4.328 0.003 1
1 242 . 9 1 1 A 20 20 ARG C C 109 177.977 177.651 0.326 1
1 243 . 9 1 1 A 20 20 ARG CA C 109 57.350 57.626 -0.276 1
1 244 . 9 1 1 A 20 20 ARG CB C 109 30.820 30.760 0.060 1
1 247 . 9 1 1 A 20 20 ARG N N 109 118.357 119.066 -0.709 1
1 248 . 9 1 1 A 21 21 LEU H H 110 7.601 7.677 -0.076 1
1 249 . 9 1 1 A 21 21 LEU HA H 110 4.380 4.384 -0.004 1
1 259 . 9 1 1 A 21 21 LEU C C 110 176.562 176.229 0.333 1
1 260 . 9 1 1 A 21 21 LEU CA C 110 56.096 55.135 0.961 1
1 261 . 9 1 1 A 21 21 LEU CB C 110 44.016 42.328 1.688 1
1 265 . 9 1 1 A 21 21 LEU N N 110 118.626 117.388 1.238 1
1 266 . 9 1 1 A 22 22 GLN H H 111 7.750 7.469 0.281 1
1 267 . 9 1 1 A 22 22 GLN HA H 111 3.870 3.909 -0.039 1
1 274 . 9 1 1 A 22 22 GLN C C 111 173.336 174.089 -0.753 1
1 275 . 9 1 1 A 22 22 GLN CA C 111 56.510 57.218 -0.708 1
1 276 . 9 1 1 A 22 22 GLN CB C 111 26.800 26.273 0.527 1
1 278 . 9 1 1 A 22 22 GLN N N 111 113.926 115.575 -1.649 1
1 280 . 9 1 1 A 23 23 CYS H H 112 7.407 7.882 -0.475 1
1 281 . 9 1 1 A 23 23 CYS HA H 112 4.469 4.899 -0.430 1
1 284 . 9 1 1 A 23 23 CYS CA C 112 52.650 56.901 -4.251 1
1 285 . 9 1 1 A 23 23 CYS CB C 112 29.750 28.756 0.994 1
1 286 . 9 1 1 A 23 23 CYS N N 112 112.681 117.741 -5.060 1
1 287 . 9 1 1 A 24 24 PRO HA H 113 4.408 4.539 -0.131 1
1 294 . 9 1 1 A 24 24 PRO C C 113 178.175 177.319 0.856 1
1 295 . 9 1 1 A 24 24 PRO CA C 113 62.040 62.597 -0.557 1
1 296 . 9 1 1 A 24 24 PRO CB C 113 31.920 32.781 -0.861 1
1 299 . 9 1 1 A 25 25 LEU H H 114 8.593 8.412 0.181 1
1 300 . 9 1 1 A 25 25 LEU HA H 114 3.765 3.899 -0.134 1
1 310 . 9 1 1 A 25 25 LEU C C 114 179.950 178.796 1.154 1
1 311 . 9 1 1 A 25 25 LEU CA C 114 57.674 57.798 -0.124 1
1 312 . 9 1 1 A 25 25 LEU CB C 114 40.690 41.501 -0.811 1
1 316 . 9 1 1 A 25 25 LEU N N 114 123.729 123.093 0.636 1
1 317 . 9 1 1 A 26 26 GLU H H 115 9.108 8.535 0.573 1
1 318 . 9 1 1 A 26 26 GLU HA H 115 3.876 4.078 -0.202 1
1 323 . 9 1 1 A 26 26 GLU C C 115 177.505 178.514 -1.009 1
1 324 . 9 1 1 A 26 26 GLU CA C 115 59.410 59.141 0.269 1
1 325 . 9 1 1 A 26 26 GLU CB C 115 28.460 29.490 -1.030 1
1 327 . 9 1 1 A 26 26 GLU N N 115 116.817 117.555 -0.738 1
1 328 . 9 1 1 A 27 27 ALA H H 116 7.360 7.705 -0.345 1
1 329 . 9 1 1 A 27 27 ALA HA H 116 4.408 4.159 0.249 1
1 333 . 9 1 1 A 27 27 ALA C C 116 177.046 177.906 -0.860 1
1 334 . 9 1 1 A 27 27 ALA CA C 116 52.970 54.439 -1.469 1
1 335 . 9 1 1 A 27 27 ALA CB C 116 19.916 18.415 1.501 1
1 336 . 9 1 1 A 27 27 ALA N N 116 118.966 120.787 -1.821 1
1 337 . 9 1 1 A 28 28 ILE H H 117 7.168 7.052 0.116 1
1 338 . 9 1 1 A 28 28 ILE HA H 117 4.432 4.432 0.000 1
1 348 . 9 1 1 A 28 28 ILE C C 117 172.641 175.589 -2.948 1
1 349 . 9 1 1 A 28 28 ILE CA C 117 59.980 59.482 0.498 1
1 350 . 9 1 1 A 28 28 ILE CB C 117 37.350 37.584 -0.234 1
1 354 . 9 1 1 A 28 28 ILE N N 117 108.913 108.874 0.039 1
1 355 . 9 1 1 A 29 29 GLN H H 118 6.562 7.329 -0.767 1
1 356 . 9 1 1 A 29 29 GLN HA H 118 3.922 4.253 -0.331 1
1 363 . 9 1 1 A 29 29 GLN C C 118 175.049 175.664 -0.615 1
1 364 . 9 1 1 A 29 29 GLN CA C 118 54.596 56.058 -1.462 1
1 365 . 9 1 1 A 29 29 GLN CB C 118 29.570 29.636 -0.066 1
1 367 . 9 1 1 A 29 29 GLN N N 118 116.455 123.257 -6.802 1
1 369 . 9 1 1 A 30 30 CYS H H 119 8.138 8.354 -0.216 1
1 370 . 9 1 1 A 30 30 CYS HA H 119 4.580 4.563 0.017 1
1 373 . 9 1 1 A 30 30 CYS CA C 119 57.810 57.025 0.785 1
1 374 . 9 1 1 A 30 30 CYS CB C 119 30.200 28.732 1.468 1
1 375 . 9 1 1 A 30 30 CYS N N 119 134.136 125.204 8.932 1
1 376 . 9 1 1 A 31 31 PRO HA H 120 4.424 4.437 -0.013 1
1 383 . 9 1 1 A 31 31 PRO C C 120 177.431 177.640 -0.209 1
1 384 . 9 1 1 A 31 31 PRO CA C 120 64.060 63.999 0.061 1
1 385 . 9 1 1 A 31 31 PRO CB C 120 32.776 31.809 0.967 1
1 388 . 9 1 1 A 32 32 ILE H H 121 11.318 7.252 4.066 1
1 389 . 9 1 1 A 32 32 ILE HA H 121 4.038 3.978 0.060 1
1 399 . 9 1 1 A 32 32 ILE C C 121 178.485 177.841 0.644 1
1 400 . 9 1 1 A 32 32 ILE CA C 121 64.060 64.087 -0.027 1
1 401 . 9 1 1 A 32 32 ILE CB C 121 39.340 38.407 0.933 1
1 405 . 9 1 1 A 32 32 ILE N N 121 124.500 117.157 7.343 1
1 406 . 9 1 1 A 33 33 THR H H 122 9.928 7.319 2.609 1
1 407 . 9 1 1 A 33 33 THR HA H 122 4.048 4.349 -0.301 1
1 412 . 9 1 1 A 33 33 THR C C 122 175.793 174.859 0.934 1
1 413 . 9 1 1 A 33 33 THR CA C 122 62.990 61.773 1.217 1
1 414 . 9 1 1 A 33 33 THR CB C 122 70.300 70.046 0.254 1
1 416 . 9 1 1 A 33 33 THR N N 122 115.136 109.290 5.846 1
1 417 . 9 1 1 A 34 34 LEU H H 123 8.439 7.744 0.695 1
1 418 . 9 1 1 A 34 34 LEU HA H 123 3.912 3.827 0.085 1
1 428 . 9 1 1 A 34 34 LEU C C 123 175.495 175.113 0.382 1
1 429 . 9 1 1 A 34 34 LEU CA C 123 56.290 56.233 0.057 1
1 430 . 9 1 1 A 34 34 LEU CB C 123 38.500 39.757 -1.257 1
1 434 . 9 1 1 A 34 34 LEU N N 123 117.230 119.202 -1.972 1
1 435 . 9 1 1 A 35 35 GLU H H 124 7.816 6.983 0.833 1
1 436 . 9 1 1 A 35 35 GLU HA H 124 4.634 4.808 -0.174 1
1 441 . 9 1 1 A 35 35 GLU C C 124 174.838 174.030 0.808 1
1 442 . 9 1 1 A 35 35 GLU CA C 124 53.780 54.771 -0.991 1
1 443 . 9 1 1 A 35 35 GLU CB C 124 33.710 32.617 1.093 1
1 445 . 9 1 1 A 35 35 GLU N N 124 116.577 114.091 2.486 1
1 446 . 9 1 1 A 36 36 GLN H H 125 8.532 8.371 0.161 1
1 447 . 9 1 1 A 36 36 GLN HA H 125 4.958 4.343 0.615 1
1 454 . 9 1 1 A 36 36 GLN CA C 125 53.350 53.414 -0.064 1
1 455 . 9 1 1 A 36 36 GLN CB C 125 29.950 29.276 0.674 1
1 457 . 9 1 1 A 36 36 GLN N N 125 123.034 123.942 -0.908 1
1 459 . 9 1 1 A 37 37 PRO HA H 126 4.458 4.723 -0.265 1
1 466 . 9 1 1 A 37 37 PRO C C 126 176.314 176.539 -0.225 1
1 467 . 9 1 1 A 37 37 PRO CA C 126 62.816 62.349 0.467 1
1 468 . 9 1 1 A 37 37 PRO CB C 126 33.070 32.895 0.175 1
1 471 . 9 1 1 A 38 38 GLU H H 127 8.626 8.391 0.235 1
1 472 . 9 1 1 A 38 38 GLU HA H 127 4.274 4.184 0.090 1
1 477 . 9 1 1 A 38 38 GLU C C 127 177.877 175.891 1.986 1
1 478 . 9 1 1 A 38 38 GLU CA C 127 58.730 56.828 1.902 1
1 479 . 9 1 1 A 38 38 GLU CB C 127 30.340 30.130 0.210 1
1 481 . 9 1 1 A 38 38 GLU N N 127 120.691 119.138 1.553 1
1 482 . 9 1 1 A 39 39 LYS H H 128 7.861 7.587 0.274 1
1 483 . 9 1 1 A 39 39 LYS HA H 128 4.889 4.794 0.095 1
1 492 . 9 1 1 A 39 39 LYS C C 128 175.446 175.026 0.420 1
1 493 . 9 1 1 A 39 39 LYS CA C 128 53.670 54.894 -1.224 1
1 494 . 9 1 1 A 39 39 LYS CB C 128 33.630 35.932 -2.302 1
1 498 . 9 1 1 A 39 39 LYS N N 128 117.878 116.918 0.960 1
1 499 . 9 1 1 A 40 40 GLY H H 129 8.426 7.930 0.496 1
1 500 . 9 1 1 A 40 40 GLY HA2 H 129 4.970 4.040 0.930 1
1 501 . 9 1 1 A 40 40 GLY HA3 H 129 2.458 4.161 -1.703 1
1 502 . 9 1 1 A 40 40 GLY C C 129 170.048 172.288 -2.240 1
1 503 . 9 1 1 A 40 40 GLY CA C 129 42.910 45.013 -2.103 1
1 504 . 9 1 1 A 40 40 GLY N N 129 112.604 106.465 6.139 1
1 505 . 9 1 1 A 41 41 ILE H H 130 8.596 9.058 -0.462 1
1 506 . 9 1 1 A 41 41 ILE HA H 130 4.636 5.177 -0.541 1
1 516 . 9 1 1 A 41 41 ILE C C 130 172.691 174.326 -1.635 1
1 517 . 9 1 1 A 41 41 ILE CA C 130 58.500 58.782 -0.282 1
1 518 . 9 1 1 A 41 41 ILE CB C 130 43.320 40.809 2.511 1
1 522 . 9 1 1 A 41 41 ILE N N 130 113.363 116.247 -2.884 1
1 523 . 9 1 1 A 42 42 PHE H H 131 8.994 8.915 0.079 1
1 524 . 9 1 1 A 42 42 PHE HA H 131 5.075 5.577 -0.502 1
1 532 . 9 1 1 A 42 42 PHE C C 131 175.111 174.920 0.191 1
1 533 . 9 1 1 A 42 42 PHE CA C 131 58.680 57.075 1.605 1
1 534 . 9 1 1 A 42 42 PHE CB C 131 42.220 40.793 1.427 1
1 538 . 9 1 1 A 42 42 PHE N N 131 125.156 121.755 3.401 1
1 539 . 9 1 1 A 43 43 VAL H H 132 8.399 9.478 -1.079 1
1 540 . 9 1 1 A 43 43 VAL HA H 132 4.920 4.731 0.189 1
1 548 . 9 1 1 A 43 43 VAL C C 132 178.175 175.100 3.075 1
1 549 . 9 1 1 A 43 43 VAL CA C 132 59.600 61.000 -1.400 1
1 550 . 9 1 1 A 43 43 VAL CB C 132 35.920 34.072 1.848 1
1 553 . 9 1 1 A 43 43 VAL N N 132 119.371 123.112 -3.741 1
1 554 . 9 1 1 A 44 44 LYS H H 133 10.041 8.602 1.439 1
1 555 . 9 1 1 A 44 44 LYS HA H 133 4.920 4.443 0.477 1
1 564 . 9 1 1 A 44 44 LYS C C 133 177.195 176.159 1.036 1
1 565 . 9 1 1 A 44 44 LYS CA C 133 57.310 56.261 1.049 1
1 566 . 9 1 1 A 44 44 LYS CB C 133 34.410 32.524 1.886 1
1 570 . 9 1 1 A 44 44 LYS N N 133 130.928 126.993 3.935 1
1 571 . 9 1 1 A 45 45 ASN H H 134 8.534 9.251 -0.717 1
1 572 . 9 1 1 A 45 45 ASN HA H 134 4.151 4.799 -0.648 1
1 577 . 9 1 1 A 45 45 ASN C C 134 174.217 175.304 -1.087 1
1 578 . 9 1 1 A 45 45 ASN CA C 134 55.290 52.489 2.801 1
1 579 . 9 1 1 A 45 45 ASN CB C 134 37.530 36.502 1.028 1
1 580 . 9 1 1 A 45 45 ASN N N 134 119.452 124.062 -4.610 1
1 582 . 9 1 1 A 46 46 SER H H 135 7.570 8.044 -0.474 1
1 583 . 9 1 1 A 46 46 SER HA H 135 4.220 4.098 0.122 1
1 586 . 9 1 1 A 46 46 SER C C 135 174.490 176.902 -2.412 1
1 587 . 9 1 1 A 46 46 SER CA C 135 57.090 61.435 -4.345 1
1 588 . 9 1 1 A 46 46 SER CB C 135 64.126 63.128 0.998 1
1 589 . 9 1 1 A 46 46 SER N N 135 105.613 119.378 -13.765 1
1 590 . 9 1 1 A 47 47 ASP H H 136 9.113 8.300 0.813 1
1 591 . 9 1 1 A 47 47 ASP HA H 136 4.220 4.329 -0.109 1
1 594 . 9 1 1 A 47 47 ASP CA C 136 57.610 57.081 0.529 1
1 595 . 9 1 1 A 47 47 ASP CB C 136 40.810 41.245 -0.435 1
1 596 . 9 1 1 A 47 47 ASP N N 136 120.995 120.746 0.249 1
1 597 . 9 1 1 A 48 48 GLY H H 137 8.172 8.206 -0.034 1
1 598 . 9 1 1 A 48 48 GLY HA2 H 137 4.096 3.742 0.354 1
1 599 . 9 1 1 A 48 48 GLY HA3 H 137 3.664 3.743 -0.079 1
1 600 . 9 1 1 A 48 48 GLY C C 137 173.990 175.284 -1.294 1
1 601 . 9 1 1 A 48 48 GLY CA C 137 45.130 47.307 -2.177 1
1 602 . 9 1 1 A 48 48 GLY N N 137 105.838 106.841 -1.003 1
1 603 . 9 1 1 A 49 49 SER H H 138 7.252 7.773 -0.521 1
1 604 . 9 1 1 A 49 49 SER HA H 138 4.503 4.770 -0.267 1
1 607 . 9 1 1 A 49 49 SER C C 138 173.857 173.933 -0.076 1
1 608 . 9 1 1 A 49 49 SER CA C 138 57.340 57.310 0.030 1
1 609 . 9 1 1 A 49 49 SER CB C 138 65.370 64.913 0.457 1
1 610 . 9 1 1 A 49 49 SER N N 138 114.942 114.269 0.673 1
1 611 . 9 1 1 A 50 50 ASP H H 139 8.276 8.069 0.207 1
1 612 . 9 1 1 A 50 50 ASP HA H 139 4.618 4.307 0.311 1
1 615 . 9 1 1 A 50 50 ASP C C 139 174.577 174.635 -0.058 1
1 616 . 9 1 1 A 50 50 ASP CA C 139 53.116 55.086 -1.970 1
1 617 . 9 1 1 A 50 50 ASP CB C 139 40.520 39.472 1.048 1
1 618 . 9 1 1 A 50 50 ASP N N 139 122.088 121.297 0.791 1
1 619 . 9 1 1 A 51 51 VAL H H 140 8.192 7.350 0.842 1
1 620 . 9 1 1 A 51 51 VAL HA H 140 4.299 4.407 -0.108 1
1 628 . 9 1 1 A 51 51 VAL C C 140 175.867 175.120 0.747 1
1 629 . 9 1 1 A 51 51 VAL CA C 140 62.950 61.206 1.744 1
1 630 . 9 1 1 A 51 51 VAL CB C 140 33.230 34.209 -0.979 1
1 632 . 9 1 1 A 51 51 VAL N N 140 121.167 118.753 2.414 1
1 633 . 9 1 1 A 52 52 CYS H H 141 8.391 8.891 -0.500 1
1 634 . 9 1 1 A 52 52 CYS HA H 141 5.247 5.222 0.025 1
1 637 . 9 1 1 A 52 52 CYS C C 141 172.778 175.006 -2.228 1
1 638 . 9 1 1 A 52 52 CYS CA C 141 56.480 58.427 -1.947 1
1 639 . 9 1 1 A 52 52 CYS CB C 141 31.960 28.250 3.710 1
1 640 . 9 1 1 A 52 52 CYS N N 141 121.884 126.504 -4.620 1
1 641 . 9 1 1 A 53 53 THR H H 142 8.777 9.043 -0.266 1
1 642 . 9 1 1 A 53 53 THR HA H 142 4.489 4.973 -0.484 1
1 648 . 9 1 1 A 53 53 THR C C 142 171.885 172.592 -0.707 1
1 649 . 9 1 1 A 53 53 THR CA C 142 62.070 61.445 0.625 1
1 650 . 9 1 1 A 53 53 THR CB C 142 71.390 71.389 0.001 1
1 652 . 9 1 1 A 53 53 THR N N 142 118.132 117.873 0.259 1
1 653 . 9 1 1 A 54 54 LEU H H 143 8.409 8.413 -0.004 1
1 654 . 9 1 1 A 54 54 LEU HA H 143 4.276 4.477 -0.201 1
1 664 . 9 1 1 A 54 54 LEU C C 143 174.366 174.249 0.117 1
1 665 . 9 1 1 A 54 54 LEU CA C 143 54.330 53.181 1.149 1
1 666 . 9 1 1 A 54 54 LEU CB C 143 42.396 42.747 -0.351 1
1 670 . 9 1 1 A 54 54 LEU N N 143 127.980 128.533 -0.553 1
1 671 . 9 1 1 A 55 55 PHE H H 144 8.646 8.753 -0.107 1
1 672 . 9 1 1 A 55 55 PHE HA H 144 5.455 4.742 0.713 1
1 680 . 9 1 1 A 55 55 PHE C C 144 176.054 175.400 0.654 1
1 681 . 9 1 1 A 55 55 PHE CA C 144 55.250 56.952 -1.702 1
1 682 . 9 1 1 A 55 55 PHE CB C 144 44.100 40.804 3.296 1
1 686 . 9 1 1 A 55 55 PHE N N 144 122.010 126.838 -4.828 1
1 687 . 9 1 1 A 56 56 ASP H H 145 11.575 8.287 3.288 1
1 688 . 9 1 1 A 56 56 ASP HA H 145 4.416 4.380 0.036 1
1 691 . 9 1 1 A 56 56 ASP C C 145 176.748 177.373 -0.625 1
1 692 . 9 1 1 A 56 56 ASP CA C 145 55.840 54.653 1.187 1
1 693 . 9 1 1 A 56 56 ASP CB C 145 44.390 42.286 2.104 1
1 694 . 9 1 1 A 56 56 ASP N N 145 121.936 123.305 -1.369 1
1 695 . 9 1 1 A 57 57 ALA H H 146 8.508 8.565 -0.057 1
1 696 . 9 1 1 A 57 57 ALA HA H 146 3.797 4.115 -0.318 1
1 700 . 9 1 1 A 57 57 ALA C C 146 178.696 179.936 -1.240 1
1 701 . 9 1 1 A 57 57 ALA CA C 146 55.990 55.618 0.372 1
1 702 . 9 1 1 A 57 57 ALA CB C 146 18.840 18.228 0.612 1
1 703 . 9 1 1 A 57 57 ALA N N 146 130.243 129.102 1.141 1
1 704 . 9 1 1 A 58 58 ALA H H 147 8.378 7.733 0.645 1
1 705 . 9 1 1 A 58 58 ALA HA H 147 4.078 4.169 -0.091 1
1 709 . 9 1 1 A 58 58 ALA C C 147 181.091 179.672 1.419 1
1 710 . 9 1 1 A 58 58 ALA CA C 147 54.770 54.845 -0.075 1
1 711 . 9 1 1 A 58 58 ALA CB C 147 17.700 18.306 -0.606 1
1 712 . 9 1 1 A 58 58 ALA N N 147 121.997 120.179 1.818 1
1 713 . 9 1 1 A 59 59 ALA H H 148 9.138 7.987 1.151 1
1 714 . 9 1 1 A 59 59 ALA HA H 148 3.975 4.134 -0.159 1
1 718 . 9 1 1 A 59 59 ALA C C 148 180.508 179.872 0.636 1
1 719 . 9 1 1 A 59 59 ALA CA C 148 54.840 55.044 -0.204 1
1 720 . 9 1 1 A 59 59 ALA CB C 148 18.600 18.522 0.078 1
1 721 . 9 1 1 A 59 59 ALA N N 148 123.595 120.274 3.321 1
1 722 . 9 1 1 A 60 60 PHE H H 149 8.814 8.094 0.720 1
1 723 . 9 1 1 A 60 60 PHE HA H 149 3.722 4.022 -0.300 1
1 731 . 9 1 1 A 60 60 PHE C C 149 176.773 177.469 -0.696 1
1 732 . 9 1 1 A 60 60 PHE CA C 149 62.030 61.606 0.424 1
1 733 . 9 1 1 A 60 60 PHE CB C 149 39.960 38.915 1.045 1
1 737 . 9 1 1 A 60 60 PHE N N 149 120.354 120.013 0.341 1
1 738 . 9 1 1 A 61 61 SER H H 150 8.276 8.233 0.043 1
1 739 . 9 1 1 A 61 61 SER HA H 150 3.880 4.150 -0.270 1
1 742 . 9 1 1 A 61 61 SER C C 150 177.691 177.149 0.542 1
1 743 . 9 1 1 A 61 61 SER CA C 150 62.190 61.269 0.921 1
1 744 . 9 1 1 A 61 61 SER CB C 150 63.016 63.192 -0.176 1
1 745 . 9 1 1 A 61 61 SER N N 150 112.086 114.007 -1.921 1
1 746 . 9 1 1 A 62 62 ARG H H 151 7.829 7.731 0.098 1
1 747 . 9 1 1 A 62 62 ARG HA H 151 3.971 4.070 -0.099 1
1 754 . 9 1 1 A 62 62 ARG C C 151 178.287 178.729 -0.442 1
1 755 . 9 1 1 A 62 62 ARG CA C 151 59.340 59.079 0.261 1
1 756 . 9 1 1 A 62 62 ARG CB C 151 29.760 29.791 -0.031 1
1 759 . 9 1 1 A 62 62 ARG N N 151 121.090 121.560 -0.470 1
1 760 . 9 1 1 A 63 63 LEU H H 152 7.390 7.734 -0.344 1
1 761 . 9 1 1 A 63 63 LEU HA H 152 3.791 3.923 -0.132 1
1 771 . 9 1 1 A 63 63 LEU C C 152 179.106 178.865 0.241 1
1 772 . 9 1 1 A 63 63 LEU CA C 152 58.900 57.895 1.005 1
1 773 . 9 1 1 A 63 63 LEU CB C 152 41.140 41.426 -0.286 1
1 777 . 9 1 1 A 63 63 LEU N N 152 121.129 119.257 1.872 1
1 778 . 9 1 1 A 64 64 VAL H H 153 7.552 8.012 -0.460 1
1 779 . 9 1 1 A 64 64 VAL HA H 153 3.411 3.478 -0.067 1
1 787 . 9 1 1 A 64 64 VAL C C 153 180.595 178.094 2.501 1
1 788 . 9 1 1 A 64 64 VAL CA C 153 65.644 66.329 -0.685 1
1 789 . 9 1 1 A 64 64 VAL CB C 153 31.410 31.451 -0.041 1
1 792 . 9 1 1 A 64 64 VAL N N 153 118.280 118.155 0.125 1
1 793 . 9 1 1 A 65 65 GLY H H 154 8.061 8.070 -0.009 1
1 794 . 9 1 1 A 65 65 GLY HA2 H 154 3.846 3.752 0.094 1
1 795 . 9 1 1 A 65 65 GLY HA3 H 154 3.809 3.754 0.055 1
1 796 . 9 1 1 A 65 65 GLY C C 154 175.235 176.527 -1.292 1
1 797 . 9 1 1 A 65 65 GLY CA C 154 46.630 47.103 -0.473 1
1 798 . 9 1 1 A 65 65 GLY N N 154 108.622 107.769 0.853 1
1 799 . 9 1 1 A 66 66 GLU H H 155 7.528 7.680 -0.152 1
1 800 . 9 1 1 A 66 66 GLU HA H 155 4.228 4.296 -0.068 1
1 805 . 9 1 1 A 66 66 GLU C C 155 176.761 176.559 0.202 1
1 806 . 9 1 1 A 66 66 GLU CA C 155 56.590 56.472 0.118 1
1 807 . 9 1 1 A 66 66 GLU CB C 155 30.490 30.064 0.426 1
1 809 . 9 1 1 A 66 66 GLU N N 155 118.361 118.899 -0.538 1
1 810 . 9 1 1 A 67 67 GLY H H 156 7.884 7.772 0.112 1
1 811 . 9 1 1 A 67 67 GLY HA2 H 156 3.918 3.902 0.016 1
1 812 . 9 1 1 A 67 67 GLY HA3 H 156 3.747 3.913 -0.166 1
1 813 . 9 1 1 A 67 67 GLY C C 156 174.788 174.365 0.423 1
1 814 . 9 1 1 A 67 67 GLY CA C 156 45.890 45.168 0.722 1
1 815 . 9 1 1 A 67 67 GLY N N 156 108.465 107.791 0.674 1
1 816 . 9 1 1 A 68 68 LEU H H 157 7.332 7.652 -0.320 1
1 817 . 9 1 1 A 68 68 LEU HA H 157 4.361 4.394 -0.033 1
1 827 . 9 1 1 A 68 68 LEU CA C 157 53.060 52.801 0.259 1
1 828 . 9 1 1 A 68 68 LEU CB C 157 41.100 42.100 -1.000 1
1 832 . 9 1 1 A 68 68 LEU N N 157 121.920 122.274 -0.354 1
1 833 . 9 1 1 A 69 69 PRO HA H 158 4.485 4.591 -0.106 1
1 840 . 9 1 1 A 69 69 PRO C C 158 174.602 176.225 -1.623 1
1 841 . 9 1 1 A 69 69 PRO CA C 158 61.556 62.224 -0.668 1
1 842 . 9 1 1 A 69 69 PRO CB C 158 32.370 32.980 -0.610 1
1 845 . 9 1 1 A 70 70 HIS H H 159 8.759 8.647 0.112 1
1 846 . 9 1 1 A 70 70 HIS HA H 159 3.947 4.572 -0.625 1
1 852 . 9 1 1 A 70 70 HIS CA C 159 56.250 55.203 1.047 1
1 853 . 9 1 1 A 70 70 HIS CB C 159 32.280 31.000 1.280 1
1 856 . 9 1 1 A 70 70 HIS N N 159 119.423 120.443 -1.020 1
1 857 . 9 1 1 A 71 71 PRO HA H 160 4.424 4.368 0.056 1
1 864 . 9 1 1 A 71 71 PRO C C 160 177.567 178.461 -0.894 1
1 865 . 9 1 1 A 71 71 PRO CA C 160 64.574 64.659 -0.085 1
1 866 . 9 1 1 A 71 71 PRO CB C 160 32.340 32.124 0.216 1
1 869 . 9 1 1 A 72 72 LEU H H 161 10.123 7.539 2.584 1
1 870 . 9 1 1 A 72 72 LEU HA H 161 4.778 4.285 0.493 1
1 880 . 9 1 1 A 72 72 LEU C C 161 178.721 177.930 0.791 1
1 881 . 9 1 1 A 72 72 LEU CA C 161 55.800 57.319 -1.519 1
1 882 . 9 1 1 A 72 72 LEU CB C 161 42.440 42.555 -0.115 1
1 886 . 9 1 1 A 72 72 LEU N N 161 117.374 117.298 0.076 1
1 887 . 9 1 1 A 73 73 THR H H 162 7.523 7.722 -0.199 1
1 888 . 9 1 1 A 73 73 THR HA H 162 4.291 4.506 -0.215 1
1 893 . 9 1 1 A 73 73 THR C C 162 175.557 174.351 1.206 1
1 894 . 9 1 1 A 73 73 THR CA C 162 61.440 62.328 -0.888 1
1 895 . 9 1 1 A 73 73 THR CB C 162 70.500 69.907 0.593 1
1 897 . 9 1 1 A 73 73 THR N N 162 107.787 111.972 -4.185 1
1 898 . 9 1 1 A 74 74 ARG H H 163 8.361 7.865 0.496 1
1 899 . 9 1 1 A 74 74 ARG HA H 163 3.836 4.380 -0.544 1
1 906 . 9 1 1 A 74 74 ARG C C 163 174.701 175.301 -0.600 1
1 907 . 9 1 1 A 74 74 ARG CA C 163 57.980 57.637 0.343 1
1 908 . 9 1 1 A 74 74 ARG CB C 163 26.770 27.067 -0.297 1
1 911 . 9 1 1 A 74 74 ARG N N 163 115.130 118.451 -3.321 1
1 912 . 9 1 1 A 75 75 GLU H H 164 7.430 8.054 -0.624 1
1 913 . 9 1 1 A 75 75 GLU HA H 164 4.636 4.466 0.170 1
1 918 . 9 1 1 A 75 75 GLU CA C 164 53.699 54.867 -1.168 1
1 919 . 9 1 1 A 75 75 GLU CB C 164 29.550 29.014 0.536 1
1 921 . 9 1 1 A 75 75 GLU N N 164 120.076 119.101 0.975 1
1 922 . 9 1 1 A 76 76 PRO HA H 165 4.272 4.497 -0.225 1
1 929 . 9 1 1 A 76 76 PRO C C 165 176.649 177.005 -0.356 1
1 930 . 9 1 1 A 76 76 PRO CA C 165 63.204 63.124 0.080 1
1 931 . 9 1 1 A 76 76 PRO CB C 165 31.680 31.684 -0.004 1
1 934 . 9 1 1 A 77 77 ILE H H 166 8.812 8.219 0.593 1
1 935 . 9 1 1 A 77 77 ILE HA H 166 3.838 4.258 -0.420 1
1 945 . 9 1 1 A 77 77 ILE C C 166 175.235 176.020 -0.785 1
1 946 . 9 1 1 A 77 77 ILE CA C 166 62.816 61.343 1.473 1
1 947 . 9 1 1 A 77 77 ILE CB C 166 37.750 37.962 -0.212 1
1 951 . 9 1 1 A 77 77 ILE N N 166 123.831 124.130 -0.299 1
1 952 . 9 1 1 A 78 78 THR H H 167 6.625 8.534 -1.909 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 167 174.143 174.290 -0.147 1
1 959 . 9 1 1 A 78 78 THR CA C 167 58.750 60.144 -1.394 1
1 960 . 9 1 1 A 78 78 THR CB C 167 71.320 70.969 0.351 1
1 962 . 9 1 1 A 78 78 THR N N 167 115.293 117.746 -2.453 1
1 963 . 9 1 1 A 79 79 ALA H H 168 9.088 8.977 0.111 1
1 964 . 9 1 1 A 79 79 ALA HA H 168 3.916 4.112 -0.196 1
1 968 . 9 1 1 A 79 79 ALA C C 168 179.788 179.232 0.556 1
1 969 . 9 1 1 A 79 79 ALA CA C 168 55.480 55.038 0.442 1
1 970 . 9 1 1 A 79 79 ALA CB C 168 17.630 18.461 -0.831 1
1 971 . 9 1 1 A 79 79 ALA N N 168 122.102 127.557 -5.455 1
1 972 . 9 1 1 A 80 80 SER H H 169 7.988 7.679 0.309 1
1 973 . 9 1 1 A 80 80 SER HA H 169 4.058 4.170 -0.112 1
1 976 . 9 1 1 A 80 80 SER C C 169 176.029 175.801 0.228 1
1 977 . 9 1 1 A 80 80 SER CA C 169 60.750 61.252 -0.502 1
1 978 . 9 1 1 A 80 80 SER CB C 169 62.510 63.120 -0.610 1
1 979 . 9 1 1 A 80 80 SER N N 169 109.541 113.082 -3.541 1
1 980 . 9 1 1 A 81 81 ILE H H 170 6.968 7.103 -0.135 1
1 981 . 9 1 1 A 81 81 ILE HA H 170 4.315 4.600 -0.285 1
1 991 . 9 1 1 A 81 81 ILE C C 170 174.242 175.003 -0.761 1
1 992 . 9 1 1 A 81 81 ILE CA C 170 62.296 60.864 1.432 1
1 993 . 9 1 1 A 81 81 ILE CB C 170 37.686 38.502 -0.816 1
1 997 . 9 1 1 A 81 81 ILE N N 170 112.476 112.208 0.268 1
1 998 . 9 1 1 A 82 82 ILE H H 171 7.345 7.454 -0.109 1
1 999 . 9 1 1 A 82 82 ILE HA H 171 4.339 4.676 -0.337 1
1 1009 . 9 1 1 A 82 82 ILE C C 171 174.999 174.543 0.456 1
1 1010 . 9 1 1 A 82 82 ILE CA C 171 61.150 59.967 1.183 1
1 1011 . 9 1 1 A 82 82 ILE CB C 171 37.230 40.856 -3.626 1
1 1015 . 9 1 1 A 82 82 ILE N N 171 124.260 124.794 -0.534 1
1 1016 . 9 1 1 A 83 83 VAL H H 172 7.923 9.141 -1.218 1
1 1017 . 9 1 1 A 83 83 VAL HA H 172 4.673 5.030 -0.357 1
1 1025 . 9 1 1 A 83 83 VAL C C 172 174.887 175.156 -0.269 1
1 1026 . 9 1 1 A 83 83 VAL CA C 172 59.340 58.945 0.395 1
1 1027 . 9 1 1 A 83 83 VAL CB C 172 34.840 36.227 -1.387 1
1 1030 . 9 1 1 A 83 83 VAL N N 172 120.931 121.921 -0.990 1
1 1031 . 9 1 1 A 84 84 LYS H H 173 8.406 8.498 -0.092 1
1 1032 . 9 1 1 A 84 84 LYS HA H 173 4.410 4.662 -0.252 1
1 1041 . 9 1 1 A 84 84 LYS C C 173 178.734 178.540 0.194 1
1 1042 . 9 1 1 A 84 84 LYS CA C 173 56.360 55.055 1.305 1
1 1043 . 9 1 1 A 84 84 LYS CB C 173 33.100 33.150 -0.050 1
1 1047 . 9 1 1 A 84 84 LYS N N 173 121.251 120.952 0.299 1
1 1048 . 9 1 1 A 85 85 HIS H H 174 9.221 9.113 0.108 1
1 1049 . 9 1 1 A 85 85 HIS HA H 174 4.024 3.863 0.161 1
1 1053 . 9 1 1 A 85 85 HIS C C 174 177.183 176.731 0.452 1
1 1054 . 9 1 1 A 85 85 HIS CA C 174 59.460 60.313 -0.853 1
1 1055 . 9 1 1 A 85 85 HIS CB C 174 27.920 29.274 -1.354 1
1 1057 . 9 1 1 A 85 85 HIS N N 174 121.545 122.624 -1.079 1
1 1058 . 9 1 1 A 86 86 GLU H H 175 8.699 8.108 0.591 1
1 1059 . 9 1 1 A 86 86 GLU HA H 175 3.900 3.910 -0.010 1
1 1064 . 9 1 1 A 86 86 GLU C C 175 177.220 178.280 -1.060 1
1 1065 . 9 1 1 A 86 86 GLU CA C 175 58.420 58.287 0.133 1
1 1066 . 9 1 1 A 86 86 GLU CB C 175 28.690 29.263 -0.573 1
1 1068 . 9 1 1 A 86 86 GLU N N 175 118.011 119.105 -1.094 1
1 1069 . 9 1 1 A 87 87 GLU H H 176 7.621 7.852 -0.231 1
1 1070 . 9 1 1 A 87 87 GLU HA H 176 4.177 4.093 0.084 1
1 1075 . 9 1 1 A 87 87 GLU C C 176 175.222 175.997 -0.775 1
1 1076 . 9 1 1 A 87 87 GLU CA C 176 56.390 58.203 -1.813 1
1 1077 . 9 1 1 A 87 87 GLU CB C 176 30.430 30.207 0.223 1
1 1079 . 9 1 1 A 87 87 GLU N N 176 116.753 118.975 -2.222 1
1 1080 . 9 1 1 A 88 88 CYS H H 177 7.239 7.246 -0.007 1
1 1081 . 9 1 1 A 88 88 CYS HA H 177 5.148 5.131 0.017 1
1 1084 . 9 1 1 A 88 88 CYS C C 177 173.249 173.703 -0.454 1
1 1085 . 9 1 1 A 88 88 CYS CA C 177 57.240 56.869 0.371 1
1 1086 . 9 1 1 A 88 88 CYS CB C 177 31.020 30.676 0.344 1
1 1087 . 9 1 1 A 88 88 CYS N N 177 116.096 115.275 0.821 1
1 1088 . 9 1 1 A 89 89 ILE H H 178 8.912 8.692 0.220 1
1 1089 . 9 1 1 A 89 89 ILE HA H 178 4.580 4.935 -0.355 1
1 1099 . 9 1 1 A 89 89 ILE C C 178 173.386 174.414 -1.028 1
1 1100 . 9 1 1 A 89 89 ILE CA C 178 59.270 59.104 0.166 1
1 1101 . 9 1 1 A 89 89 ILE CB C 178 42.990 41.870 1.120 1
1 1105 . 9 1 1 A 89 89 ILE N N 178 119.490 118.439 1.051 1
1 1106 . 9 1 1 A 90 90 TYR H H 179 9.047 8.780 0.267 1
1 1107 . 9 1 1 A 90 90 TYR HA H 179 3.753 4.046 -0.293 1
1 1112 . 9 1 1 A 90 90 TYR C C 179 173.932 174.214 -0.282 1
1 1113 . 9 1 1 A 90 90 TYR CA C 179 59.860 57.475 2.385 1
1 1114 . 9 1 1 A 90 90 TYR CB C 179 37.530 38.639 -1.109 1
1 1116 . 9 1 1 A 90 90 TYR N N 179 126.270 122.403 3.867 1
1 1117 . 9 1 1 A 91 91 ASP H H 180 7.462 8.085 -0.623 1
1 1118 . 9 1 1 A 91 91 ASP HA H 180 4.639 4.770 -0.131 1
1 1121 . 9 1 1 A 91 91 ASP C C 180 175.297 176.182 -0.885 1
1 1122 . 9 1 1 A 91 91 ASP CA C 180 52.496 52.709 -0.213 1
1 1123 . 9 1 1 A 91 91 ASP CB C 180 43.380 42.704 0.676 1
1 1124 . 9 1 1 A 91 91 ASP N N 180 129.593 124.032 5.561 1
1 1125 . 9 1 1 A 92 92 ASP H H 181 8.719 9.195 -0.476 1
1 1126 . 9 1 1 A 92 92 ASP HA H 181 4.109 4.339 -0.230 1
1 1129 . 9 1 1 A 92 92 ASP C C 181 177.555 177.465 0.090 1
1 1130 . 9 1 1 A 92 92 ASP CA C 181 56.390 56.980 -0.590 1
1 1131 . 9 1 1 A 92 92 ASP CB C 181 41.330 40.941 0.389 1
1 1132 . 9 1 1 A 92 92 ASP N N 181 125.691 127.030 -1.339 1
1 1133 . 9 1 1 A 93 93 THR H H 182 8.271 7.953 0.318 1
1 1134 . 9 1 1 A 93 93 THR HA H 182 4.036 3.958 0.078 1
1 1139 . 9 1 1 A 93 93 THR C C 182 176.289 176.070 0.219 1
1 1140 . 9 1 1 A 93 93 THR CA C 182 65.054 64.966 0.088 1
1 1141 . 9 1 1 A 93 93 THR CB C 182 68.560 68.873 -0.313 1
1 1143 . 9 1 1 A 93 93 THR N N 182 114.813 113.559 1.254 1
1 1144 . 9 1 1 A 94 94 ARG H H 183 7.753 7.639 0.114 1
1 1145 . 9 1 1 A 94 94 ARG HA H 183 4.139 4.373 -0.234 1
1 1152 . 9 1 1 A 94 94 ARG C C 183 176.897 176.834 0.063 1
1 1153 . 9 1 1 A 94 94 ARG CA C 183 55.350 55.962 -0.612 1
1 1154 . 9 1 1 A 94 94 ARG CB C 183 30.930 31.326 -0.396 1
1 1157 . 9 1 1 A 94 94 ARG N N 183 120.101 117.803 2.298 1
1 1158 . 9 1 1 A 95 95 GLY H H 184 8.112 9.003 -0.891 1
1 1159 . 9 1 1 A 95 95 GLY HA2 H 184 3.838 3.882 -0.044 1
1 1160 . 9 1 1 A 95 95 GLY HA3 H 184 3.670 3.888 -0.218 1
1 1161 . 9 1 1 A 95 95 GLY C C 184 173.659 173.269 0.390 1
1 1162 . 9 1 1 A 95 95 GLY CA C 184 46.040 46.068 -0.028 1
1 1163 . 9 1 1 A 95 95 GLY N N 184 108.106 109.161 -1.055 1
1 1164 . 9 1 1 A 96 96 ASN H H 185 6.833 7.368 -0.535 1
1 1165 . 9 1 1 A 96 96 ASN HA H 185 4.944 4.932 0.012 1
1 1170 . 9 1 1 A 96 96 ASN C C 185 174.267 173.427 0.840 1
1 1171 . 9 1 1 A 96 96 ASN CA C 185 52.560 52.378 0.182 1
1 1172 . 9 1 1 A 96 96 ASN CB C 185 45.890 41.630 4.260 1
1 1173 . 9 1 1 A 96 96 ASN N N 185 113.392 116.523 -3.131 1
1 1175 . 9 1 1 A 97 97 PHE H H 186 9.108 8.574 0.534 1
1 1176 . 9 1 1 A 97 97 PHE HA H 186 4.782 4.880 -0.098 1
1 1183 . 9 1 1 A 97 97 PHE C C 186 174.862 175.763 -0.901 1
1 1184 . 9 1 1 A 97 97 PHE CA C 186 60.056 59.736 0.320 1
1 1185 . 9 1 1 A 97 97 PHE CB C 186 40.180 39.401 0.779 1
1 1188 . 9 1 1 A 97 97 PHE N N 186 118.741 119.453 -0.712 1
1 1189 . 9 1 1 A 98 98 ILE H H 187 8.933 8.646 0.287 1
1 1190 . 9 1 1 A 98 98 ILE HA H 187 5.458 4.995 0.463 1
1 1200 . 9 1 1 A 98 98 ILE C C 187 176.041 174.990 1.051 1
1 1201 . 9 1 1 A 98 98 ILE CA C 187 57.610 59.183 -1.573 1
1 1202 . 9 1 1 A 98 98 ILE CB C 187 42.070 42.333 -0.263 1
1 1206 . 9 1 1 A 98 98 ILE N N 187 117.857 118.781 -0.924 1
1 1207 . 9 1 1 A 99 99 ILE H H 188 8.284 8.718 -0.434 1
1 1208 . 9 1 1 A 99 99 ILE HA H 188 4.341 4.168 0.173 1
1 1218 . 9 1 1 A 99 99 ILE C C 188 176.413 176.434 -0.021 1
1 1219 . 9 1 1 A 99 99 ILE CA C 188 59.190 61.377 -2.187 1
1 1220 . 9 1 1 A 99 99 ILE CB C 188 37.940 38.135 -0.195 1
1 1224 . 9 1 1 A 99 99 ILE N N 188 121.796 122.923 -1.127 1
1 1225 . 9 1 1 A 100 100 LYS H H 189 8.463 8.043 0.420 1
1 1226 . 9 1 1 A 100 100 LYS HA H 189 4.040 4.229 -0.189 1
1 1235 . 9 1 1 A 100 100 LYS C C 189 176.848 177.294 -0.446 1
1 1236 . 9 1 1 A 100 100 LYS CA C 189 57.241 56.434 0.807 1
1 1237 . 9 1 1 A 100 100 LYS CB C 189 33.400 33.293 0.107 1
1 1241 . 9 1 1 A 100 100 LYS N N 189 127.995 124.451 3.544 1
1 1242 . 9 1 1 A 101 101 GLY H H 190 8.346 8.760 -0.414 1
1 1243 . 9 1 1 A 101 101 GLY HA2 H 190 3.947 3.948 -0.001 1
1 1244 . 9 1 1 A 101 101 GLY HA3 H 190 3.813 3.954 -0.141 1
1 1245 . 9 1 1 A 101 101 GLY C C 190 172.902 174.391 -1.489 1
1 1246 . 9 1 1 A 101 101 GLY CA C 190 44.920 46.863 -1.943 1
1 1247 . 9 1 1 A 101 101 GLY N N 190 110.882 110.190 0.692 1
1 7 . 10 1 1 A 2 2 GLN H H 91 8.786 8.172 0.614 1
1 8 . 10 1 1 A 2 2 GLN HA H 91 4.005 3.942 0.063 1
1 15 . 10 1 1 A 2 2 GLN C C 91 177.270 178.843 -1.573 1
1 16 . 10 1 1 A 2 2 GLN CA C 91 58.220 59.023 -0.803 1
1 17 . 10 1 1 A 2 2 GLN CB C 91 28.650 28.413 0.237 1
1 19 . 10 1 1 A 2 2 GLN N N 91 121.993 121.744 0.249 1
1 21 . 10 1 1 A 3 3 GLU H H 92 8.430 8.440 -0.010 1
1 22 . 10 1 1 A 3 3 GLU HA H 92 4.007 4.101 -0.094 1
1 27 . 10 1 1 A 3 3 GLU C C 92 178.287 178.762 -0.475 1
1 28 . 10 1 1 A 3 3 GLU CA C 92 59.490 59.152 0.338 1
1 29 . 10 1 1 A 3 3 GLU CB C 92 29.506 28.848 0.658 1
1 31 . 10 1 1 A 3 3 GLU N N 92 120.195 118.733 1.462 1
1 32 . 10 1 1 A 4 4 SER H H 93 8.209 8.166 0.043 1
1 33 . 10 1 1 A 4 4 SER HA H 93 4.272 4.211 0.061 1
1 36 . 10 1 1 A 4 4 SER C C 93 177.369 175.917 1.452 1
1 37 . 10 1 1 A 4 4 SER CA C 93 61.044 62.446 -1.402 1
1 38 . 10 1 1 A 4 4 SER CB C 93 62.950 63.024 -0.074 1
1 39 . 10 1 1 A 4 4 SER N N 93 115.524 118.174 -2.650 1
1 40 . 10 1 1 A 5 5 ILE H H 94 8.080 7.979 0.101 1
1 41 . 10 1 1 A 5 5 ILE HA H 94 3.530 3.609 -0.079 1
1 51 . 10 1 1 A 5 5 ILE C C 94 177.778 177.786 -0.008 1
1 52 . 10 1 1 A 5 5 ILE CA C 94 65.710 65.537 0.173 1
1 53 . 10 1 1 A 5 5 ILE CB C 94 37.800 37.904 -0.104 1
1 57 . 10 1 1 A 5 5 ILE N N 94 124.148 121.390 2.758 1
1 58 . 10 1 1 A 6 6 GLN H H 95 8.374 8.079 0.295 1
1 59 . 10 1 1 A 6 6 GLN HA H 95 4.125 4.159 -0.034 1
1 66 . 10 1 1 A 6 6 GLN C C 95 179.726 179.048 0.678 1
1 67 . 10 1 1 A 6 6 GLN CA C 95 59.190 58.944 0.246 1
1 68 . 10 1 1 A 6 6 GLN CB C 95 27.060 27.902 -0.842 1
1 70 . 10 1 1 A 6 6 GLN N N 95 118.257 118.225 0.032 1
1 72 . 10 1 1 A 7 7 ASN H H 96 8.456 7.965 0.491 1
1 73 . 10 1 1 A 7 7 ASN HA H 96 4.446 4.500 -0.054 1
1 78 . 10 1 1 A 7 7 ASN C C 96 177.257 178.287 -1.030 1
1 79 . 10 1 1 A 7 7 ASN CA C 96 56.020 56.067 -0.047 1
1 80 . 10 1 1 A 7 7 ASN CB C 96 38.126 37.850 0.276 1
1 81 . 10 1 1 A 7 7 ASN N N 96 118.597 118.821 -0.224 1
1 83 . 10 1 1 A 8 8 LYS H H 97 7.732 7.711 0.021 1
1 84 . 10 1 1 A 8 8 LYS HA H 97 4.129 4.072 0.057 1
1 93 . 10 1 1 A 8 8 LYS C C 97 179.143 179.332 -0.189 1
1 94 . 10 1 1 A 8 8 LYS CA C 97 59.126 59.264 -0.138 1
1 95 . 10 1 1 A 8 8 LYS CB C 97 32.070 32.135 -0.065 1
1 99 . 10 1 1 A 8 8 LYS N N 97 122.381 118.634 3.747 1
1 100 . 10 1 1 A 9 9 ILE H H 98 8.452 8.013 0.439 1
1 101 . 10 1 1 A 9 9 ILE HA H 98 3.480 3.720 -0.240 1
1 111 . 10 1 1 A 9 9 ILE C C 98 177.406 178.008 -0.602 1
1 112 . 10 1 1 A 9 9 ILE CA C 98 66.430 65.460 0.970 1
1 113 . 10 1 1 A 9 9 ILE CB C 98 37.980 37.861 0.119 1
1 117 . 10 1 1 A 9 9 ILE N N 98 119.950 121.098 -1.148 1
1 118 . 10 1 1 A 10 10 SER H H 99 7.924 7.989 -0.065 1
1 119 . 10 1 1 A 10 10 SER HA H 99 3.983 4.217 -0.234 1
1 122 . 10 1 1 A 10 10 SER C C 99 176.327 176.369 -0.042 1
1 123 . 10 1 1 A 10 10 SER CA C 99 61.990 61.858 0.132 1
1 124 . 10 1 1 A 10 10 SER CB C 99 62.790 62.920 -0.130 1
1 125 . 10 1 1 A 10 10 SER N N 99 113.568 115.845 -2.277 1
1 126 . 10 1 1 A 11 11 GLN H H 100 7.832 7.025 0.807 1
1 127 . 10 1 1 A 11 11 GLN HA H 100 4.238 4.171 0.067 1
1 134 . 10 1 1 A 11 11 GLN C C 100 178.088 178.199 -0.111 1
1 135 . 10 1 1 A 11 11 GLN CA C 100 57.900 58.125 -0.225 1
1 136 . 10 1 1 A 11 11 GLN CB C 100 29.790 28.791 0.999 1
1 138 . 10 1 1 A 11 11 GLN N N 100 117.487 120.213 -2.726 1
1 140 . 10 1 1 A 12 12 CYS H H 101 7.920 8.106 -0.186 1
1 141 . 10 1 1 A 12 12 CYS HA H 101 4.657 4.557 0.100 1
1 144 . 10 1 1 A 12 12 CYS C C 101 175.446 174.909 0.537 1
1 145 . 10 1 1 A 12 12 CYS CA C 101 60.654 61.176 -0.522 1
1 146 . 10 1 1 A 12 12 CYS CB C 101 29.310 28.038 1.272 1
1 147 . 10 1 1 A 12 12 CYS N N 101 114.221 117.232 -3.011 1
1 148 . 10 1 1 A 13 13 LYS H H 102 8.029 7.336 0.693 1
1 149 . 10 1 1 A 13 13 LYS HA H 102 5.069 4.703 0.366 1
1 158 . 10 1 1 A 13 13 LYS C C 102 174.800 176.339 -1.539 1
1 159 . 10 1 1 A 13 13 LYS CA C 102 56.394 56.117 0.277 1
1 160 . 10 1 1 A 13 13 LYS CB C 102 32.770 33.337 -0.567 1
1 164 . 10 1 1 A 13 13 LYS N N 102 124.129 119.246 4.883 1
1 165 . 10 1 1 A 14 14 PHE H H 103 8.737 8.639 0.098 1
1 166 . 10 1 1 A 14 14 PHE HA H 103 5.059 5.047 0.012 1
1 174 . 10 1 1 A 14 14 PHE C C 103 173.560 173.140 0.420 1
1 175 . 10 1 1 A 14 14 PHE CA C 103 55.470 56.087 -0.617 1
1 176 . 10 1 1 A 14 14 PHE CB C 103 41.760 41.097 0.663 1
1 180 . 10 1 1 A 14 14 PHE N N 103 118.661 116.453 2.208 1
1 181 . 10 1 1 A 15 15 SER H H 104 8.826 8.832 -0.006 1
1 182 . 10 1 1 A 15 15 SER HA H 104 4.602 4.436 0.166 1
1 185 . 10 1 1 A 15 15 SER C C 104 173.795 173.504 0.291 1
1 186 . 10 1 1 A 15 15 SER CA C 104 58.610 58.965 -0.355 1
1 187 . 10 1 1 A 15 15 SER CB C 104 62.690 62.768 -0.078 1
1 188 . 10 1 1 A 15 15 SER N N 104 117.781 116.886 0.895 1
1 189 . 10 1 1 A 16 16 VAL H H 105 7.784 8.147 -0.363 1
1 190 . 10 1 1 A 16 16 VAL HA H 105 3.370 4.151 -0.781 1
1 198 . 10 1 1 A 16 16 VAL C C 105 174.987 175.321 -0.334 1
1 199 . 10 1 1 A 16 16 VAL CA C 105 63.580 62.667 0.913 1
1 200 . 10 1 1 A 16 16 VAL CB C 105 31.410 30.652 0.758 1
1 203 . 10 1 1 A 16 16 VAL N N 105 129.075 126.633 2.442 1
1 204 . 10 1 1 A 17 17 CYS H H 106 8.536 8.325 0.211 1
1 205 . 10 1 1 A 17 17 CYS HA H 106 5.011 4.923 0.088 1
1 208 . 10 1 1 A 17 17 CYS CA C 106 55.260 56.484 -1.224 1
1 209 . 10 1 1 A 17 17 CYS CB C 106 28.210 28.457 -0.247 1
1 210 . 10 1 1 A 17 17 CYS N N 106 130.045 127.201 2.844 1
1 211 . 10 1 1 A 18 18 PRO HA H 107 3.991 4.359 -0.368 1
1 218 . 10 1 1 A 18 18 PRO C C 107 178.188 178.241 -0.053 1
1 219 . 10 1 1 A 18 18 PRO CA C 107 65.940 64.747 1.193 1
1 220 . 10 1 1 A 18 18 PRO CB C 107 32.000 32.205 -0.205 1
1 223 . 10 1 1 A 19 19 GLU H H 108 9.260 9.078 0.182 1
1 224 . 10 1 1 A 19 19 GLU HA H 108 4.119 4.067 0.052 1
1 229 . 10 1 1 A 19 19 GLU C C 108 178.721 178.726 -0.005 1
1 230 . 10 1 1 A 19 19 GLU CA C 108 59.300 59.573 -0.273 1
1 231 . 10 1 1 A 19 19 GLU CB C 108 28.920 28.707 0.213 1
1 233 . 10 1 1 A 19 19 GLU N N 108 118.270 116.387 1.883 1
1 234 . 10 1 1 A 20 20 ARG H H 109 7.672 7.616 0.056 1
1 235 . 10 1 1 A 20 20 ARG HA H 109 4.331 4.120 0.211 1
1 242 . 10 1 1 A 20 20 ARG C C 109 177.977 178.721 -0.744 1
1 243 . 10 1 1 A 20 20 ARG CA C 109 57.350 58.419 -1.069 1
1 244 . 10 1 1 A 20 20 ARG CB C 109 30.820 30.291 0.529 1
1 247 . 10 1 1 A 20 20 ARG N N 109 118.357 120.010 -1.653 1
1 248 . 10 1 1 A 21 21 LEU H H 110 7.601 7.784 -0.183 1
1 249 . 10 1 1 A 21 21 LEU HA H 110 4.380 4.253 0.127 1
1 259 . 10 1 1 A 21 21 LEU C C 110 176.562 176.479 0.083 1
1 260 . 10 1 1 A 21 21 LEU CA C 110 56.096 55.946 0.150 1
1 261 . 10 1 1 A 21 21 LEU CB C 110 44.016 42.257 1.759 1
1 265 . 10 1 1 A 21 21 LEU N N 110 118.626 118.577 0.049 1
1 266 . 10 1 1 A 22 22 GLN H H 111 7.750 7.557 0.193 1
1 267 . 10 1 1 A 22 22 GLN HA H 111 3.870 3.951 -0.081 1
1 274 . 10 1 1 A 22 22 GLN C C 111 173.336 174.803 -1.467 1
1 275 . 10 1 1 A 22 22 GLN CA C 111 56.510 57.364 -0.854 1
1 276 . 10 1 1 A 22 22 GLN CB C 111 26.800 26.743 0.057 1
1 278 . 10 1 1 A 22 22 GLN N N 111 113.926 115.424 -1.498 1
1 280 . 10 1 1 A 23 23 CYS H H 112 7.407 7.836 -0.429 1
1 281 . 10 1 1 A 23 23 CYS HA H 112 4.469 4.669 -0.200 1
1 284 . 10 1 1 A 23 23 CYS CA C 112 52.650 57.844 -5.194 1
1 285 . 10 1 1 A 23 23 CYS CB C 112 29.750 28.464 1.286 1
1 286 . 10 1 1 A 23 23 CYS N N 112 112.681 118.328 -5.647 1
1 287 . 10 1 1 A 24 24 PRO HA H 113 4.408 4.534 -0.126 1
1 294 . 10 1 1 A 24 24 PRO C C 113 178.175 177.666 0.509 1
1 295 . 10 1 1 A 24 24 PRO CA C 113 62.040 62.845 -0.805 1
1 296 . 10 1 1 A 24 24 PRO CB C 113 31.920 32.599 -0.679 1
1 299 . 10 1 1 A 25 25 LEU H H 114 8.593 8.461 0.132 1
1 300 . 10 1 1 A 25 25 LEU HA H 114 3.765 3.903 -0.138 1
1 310 . 10 1 1 A 25 25 LEU C C 114 179.950 178.858 1.092 1
1 311 . 10 1 1 A 25 25 LEU CA C 114 57.674 57.922 -0.248 1
1 312 . 10 1 1 A 25 25 LEU CB C 114 40.690 41.520 -0.830 1
1 316 . 10 1 1 A 25 25 LEU N N 114 123.729 123.673 0.056 1
1 317 . 10 1 1 A 26 26 GLU H H 115 9.108 8.578 0.530 1
1 318 . 10 1 1 A 26 26 GLU HA H 115 3.876 4.023 -0.147 1
1 323 . 10 1 1 A 26 26 GLU C C 115 177.505 178.635 -1.130 1
1 324 . 10 1 1 A 26 26 GLU CA C 115 59.410 59.260 0.150 1
1 325 . 10 1 1 A 26 26 GLU CB C 115 28.460 29.366 -0.906 1
1 327 . 10 1 1 A 26 26 GLU N N 115 116.817 117.584 -0.767 1
1 328 . 10 1 1 A 27 27 ALA H H 116 7.360 7.505 -0.145 1
1 329 . 10 1 1 A 27 27 ALA HA H 116 4.408 4.121 0.287 1
1 333 . 10 1 1 A 27 27 ALA C C 116 177.046 178.013 -0.967 1
1 334 . 10 1 1 A 27 27 ALA CA C 116 52.970 54.527 -1.557 1
1 335 . 10 1 1 A 27 27 ALA CB C 116 19.916 18.424 1.492 1
1 336 . 10 1 1 A 27 27 ALA N N 116 118.966 121.499 -2.533 1
1 337 . 10 1 1 A 28 28 ILE H H 117 7.168 7.064 0.104 1
1 338 . 10 1 1 A 28 28 ILE HA H 117 4.432 4.403 0.029 1
1 348 . 10 1 1 A 28 28 ILE C C 117 172.641 175.564 -2.923 1
1 349 . 10 1 1 A 28 28 ILE CA C 117 59.980 59.957 0.023 1
1 350 . 10 1 1 A 28 28 ILE CB C 117 37.350 37.798 -0.448 1
1 354 . 10 1 1 A 28 28 ILE N N 117 108.913 108.653 0.260 1
1 355 . 10 1 1 A 29 29 GLN H H 118 6.562 7.175 -0.613 1
1 356 . 10 1 1 A 29 29 GLN HA H 118 3.922 4.051 -0.129 1
1 363 . 10 1 1 A 29 29 GLN C C 118 175.049 175.389 -0.340 1
1 364 . 10 1 1 A 29 29 GLN CA C 118 54.596 56.539 -1.943 1
1 365 . 10 1 1 A 29 29 GLN CB C 118 29.570 28.950 0.620 1
1 367 . 10 1 1 A 29 29 GLN N N 118 116.455 123.437 -6.982 1
1 369 . 10 1 1 A 30 30 CYS H H 119 8.138 8.536 -0.398 1
1 370 . 10 1 1 A 30 30 CYS HA H 119 4.580 4.528 0.052 1
1 373 . 10 1 1 A 30 30 CYS CA C 119 57.810 57.466 0.344 1
1 374 . 10 1 1 A 30 30 CYS CB C 119 30.200 28.746 1.454 1
1 375 . 10 1 1 A 30 30 CYS N N 119 134.136 125.344 8.792 1
1 376 . 10 1 1 A 31 31 PRO HA H 120 4.424 4.432 -0.008 1
1 383 . 10 1 1 A 31 31 PRO C C 120 177.431 177.551 -0.120 1
1 384 . 10 1 1 A 31 31 PRO CA C 120 64.060 64.104 -0.044 1
1 385 . 10 1 1 A 31 31 PRO CB C 120 32.776 31.816 0.960 1
1 388 . 10 1 1 A 32 32 ILE H H 121 11.318 7.761 3.557 1
1 389 . 10 1 1 A 32 32 ILE HA H 121 4.038 3.985 0.053 1
1 399 . 10 1 1 A 32 32 ILE C C 121 178.485 177.830 0.655 1
1 400 . 10 1 1 A 32 32 ILE CA C 121 64.060 64.082 -0.022 1
1 401 . 10 1 1 A 32 32 ILE CB C 121 39.340 38.443 0.897 1
1 405 . 10 1 1 A 32 32 ILE N N 121 124.500 117.271 7.229 1
1 406 . 10 1 1 A 33 33 THR H H 122 9.928 7.288 2.640 1
1 407 . 10 1 1 A 33 33 THR HA H 122 4.048 4.356 -0.308 1
1 412 . 10 1 1 A 33 33 THR C C 122 175.793 174.490 1.303 1
1 413 . 10 1 1 A 33 33 THR CA C 122 62.990 61.763 1.227 1
1 414 . 10 1 1 A 33 33 THR CB C 122 70.300 70.069 0.231 1
1 416 . 10 1 1 A 33 33 THR N N 122 115.136 109.248 5.888 1
1 417 . 10 1 1 A 34 34 LEU H H 123 8.439 7.762 0.677 1
1 418 . 10 1 1 A 34 34 LEU HA H 123 3.912 3.793 0.119 1
1 428 . 10 1 1 A 34 34 LEU C C 123 175.495 175.243 0.252 1
1 429 . 10 1 1 A 34 34 LEU CA C 123 56.290 56.035 0.255 1
1 430 . 10 1 1 A 34 34 LEU CB C 123 38.500 39.999 -1.499 1
1 434 . 10 1 1 A 34 34 LEU N N 123 117.230 119.218 -1.988 1
1 435 . 10 1 1 A 35 35 GLU H H 124 7.816 7.000 0.816 1
1 436 . 10 1 1 A 35 35 GLU HA H 124 4.634 4.708 -0.074 1
1 441 . 10 1 1 A 35 35 GLU C C 124 174.838 173.944 0.894 1
1 442 . 10 1 1 A 35 35 GLU CA C 124 53.780 54.853 -1.073 1
1 443 . 10 1 1 A 35 35 GLU CB C 124 33.710 31.972 1.738 1
1 445 . 10 1 1 A 35 35 GLU N N 124 116.577 114.263 2.314 1
1 446 . 10 1 1 A 36 36 GLN H H 125 8.532 8.559 -0.027 1
1 447 . 10 1 1 A 36 36 GLN HA H 125 4.958 4.422 0.536 1
1 454 . 10 1 1 A 36 36 GLN CA C 125 53.350 53.507 -0.157 1
1 455 . 10 1 1 A 36 36 GLN CB C 125 29.950 29.330 0.620 1
1 457 . 10 1 1 A 36 36 GLN N N 125 123.034 122.991 0.043 1
1 459 . 10 1 1 A 37 37 PRO HA H 126 4.458 4.599 -0.141 1
1 466 . 10 1 1 A 37 37 PRO C C 126 176.314 177.165 -0.851 1
1 467 . 10 1 1 A 37 37 PRO CA C 126 62.816 62.535 0.281 1
1 468 . 10 1 1 A 37 37 PRO CB C 126 33.070 32.585 0.485 1
1 471 . 10 1 1 A 38 38 GLU H H 127 8.626 8.382 0.244 1
1 472 . 10 1 1 A 38 38 GLU HA H 127 4.274 4.147 0.127 1
1 477 . 10 1 1 A 38 38 GLU C C 127 177.877 176.503 1.374 1
1 478 . 10 1 1 A 38 38 GLU CA C 127 58.730 58.246 0.484 1
1 479 . 10 1 1 A 38 38 GLU CB C 127 30.340 30.128 0.212 1
1 481 . 10 1 1 A 38 38 GLU N N 127 120.691 119.262 1.429 1
1 482 . 10 1 1 A 39 39 LYS H H 128 7.861 7.661 0.200 1
1 483 . 10 1 1 A 39 39 LYS HA H 128 4.889 4.772 0.117 1
1 492 . 10 1 1 A 39 39 LYS C C 128 175.446 174.756 0.690 1
1 493 . 10 1 1 A 39 39 LYS CA C 128 53.670 54.572 -0.902 1
1 494 . 10 1 1 A 39 39 LYS CB C 128 33.630 35.936 -2.306 1
1 498 . 10 1 1 A 39 39 LYS N N 128 117.878 116.813 1.065 1
1 499 . 10 1 1 A 40 40 GLY H H 129 8.426 7.969 0.457 1
1 500 . 10 1 1 A 40 40 GLY HA2 H 129 4.970 3.951 1.019 1
1 501 . 10 1 1 A 40 40 GLY HA3 H 129 2.458 4.115 -1.657 1
1 502 . 10 1 1 A 40 40 GLY C C 129 170.048 172.179 -2.131 1
1 503 . 10 1 1 A 40 40 GLY CA C 129 42.910 44.934 -2.024 1
1 504 . 10 1 1 A 40 40 GLY N N 129 112.604 105.501 7.103 1
1 505 . 10 1 1 A 41 41 ILE H H 130 8.596 9.066 -0.470 1
1 506 . 10 1 1 A 41 41 ILE HA H 130 4.636 5.097 -0.461 1
1 516 . 10 1 1 A 41 41 ILE C C 130 172.691 174.038 -1.347 1
1 517 . 10 1 1 A 41 41 ILE CA C 130 58.500 58.725 -0.225 1
1 518 . 10 1 1 A 41 41 ILE CB C 130 43.320 41.205 2.115 1
1 522 . 10 1 1 A 41 41 ILE N N 130 113.363 116.857 -3.494 1
1 523 . 10 1 1 A 42 42 PHE H H 131 8.994 8.846 0.148 1
1 524 . 10 1 1 A 42 42 PHE HA H 131 5.075 5.518 -0.443 1
1 532 . 10 1 1 A 42 42 PHE C C 131 175.111 174.594 0.517 1
1 533 . 10 1 1 A 42 42 PHE CA C 131 58.680 56.851 1.829 1
1 534 . 10 1 1 A 42 42 PHE CB C 131 42.220 40.851 1.369 1
1 538 . 10 1 1 A 42 42 PHE N N 131 125.156 120.019 5.137 1
1 539 . 10 1 1 A 43 43 VAL H H 132 8.399 9.194 -0.795 1
1 540 . 10 1 1 A 43 43 VAL HA H 132 4.920 4.704 0.216 1
1 548 . 10 1 1 A 43 43 VAL C C 132 178.175 175.085 3.090 1
1 549 . 10 1 1 A 43 43 VAL CA C 132 59.600 61.085 -1.485 1
1 550 . 10 1 1 A 43 43 VAL CB C 132 35.920 34.221 1.699 1
1 553 . 10 1 1 A 43 43 VAL N N 132 119.371 122.991 -3.620 1
1 554 . 10 1 1 A 44 44 LYS H H 133 10.041 8.535 1.506 1
1 555 . 10 1 1 A 44 44 LYS HA H 133 4.920 4.448 0.472 1
1 564 . 10 1 1 A 44 44 LYS C C 133 177.195 175.913 1.282 1
1 565 . 10 1 1 A 44 44 LYS CA C 133 57.310 56.008 1.302 1
1 566 . 10 1 1 A 44 44 LYS CB C 133 34.410 32.139 2.271 1
1 570 . 10 1 1 A 44 44 LYS N N 133 130.928 126.404 4.524 1
1 571 . 10 1 1 A 45 45 ASN H H 134 8.534 9.186 -0.652 1
1 572 . 10 1 1 A 45 45 ASN HA H 134 4.151 4.851 -0.700 1
1 577 . 10 1 1 A 45 45 ASN C C 134 174.217 175.465 -1.248 1
1 578 . 10 1 1 A 45 45 ASN CA C 134 55.290 52.275 3.015 1
1 579 . 10 1 1 A 45 45 ASN CB C 134 37.530 36.398 1.132 1
1 580 . 10 1 1 A 45 45 ASN N N 134 119.452 124.476 -5.024 1
1 582 . 10 1 1 A 46 46 SER H H 135 7.570 8.080 -0.510 1
1 583 . 10 1 1 A 46 46 SER HA H 135 4.220 4.178 0.042 1
1 586 . 10 1 1 A 46 46 SER C C 135 174.490 176.462 -1.972 1
1 587 . 10 1 1 A 46 46 SER CA C 135 57.090 61.077 -3.987 1
1 588 . 10 1 1 A 46 46 SER CB C 135 64.126 63.060 1.066 1
1 589 . 10 1 1 A 46 46 SER N N 135 105.613 119.306 -13.693 1
1 590 . 10 1 1 A 47 47 ASP H H 136 9.113 8.036 1.077 1
1 591 . 10 1 1 A 47 47 ASP HA H 136 4.220 4.314 -0.094 1
1 594 . 10 1 1 A 47 47 ASP CA C 136 57.610 57.071 0.539 1
1 595 . 10 1 1 A 47 47 ASP CB C 136 40.810 40.416 0.394 1
1 596 . 10 1 1 A 47 47 ASP N N 136 120.995 121.440 -0.445 1
1 597 . 10 1 1 A 48 48 GLY H H 137 8.172 8.245 -0.073 1
1 598 . 10 1 1 A 48 48 GLY HA2 H 137 4.096 3.781 0.315 1
1 599 . 10 1 1 A 48 48 GLY HA3 H 137 3.664 3.790 -0.126 1
1 600 . 10 1 1 A 48 48 GLY C C 137 173.990 175.437 -1.447 1
1 601 . 10 1 1 A 48 48 GLY CA C 137 45.130 47.452 -2.322 1
1 602 . 10 1 1 A 48 48 GLY N N 137 105.838 107.642 -1.804 1
1 603 . 10 1 1 A 49 49 SER H H 138 7.252 7.676 -0.424 1
1 604 . 10 1 1 A 49 49 SER HA H 138 4.503 4.755 -0.252 1
1 607 . 10 1 1 A 49 49 SER C C 138 173.857 173.509 0.348 1
1 608 . 10 1 1 A 49 49 SER CA C 138 57.340 57.280 0.060 1
1 609 . 10 1 1 A 49 49 SER CB C 138 65.370 63.991 1.379 1
1 610 . 10 1 1 A 49 49 SER N N 138 114.942 112.149 2.793 1
1 611 . 10 1 1 A 50 50 ASP H H 139 8.276 8.200 0.076 1
1 612 . 10 1 1 A 50 50 ASP HA H 139 4.618 4.263 0.355 1
1 615 . 10 1 1 A 50 50 ASP C C 139 174.577 174.944 -0.367 1
1 616 . 10 1 1 A 50 50 ASP CA C 139 53.116 55.380 -2.264 1
1 617 . 10 1 1 A 50 50 ASP CB C 139 40.520 40.198 0.322 1
1 618 . 10 1 1 A 50 50 ASP N N 139 122.088 120.987 1.101 1
1 619 . 10 1 1 A 51 51 VAL H H 140 8.192 7.586 0.606 1
1 620 . 10 1 1 A 51 51 VAL HA H 140 4.299 4.228 0.071 1
1 628 . 10 1 1 A 51 51 VAL C C 140 175.867 174.950 0.917 1
1 629 . 10 1 1 A 51 51 VAL CA C 140 62.950 62.824 0.126 1
1 630 . 10 1 1 A 51 51 VAL CB C 140 33.230 31.603 1.627 1
1 632 . 10 1 1 A 51 51 VAL N N 140 121.167 119.527 1.640 1
1 633 . 10 1 1 A 52 52 CYS H H 141 8.391 8.887 -0.496 1
1 634 . 10 1 1 A 52 52 CYS HA H 141 5.247 5.302 -0.055 1
1 637 . 10 1 1 A 52 52 CYS C C 141 172.778 174.899 -2.121 1
1 638 . 10 1 1 A 52 52 CYS CA C 141 56.480 58.020 -1.540 1
1 639 . 10 1 1 A 52 52 CYS CB C 141 31.960 28.692 3.268 1
1 640 . 10 1 1 A 52 52 CYS N N 141 121.884 127.195 -5.311 1
1 641 . 10 1 1 A 53 53 THR H H 142 8.777 9.040 -0.263 1
1 642 . 10 1 1 A 53 53 THR HA H 142 4.489 4.930 -0.441 1
1 648 . 10 1 1 A 53 53 THR C C 142 171.885 172.522 -0.637 1
1 649 . 10 1 1 A 53 53 THR CA C 142 62.070 61.404 0.666 1
1 650 . 10 1 1 A 53 53 THR CB C 142 71.390 71.397 -0.007 1
1 652 . 10 1 1 A 53 53 THR N N 142 118.132 120.023 -1.891 1
1 653 . 10 1 1 A 54 54 LEU H H 143 8.409 8.399 0.010 1
1 654 . 10 1 1 A 54 54 LEU HA H 143 4.276 4.582 -0.306 1
1 664 . 10 1 1 A 54 54 LEU C C 143 174.366 174.137 0.229 1
1 665 . 10 1 1 A 54 54 LEU CA C 143 54.330 53.346 0.984 1
1 666 . 10 1 1 A 54 54 LEU CB C 143 42.396 42.854 -0.458 1
1 670 . 10 1 1 A 54 54 LEU N N 143 127.980 128.316 -0.336 1
1 671 . 10 1 1 A 55 55 PHE H H 144 8.646 8.529 0.117 1
1 672 . 10 1 1 A 55 55 PHE HA H 144 5.455 4.837 0.618 1
1 680 . 10 1 1 A 55 55 PHE C C 144 176.054 175.124 0.930 1
1 681 . 10 1 1 A 55 55 PHE CA C 144 55.250 57.119 -1.869 1
1 682 . 10 1 1 A 55 55 PHE CB C 144 44.100 40.811 3.289 1
1 686 . 10 1 1 A 55 55 PHE N N 144 122.010 126.857 -4.847 1
1 687 . 10 1 1 A 56 56 ASP H H 145 11.575 8.263 3.312 1
1 688 . 10 1 1 A 56 56 ASP HA H 145 4.416 4.533 -0.117 1
1 691 . 10 1 1 A 56 56 ASP C C 145 176.748 177.484 -0.736 1
1 692 . 10 1 1 A 56 56 ASP CA C 145 55.840 54.827 1.013 1
1 693 . 10 1 1 A 56 56 ASP CB C 145 44.390 42.189 2.201 1
1 694 . 10 1 1 A 56 56 ASP N N 145 121.936 124.280 -2.344 1
1 695 . 10 1 1 A 57 57 ALA H H 146 8.508 8.795 -0.287 1
1 696 . 10 1 1 A 57 57 ALA HA H 146 3.797 4.022 -0.225 1
1 700 . 10 1 1 A 57 57 ALA C C 146 178.696 179.672 -0.976 1
1 701 . 10 1 1 A 57 57 ALA CA C 146 55.990 55.413 0.577 1
1 702 . 10 1 1 A 57 57 ALA CB C 146 18.840 18.104 0.736 1
1 703 . 10 1 1 A 57 57 ALA N N 146 130.243 129.421 0.822 1
1 704 . 10 1 1 A 58 58 ALA H H 147 8.378 7.623 0.755 1
1 705 . 10 1 1 A 58 58 ALA HA H 147 4.078 4.180 -0.102 1
1 709 . 10 1 1 A 58 58 ALA C C 147 181.091 179.732 1.359 1
1 710 . 10 1 1 A 58 58 ALA CA C 147 54.770 54.345 0.425 1
1 711 . 10 1 1 A 58 58 ALA CB C 147 17.700 18.397 -0.697 1
1 712 . 10 1 1 A 58 58 ALA N N 147 121.997 119.603 2.394 1
1 713 . 10 1 1 A 59 59 ALA H H 148 9.138 7.790 1.348 1
1 714 . 10 1 1 A 59 59 ALA HA H 148 3.975 4.140 -0.165 1
1 718 . 10 1 1 A 59 59 ALA C C 148 180.508 179.796 0.712 1
1 719 . 10 1 1 A 59 59 ALA CA C 148 54.840 54.985 -0.145 1
1 720 . 10 1 1 A 59 59 ALA CB C 148 18.600 18.658 -0.058 1
1 721 . 10 1 1 A 59 59 ALA N N 148 123.595 119.886 3.709 1
1 722 . 10 1 1 A 60 60 PHE H H 149 8.814 8.171 0.643 1
1 723 . 10 1 1 A 60 60 PHE HA H 149 3.722 4.028 -0.306 1
1 731 . 10 1 1 A 60 60 PHE C C 149 176.773 177.455 -0.682 1
1 732 . 10 1 1 A 60 60 PHE CA C 149 62.030 61.487 0.543 1
1 733 . 10 1 1 A 60 60 PHE CB C 149 39.960 38.973 0.987 1
1 737 . 10 1 1 A 60 60 PHE N N 149 120.354 120.111 0.243 1
1 738 . 10 1 1 A 61 61 SER H H 150 8.276 8.084 0.192 1
1 739 . 10 1 1 A 61 61 SER HA H 150 3.880 4.114 -0.234 1
1 742 . 10 1 1 A 61 61 SER C C 150 177.691 177.184 0.507 1
1 743 . 10 1 1 A 61 61 SER CA C 150 62.190 61.407 0.783 1
1 744 . 10 1 1 A 61 61 SER CB C 150 63.016 63.123 -0.107 1
1 745 . 10 1 1 A 61 61 SER N N 150 112.086 114.005 -1.919 1
1 746 . 10 1 1 A 62 62 ARG H H 151 7.829 7.808 0.021 1
1 747 . 10 1 1 A 62 62 ARG HA H 151 3.971 4.042 -0.071 1
1 754 . 10 1 1 A 62 62 ARG C C 151 178.287 178.679 -0.392 1
1 755 . 10 1 1 A 62 62 ARG CA C 151 59.340 59.259 0.081 1
1 756 . 10 1 1 A 62 62 ARG CB C 151 29.760 29.784 -0.024 1
1 759 . 10 1 1 A 62 62 ARG N N 151 121.090 121.409 -0.319 1
1 760 . 10 1 1 A 63 63 LEU H H 152 7.390 7.611 -0.221 1
1 761 . 10 1 1 A 63 63 LEU HA H 152 3.791 3.939 -0.148 1
1 771 . 10 1 1 A 63 63 LEU C C 152 179.106 179.190 -0.084 1
1 772 . 10 1 1 A 63 63 LEU CA C 152 58.900 57.958 0.942 1
1 773 . 10 1 1 A 63 63 LEU CB C 152 41.140 41.571 -0.431 1
1 777 . 10 1 1 A 63 63 LEU N N 152 121.129 119.287 1.842 1
1 778 . 10 1 1 A 64 64 VAL H H 153 7.552 7.825 -0.273 1
1 779 . 10 1 1 A 64 64 VAL HA H 153 3.411 3.549 -0.138 1
1 787 . 10 1 1 A 64 64 VAL C C 153 180.595 178.464 2.131 1
1 788 . 10 1 1 A 64 64 VAL CA C 153 65.644 66.136 -0.492 1
1 789 . 10 1 1 A 64 64 VAL CB C 153 31.410 31.437 -0.027 1
1 792 . 10 1 1 A 64 64 VAL N N 153 118.280 119.177 -0.897 1
1 793 . 10 1 1 A 65 65 GLY H H 154 8.061 8.225 -0.164 1
1 794 . 10 1 1 A 65 65 GLY HA2 H 154 3.846 3.750 0.096 1
1 795 . 10 1 1 A 65 65 GLY HA3 H 154 3.809 3.752 0.057 1
1 796 . 10 1 1 A 65 65 GLY C C 154 175.235 175.597 -0.362 1
1 797 . 10 1 1 A 65 65 GLY CA C 154 46.630 46.982 -0.352 1
1 798 . 10 1 1 A 65 65 GLY N N 154 108.622 107.670 0.952 1
1 799 . 10 1 1 A 66 66 GLU H H 155 7.528 7.545 -0.017 1
1 800 . 10 1 1 A 66 66 GLU HA H 155 4.228 4.376 -0.148 1
1 805 . 10 1 1 A 66 66 GLU C C 155 176.761 176.986 -0.225 1
1 806 . 10 1 1 A 66 66 GLU CA C 155 56.590 56.182 0.408 1
1 807 . 10 1 1 A 66 66 GLU CB C 155 30.490 30.629 -0.139 1
1 809 . 10 1 1 A 66 66 GLU N N 155 118.361 118.835 -0.474 1
1 810 . 10 1 1 A 67 67 GLY H H 156 7.884 7.756 0.128 1
1 811 . 10 1 1 A 67 67 GLY HA2 H 156 3.918 3.858 0.060 1
1 812 . 10 1 1 A 67 67 GLY HA3 H 156 3.747 3.873 -0.126 1
1 813 . 10 1 1 A 67 67 GLY C C 156 174.788 174.625 0.163 1
1 814 . 10 1 1 A 67 67 GLY CA C 156 45.890 45.753 0.137 1
1 815 . 10 1 1 A 67 67 GLY N N 156 108.465 109.725 -1.260 1
1 816 . 10 1 1 A 68 68 LEU H H 157 7.332 7.927 -0.595 1
1 817 . 10 1 1 A 68 68 LEU HA H 157 4.361 4.400 -0.039 1
1 827 . 10 1 1 A 68 68 LEU CA C 157 53.060 52.777 0.283 1
1 828 . 10 1 1 A 68 68 LEU CB C 157 41.100 41.567 -0.467 1
1 832 . 10 1 1 A 68 68 LEU N N 157 121.920 121.948 -0.028 1
1 833 . 10 1 1 A 69 69 PRO HA H 158 4.485 4.553 -0.068 1
1 840 . 10 1 1 A 69 69 PRO C C 158 174.602 176.222 -1.620 1
1 841 . 10 1 1 A 69 69 PRO CA C 158 61.556 62.251 -0.695 1
1 842 . 10 1 1 A 69 69 PRO CB C 158 32.370 32.424 -0.054 1
1 845 . 10 1 1 A 70 70 HIS H H 159 8.759 8.630 0.129 1
1 846 . 10 1 1 A 70 70 HIS HA H 159 3.947 4.416 -0.469 1
1 852 . 10 1 1 A 70 70 HIS CA C 159 56.250 55.210 1.040 1
1 853 . 10 1 1 A 70 70 HIS CB C 159 32.280 30.909 1.371 1
1 856 . 10 1 1 A 70 70 HIS N N 159 119.423 120.852 -1.429 1
1 857 . 10 1 1 A 71 71 PRO HA H 160 4.424 4.424 0.000 1
1 864 . 10 1 1 A 71 71 PRO C C 160 177.567 178.067 -0.500 1
1 865 . 10 1 1 A 71 71 PRO CA C 160 64.574 64.506 0.068 1
1 866 . 10 1 1 A 71 71 PRO CB C 160 32.340 31.908 0.432 1
1 869 . 10 1 1 A 72 72 LEU H H 161 10.123 7.833 2.290 1
1 870 . 10 1 1 A 72 72 LEU HA H 161 4.778 4.355 0.423 1
1 880 . 10 1 1 A 72 72 LEU C C 161 178.721 178.035 0.686 1
1 881 . 10 1 1 A 72 72 LEU CA C 161 55.800 56.667 -0.867 1
1 882 . 10 1 1 A 72 72 LEU CB C 161 42.440 43.275 -0.835 1
1 886 . 10 1 1 A 72 72 LEU N N 161 117.374 117.389 -0.015 1
1 887 . 10 1 1 A 73 73 THR H H 162 7.523 7.946 -0.423 1
1 888 . 10 1 1 A 73 73 THR HA H 162 4.291 4.507 -0.216 1
1 893 . 10 1 1 A 73 73 THR C C 162 175.557 174.352 1.205 1
1 894 . 10 1 1 A 73 73 THR CA C 162 61.440 62.294 -0.854 1
1 895 . 10 1 1 A 73 73 THR CB C 162 70.500 69.751 0.749 1
1 897 . 10 1 1 A 73 73 THR N N 162 107.787 111.385 -3.598 1
1 898 . 10 1 1 A 74 74 ARG H H 163 8.361 7.845 0.516 1
1 899 . 10 1 1 A 74 74 ARG HA H 163 3.836 4.336 -0.500 1
1 906 . 10 1 1 A 74 74 ARG C C 163 174.701 175.299 -0.598 1
1 907 . 10 1 1 A 74 74 ARG CA C 163 57.980 57.538 0.442 1
1 908 . 10 1 1 A 74 74 ARG CB C 163 26.770 27.091 -0.321 1
1 911 . 10 1 1 A 74 74 ARG N N 163 115.130 118.423 -3.293 1
1 912 . 10 1 1 A 75 75 GLU H H 164 7.430 8.066 -0.636 1
1 913 . 10 1 1 A 75 75 GLU HA H 164 4.636 4.423 0.213 1
1 918 . 10 1 1 A 75 75 GLU CA C 164 53.699 55.249 -1.550 1
1 919 . 10 1 1 A 75 75 GLU CB C 164 29.550 28.753 0.797 1
1 921 . 10 1 1 A 75 75 GLU N N 164 120.076 118.884 1.192 1
1 922 . 10 1 1 A 76 76 PRO HA H 165 4.272 4.564 -0.292 1
1 929 . 10 1 1 A 76 76 PRO C C 165 176.649 176.909 -0.260 1
1 930 . 10 1 1 A 76 76 PRO CA C 165 63.204 63.037 0.167 1
1 931 . 10 1 1 A 76 76 PRO CB C 165 31.680 31.568 0.112 1
1 934 . 10 1 1 A 77 77 ILE H H 166 8.812 8.232 0.580 1
1 935 . 10 1 1 A 77 77 ILE HA H 166 3.838 4.282 -0.444 1
1 945 . 10 1 1 A 77 77 ILE C C 166 175.235 176.042 -0.807 1
1 946 . 10 1 1 A 77 77 ILE CA C 166 62.816 61.213 1.603 1
1 947 . 10 1 1 A 77 77 ILE CB C 166 37.750 36.995 0.755 1
1 951 . 10 1 1 A 77 77 ILE N N 166 123.831 124.378 -0.547 1
1 952 . 10 1 1 A 78 78 THR H H 167 6.625 8.661 -2.036 1
1 953 . 10 1 1 A 78 78 THR HA H 167 4.632 5.052 -0.420 1
1 958 . 10 1 1 A 78 78 THR C C 167 174.143 174.241 -0.098 1
1 959 . 10 1 1 A 78 78 THR CA C 167 58.750 60.123 -1.373 1
1 960 . 10 1 1 A 78 78 THR CB C 167 71.320 70.888 0.432 1
1 962 . 10 1 1 A 78 78 THR N N 167 115.293 119.007 -3.714 1
1 963 . 10 1 1 A 79 79 ALA H H 168 9.088 8.955 0.133 1
1 964 . 10 1 1 A 79 79 ALA HA H 168 3.916 4.227 -0.311 1
1 968 . 10 1 1 A 79 79 ALA C C 168 179.788 179.520 0.268 1
1 969 . 10 1 1 A 79 79 ALA CA C 168 55.480 54.328 1.152 1
1 970 . 10 1 1 A 79 79 ALA CB C 168 17.630 18.589 -0.959 1
1 971 . 10 1 1 A 79 79 ALA N N 168 122.102 127.614 -5.512 1
1 972 . 10 1 1 A 80 80 SER H H 169 7.988 7.739 0.249 1
1 973 . 10 1 1 A 80 80 SER HA H 169 4.058 4.215 -0.157 1
1 976 . 10 1 1 A 80 80 SER C C 169 176.029 176.033 -0.004 1
1 977 . 10 1 1 A 80 80 SER CA C 169 60.750 61.916 -1.166 1
1 978 . 10 1 1 A 80 80 SER CB C 169 62.510 63.164 -0.654 1
1 979 . 10 1 1 A 80 80 SER N N 169 109.541 114.715 -5.174 1
1 980 . 10 1 1 A 81 81 ILE H H 170 6.968 7.582 -0.614 1
1 981 . 10 1 1 A 81 81 ILE HA H 170 4.315 4.523 -0.208 1
1 991 . 10 1 1 A 81 81 ILE C C 170 174.242 175.438 -1.196 1
1 992 . 10 1 1 A 81 81 ILE CA C 170 62.296 61.016 1.280 1
1 993 . 10 1 1 A 81 81 ILE CB C 170 37.686 38.463 -0.777 1
1 997 . 10 1 1 A 81 81 ILE N N 170 112.476 112.329 0.147 1
1 998 . 10 1 1 A 82 82 ILE H H 171 7.345 7.513 -0.168 1
1 999 . 10 1 1 A 82 82 ILE HA H 171 4.339 4.469 -0.130 1
1 1009 . 10 1 1 A 82 82 ILE C C 171 174.999 174.492 0.507 1
1 1010 . 10 1 1 A 82 82 ILE CA C 171 61.150 60.750 0.400 1
1 1011 . 10 1 1 A 82 82 ILE CB C 171 37.230 39.846 -2.616 1
1 1015 . 10 1 1 A 82 82 ILE N N 171 124.260 124.932 -0.672 1
1 1016 . 10 1 1 A 83 83 VAL H H 172 7.923 8.981 -1.058 1
1 1017 . 10 1 1 A 83 83 VAL HA H 172 4.673 5.057 -0.384 1
1 1025 . 10 1 1 A 83 83 VAL C C 172 174.887 175.547 -0.660 1
1 1026 . 10 1 1 A 83 83 VAL CA C 172 59.340 58.831 0.509 1
1 1027 . 10 1 1 A 83 83 VAL CB C 172 34.840 35.576 -0.736 1
1 1030 . 10 1 1 A 83 83 VAL N N 172 120.931 122.118 -1.187 1
1 1031 . 10 1 1 A 84 84 LYS H H 173 8.406 8.444 -0.038 1
1 1032 . 10 1 1 A 84 84 LYS HA H 173 4.410 4.510 -0.100 1
1 1041 . 10 1 1 A 84 84 LYS C C 173 178.734 178.003 0.731 1
1 1042 . 10 1 1 A 84 84 LYS CA C 173 56.360 55.484 0.876 1
1 1043 . 10 1 1 A 84 84 LYS CB C 173 33.100 33.297 -0.197 1
1 1047 . 10 1 1 A 84 84 LYS N N 173 121.251 121.033 0.218 1
1 1048 . 10 1 1 A 85 85 HIS H H 174 9.221 8.965 0.256 1
1 1049 . 10 1 1 A 85 85 HIS HA H 174 4.024 4.541 -0.517 1
1 1053 . 10 1 1 A 85 85 HIS C C 174 177.183 176.904 0.279 1
1 1054 . 10 1 1 A 85 85 HIS CA C 174 59.460 59.097 0.363 1
1 1055 . 10 1 1 A 85 85 HIS CB C 174 27.920 29.412 -1.492 1
1 1057 . 10 1 1 A 85 85 HIS N N 174 121.545 121.095 0.450 1
1 1058 . 10 1 1 A 86 86 GLU H H 175 8.699 7.856 0.843 1
1 1059 . 10 1 1 A 86 86 GLU HA H 175 3.900 3.995 -0.095 1
1 1064 . 10 1 1 A 86 86 GLU C C 175 177.220 178.258 -1.038 1
1 1065 . 10 1 1 A 86 86 GLU CA C 175 58.420 58.936 -0.516 1
1 1066 . 10 1 1 A 86 86 GLU CB C 175 28.690 29.286 -0.596 1
1 1068 . 10 1 1 A 86 86 GLU N N 175 118.011 120.354 -2.343 1
1 1069 . 10 1 1 A 87 87 GLU H H 176 7.621 7.585 0.036 1
1 1070 . 10 1 1 A 87 87 GLU HA H 176 4.177 4.122 0.055 1
1 1075 . 10 1 1 A 87 87 GLU C C 176 175.222 176.002 -0.780 1
1 1076 . 10 1 1 A 87 87 GLU CA C 176 56.390 58.163 -1.773 1
1 1077 . 10 1 1 A 87 87 GLU CB C 176 30.430 30.441 -0.011 1
1 1079 . 10 1 1 A 87 87 GLU N N 176 116.753 117.949 -1.196 1
1 1080 . 10 1 1 A 88 88 CYS H H 177 7.239 7.308 -0.069 1
1 1081 . 10 1 1 A 88 88 CYS HA H 177 5.148 5.102 0.046 1
1 1084 . 10 1 1 A 88 88 CYS C C 177 173.249 172.601 0.648 1
1 1085 . 10 1 1 A 88 88 CYS CA C 177 57.240 56.688 0.552 1
1 1086 . 10 1 1 A 88 88 CYS CB C 177 31.020 31.060 -0.040 1
1 1087 . 10 1 1 A 88 88 CYS N N 177 116.096 115.520 0.576 1
1 1088 . 10 1 1 A 89 89 ILE H H 178 8.912 8.607 0.305 1
1 1089 . 10 1 1 A 89 89 ILE HA H 178 4.580 4.965 -0.385 1
1 1099 . 10 1 1 A 89 89 ILE C C 178 173.386 174.135 -0.749 1
1 1100 . 10 1 1 A 89 89 ILE CA C 178 59.270 59.098 0.172 1
1 1101 . 10 1 1 A 89 89 ILE CB C 178 42.990 41.930 1.060 1
1 1105 . 10 1 1 A 89 89 ILE N N 178 119.490 117.586 1.904 1
1 1106 . 10 1 1 A 90 90 TYR H H 179 9.047 8.607 0.440 1
1 1107 . 10 1 1 A 90 90 TYR HA H 179 3.753 4.011 -0.258 1
1 1112 . 10 1 1 A 90 90 TYR C C 179 173.932 173.990 -0.058 1
1 1113 . 10 1 1 A 90 90 TYR CA C 179 59.860 57.382 2.478 1
1 1114 . 10 1 1 A 90 90 TYR CB C 179 37.530 38.698 -1.168 1
1 1116 . 10 1 1 A 90 90 TYR N N 179 126.270 121.738 4.532 1
1 1117 . 10 1 1 A 91 91 ASP H H 180 7.462 8.113 -0.651 1
1 1118 . 10 1 1 A 91 91 ASP HA H 180 4.639 4.730 -0.091 1
1 1121 . 10 1 1 A 91 91 ASP C C 180 175.297 176.249 -0.952 1
1 1122 . 10 1 1 A 91 91 ASP CA C 180 52.496 52.880 -0.384 1
1 1123 . 10 1 1 A 91 91 ASP CB C 180 43.380 42.992 0.388 1
1 1124 . 10 1 1 A 91 91 ASP N N 180 129.593 124.438 5.155 1
1 1125 . 10 1 1 A 92 92 ASP H H 181 8.719 9.107 -0.388 1
1 1126 . 10 1 1 A 92 92 ASP HA H 181 4.109 4.340 -0.231 1
1 1129 . 10 1 1 A 92 92 ASP C C 181 177.555 177.581 -0.026 1
1 1130 . 10 1 1 A 92 92 ASP CA C 181 56.390 56.925 -0.535 1
1 1131 . 10 1 1 A 92 92 ASP CB C 181 41.330 41.065 0.265 1
1 1132 . 10 1 1 A 92 92 ASP N N 181 125.691 126.894 -1.203 1
1 1133 . 10 1 1 A 93 93 THR H H 182 8.271 7.595 0.676 1
1 1134 . 10 1 1 A 93 93 THR HA H 182 4.036 3.972 0.064 1
1 1139 . 10 1 1 A 93 93 THR C C 182 176.289 176.283 0.006 1
1 1140 . 10 1 1 A 93 93 THR CA C 182 65.054 64.899 0.155 1
1 1141 . 10 1 1 A 93 93 THR CB C 182 68.560 68.825 -0.265 1
1 1143 . 10 1 1 A 93 93 THR N N 182 114.813 113.742 1.071 1
1 1144 . 10 1 1 A 94 94 ARG H H 183 7.753 7.603 0.150 1
1 1145 . 10 1 1 A 94 94 ARG HA H 183 4.139 4.277 -0.138 1
1 1152 . 10 1 1 A 94 94 ARG C C 183 176.897 177.149 -0.252 1
1 1153 . 10 1 1 A 94 94 ARG CA C 183 55.350 56.344 -0.994 1
1 1154 . 10 1 1 A 94 94 ARG CB C 183 30.930 30.911 0.019 1
1 1157 . 10 1 1 A 94 94 ARG N N 183 120.101 117.889 2.212 1
1 1158 . 10 1 1 A 95 95 GLY H H 184 8.112 8.831 -0.719 1
1 1159 . 10 1 1 A 95 95 GLY HA2 H 184 3.838 3.884 -0.046 1
1 1160 . 10 1 1 A 95 95 GLY HA3 H 184 3.670 3.885 -0.215 1
1 1161 . 10 1 1 A 95 95 GLY C C 184 173.659 173.344 0.315 1
1 1162 . 10 1 1 A 95 95 GLY CA C 184 46.040 45.816 0.224 1
1 1163 . 10 1 1 A 95 95 GLY N N 184 108.106 108.802 -0.696 1
1 1164 . 10 1 1 A 96 96 ASN H H 185 6.833 7.458 -0.625 1
1 1165 . 10 1 1 A 96 96 ASN HA H 185 4.944 5.047 -0.103 1
1 1170 . 10 1 1 A 96 96 ASN C C 185 174.267 173.495 0.772 1
1 1171 . 10 1 1 A 96 96 ASN CA C 185 52.560 52.435 0.125 1
1 1172 . 10 1 1 A 96 96 ASN CB C 185 45.890 41.623 4.267 1
1 1173 . 10 1 1 A 96 96 ASN N N 185 113.392 116.674 -3.282 1
1 1175 . 10 1 1 A 97 97 PHE H H 186 9.108 8.790 0.318 1
1 1176 . 10 1 1 A 97 97 PHE HA H 186 4.782 4.869 -0.087 1
1 1183 . 10 1 1 A 97 97 PHE C C 186 174.862 175.699 -0.837 1
1 1184 . 10 1 1 A 97 97 PHE CA C 186 60.056 59.527 0.529 1
1 1185 . 10 1 1 A 97 97 PHE CB C 186 40.180 39.638 0.542 1
1 1188 . 10 1 1 A 97 97 PHE N N 186 118.741 119.431 -0.690 1
1 1189 . 10 1 1 A 98 98 ILE H H 187 8.933 8.718 0.215 1
1 1190 . 10 1 1 A 98 98 ILE HA H 187 5.458 5.042 0.416 1
1 1200 . 10 1 1 A 98 98 ILE C C 187 176.041 175.023 1.018 1
1 1201 . 10 1 1 A 98 98 ILE CA C 187 57.610 59.140 -1.530 1
1 1202 . 10 1 1 A 98 98 ILE CB C 187 42.070 42.047 0.023 1
1 1206 . 10 1 1 A 98 98 ILE N N 187 117.857 118.124 -0.267 1
1 1207 . 10 1 1 A 99 99 ILE H H 188 8.284 8.468 -0.184 1
1 1208 . 10 1 1 A 99 99 ILE HA H 188 4.341 4.144 0.197 1
1 1218 . 10 1 1 A 99 99 ILE C C 188 176.413 176.534 -0.121 1
1 1219 . 10 1 1 A 99 99 ILE CA C 188 59.190 61.359 -2.169 1
1 1220 . 10 1 1 A 99 99 ILE CB C 188 37.940 38.278 -0.338 1
1 1224 . 10 1 1 A 99 99 ILE N N 188 121.796 122.417 -0.621 1
1 1225 . 10 1 1 A 100 100 LYS H H 189 8.463 8.555 -0.092 1
1 1226 . 10 1 1 A 100 100 LYS HA H 189 4.040 4.329 -0.289 1
1 1235 . 10 1 1 A 100 100 LYS C C 189 176.848 177.890 -1.042 1
1 1236 . 10 1 1 A 100 100 LYS CA C 189 57.241 55.811 1.430 1
1 1237 . 10 1 1 A 100 100 LYS CB C 189 33.400 33.107 0.293 1
1 1241 . 10 1 1 A 100 100 LYS N N 189 127.995 124.411 3.584 1
1 1242 . 10 1 1 A 101 101 GLY H H 190 8.346 8.420 -0.074 1
1 1243 . 10 1 1 A 101 101 GLY HA2 H 190 3.947 3.802 0.145 1
1 1244 . 10 1 1 A 101 101 GLY HA3 H 190 3.813 3.807 0.006 1
1 1245 . 10 1 1 A 101 101 GLY C C 190 172.902 174.260 -1.358 1
1 1246 . 10 1 1 A 101 101 GLY CA C 190 44.920 46.583 -1.663 1
1 1247 . 10 1 1 A 101 101 GLY N N 190 110.882 111.322 -0.440 1
1 7 . 11 1 1 A 2 2 GLN H H 91 8.786 8.514 0.272 1
1 8 . 11 1 1 A 2 2 GLN HA H 91 4.005 3.971 0.034 1
1 15 . 11 1 1 A 2 2 GLN C C 91 177.270 178.285 -1.015 1
1 16 . 11 1 1 A 2 2 GLN CA C 91 58.220 59.080 -0.860 1
1 17 . 11 1 1 A 2 2 GLN CB C 91 28.650 28.056 0.594 1
1 19 . 11 1 1 A 2 2 GLN N N 91 121.993 120.644 1.349 1
1 21 . 11 1 1 A 3 3 GLU H H 92 8.430 8.316 0.114 1
1 22 . 11 1 1 A 3 3 GLU HA H 92 4.007 4.111 -0.104 1
1 27 . 11 1 1 A 3 3 GLU C C 92 178.287 179.125 -0.838 1
1 28 . 11 1 1 A 3 3 GLU CA C 92 59.490 59.295 0.195 1
1 29 . 11 1 1 A 3 3 GLU CB C 92 29.506 29.294 0.212 1
1 31 . 11 1 1 A 3 3 GLU N N 92 120.195 118.502 1.693 1
1 32 . 11 1 1 A 4 4 SER H H 93 8.209 7.761 0.448 1
1 33 . 11 1 1 A 4 4 SER HA H 93 4.272 4.266 0.006 1
1 36 . 11 1 1 A 4 4 SER C C 93 177.369 177.500 -0.131 1
1 37 . 11 1 1 A 4 4 SER CA C 93 61.044 61.404 -0.360 1
1 38 . 11 1 1 A 4 4 SER CB C 93 62.950 62.816 0.134 1
1 39 . 11 1 1 A 4 4 SER N N 93 115.524 114.936 0.588 1
1 40 . 11 1 1 A 5 5 ILE H H 94 8.080 7.519 0.561 1
1 41 . 11 1 1 A 5 5 ILE HA H 94 3.530 3.606 -0.076 1
1 51 . 11 1 1 A 5 5 ILE C C 94 177.778 177.602 0.176 1
1 52 . 11 1 1 A 5 5 ILE CA C 94 65.710 65.303 0.407 1
1 53 . 11 1 1 A 5 5 ILE CB C 94 37.800 37.441 0.359 1
1 57 . 11 1 1 A 5 5 ILE N N 94 124.148 121.905 2.243 1
1 58 . 11 1 1 A 6 6 GLN H H 95 8.374 8.329 0.045 1
1 59 . 11 1 1 A 6 6 GLN HA H 95 4.125 3.944 0.181 1
1 66 . 11 1 1 A 6 6 GLN C C 95 179.726 179.284 0.442 1
1 67 . 11 1 1 A 6 6 GLN CA C 95 59.190 59.074 0.116 1
1 68 . 11 1 1 A 6 6 GLN CB C 95 27.060 28.742 -1.682 1
1 70 . 11 1 1 A 6 6 GLN N N 95 118.257 118.861 -0.604 1
1 72 . 11 1 1 A 7 7 ASN H H 96 8.456 7.881 0.575 1
1 73 . 11 1 1 A 7 7 ASN HA H 96 4.446 4.548 -0.102 1
1 78 . 11 1 1 A 7 7 ASN C C 96 177.257 178.496 -1.239 1
1 79 . 11 1 1 A 7 7 ASN CA C 96 56.020 56.081 -0.061 1
1 80 . 11 1 1 A 7 7 ASN CB C 96 38.126 37.800 0.326 1
1 81 . 11 1 1 A 7 7 ASN N N 96 118.597 118.465 0.132 1
1 83 . 11 1 1 A 8 8 LYS H H 97 7.732 7.751 -0.019 1
1 84 . 11 1 1 A 8 8 LYS HA H 97 4.129 4.046 0.083 1
1 93 . 11 1 1 A 8 8 LYS C C 97 179.143 179.461 -0.318 1
1 94 . 11 1 1 A 8 8 LYS CA C 97 59.126 59.513 -0.387 1
1 95 . 11 1 1 A 8 8 LYS CB C 97 32.070 32.521 -0.451 1
1 99 . 11 1 1 A 8 8 LYS N N 97 122.381 118.809 3.572 1
1 100 . 11 1 1 A 9 9 ILE H H 98 8.452 8.097 0.355 1
1 101 . 11 1 1 A 9 9 ILE HA H 98 3.480 3.779 -0.299 1
1 111 . 11 1 1 A 9 9 ILE C C 98 177.406 178.277 -0.871 1
1 112 . 11 1 1 A 9 9 ILE CA C 98 66.430 65.195 1.235 1
1 113 . 11 1 1 A 9 9 ILE CB C 98 37.980 37.729 0.251 1
1 117 . 11 1 1 A 9 9 ILE N N 98 119.950 120.918 -0.968 1
1 118 . 11 1 1 A 10 10 SER H H 99 7.924 7.859 0.065 1
1 119 . 11 1 1 A 10 10 SER HA H 99 3.983 4.144 -0.161 1
1 122 . 11 1 1 A 10 10 SER C C 99 176.327 176.871 -0.544 1
1 123 . 11 1 1 A 10 10 SER CA C 99 61.990 61.451 0.539 1
1 124 . 11 1 1 A 10 10 SER CB C 99 62.790 62.995 -0.205 1
1 125 . 11 1 1 A 10 10 SER N N 99 113.568 116.137 -2.569 1
1 126 . 11 1 1 A 11 11 GLN H H 100 7.832 7.715 0.117 1
1 127 . 11 1 1 A 11 11 GLN HA H 100 4.238 4.194 0.044 1
1 134 . 11 1 1 A 11 11 GLN C C 100 178.088 176.788 1.300 1
1 135 . 11 1 1 A 11 11 GLN CA C 100 57.900 58.180 -0.280 1
1 136 . 11 1 1 A 11 11 GLN CB C 100 29.790 27.996 1.794 1
1 138 . 11 1 1 A 11 11 GLN N N 100 117.487 120.360 -2.873 1
1 140 . 11 1 1 A 12 12 CYS H H 101 7.920 7.790 0.130 1
1 141 . 11 1 1 A 12 12 CYS HA H 101 4.657 4.670 -0.013 1
1 144 . 11 1 1 A 12 12 CYS C C 101 175.446 174.707 0.739 1
1 145 . 11 1 1 A 12 12 CYS CA C 101 60.654 58.783 1.871 1
1 146 . 11 1 1 A 12 12 CYS CB C 101 29.310 28.519 0.791 1
1 147 . 11 1 1 A 12 12 CYS N N 101 114.221 116.396 -2.175 1
1 148 . 11 1 1 A 13 13 LYS H H 102 8.029 7.330 0.699 1
1 149 . 11 1 1 A 13 13 LYS HA H 102 5.069 4.764 0.305 1
1 158 . 11 1 1 A 13 13 LYS C C 102 174.800 176.218 -1.418 1
1 159 . 11 1 1 A 13 13 LYS CA C 102 56.394 56.032 0.362 1
1 160 . 11 1 1 A 13 13 LYS CB C 102 32.770 33.473 -0.703 1
1 164 . 11 1 1 A 13 13 LYS N N 102 124.129 119.312 4.817 1
1 165 . 11 1 1 A 14 14 PHE H H 103 8.737 8.568 0.169 1
1 166 . 11 1 1 A 14 14 PHE HA H 103 5.059 5.095 -0.036 1
1 174 . 11 1 1 A 14 14 PHE C C 103 173.560 173.323 0.237 1
1 175 . 11 1 1 A 14 14 PHE CA C 103 55.470 56.051 -0.581 1
1 176 . 11 1 1 A 14 14 PHE CB C 103 41.760 41.278 0.482 1
1 180 . 11 1 1 A 14 14 PHE N N 103 118.661 116.594 2.067 1
1 181 . 11 1 1 A 15 15 SER H H 104 8.826 8.799 0.027 1
1 182 . 11 1 1 A 15 15 SER HA H 104 4.602 4.402 0.200 1
1 185 . 11 1 1 A 15 15 SER C C 104 173.795 173.656 0.139 1
1 186 . 11 1 1 A 15 15 SER CA C 104 58.610 58.912 -0.302 1
1 187 . 11 1 1 A 15 15 SER CB C 104 62.690 62.240 0.450 1
1 188 . 11 1 1 A 15 15 SER N N 104 117.781 116.716 1.065 1
1 189 . 11 1 1 A 16 16 VAL H H 105 7.784 7.994 -0.210 1
1 190 . 11 1 1 A 16 16 VAL HA H 105 3.370 4.044 -0.674 1
1 198 . 11 1 1 A 16 16 VAL C C 105 174.987 175.337 -0.350 1
1 199 . 11 1 1 A 16 16 VAL CA C 105 63.580 62.897 0.683 1
1 200 . 11 1 1 A 16 16 VAL CB C 105 31.410 30.885 0.525 1
1 203 . 11 1 1 A 16 16 VAL N N 105 129.075 126.500 2.575 1
1 204 . 11 1 1 A 17 17 CYS H H 106 8.536 8.719 -0.183 1
1 205 . 11 1 1 A 17 17 CYS HA H 106 5.011 4.939 0.072 1
1 208 . 11 1 1 A 17 17 CYS CA C 106 55.260 56.379 -1.119 1
1 209 . 11 1 1 A 17 17 CYS CB C 106 28.210 28.192 0.018 1
1 210 . 11 1 1 A 17 17 CYS N N 106 130.045 127.551 2.494 1
1 211 . 11 1 1 A 18 18 PRO HA H 107 3.991 4.332 -0.341 1
1 218 . 11 1 1 A 18 18 PRO C C 107 178.188 178.708 -0.520 1
1 219 . 11 1 1 A 18 18 PRO CA C 107 65.940 65.082 0.858 1
1 220 . 11 1 1 A 18 18 PRO CB C 107 32.000 32.026 -0.026 1
1 223 . 11 1 1 A 19 19 GLU H H 108 9.260 9.146 0.114 1
1 224 . 11 1 1 A 19 19 GLU HA H 108 4.119 4.131 -0.012 1
1 229 . 11 1 1 A 19 19 GLU C C 108 178.721 178.793 -0.072 1
1 230 . 11 1 1 A 19 19 GLU CA C 108 59.300 58.621 0.679 1
1 231 . 11 1 1 A 19 19 GLU CB C 108 28.920 28.265 0.655 1
1 233 . 11 1 1 A 19 19 GLU N N 108 118.270 116.373 1.897 1
1 234 . 11 1 1 A 20 20 ARG H H 109 7.672 7.640 0.032 1
1 235 . 11 1 1 A 20 20 ARG HA H 109 4.331 4.301 0.030 1
1 242 . 11 1 1 A 20 20 ARG C C 109 177.977 178.618 -0.641 1
1 243 . 11 1 1 A 20 20 ARG CA C 109 57.350 58.125 -0.775 1
1 244 . 11 1 1 A 20 20 ARG CB C 109 30.820 30.887 -0.067 1
1 247 . 11 1 1 A 20 20 ARG N N 109 118.357 119.457 -1.100 1
1 248 . 11 1 1 A 21 21 LEU H H 110 7.601 7.680 -0.079 1
1 249 . 11 1 1 A 21 21 LEU HA H 110 4.380 4.269 0.111 1
1 259 . 11 1 1 A 21 21 LEU C C 110 176.562 176.696 -0.134 1
1 260 . 11 1 1 A 21 21 LEU CA C 110 56.096 56.148 -0.052 1
1 261 . 11 1 1 A 21 21 LEU CB C 110 44.016 42.214 1.802 1
1 265 . 11 1 1 A 21 21 LEU N N 110 118.626 119.005 -0.379 1
1 266 . 11 1 1 A 22 22 GLN H H 111 7.750 7.841 -0.091 1
1 267 . 11 1 1 A 22 22 GLN HA H 111 3.870 3.957 -0.087 1
1 274 . 11 1 1 A 22 22 GLN C C 111 173.336 174.593 -1.257 1
1 275 . 11 1 1 A 22 22 GLN CA C 111 56.510 57.210 -0.700 1
1 276 . 11 1 1 A 22 22 GLN CB C 111 26.800 26.478 0.322 1
1 278 . 11 1 1 A 22 22 GLN N N 111 113.926 115.538 -1.612 1
1 280 . 11 1 1 A 23 23 CYS H H 112 7.407 7.928 -0.521 1
1 281 . 11 1 1 A 23 23 CYS HA H 112 4.469 4.912 -0.443 1
1 284 . 11 1 1 A 23 23 CYS CA C 112 52.650 57.657 -5.007 1
1 285 . 11 1 1 A 23 23 CYS CB C 112 29.750 28.616 1.134 1
1 286 . 11 1 1 A 23 23 CYS N N 112 112.681 118.253 -5.572 1
1 287 . 11 1 1 A 24 24 PRO HA H 113 4.408 4.659 -0.251 1
1 294 . 11 1 1 A 24 24 PRO C C 113 178.175 177.699 0.476 1
1 295 . 11 1 1 A 24 24 PRO CA C 113 62.040 62.943 -0.903 1
1 296 . 11 1 1 A 24 24 PRO CB C 113 31.920 32.664 -0.744 1
1 299 . 11 1 1 A 25 25 LEU H H 114 8.593 8.477 0.116 1
1 300 . 11 1 1 A 25 25 LEU HA H 114 3.765 3.931 -0.166 1
1 310 . 11 1 1 A 25 25 LEU C C 114 179.950 178.971 0.979 1
1 311 . 11 1 1 A 25 25 LEU CA C 114 57.674 57.871 -0.197 1
1 312 . 11 1 1 A 25 25 LEU CB C 114 40.690 41.511 -0.821 1
1 316 . 11 1 1 A 25 25 LEU N N 114 123.729 123.684 0.045 1
1 317 . 11 1 1 A 26 26 GLU H H 115 9.108 8.699 0.409 1
1 318 . 11 1 1 A 26 26 GLU HA H 115 3.876 4.026 -0.150 1
1 323 . 11 1 1 A 26 26 GLU C C 115 177.505 178.459 -0.954 1
1 324 . 11 1 1 A 26 26 GLU CA C 115 59.410 59.325 0.085 1
1 325 . 11 1 1 A 26 26 GLU CB C 115 28.460 29.260 -0.800 1
1 327 . 11 1 1 A 26 26 GLU N N 115 116.817 117.519 -0.702 1
1 328 . 11 1 1 A 27 27 ALA H H 116 7.360 7.622 -0.262 1
1 329 . 11 1 1 A 27 27 ALA HA H 116 4.408 4.137 0.271 1
1 333 . 11 1 1 A 27 27 ALA C C 116 177.046 177.779 -0.733 1
1 334 . 11 1 1 A 27 27 ALA CA C 116 52.970 54.410 -1.440 1
1 335 . 11 1 1 A 27 27 ALA CB C 116 19.916 18.429 1.487 1
1 336 . 11 1 1 A 27 27 ALA N N 116 118.966 120.921 -1.955 1
1 337 . 11 1 1 A 28 28 ILE H H 117 7.168 6.872 0.296 1
1 338 . 11 1 1 A 28 28 ILE HA H 117 4.432 4.302 0.130 1
1 348 . 11 1 1 A 28 28 ILE C C 117 172.641 175.119 -2.478 1
1 349 . 11 1 1 A 28 28 ILE CA C 117 59.980 59.448 0.532 1
1 350 . 11 1 1 A 28 28 ILE CB C 117 37.350 37.278 0.072 1
1 354 . 11 1 1 A 28 28 ILE N N 117 108.913 108.745 0.168 1
1 355 . 11 1 1 A 29 29 GLN H H 118 6.562 7.255 -0.693 1
1 356 . 11 1 1 A 29 29 GLN HA H 118 3.922 4.495 -0.573 1
1 363 . 11 1 1 A 29 29 GLN C C 118 175.049 175.617 -0.568 1
1 364 . 11 1 1 A 29 29 GLN CA C 118 54.596 55.485 -0.889 1
1 365 . 11 1 1 A 29 29 GLN CB C 118 29.570 29.952 -0.382 1
1 367 . 11 1 1 A 29 29 GLN N N 118 116.455 123.095 -6.640 1
1 369 . 11 1 1 A 30 30 CYS H H 119 8.138 8.412 -0.274 1
1 370 . 11 1 1 A 30 30 CYS HA H 119 4.580 4.645 -0.065 1
1 373 . 11 1 1 A 30 30 CYS CA C 119 57.810 57.109 0.701 1
1 374 . 11 1 1 A 30 30 CYS CB C 119 30.200 28.707 1.493 1
1 375 . 11 1 1 A 30 30 CYS N N 119 134.136 125.323 8.813 1
1 376 . 11 1 1 A 31 31 PRO HA H 120 4.424 4.413 0.011 1
1 383 . 11 1 1 A 31 31 PRO C C 120 177.431 177.292 0.139 1
1 384 . 11 1 1 A 31 31 PRO CA C 120 64.060 63.944 0.116 1
1 385 . 11 1 1 A 31 31 PRO CB C 120 32.776 32.002 0.774 1
1 388 . 11 1 1 A 32 32 ILE H H 121 11.318 7.760 3.558 1
1 389 . 11 1 1 A 32 32 ILE HA H 121 4.038 3.998 0.040 1
1 399 . 11 1 1 A 32 32 ILE C C 121 178.485 177.998 0.487 1
1 400 . 11 1 1 A 32 32 ILE CA C 121 64.060 63.713 0.347 1
1 401 . 11 1 1 A 32 32 ILE CB C 121 39.340 38.292 1.048 1
1 405 . 11 1 1 A 32 32 ILE N N 121 124.500 117.090 7.410 1
1 406 . 11 1 1 A 33 33 THR H H 122 9.928 7.439 2.489 1
1 407 . 11 1 1 A 33 33 THR HA H 122 4.048 4.340 -0.292 1
1 412 . 11 1 1 A 33 33 THR C C 122 175.793 174.677 1.116 1
1 413 . 11 1 1 A 33 33 THR CA C 122 62.990 61.872 1.118 1
1 414 . 11 1 1 A 33 33 THR CB C 122 70.300 69.938 0.362 1
1 416 . 11 1 1 A 33 33 THR N N 122 115.136 109.364 5.772 1
1 417 . 11 1 1 A 34 34 LEU H H 123 8.439 7.763 0.676 1
1 418 . 11 1 1 A 34 34 LEU HA H 123 3.912 3.821 0.091 1
1 428 . 11 1 1 A 34 34 LEU C C 123 175.495 175.112 0.383 1
1 429 . 11 1 1 A 34 34 LEU CA C 123 56.290 56.213 0.077 1
1 430 . 11 1 1 A 34 34 LEU CB C 123 38.500 39.857 -1.357 1
1 434 . 11 1 1 A 34 34 LEU N N 123 117.230 119.198 -1.968 1
1 435 . 11 1 1 A 35 35 GLU H H 124 7.816 6.964 0.852 1
1 436 . 11 1 1 A 35 35 GLU HA H 124 4.634 4.739 -0.105 1
1 441 . 11 1 1 A 35 35 GLU C C 124 174.838 174.039 0.799 1
1 442 . 11 1 1 A 35 35 GLU CA C 124 53.780 54.835 -1.055 1
1 443 . 11 1 1 A 35 35 GLU CB C 124 33.710 32.358 1.352 1
1 445 . 11 1 1 A 35 35 GLU N N 124 116.577 114.030 2.547 1
1 446 . 11 1 1 A 36 36 GLN H H 125 8.532 8.439 0.093 1
1 447 . 11 1 1 A 36 36 GLN HA H 125 4.958 4.340 0.618 1
1 454 . 11 1 1 A 36 36 GLN CA C 125 53.350 53.616 -0.266 1
1 455 . 11 1 1 A 36 36 GLN CB C 125 29.950 29.330 0.620 1
1 457 . 11 1 1 A 36 36 GLN N N 125 123.034 123.813 -0.779 1
1 459 . 11 1 1 A 37 37 PRO HA H 126 4.458 4.699 -0.241 1
1 466 . 11 1 1 A 37 37 PRO C C 126 176.314 176.672 -0.358 1
1 467 . 11 1 1 A 37 37 PRO CA C 126 62.816 62.402 0.414 1
1 468 . 11 1 1 A 37 37 PRO CB C 126 33.070 32.942 0.128 1
1 471 . 11 1 1 A 38 38 GLU H H 127 8.626 8.393 0.233 1
1 472 . 11 1 1 A 38 38 GLU HA H 127 4.274 4.185 0.089 1
1 477 . 11 1 1 A 38 38 GLU C C 127 177.877 176.452 1.425 1
1 478 . 11 1 1 A 38 38 GLU CA C 127 58.730 57.508 1.222 1
1 479 . 11 1 1 A 38 38 GLU CB C 127 30.340 30.417 -0.077 1
1 481 . 11 1 1 A 38 38 GLU N N 127 120.691 119.181 1.510 1
1 482 . 11 1 1 A 39 39 LYS H H 128 7.861 7.757 0.104 1
1 483 . 11 1 1 A 39 39 LYS HA H 128 4.889 4.751 0.138 1
1 492 . 11 1 1 A 39 39 LYS C C 128 175.446 174.976 0.470 1
1 493 . 11 1 1 A 39 39 LYS CA C 128 53.670 54.589 -0.919 1
1 494 . 11 1 1 A 39 39 LYS CB C 128 33.630 35.870 -2.240 1
1 498 . 11 1 1 A 39 39 LYS N N 128 117.878 117.033 0.845 1
1 499 . 11 1 1 A 40 40 GLY H H 129 8.426 7.729 0.697 1
1 500 . 11 1 1 A 40 40 GLY HA2 H 129 4.970 4.022 0.948 1
1 501 . 11 1 1 A 40 40 GLY HA3 H 129 2.458 4.142 -1.684 1
1 502 . 11 1 1 A 40 40 GLY C C 129 170.048 172.220 -2.172 1
1 503 . 11 1 1 A 40 40 GLY CA C 129 42.910 45.142 -2.232 1
1 504 . 11 1 1 A 40 40 GLY N N 129 112.604 105.723 6.881 1
1 505 . 11 1 1 A 41 41 ILE H H 130 8.596 9.049 -0.453 1
1 506 . 11 1 1 A 41 41 ILE HA H 130 4.636 5.173 -0.537 1
1 516 . 11 1 1 A 41 41 ILE C C 130 172.691 174.306 -1.615 1
1 517 . 11 1 1 A 41 41 ILE CA C 130 58.500 58.694 -0.194 1
1 518 . 11 1 1 A 41 41 ILE CB C 130 43.320 40.668 2.652 1
1 522 . 11 1 1 A 41 41 ILE N N 130 113.363 115.984 -2.621 1
1 523 . 11 1 1 A 42 42 PHE H H 131 8.994 9.088 -0.094 1
1 524 . 11 1 1 A 42 42 PHE HA H 131 5.075 5.534 -0.459 1
1 532 . 11 1 1 A 42 42 PHE C C 131 175.111 174.928 0.183 1
1 533 . 11 1 1 A 42 42 PHE CA C 131 58.680 57.151 1.529 1
1 534 . 11 1 1 A 42 42 PHE CB C 131 42.220 40.640 1.580 1
1 538 . 11 1 1 A 42 42 PHE N N 131 125.156 122.252 2.904 1
1 539 . 11 1 1 A 43 43 VAL H H 132 8.399 9.397 -0.998 1
1 540 . 11 1 1 A 43 43 VAL HA H 132 4.920 4.676 0.244 1
1 548 . 11 1 1 A 43 43 VAL C C 132 178.175 175.269 2.906 1
1 549 . 11 1 1 A 43 43 VAL CA C 132 59.600 61.156 -1.556 1
1 550 . 11 1 1 A 43 43 VAL CB C 132 35.920 34.227 1.693 1
1 553 . 11 1 1 A 43 43 VAL N N 132 119.371 123.170 -3.799 1
1 554 . 11 1 1 A 44 44 LYS H H 133 10.041 8.426 1.615 1
1 555 . 11 1 1 A 44 44 LYS HA H 133 4.920 4.428 0.492 1
1 564 . 11 1 1 A 44 44 LYS C C 133 177.195 175.564 1.631 1
1 565 . 11 1 1 A 44 44 LYS CA C 133 57.310 56.361 0.949 1
1 566 . 11 1 1 A 44 44 LYS CB C 133 34.410 32.279 2.131 1
1 570 . 11 1 1 A 44 44 LYS N N 133 130.928 126.636 4.292 1
1 571 . 11 1 1 A 45 45 ASN H H 134 8.534 8.829 -0.295 1
1 572 . 11 1 1 A 45 45 ASN HA H 134 4.151 4.721 -0.570 1
1 577 . 11 1 1 A 45 45 ASN C C 134 174.217 175.221 -1.004 1
1 578 . 11 1 1 A 45 45 ASN CA C 134 55.290 52.423 2.867 1
1 579 . 11 1 1 A 45 45 ASN CB C 134 37.530 38.342 -0.812 1
1 580 . 11 1 1 A 45 45 ASN N N 134 119.452 124.361 -4.909 1
1 582 . 11 1 1 A 46 46 SER H H 135 7.570 8.140 -0.570 1
1 583 . 11 1 1 A 46 46 SER HA H 135 4.220 4.112 0.108 1
1 586 . 11 1 1 A 46 46 SER C C 135 174.490 176.617 -2.127 1
1 587 . 11 1 1 A 46 46 SER CA C 135 57.090 61.306 -4.216 1
1 588 . 11 1 1 A 46 46 SER CB C 135 64.126 63.079 1.047 1
1 589 . 11 1 1 A 46 46 SER N N 135 105.613 121.729 -16.116 1
1 590 . 11 1 1 A 47 47 ASP H H 136 9.113 8.087 1.026 1
1 591 . 11 1 1 A 47 47 ASP HA H 136 4.220 4.386 -0.166 1
1 594 . 11 1 1 A 47 47 ASP CA C 136 57.610 57.046 0.564 1
1 595 . 11 1 1 A 47 47 ASP CB C 136 40.810 40.864 -0.054 1
1 596 . 11 1 1 A 47 47 ASP N N 136 120.995 120.903 0.092 1
1 597 . 11 1 1 A 48 48 GLY H H 137 8.172 7.542 0.630 1
1 598 . 11 1 1 A 48 48 GLY HA2 H 137 4.096 3.959 0.137 1
1 599 . 11 1 1 A 48 48 GLY HA3 H 137 3.664 3.973 -0.309 1
1 600 . 11 1 1 A 48 48 GLY C C 137 173.990 173.509 0.481 1
1 601 . 11 1 1 A 48 48 GLY CA C 137 45.130 45.298 -0.168 1
1 602 . 11 1 1 A 48 48 GLY N N 137 105.838 107.064 -1.226 1
1 603 . 11 1 1 A 49 49 SER H H 138 7.252 7.983 -0.731 1
1 604 . 11 1 1 A 49 49 SER HA H 138 4.503 4.163 0.340 1
1 607 . 11 1 1 A 49 49 SER C C 138 173.857 173.300 0.557 1
1 608 . 11 1 1 A 49 49 SER CA C 138 57.340 59.550 -2.210 1
1 609 . 11 1 1 A 49 49 SER CB C 138 65.370 61.579 3.791 1
1 610 . 11 1 1 A 49 49 SER N N 138 114.942 111.692 3.250 1
1 611 . 11 1 1 A 50 50 ASP H H 139 8.276 8.219 0.057 1
1 612 . 11 1 1 A 50 50 ASP HA H 139 4.618 4.191 0.427 1
1 615 . 11 1 1 A 50 50 ASP C C 139 174.577 175.428 -0.851 1
1 616 . 11 1 1 A 50 50 ASP CA C 139 53.116 55.782 -2.666 1
1 617 . 11 1 1 A 50 50 ASP CB C 139 40.520 39.538 0.982 1
1 618 . 11 1 1 A 50 50 ASP N N 139 122.088 111.523 10.565 1
1 619 . 11 1 1 A 51 51 VAL H H 140 8.192 7.502 0.690 1
1 620 . 11 1 1 A 51 51 VAL HA H 140 4.299 4.119 0.180 1
1 628 . 11 1 1 A 51 51 VAL C C 140 175.867 175.262 0.605 1
1 629 . 11 1 1 A 51 51 VAL CA C 140 62.950 62.782 0.168 1
1 630 . 11 1 1 A 51 51 VAL CB C 140 33.230 31.952 1.278 1
1 632 . 11 1 1 A 51 51 VAL N N 140 121.167 119.395 1.772 1
1 633 . 11 1 1 A 52 52 CYS H H 141 8.391 8.857 -0.466 1
1 634 . 11 1 1 A 52 52 CYS HA H 141 5.247 5.173 0.074 1
1 637 . 11 1 1 A 52 52 CYS C C 141 172.778 174.928 -2.150 1
1 638 . 11 1 1 A 52 52 CYS CA C 141 56.480 58.431 -1.951 1
1 639 . 11 1 1 A 52 52 CYS CB C 141 31.960 28.691 3.269 1
1 640 . 11 1 1 A 52 52 CYS N N 141 121.884 126.450 -4.566 1
1 641 . 11 1 1 A 53 53 THR H H 142 8.777 9.044 -0.267 1
1 642 . 11 1 1 A 53 53 THR HA H 142 4.489 5.047 -0.558 1
1 648 . 11 1 1 A 53 53 THR C C 142 171.885 172.746 -0.861 1
1 649 . 11 1 1 A 53 53 THR CA C 142 62.070 61.505 0.565 1
1 650 . 11 1 1 A 53 53 THR CB C 142 71.390 71.076 0.314 1
1 652 . 11 1 1 A 53 53 THR N N 142 118.132 117.865 0.267 1
1 653 . 11 1 1 A 54 54 LEU H H 143 8.409 8.410 -0.001 1
1 654 . 11 1 1 A 54 54 LEU HA H 143 4.276 4.494 -0.218 1
1 664 . 11 1 1 A 54 54 LEU C C 143 174.366 174.186 0.180 1
1 665 . 11 1 1 A 54 54 LEU CA C 143 54.330 53.183 1.147 1
1 666 . 11 1 1 A 54 54 LEU CB C 143 42.396 42.652 -0.256 1
1 670 . 11 1 1 A 54 54 LEU N N 143 127.980 129.015 -1.035 1
1 671 . 11 1 1 A 55 55 PHE H H 144 8.646 8.739 -0.093 1
1 672 . 11 1 1 A 55 55 PHE HA H 144 5.455 4.834 0.621 1
1 680 . 11 1 1 A 55 55 PHE C C 144 176.054 175.135 0.919 1
1 681 . 11 1 1 A 55 55 PHE CA C 144 55.250 56.785 -1.535 1
1 682 . 11 1 1 A 55 55 PHE CB C 144 44.100 41.031 3.069 1
1 686 . 11 1 1 A 55 55 PHE N N 144 122.010 126.949 -4.939 1
1 687 . 11 1 1 A 56 56 ASP H H 145 11.575 8.323 3.252 1
1 688 . 11 1 1 A 56 56 ASP HA H 145 4.416 4.464 -0.048 1
1 691 . 11 1 1 A 56 56 ASP C C 145 176.748 177.539 -0.791 1
1 692 . 11 1 1 A 56 56 ASP CA C 145 55.840 54.688 1.152 1
1 693 . 11 1 1 A 56 56 ASP CB C 145 44.390 42.113 2.277 1
1 694 . 11 1 1 A 56 56 ASP N N 145 121.936 123.932 -1.996 1
1 695 . 11 1 1 A 57 57 ALA H H 146 8.508 8.554 -0.046 1
1 696 . 11 1 1 A 57 57 ALA HA H 146 3.797 3.976 -0.179 1
1 700 . 11 1 1 A 57 57 ALA C C 146 178.696 180.019 -1.323 1
1 701 . 11 1 1 A 57 57 ALA CA C 146 55.990 55.312 0.678 1
1 702 . 11 1 1 A 57 57 ALA CB C 146 18.840 18.228 0.612 1
1 703 . 11 1 1 A 57 57 ALA N N 146 130.243 129.358 0.885 1
1 704 . 11 1 1 A 58 58 ALA H H 147 8.378 7.846 0.532 1
1 705 . 11 1 1 A 58 58 ALA HA H 147 4.078 4.218 -0.140 1
1 709 . 11 1 1 A 58 58 ALA C C 147 181.091 179.536 1.555 1
1 710 . 11 1 1 A 58 58 ALA CA C 147 54.770 54.903 -0.133 1
1 711 . 11 1 1 A 58 58 ALA CB C 147 17.700 18.384 -0.684 1
1 712 . 11 1 1 A 58 58 ALA N N 147 121.997 119.546 2.451 1
1 713 . 11 1 1 A 59 59 ALA H H 148 9.138 7.964 1.174 1
1 714 . 11 1 1 A 59 59 ALA HA H 148 3.975 4.076 -0.101 1
1 718 . 11 1 1 A 59 59 ALA C C 148 180.508 180.128 0.380 1
1 719 . 11 1 1 A 59 59 ALA CA C 148 54.840 55.066 -0.226 1
1 720 . 11 1 1 A 59 59 ALA CB C 148 18.600 18.574 0.026 1
1 721 . 11 1 1 A 59 59 ALA N N 148 123.595 120.633 2.962 1
1 722 . 11 1 1 A 60 60 PHE H H 149 8.814 8.165 0.649 1
1 723 . 11 1 1 A 60 60 PHE HA H 149 3.722 4.041 -0.319 1
1 731 . 11 1 1 A 60 60 PHE C C 149 176.773 177.474 -0.701 1
1 732 . 11 1 1 A 60 60 PHE CA C 149 62.030 61.480 0.550 1
1 733 . 11 1 1 A 60 60 PHE CB C 149 39.960 38.959 1.001 1
1 737 . 11 1 1 A 60 60 PHE N N 149 120.354 119.971 0.383 1
1 738 . 11 1 1 A 61 61 SER H H 150 8.276 8.032 0.244 1
1 739 . 11 1 1 A 61 61 SER HA H 150 3.880 4.203 -0.323 1
1 742 . 11 1 1 A 61 61 SER C C 150 177.691 177.163 0.528 1
1 743 . 11 1 1 A 61 61 SER CA C 150 62.190 61.193 0.997 1
1 744 . 11 1 1 A 61 61 SER CB C 150 63.016 63.225 -0.209 1
1 745 . 11 1 1 A 61 61 SER N N 150 112.086 114.139 -2.053 1
1 746 . 11 1 1 A 62 62 ARG H H 151 7.829 7.692 0.137 1
1 747 . 11 1 1 A 62 62 ARG HA H 151 3.971 4.070 -0.099 1
1 754 . 11 1 1 A 62 62 ARG C C 151 178.287 178.775 -0.488 1
1 755 . 11 1 1 A 62 62 ARG CA C 151 59.340 59.044 0.296 1
1 756 . 11 1 1 A 62 62 ARG CB C 151 29.760 29.784 -0.024 1
1 759 . 11 1 1 A 62 62 ARG N N 151 121.090 121.720 -0.630 1
1 760 . 11 1 1 A 63 63 LEU H H 152 7.390 7.676 -0.286 1
1 761 . 11 1 1 A 63 63 LEU HA H 152 3.791 3.977 -0.186 1
1 771 . 11 1 1 A 63 63 LEU C C 152 179.106 178.887 0.219 1
1 772 . 11 1 1 A 63 63 LEU CA C 152 58.900 57.947 0.953 1
1 773 . 11 1 1 A 63 63 LEU CB C 152 41.140 41.607 -0.467 1
1 777 . 11 1 1 A 63 63 LEU N N 152 121.129 119.421 1.708 1
1 778 . 11 1 1 A 64 64 VAL H H 153 7.552 8.015 -0.463 1
1 779 . 11 1 1 A 64 64 VAL HA H 153 3.411 3.474 -0.063 1
1 787 . 11 1 1 A 64 64 VAL C C 153 180.595 177.865 2.730 1
1 788 . 11 1 1 A 64 64 VAL CA C 153 65.644 66.442 -0.798 1
1 789 . 11 1 1 A 64 64 VAL CB C 153 31.410 31.402 0.008 1
1 792 . 11 1 1 A 64 64 VAL N N 153 118.280 118.130 0.150 1
1 793 . 11 1 1 A 65 65 GLY H H 154 8.061 8.048 0.013 1
1 794 . 11 1 1 A 65 65 GLY HA2 H 154 3.846 3.752 0.094 1
1 795 . 11 1 1 A 65 65 GLY HA3 H 154 3.809 3.754 0.055 1
1 796 . 11 1 1 A 65 65 GLY C C 154 175.235 176.328 -1.093 1
1 797 . 11 1 1 A 65 65 GLY CA C 154 46.630 47.204 -0.574 1
1 798 . 11 1 1 A 65 65 GLY N N 154 108.622 107.744 0.878 1
1 799 . 11 1 1 A 66 66 GLU H H 155 7.528 7.635 -0.107 1
1 800 . 11 1 1 A 66 66 GLU HA H 155 4.228 4.307 -0.079 1
1 805 . 11 1 1 A 66 66 GLU C C 155 176.761 176.811 -0.050 1
1 806 . 11 1 1 A 66 66 GLU CA C 155 56.590 56.437 0.153 1
1 807 . 11 1 1 A 66 66 GLU CB C 155 30.490 30.107 0.383 1
1 809 . 11 1 1 A 66 66 GLU N N 155 118.361 119.993 -1.632 1
1 810 . 11 1 1 A 67 67 GLY H H 156 7.884 7.796 0.088 1
1 811 . 11 1 1 A 67 67 GLY HA2 H 156 3.918 3.894 0.024 1
1 812 . 11 1 1 A 67 67 GLY HA3 H 156 3.747 3.906 -0.159 1
1 813 . 11 1 1 A 67 67 GLY C C 156 174.788 174.515 0.273 1
1 814 . 11 1 1 A 67 67 GLY CA C 156 45.890 45.566 0.324 1
1 815 . 11 1 1 A 67 67 GLY N N 156 108.465 108.841 -0.376 1
1 816 . 11 1 1 A 68 68 LEU H H 157 7.332 7.934 -0.602 1
1 817 . 11 1 1 A 68 68 LEU HA H 157 4.361 4.421 -0.060 1
1 827 . 11 1 1 A 68 68 LEU CA C 157 53.060 52.732 0.328 1
1 828 . 11 1 1 A 68 68 LEU CB C 157 41.100 41.567 -0.467 1
1 832 . 11 1 1 A 68 68 LEU N N 157 121.920 121.620 0.300 1
1 833 . 11 1 1 A 69 69 PRO HA H 158 4.485 4.583 -0.098 1
1 840 . 11 1 1 A 69 69 PRO C C 158 174.602 176.220 -1.618 1
1 841 . 11 1 1 A 69 69 PRO CA C 158 61.556 62.228 -0.672 1
1 842 . 11 1 1 A 69 69 PRO CB C 158 32.370 32.738 -0.368 1
1 845 . 11 1 1 A 70 70 HIS H H 159 8.759 8.604 0.155 1
1 846 . 11 1 1 A 70 70 HIS HA H 159 3.947 4.522 -0.575 1
1 852 . 11 1 1 A 70 70 HIS CA C 159 56.250 55.119 1.131 1
1 853 . 11 1 1 A 70 70 HIS CB C 159 32.280 31.085 1.195 1
1 856 . 11 1 1 A 70 70 HIS N N 159 119.423 120.485 -1.062 1
1 857 . 11 1 1 A 71 71 PRO HA H 160 4.424 4.396 0.028 1
1 864 . 11 1 1 A 71 71 PRO C C 160 177.567 178.204 -0.637 1
1 865 . 11 1 1 A 71 71 PRO CA C 160 64.574 64.695 -0.121 1
1 866 . 11 1 1 A 71 71 PRO CB C 160 32.340 31.891 0.449 1
1 869 . 11 1 1 A 72 72 LEU H H 161 10.123 7.473 2.650 1
1 870 . 11 1 1 A 72 72 LEU HA H 161 4.778 4.314 0.464 1
1 880 . 11 1 1 A 72 72 LEU C C 161 178.721 178.427 0.294 1
1 881 . 11 1 1 A 72 72 LEU CA C 161 55.800 56.873 -1.073 1
1 882 . 11 1 1 A 72 72 LEU CB C 161 42.440 42.851 -0.411 1
1 886 . 11 1 1 A 72 72 LEU N N 161 117.374 117.329 0.045 1
1 887 . 11 1 1 A 73 73 THR H H 162 7.523 7.944 -0.421 1
1 888 . 11 1 1 A 73 73 THR HA H 162 4.291 4.482 -0.191 1
1 893 . 11 1 1 A 73 73 THR C C 162 175.557 174.171 1.386 1
1 894 . 11 1 1 A 73 73 THR CA C 162 61.440 63.351 -1.911 1
1 895 . 11 1 1 A 73 73 THR CB C 162 70.500 69.596 0.904 1
1 897 . 11 1 1 A 73 73 THR N N 162 107.787 112.445 -4.658 1
1 898 . 11 1 1 A 74 74 ARG H H 163 8.361 7.892 0.469 1
1 899 . 11 1 1 A 74 74 ARG HA H 163 3.836 4.302 -0.466 1
1 906 . 11 1 1 A 74 74 ARG C C 163 174.701 174.929 -0.228 1
1 907 . 11 1 1 A 74 74 ARG CA C 163 57.980 57.563 0.417 1
1 908 . 11 1 1 A 74 74 ARG CB C 163 26.770 27.094 -0.324 1
1 911 . 11 1 1 A 74 74 ARG N N 163 115.130 118.376 -3.246 1
1 912 . 11 1 1 A 75 75 GLU H H 164 7.430 8.045 -0.615 1
1 913 . 11 1 1 A 75 75 GLU HA H 164 4.636 4.605 0.031 1
1 918 . 11 1 1 A 75 75 GLU CA C 164 53.699 54.539 -0.840 1
1 919 . 11 1 1 A 75 75 GLU CB C 164 29.550 29.035 0.515 1
1 921 . 11 1 1 A 75 75 GLU N N 164 120.076 118.375 1.701 1
1 922 . 11 1 1 A 76 76 PRO HA H 165 4.272 4.470 -0.198 1
1 929 . 11 1 1 A 76 76 PRO C C 165 176.649 176.910 -0.261 1
1 930 . 11 1 1 A 76 76 PRO CA C 165 63.204 63.134 0.070 1
1 931 . 11 1 1 A 76 76 PRO CB C 165 31.680 31.737 -0.057 1
1 934 . 11 1 1 A 77 77 ILE H H 166 8.812 8.238 0.574 1
1 935 . 11 1 1 A 77 77 ILE HA H 166 3.838 4.292 -0.454 1
1 945 . 11 1 1 A 77 77 ILE C C 166 175.235 176.052 -0.817 1
1 946 . 11 1 1 A 77 77 ILE CA C 166 62.816 61.354 1.462 1
1 947 . 11 1 1 A 77 77 ILE CB C 166 37.750 38.378 -0.628 1
1 951 . 11 1 1 A 77 77 ILE N N 166 123.831 123.879 -0.048 1
1 952 . 11 1 1 A 78 78 THR H H 167 6.625 8.541 -1.916 1
1 953 . 11 1 1 A 78 78 THR HA H 167 4.632 5.048 -0.416 1
1 958 . 11 1 1 A 78 78 THR C C 167 174.143 174.283 -0.140 1
1 959 . 11 1 1 A 78 78 THR CA C 167 58.750 60.128 -1.378 1
1 960 . 11 1 1 A 78 78 THR CB C 167 71.320 70.793 0.527 1
1 962 . 11 1 1 A 78 78 THR N N 167 115.293 117.640 -2.347 1
1 963 . 11 1 1 A 79 79 ALA H H 168 9.088 8.972 0.116 1
1 964 . 11 1 1 A 79 79 ALA HA H 168 3.916 4.139 -0.223 1
1 968 . 11 1 1 A 79 79 ALA C C 168 179.788 179.590 0.198 1
1 969 . 11 1 1 A 79 79 ALA CA C 168 55.480 54.766 0.714 1
1 970 . 11 1 1 A 79 79 ALA CB C 168 17.630 18.443 -0.813 1
1 971 . 11 1 1 A 79 79 ALA N N 168 122.102 127.759 -5.657 1
1 972 . 11 1 1 A 80 80 SER H H 169 7.988 7.820 0.168 1
1 973 . 11 1 1 A 80 80 SER HA H 169 4.058 4.206 -0.148 1
1 976 . 11 1 1 A 80 80 SER C C 169 176.029 175.806 0.223 1
1 977 . 11 1 1 A 80 80 SER CA C 169 60.750 61.711 -0.961 1
1 978 . 11 1 1 A 80 80 SER CB C 169 62.510 63.179 -0.669 1
1 979 . 11 1 1 A 80 80 SER N N 169 109.541 114.749 -5.208 1
1 980 . 11 1 1 A 81 81 ILE H H 170 6.968 7.184 -0.216 1
1 981 . 11 1 1 A 81 81 ILE HA H 170 4.315 4.556 -0.241 1
1 991 . 11 1 1 A 81 81 ILE C C 170 174.242 175.247 -1.005 1
1 992 . 11 1 1 A 81 81 ILE CA C 170 62.296 60.805 1.491 1
1 993 . 11 1 1 A 81 81 ILE CB C 170 37.686 38.634 -0.948 1
1 997 . 11 1 1 A 81 81 ILE N N 170 112.476 112.265 0.211 1
1 998 . 11 1 1 A 82 82 ILE H H 171 7.345 7.424 -0.079 1
1 999 . 11 1 1 A 82 82 ILE HA H 171 4.339 4.676 -0.337 1
1 1009 . 11 1 1 A 82 82 ILE C C 171 174.999 174.608 0.391 1
1 1010 . 11 1 1 A 82 82 ILE CA C 171 61.150 60.224 0.926 1
1 1011 . 11 1 1 A 82 82 ILE CB C 171 37.230 40.321 -3.091 1
1 1015 . 11 1 1 A 82 82 ILE N N 171 124.260 125.057 -0.797 1
1 1016 . 11 1 1 A 83 83 VAL H H 172 7.923 9.144 -1.221 1
1 1017 . 11 1 1 A 83 83 VAL HA H 172 4.673 5.079 -0.406 1
1 1025 . 11 1 1 A 83 83 VAL C C 172 174.887 175.198 -0.311 1
1 1026 . 11 1 1 A 83 83 VAL CA C 172 59.340 59.058 0.282 1
1 1027 . 11 1 1 A 83 83 VAL CB C 172 34.840 36.037 -1.197 1
1 1030 . 11 1 1 A 83 83 VAL N N 172 120.931 122.080 -1.149 1
1 1031 . 11 1 1 A 84 84 LYS H H 173 8.406 8.653 -0.247 1
1 1032 . 11 1 1 A 84 84 LYS HA H 173 4.410 4.737 -0.327 1
1 1041 . 11 1 1 A 84 84 LYS C C 173 178.734 178.442 0.292 1
1 1042 . 11 1 1 A 84 84 LYS CA C 173 56.360 54.895 1.465 1
1 1043 . 11 1 1 A 84 84 LYS CB C 173 33.100 33.724 -0.624 1
1 1047 . 11 1 1 A 84 84 LYS N N 173 121.251 120.793 0.458 1
1 1048 . 11 1 1 A 85 85 HIS H H 174 9.221 9.098 0.123 1
1 1049 . 11 1 1 A 85 85 HIS HA H 174 4.024 3.879 0.145 1
1 1053 . 11 1 1 A 85 85 HIS C C 174 177.183 176.836 0.347 1
1 1054 . 11 1 1 A 85 85 HIS CA C 174 59.460 60.008 -0.548 1
1 1055 . 11 1 1 A 85 85 HIS CB C 174 27.920 29.415 -1.495 1
1 1057 . 11 1 1 A 85 85 HIS N N 174 121.545 122.647 -1.102 1
1 1058 . 11 1 1 A 86 86 GLU H H 175 8.699 8.205 0.494 1
1 1059 . 11 1 1 A 86 86 GLU HA H 175 3.900 3.928 -0.028 1
1 1064 . 11 1 1 A 86 86 GLU C C 175 177.220 178.162 -0.942 1
1 1065 . 11 1 1 A 86 86 GLU CA C 175 58.420 58.727 -0.307 1
1 1066 . 11 1 1 A 86 86 GLU CB C 175 28.690 29.269 -0.579 1
1 1068 . 11 1 1 A 86 86 GLU N N 175 118.011 118.748 -0.737 1
1 1069 . 11 1 1 A 87 87 GLU H H 176 7.621 7.756 -0.135 1
1 1070 . 11 1 1 A 87 87 GLU HA H 176 4.177 4.110 0.067 1
1 1075 . 11 1 1 A 87 87 GLU C C 176 175.222 176.044 -0.822 1
1 1076 . 11 1 1 A 87 87 GLU CA C 176 56.390 58.165 -1.775 1
1 1077 . 11 1 1 A 87 87 GLU CB C 176 30.430 30.230 0.200 1
1 1079 . 11 1 1 A 87 87 GLU N N 176 116.753 118.637 -1.884 1
1 1080 . 11 1 1 A 88 88 CYS H H 177 7.239 7.229 0.010 1
1 1081 . 11 1 1 A 88 88 CYS HA H 177 5.148 5.226 -0.078 1
1 1084 . 11 1 1 A 88 88 CYS C C 177 173.249 173.171 0.078 1
1 1085 . 11 1 1 A 88 88 CYS CA C 177 57.240 56.682 0.558 1
1 1086 . 11 1 1 A 88 88 CYS CB C 177 31.020 30.798 0.222 1
1 1087 . 11 1 1 A 88 88 CYS N N 177 116.096 115.344 0.752 1
1 1088 . 11 1 1 A 89 89 ILE H H 178 8.912 8.571 0.341 1
1 1089 . 11 1 1 A 89 89 ILE HA H 178 4.580 4.873 -0.293 1
1 1099 . 11 1 1 A 89 89 ILE C C 178 173.386 174.314 -0.928 1
1 1100 . 11 1 1 A 89 89 ILE CA C 178 59.270 59.197 0.073 1
1 1101 . 11 1 1 A 89 89 ILE CB C 178 42.990 41.893 1.097 1
1 1105 . 11 1 1 A 89 89 ILE N N 178 119.490 118.117 1.373 1
1 1106 . 11 1 1 A 90 90 TYR H H 179 9.047 8.513 0.534 1
1 1107 . 11 1 1 A 90 90 TYR HA H 179 3.753 4.019 -0.266 1
1 1112 . 11 1 1 A 90 90 TYR C C 179 173.932 173.988 -0.056 1
1 1113 . 11 1 1 A 90 90 TYR CA C 179 59.860 59.222 0.638 1
1 1114 . 11 1 1 A 90 90 TYR CB C 179 37.530 38.755 -1.225 1
1 1116 . 11 1 1 A 90 90 TYR N N 179 126.270 124.088 2.182 1
1 1117 . 11 1 1 A 91 91 ASP H H 180 7.462 8.039 -0.577 1
1 1118 . 11 1 1 A 91 91 ASP HA H 180 4.639 4.611 0.028 1
1 1121 . 11 1 1 A 91 91 ASP C C 180 175.297 175.675 -0.378 1
1 1122 . 11 1 1 A 91 91 ASP CA C 180 52.496 52.375 0.121 1
1 1123 . 11 1 1 A 91 91 ASP CB C 180 43.380 43.223 0.157 1
1 1124 . 11 1 1 A 91 91 ASP N N 180 129.593 127.202 2.391 1
1 1125 . 11 1 1 A 92 92 ASP H H 181 8.719 8.641 0.078 1
1 1126 . 11 1 1 A 92 92 ASP HA H 181 4.109 4.236 -0.127 1
1 1129 . 11 1 1 A 92 92 ASP C C 181 177.555 177.494 0.061 1
1 1130 . 11 1 1 A 92 92 ASP CA C 181 56.390 57.243 -0.853 1
1 1131 . 11 1 1 A 92 92 ASP CB C 181 41.330 40.952 0.378 1
1 1132 . 11 1 1 A 92 92 ASP N N 181 125.691 126.713 -1.022 1
1 1133 . 11 1 1 A 93 93 THR H H 182 8.271 7.440 0.831 1
1 1134 . 11 1 1 A 93 93 THR HA H 182 4.036 3.946 0.090 1
1 1139 . 11 1 1 A 93 93 THR C C 182 176.289 176.454 -0.165 1
1 1140 . 11 1 1 A 93 93 THR CA C 182 65.054 64.929 0.125 1
1 1141 . 11 1 1 A 93 93 THR CB C 182 68.560 68.886 -0.326 1
1 1143 . 11 1 1 A 93 93 THR N N 182 114.813 113.486 1.327 1
1 1144 . 11 1 1 A 94 94 ARG H H 183 7.753 7.632 0.121 1
1 1145 . 11 1 1 A 94 94 ARG HA H 183 4.139 4.239 -0.100 1
1 1152 . 11 1 1 A 94 94 ARG C C 183 176.897 177.080 -0.183 1
1 1153 . 11 1 1 A 94 94 ARG CA C 183 55.350 56.312 -0.962 1
1 1154 . 11 1 1 A 94 94 ARG CB C 183 30.930 30.875 0.055 1
1 1157 . 11 1 1 A 94 94 ARG N N 183 120.101 117.739 2.362 1
1 1158 . 11 1 1 A 95 95 GLY H H 184 8.112 8.737 -0.625 1
1 1159 . 11 1 1 A 95 95 GLY HA2 H 184 3.838 3.886 -0.048 1
1 1160 . 11 1 1 A 95 95 GLY HA3 H 184 3.670 3.890 -0.220 1
1 1161 . 11 1 1 A 95 95 GLY C C 184 173.659 173.347 0.312 1
1 1162 . 11 1 1 A 95 95 GLY CA C 184 46.040 45.893 0.147 1
1 1163 . 11 1 1 A 95 95 GLY N N 184 108.106 108.617 -0.511 1
1 1164 . 11 1 1 A 96 96 ASN H H 185 6.833 7.403 -0.570 1
1 1165 . 11 1 1 A 96 96 ASN HA H 185 4.944 5.004 -0.060 1
1 1170 . 11 1 1 A 96 96 ASN C C 185 174.267 173.508 0.759 1
1 1171 . 11 1 1 A 96 96 ASN CA C 185 52.560 52.454 0.106 1
1 1172 . 11 1 1 A 96 96 ASN CB C 185 45.890 41.519 4.371 1
1 1173 . 11 1 1 A 96 96 ASN N N 185 113.392 116.371 -2.979 1
1 1175 . 11 1 1 A 97 97 PHE H H 186 9.108 8.725 0.383 1
1 1176 . 11 1 1 A 97 97 PHE HA H 186 4.782 4.813 -0.031 1
1 1183 . 11 1 1 A 97 97 PHE C C 186 174.862 175.755 -0.893 1
1 1184 . 11 1 1 A 97 97 PHE CA C 186 60.056 59.672 0.384 1
1 1185 . 11 1 1 A 97 97 PHE CB C 186 40.180 39.376 0.804 1
1 1188 . 11 1 1 A 97 97 PHE N N 186 118.741 119.181 -0.440 1
1 1189 . 11 1 1 A 98 98 ILE H H 187 8.933 8.748 0.185 1
1 1190 . 11 1 1 A 98 98 ILE HA H 187 5.458 4.901 0.557 1
1 1200 . 11 1 1 A 98 98 ILE C C 187 176.041 175.002 1.039 1
1 1201 . 11 1 1 A 98 98 ILE CA C 187 57.610 58.993 -1.383 1
1 1202 . 11 1 1 A 98 98 ILE CB C 187 42.070 41.990 0.080 1
1 1206 . 11 1 1 A 98 98 ILE N N 187 117.857 118.925 -1.068 1
1 1207 . 11 1 1 A 99 99 ILE H H 188 8.284 8.709 -0.425 1
1 1208 . 11 1 1 A 99 99 ILE HA H 188 4.341 4.053 0.288 1
1 1218 . 11 1 1 A 99 99 ILE C C 188 176.413 176.403 0.010 1
1 1219 . 11 1 1 A 99 99 ILE CA C 188 59.190 61.665 -2.475 1
1 1220 . 11 1 1 A 99 99 ILE CB C 188 37.940 38.248 -0.308 1
1 1224 . 11 1 1 A 99 99 ILE N N 188 121.796 123.390 -1.594 1
1 1225 . 11 1 1 A 100 100 LYS H H 189 8.463 8.474 -0.011 1
1 1226 . 11 1 1 A 100 100 LYS HA H 189 4.040 4.163 -0.123 1
1 1235 . 11 1 1 A 100 100 LYS C C 189 176.848 177.496 -0.648 1
1 1236 . 11 1 1 A 100 100 LYS CA C 189 57.241 56.377 0.864 1
1 1237 . 11 1 1 A 100 100 LYS CB C 189 33.400 32.844 0.556 1
1 1241 . 11 1 1 A 100 100 LYS N N 189 127.995 124.801 3.194 1
1 1242 . 11 1 1 A 101 101 GLY H H 190 8.346 8.434 -0.088 1
1 1243 . 11 1 1 A 101 101 GLY HA2 H 190 3.947 3.931 0.016 1
1 1244 . 11 1 1 A 101 101 GLY HA3 H 190 3.813 3.936 -0.123 1
1 1245 . 11 1 1 A 101 101 GLY C C 190 172.902 173.781 -0.879 1
1 1246 . 11 1 1 A 101 101 GLY CA C 190 44.920 45.531 -0.611 1
1 1247 . 11 1 1 A 101 101 GLY N N 190 110.882 112.883 -2.001 1
1 7 . 12 1 1 A 2 2 GLN H H 91 8.786 8.600 0.186 1
1 8 . 12 1 1 A 2 2 GLN HA H 91 4.005 4.280 -0.275 1
1 15 . 12 1 1 A 2 2 GLN C C 91 177.270 177.935 -0.665 1
1 16 . 12 1 1 A 2 2 GLN CA C 91 58.220 57.933 0.287 1
1 17 . 12 1 1 A 2 2 GLN CB C 91 28.650 28.661 -0.011 1
1 19 . 12 1 1 A 2 2 GLN N N 91 121.993 125.876 -3.883 1
1 21 . 12 1 1 A 3 3 GLU H H 92 8.430 8.351 0.079 1
1 22 . 12 1 1 A 3 3 GLU HA H 92 4.007 4.122 -0.115 1
1 27 . 12 1 1 A 3 3 GLU C C 92 178.287 178.348 -0.061 1
1 28 . 12 1 1 A 3 3 GLU CA C 92 59.490 59.200 0.290 1
1 29 . 12 1 1 A 3 3 GLU CB C 92 29.506 29.397 0.109 1
1 31 . 12 1 1 A 3 3 GLU N N 92 120.195 119.096 1.099 1
1 32 . 12 1 1 A 4 4 SER H H 93 8.209 8.024 0.185 1
1 33 . 12 1 1 A 4 4 SER HA H 93 4.272 4.259 0.013 1
1 36 . 12 1 1 A 4 4 SER C C 93 177.369 176.490 0.879 1
1 37 . 12 1 1 A 4 4 SER CA C 93 61.044 62.394 -1.350 1
1 38 . 12 1 1 A 4 4 SER CB C 93 62.950 63.035 -0.085 1
1 39 . 12 1 1 A 4 4 SER N N 93 115.524 116.375 -0.851 1
1 40 . 12 1 1 A 5 5 ILE H H 94 8.080 7.607 0.473 1
1 41 . 12 1 1 A 5 5 ILE HA H 94 3.530 3.628 -0.098 1
1 51 . 12 1 1 A 5 5 ILE C C 94 177.778 177.710 0.068 1
1 52 . 12 1 1 A 5 5 ILE CA C 94 65.710 65.315 0.395 1
1 53 . 12 1 1 A 5 5 ILE CB C 94 37.800 37.329 0.471 1
1 57 . 12 1 1 A 5 5 ILE N N 94 124.148 121.300 2.848 1
1 58 . 12 1 1 A 6 6 GLN H H 95 8.374 8.356 0.018 1
1 59 . 12 1 1 A 6 6 GLN HA H 95 4.125 3.971 0.154 1
1 66 . 12 1 1 A 6 6 GLN C C 95 179.726 179.162 0.564 1
1 67 . 12 1 1 A 6 6 GLN CA C 95 59.190 59.018 0.172 1
1 68 . 12 1 1 A 6 6 GLN CB C 95 27.060 28.532 -1.472 1
1 70 . 12 1 1 A 6 6 GLN N N 95 118.257 118.987 -0.730 1
1 72 . 12 1 1 A 7 7 ASN H H 96 8.456 8.026 0.430 1
1 73 . 12 1 1 A 7 7 ASN HA H 96 4.446 4.585 -0.139 1
1 78 . 12 1 1 A 7 7 ASN C C 96 177.257 178.479 -1.222 1
1 79 . 12 1 1 A 7 7 ASN CA C 96 56.020 55.950 0.070 1
1 80 . 12 1 1 A 7 7 ASN CB C 96 38.126 37.887 0.239 1
1 81 . 12 1 1 A 7 7 ASN N N 96 118.597 118.572 0.025 1
1 83 . 12 1 1 A 8 8 LYS H H 97 7.732 7.829 -0.097 1
1 84 . 12 1 1 A 8 8 LYS HA H 97 4.129 4.070 0.059 1
1 93 . 12 1 1 A 8 8 LYS C C 97 179.143 179.765 -0.622 1
1 94 . 12 1 1 A 8 8 LYS CA C 97 59.126 59.494 -0.368 1
1 95 . 12 1 1 A 8 8 LYS CB C 97 32.070 32.143 -0.073 1
1 99 . 12 1 1 A 8 8 LYS N N 97 122.381 120.068 2.313 1
1 100 . 12 1 1 A 9 9 ILE H H 98 8.452 8.415 0.037 1
1 101 . 12 1 1 A 9 9 ILE HA H 98 3.480 3.739 -0.259 1
1 111 . 12 1 1 A 9 9 ILE C C 98 177.406 178.392 -0.986 1
1 112 . 12 1 1 A 9 9 ILE CA C 98 66.430 65.582 0.848 1
1 113 . 12 1 1 A 9 9 ILE CB C 98 37.980 37.699 0.281 1
1 117 . 12 1 1 A 9 9 ILE N N 98 119.950 121.188 -1.238 1
1 118 . 12 1 1 A 10 10 SER H H 99 7.924 8.037 -0.113 1
1 119 . 12 1 1 A 10 10 SER HA H 99 3.983 4.166 -0.183 1
1 122 . 12 1 1 A 10 10 SER C C 99 176.327 176.462 -0.135 1
1 123 . 12 1 1 A 10 10 SER CA C 99 61.990 61.437 0.553 1
1 124 . 12 1 1 A 10 10 SER CB C 99 62.790 62.926 -0.136 1
1 125 . 12 1 1 A 10 10 SER N N 99 113.568 116.467 -2.899 1
1 126 . 12 1 1 A 11 11 GLN H H 100 7.832 8.035 -0.203 1
1 127 . 12 1 1 A 11 11 GLN HA H 100 4.238 4.200 0.038 1
1 134 . 12 1 1 A 11 11 GLN C C 100 178.088 176.416 1.672 1
1 135 . 12 1 1 A 11 11 GLN CA C 100 57.900 57.883 0.017 1
1 136 . 12 1 1 A 11 11 GLN CB C 100 29.790 28.937 0.853 1
1 138 . 12 1 1 A 11 11 GLN N N 100 117.487 119.683 -2.196 1
1 140 . 12 1 1 A 12 12 CYS H H 101 7.920 7.570 0.350 1
1 141 . 12 1 1 A 12 12 CYS HA H 101 4.657 4.679 -0.022 1
1 144 . 12 1 1 A 12 12 CYS C C 101 175.446 174.751 0.695 1
1 145 . 12 1 1 A 12 12 CYS CA C 101 60.654 58.945 1.709 1
1 146 . 12 1 1 A 12 12 CYS CB C 101 29.310 28.964 0.346 1
1 147 . 12 1 1 A 12 12 CYS N N 101 114.221 117.222 -3.001 1
1 148 . 12 1 1 A 13 13 LYS H H 102 8.029 7.324 0.705 1
1 149 . 12 1 1 A 13 13 LYS HA H 102 5.069 4.804 0.265 1
1 158 . 12 1 1 A 13 13 LYS C C 102 174.800 176.306 -1.506 1
1 159 . 12 1 1 A 13 13 LYS CA C 102 56.394 56.190 0.204 1
1 160 . 12 1 1 A 13 13 LYS CB C 102 32.770 33.416 -0.646 1
1 164 . 12 1 1 A 13 13 LYS N N 102 124.129 119.240 4.889 1
1 165 . 12 1 1 A 14 14 PHE H H 103 8.737 8.729 0.008 1
1 166 . 12 1 1 A 14 14 PHE HA H 103 5.059 5.108 -0.049 1
1 174 . 12 1 1 A 14 14 PHE C C 103 173.560 173.290 0.270 1
1 175 . 12 1 1 A 14 14 PHE CA C 103 55.470 56.052 -0.582 1
1 176 . 12 1 1 A 14 14 PHE CB C 103 41.760 41.245 0.515 1
1 180 . 12 1 1 A 14 14 PHE N N 103 118.661 116.589 2.072 1
1 181 . 12 1 1 A 15 15 SER H H 104 8.826 8.816 0.010 1
1 182 . 12 1 1 A 15 15 SER HA H 104 4.602 4.409 0.193 1
1 185 . 12 1 1 A 15 15 SER C C 104 173.795 173.637 0.158 1
1 186 . 12 1 1 A 15 15 SER CA C 104 58.610 59.058 -0.448 1
1 187 . 12 1 1 A 15 15 SER CB C 104 62.690 62.505 0.185 1
1 188 . 12 1 1 A 15 15 SER N N 104 117.781 116.716 1.065 1
1 189 . 12 1 1 A 16 16 VAL H H 105 7.784 8.014 -0.230 1
1 190 . 12 1 1 A 16 16 VAL HA H 105 3.370 3.977 -0.607 1
1 198 . 12 1 1 A 16 16 VAL C C 105 174.987 175.165 -0.178 1
1 199 . 12 1 1 A 16 16 VAL CA C 105 63.580 62.918 0.662 1
1 200 . 12 1 1 A 16 16 VAL CB C 105 31.410 30.776 0.634 1
1 203 . 12 1 1 A 16 16 VAL N N 105 129.075 126.579 2.496 1
1 204 . 12 1 1 A 17 17 CYS H H 106 8.536 8.654 -0.118 1
1 205 . 12 1 1 A 17 17 CYS HA H 106 5.011 4.989 0.022 1
1 208 . 12 1 1 A 17 17 CYS CA C 106 55.260 56.314 -1.054 1
1 209 . 12 1 1 A 17 17 CYS CB C 106 28.210 28.508 -0.298 1
1 210 . 12 1 1 A 17 17 CYS N N 106 130.045 127.178 2.867 1
1 211 . 12 1 1 A 18 18 PRO HA H 107 3.991 4.395 -0.404 1
1 218 . 12 1 1 A 18 18 PRO C C 107 178.188 178.363 -0.175 1
1 219 . 12 1 1 A 18 18 PRO CA C 107 65.940 64.698 1.242 1
1 220 . 12 1 1 A 18 18 PRO CB C 107 32.000 31.969 0.031 1
1 223 . 12 1 1 A 19 19 GLU H H 108 9.260 9.023 0.237 1
1 224 . 12 1 1 A 19 19 GLU HA H 108 4.119 4.129 -0.010 1
1 229 . 12 1 1 A 19 19 GLU C C 108 178.721 178.595 0.126 1
1 230 . 12 1 1 A 19 19 GLU CA C 108 59.300 58.830 0.470 1
1 231 . 12 1 1 A 19 19 GLU CB C 108 28.920 28.680 0.240 1
1 233 . 12 1 1 A 19 19 GLU N N 108 118.270 115.878 2.392 1
1 234 . 12 1 1 A 20 20 ARG H H 109 7.672 7.800 -0.128 1
1 235 . 12 1 1 A 20 20 ARG HA H 109 4.331 4.346 -0.015 1
1 242 . 12 1 1 A 20 20 ARG C C 109 177.977 178.395 -0.418 1
1 243 . 12 1 1 A 20 20 ARG CA C 109 57.350 57.908 -0.558 1
1 244 . 12 1 1 A 20 20 ARG CB C 109 30.820 30.987 -0.167 1
1 247 . 12 1 1 A 20 20 ARG N N 109 118.357 119.251 -0.894 1
1 248 . 12 1 1 A 21 21 LEU H H 110 7.601 7.992 -0.391 1
1 249 . 12 1 1 A 21 21 LEU HA H 110 4.380 4.340 0.040 1
1 259 . 12 1 1 A 21 21 LEU C C 110 176.562 176.524 0.038 1
1 260 . 12 1 1 A 21 21 LEU CA C 110 56.096 56.357 -0.261 1
1 261 . 12 1 1 A 21 21 LEU CB C 110 44.016 42.245 1.771 1
1 265 . 12 1 1 A 21 21 LEU N N 110 118.626 118.877 -0.251 1
1 266 . 12 1 1 A 22 22 GLN H H 111 7.750 7.580 0.170 1
1 267 . 12 1 1 A 22 22 GLN HA H 111 3.870 3.948 -0.078 1
1 274 . 12 1 1 A 22 22 GLN C C 111 173.336 174.176 -0.840 1
1 275 . 12 1 1 A 22 22 GLN CA C 111 56.510 56.943 -0.433 1
1 276 . 12 1 1 A 22 22 GLN CB C 111 26.800 26.373 0.427 1
1 278 . 12 1 1 A 22 22 GLN N N 111 113.926 115.934 -2.008 1
1 280 . 12 1 1 A 23 23 CYS H H 112 7.407 7.878 -0.471 1
1 281 . 12 1 1 A 23 23 CYS HA H 112 4.469 4.998 -0.529 1
1 284 . 12 1 1 A 23 23 CYS CA C 112 52.650 56.669 -4.019 1
1 285 . 12 1 1 A 23 23 CYS CB C 112 29.750 30.109 -0.359 1
1 286 . 12 1 1 A 23 23 CYS N N 112 112.681 117.349 -4.668 1
1 287 . 12 1 1 A 24 24 PRO HA H 113 4.408 4.608 -0.200 1
1 294 . 12 1 1 A 24 24 PRO C C 113 178.175 177.789 0.386 1
1 295 . 12 1 1 A 24 24 PRO CA C 113 62.040 62.999 -0.959 1
1 296 . 12 1 1 A 24 24 PRO CB C 113 31.920 32.333 -0.413 1
1 299 . 12 1 1 A 25 25 LEU H H 114 8.593 8.484 0.109 1
1 300 . 12 1 1 A 25 25 LEU HA H 114 3.765 3.948 -0.183 1
1 310 . 12 1 1 A 25 25 LEU C C 114 179.950 179.030 0.920 1
1 311 . 12 1 1 A 25 25 LEU CA C 114 57.674 57.673 0.001 1
1 312 . 12 1 1 A 25 25 LEU CB C 114 40.690 41.517 -0.827 1
1 316 . 12 1 1 A 25 25 LEU N N 114 123.729 123.520 0.209 1
1 317 . 12 1 1 A 26 26 GLU H H 115 9.108 8.693 0.415 1
1 318 . 12 1 1 A 26 26 GLU HA H 115 3.876 4.029 -0.153 1
1 323 . 12 1 1 A 26 26 GLU C C 115 177.505 178.530 -1.025 1
1 324 . 12 1 1 A 26 26 GLU CA C 115 59.410 59.340 0.070 1
1 325 . 12 1 1 A 26 26 GLU CB C 115 28.460 29.303 -0.843 1
1 327 . 12 1 1 A 26 26 GLU N N 115 116.817 117.745 -0.928 1
1 328 . 12 1 1 A 27 27 ALA H H 116 7.360 7.638 -0.278 1
1 329 . 12 1 1 A 27 27 ALA HA H 116 4.408 4.117 0.291 1
1 333 . 12 1 1 A 27 27 ALA C C 116 177.046 177.816 -0.770 1
1 334 . 12 1 1 A 27 27 ALA CA C 116 52.970 54.409 -1.439 1
1 335 . 12 1 1 A 27 27 ALA CB C 116 19.916 18.363 1.553 1
1 336 . 12 1 1 A 27 27 ALA N N 116 118.966 120.888 -1.922 1
1 337 . 12 1 1 A 28 28 ILE H H 117 7.168 6.926 0.242 1
1 338 . 12 1 1 A 28 28 ILE HA H 117 4.432 4.372 0.060 1
1 348 . 12 1 1 A 28 28 ILE C C 117 172.641 175.456 -2.815 1
1 349 . 12 1 1 A 28 28 ILE CA C 117 59.980 59.494 0.486 1
1 350 . 12 1 1 A 28 28 ILE CB C 117 37.350 37.385 -0.035 1
1 354 . 12 1 1 A 28 28 ILE N N 117 108.913 108.808 0.105 1
1 355 . 12 1 1 A 29 29 GLN H H 118 6.562 7.220 -0.658 1
1 356 . 12 1 1 A 29 29 GLN HA H 118 3.922 4.276 -0.354 1
1 363 . 12 1 1 A 29 29 GLN C C 118 175.049 175.498 -0.449 1
1 364 . 12 1 1 A 29 29 GLN CA C 118 54.596 55.998 -1.402 1
1 365 . 12 1 1 A 29 29 GLN CB C 118 29.570 29.340 0.230 1
1 367 . 12 1 1 A 29 29 GLN N N 118 116.455 123.270 -6.815 1
1 369 . 12 1 1 A 30 30 CYS H H 119 8.138 8.171 -0.033 1
1 370 . 12 1 1 A 30 30 CYS HA H 119 4.580 4.663 -0.083 1
1 373 . 12 1 1 A 30 30 CYS CA C 119 57.810 56.872 0.938 1
1 374 . 12 1 1 A 30 30 CYS CB C 119 30.200 28.668 1.532 1
1 375 . 12 1 1 A 30 30 CYS N N 119 134.136 125.573 8.563 1
1 376 . 12 1 1 A 31 31 PRO HA H 120 4.424 4.451 -0.027 1
1 383 . 12 1 1 A 31 31 PRO C C 120 177.431 177.449 -0.018 1
1 384 . 12 1 1 A 31 31 PRO CA C 120 64.060 63.994 0.066 1
1 385 . 12 1 1 A 31 31 PRO CB C 120 32.776 32.138 0.638 1
1 388 . 12 1 1 A 32 32 ILE H H 121 11.318 7.768 3.550 1
1 389 . 12 1 1 A 32 32 ILE HA H 121 4.038 4.007 0.031 1
1 399 . 12 1 1 A 32 32 ILE C C 121 178.485 178.355 0.130 1
1 400 . 12 1 1 A 32 32 ILE CA C 121 64.060 63.722 0.338 1
1 401 . 12 1 1 A 32 32 ILE CB C 121 39.340 38.181 1.159 1
1 405 . 12 1 1 A 32 32 ILE N N 121 124.500 117.158 7.342 1
1 406 . 12 1 1 A 33 33 THR H H 122 9.928 7.550 2.378 1
1 407 . 12 1 1 A 33 33 THR HA H 122 4.048 4.241 -0.193 1
1 412 . 12 1 1 A 33 33 THR C C 122 175.793 174.739 1.054 1
1 413 . 12 1 1 A 33 33 THR CA C 122 62.990 62.676 0.314 1
1 414 . 12 1 1 A 33 33 THR CB C 122 70.300 70.121 0.179 1
1 416 . 12 1 1 A 33 33 THR N N 122 115.136 109.469 5.667 1
1 417 . 12 1 1 A 34 34 LEU H H 123 8.439 7.699 0.740 1
1 418 . 12 1 1 A 34 34 LEU HA H 123 3.912 3.779 0.133 1
1 428 . 12 1 1 A 34 34 LEU C C 123 175.495 175.107 0.388 1
1 429 . 12 1 1 A 34 34 LEU CA C 123 56.290 56.272 0.018 1
1 430 . 12 1 1 A 34 34 LEU CB C 123 38.500 39.847 -1.347 1
1 434 . 12 1 1 A 34 34 LEU N N 123 117.230 119.068 -1.838 1
1 435 . 12 1 1 A 35 35 GLU H H 124 7.816 7.446 0.370 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 124 174.838 173.929 0.909 1
1 442 . 12 1 1 A 35 35 GLU CA C 124 53.780 54.794 -1.014 1
1 443 . 12 1 1 A 35 35 GLU CB C 124 33.710 32.301 1.409 1
1 445 . 12 1 1 A 35 35 GLU N N 124 116.577 114.296 2.281 1
1 446 . 12 1 1 A 36 36 GLN H H 125 8.532 8.500 0.032 1
1 447 . 12 1 1 A 36 36 GLN HA H 125 4.958 4.368 0.590 1
1 454 . 12 1 1 A 36 36 GLN CA C 125 53.350 53.286 0.064 1
1 455 . 12 1 1 A 36 36 GLN CB C 125 29.950 29.307 0.643 1
1 457 . 12 1 1 A 36 36 GLN N N 125 123.034 123.529 -0.495 1
1 459 . 12 1 1 A 37 37 PRO HA H 126 4.458 4.593 -0.135 1
1 466 . 12 1 1 A 37 37 PRO C C 126 176.314 177.149 -0.835 1
1 467 . 12 1 1 A 37 37 PRO CA C 126 62.816 62.680 0.136 1
1 468 . 12 1 1 A 37 37 PRO CB C 126 33.070 32.628 0.442 1
1 471 . 12 1 1 A 38 38 GLU H H 127 8.626 8.375 0.251 1
1 472 . 12 1 1 A 38 38 GLU HA H 127 4.274 4.137 0.137 1
1 477 . 12 1 1 A 38 38 GLU C C 127 177.877 176.496 1.381 1
1 478 . 12 1 1 A 38 38 GLU CA C 127 58.730 58.335 0.395 1
1 479 . 12 1 1 A 38 38 GLU CB C 127 30.340 30.190 0.150 1
1 481 . 12 1 1 A 38 38 GLU N N 127 120.691 119.233 1.458 1
1 482 . 12 1 1 A 39 39 LYS H H 128 7.861 7.644 0.217 1
1 483 . 12 1 1 A 39 39 LYS HA H 128 4.889 4.675 0.214 1
1 492 . 12 1 1 A 39 39 LYS C C 128 175.446 174.958 0.488 1
1 493 . 12 1 1 A 39 39 LYS CA C 128 53.670 54.554 -0.884 1
1 494 . 12 1 1 A 39 39 LYS CB C 128 33.630 35.961 -2.331 1
1 498 . 12 1 1 A 39 39 LYS N N 128 117.878 116.624 1.254 1
1 499 . 12 1 1 A 40 40 GLY H H 129 8.426 7.893 0.533 1
1 500 . 12 1 1 A 40 40 GLY HA2 H 129 4.970 3.997 0.973 1
1 501 . 12 1 1 A 40 40 GLY HA3 H 129 2.458 4.153 -1.695 1
1 502 . 12 1 1 A 40 40 GLY C C 129 170.048 172.223 -2.175 1
1 503 . 12 1 1 A 40 40 GLY CA C 129 42.910 45.077 -2.167 1
1 504 . 12 1 1 A 40 40 GLY N N 129 112.604 105.531 7.073 1
1 505 . 12 1 1 A 41 41 ILE H H 130 8.596 8.980 -0.384 1
1 506 . 12 1 1 A 41 41 ILE HA H 130 4.636 5.109 -0.473 1
1 516 . 12 1 1 A 41 41 ILE C C 130 172.691 174.185 -1.494 1
1 517 . 12 1 1 A 41 41 ILE CA C 130 58.500 58.638 -0.138 1
1 518 . 12 1 1 A 41 41 ILE CB C 130 43.320 41.781 1.539 1
1 522 . 12 1 1 A 41 41 ILE N N 130 113.363 115.788 -2.425 1
1 523 . 12 1 1 A 42 42 PHE H H 131 8.994 8.836 0.158 1
1 524 . 12 1 1 A 42 42 PHE HA H 131 5.075 5.620 -0.545 1
1 532 . 12 1 1 A 42 42 PHE C C 131 175.111 174.640 0.471 1
1 533 . 12 1 1 A 42 42 PHE CA C 131 58.680 56.995 1.685 1
1 534 . 12 1 1 A 42 42 PHE CB C 131 42.220 40.488 1.732 1
1 538 . 12 1 1 A 42 42 PHE N N 131 125.156 121.497 3.659 1
1 539 . 12 1 1 A 43 43 VAL H H 132 8.399 9.263 -0.864 1
1 540 . 12 1 1 A 43 43 VAL HA H 132 4.920 4.695 0.225 1
1 548 . 12 1 1 A 43 43 VAL C C 132 178.175 175.649 2.526 1
1 549 . 12 1 1 A 43 43 VAL CA C 132 59.600 61.129 -1.529 1
1 550 . 12 1 1 A 43 43 VAL CB C 132 35.920 34.092 1.828 1
1 553 . 12 1 1 A 43 43 VAL N N 132 119.371 123.275 -3.904 1
1 554 . 12 1 1 A 44 44 LYS H H 133 10.041 8.609 1.432 1
1 555 . 12 1 1 A 44 44 LYS HA H 133 4.920 4.616 0.304 1
1 564 . 12 1 1 A 44 44 LYS C C 133 177.195 176.210 0.985 1
1 565 . 12 1 1 A 44 44 LYS CA C 133 57.310 56.627 0.683 1
1 566 . 12 1 1 A 44 44 LYS CB C 133 34.410 32.530 1.880 1
1 570 . 12 1 1 A 44 44 LYS N N 133 130.928 126.879 4.049 1
1 571 . 12 1 1 A 45 45 ASN H H 134 8.534 8.939 -0.405 1
1 572 . 12 1 1 A 45 45 ASN HA H 134 4.151 4.853 -0.702 1
1 577 . 12 1 1 A 45 45 ASN C C 134 174.217 175.311 -1.094 1
1 578 . 12 1 1 A 45 45 ASN CA C 134 55.290 52.326 2.964 1
1 579 . 12 1 1 A 45 45 ASN CB C 134 37.530 36.426 1.104 1
1 580 . 12 1 1 A 45 45 ASN N N 134 119.452 122.841 -3.389 1
1 582 . 12 1 1 A 46 46 SER H H 135 7.570 7.956 -0.386 1
1 583 . 12 1 1 A 46 46 SER HA H 135 4.220 4.083 0.137 1
1 586 . 12 1 1 A 46 46 SER C C 135 174.490 177.018 -2.528 1
1 587 . 12 1 1 A 46 46 SER CA C 135 57.090 61.506 -4.416 1
1 588 . 12 1 1 A 46 46 SER CB C 135 64.126 63.006 1.120 1
1 589 . 12 1 1 A 46 46 SER N N 135 105.613 119.369 -13.756 1
1 590 . 12 1 1 A 47 47 ASP H H 136 9.113 8.154 0.959 1
1 591 . 12 1 1 A 47 47 ASP HA H 136 4.220 4.315 -0.095 1
1 594 . 12 1 1 A 47 47 ASP CA C 136 57.610 57.044 0.566 1
1 595 . 12 1 1 A 47 47 ASP CB C 136 40.810 40.338 0.472 1
1 596 . 12 1 1 A 47 47 ASP N N 136 120.995 121.030 -0.035 1
1 597 . 12 1 1 A 48 48 GLY H H 137 8.172 8.245 -0.073 1
1 598 . 12 1 1 A 48 48 GLY HA2 H 137 4.096 3.761 0.335 1
1 599 . 12 1 1 A 48 48 GLY HA3 H 137 3.664 3.770 -0.106 1
1 600 . 12 1 1 A 48 48 GLY C C 137 173.990 175.217 -1.227 1
1 601 . 12 1 1 A 48 48 GLY CA C 137 45.130 47.349 -2.219 1
1 602 . 12 1 1 A 48 48 GLY N N 137 105.838 107.524 -1.686 1
1 603 . 12 1 1 A 49 49 SER H H 138 7.252 7.491 -0.239 1
1 604 . 12 1 1 A 49 49 SER HA H 138 4.503 4.649 -0.146 1
1 607 . 12 1 1 A 49 49 SER C C 138 173.857 173.727 0.130 1
1 608 . 12 1 1 A 49 49 SER CA C 138 57.340 57.170 0.170 1
1 609 . 12 1 1 A 49 49 SER CB C 138 65.370 64.197 1.173 1
1 610 . 12 1 1 A 49 49 SER N N 138 114.942 112.203 2.739 1
1 611 . 12 1 1 A 50 50 ASP H H 139 8.276 7.941 0.335 1
1 612 . 12 1 1 A 50 50 ASP HA H 139 4.618 4.238 0.380 1
1 615 . 12 1 1 A 50 50 ASP C C 139 174.577 174.880 -0.303 1
1 616 . 12 1 1 A 50 50 ASP CA C 139 53.116 55.296 -2.180 1
1 617 . 12 1 1 A 50 50 ASP CB C 139 40.520 40.047 0.473 1
1 618 . 12 1 1 A 50 50 ASP N N 139 122.088 120.110 1.978 1
1 619 . 12 1 1 A 51 51 VAL H H 140 8.192 7.519 0.673 1
1 620 . 12 1 1 A 51 51 VAL HA H 140 4.299 4.414 -0.115 1
1 628 . 12 1 1 A 51 51 VAL C C 140 175.867 175.328 0.539 1
1 629 . 12 1 1 A 51 51 VAL CA C 140 62.950 61.976 0.974 1
1 630 . 12 1 1 A 51 51 VAL CB C 140 33.230 33.007 0.223 1
1 632 . 12 1 1 A 51 51 VAL N N 140 121.167 118.961 2.206 1
1 633 . 12 1 1 A 52 52 CYS H H 141 8.391 8.600 -0.209 1
1 634 . 12 1 1 A 52 52 CYS HA H 141 5.247 5.579 -0.332 1
1 637 . 12 1 1 A 52 52 CYS C C 141 172.778 173.504 -0.726 1
1 638 . 12 1 1 A 52 52 CYS CA C 141 56.480 56.995 -0.515 1
1 639 . 12 1 1 A 52 52 CYS CB C 141 31.960 31.192 0.768 1
1 640 . 12 1 1 A 52 52 CYS N N 141 121.884 120.021 1.863 1
1 641 . 12 1 1 A 53 53 THR H H 142 8.777 8.941 -0.164 1
1 642 . 12 1 1 A 53 53 THR HA H 142 4.489 5.097 -0.608 1
1 648 . 12 1 1 A 53 53 THR C C 142 171.885 172.606 -0.721 1
1 649 . 12 1 1 A 53 53 THR CA C 142 62.070 61.456 0.614 1
1 650 . 12 1 1 A 53 53 THR CB C 142 71.390 71.509 -0.119 1
1 652 . 12 1 1 A 53 53 THR N N 142 118.132 117.915 0.217 1
1 653 . 12 1 1 A 54 54 LEU H H 143 8.409 8.477 -0.068 1
1 654 . 12 1 1 A 54 54 LEU HA H 143 4.276 4.491 -0.215 1
1 664 . 12 1 1 A 54 54 LEU C C 143 174.366 174.165 0.201 1
1 665 . 12 1 1 A 54 54 LEU CA C 143 54.330 53.202 1.128 1
1 666 . 12 1 1 A 54 54 LEU CB C 143 42.396 42.703 -0.307 1
1 670 . 12 1 1 A 54 54 LEU N N 143 127.980 128.193 -0.213 1
1 671 . 12 1 1 A 55 55 PHE H H 144 8.646 8.519 0.127 1
1 672 . 12 1 1 A 55 55 PHE HA H 144 5.455 4.795 0.660 1
1 680 . 12 1 1 A 55 55 PHE C C 144 176.054 174.952 1.102 1
1 681 . 12 1 1 A 55 55 PHE CA C 144 55.250 56.715 -1.465 1
1 682 . 12 1 1 A 55 55 PHE CB C 144 44.100 41.186 2.914 1
1 686 . 12 1 1 A 55 55 PHE N N 144 122.010 126.863 -4.853 1
1 687 . 12 1 1 A 56 56 ASP H H 145 11.575 8.264 3.311 1
1 688 . 12 1 1 A 56 56 ASP HA H 145 4.416 4.518 -0.102 1
1 691 . 12 1 1 A 56 56 ASP C C 145 176.748 177.451 -0.703 1
1 692 . 12 1 1 A 56 56 ASP CA C 145 55.840 54.819 1.021 1
1 693 . 12 1 1 A 56 56 ASP CB C 145 44.390 42.014 2.376 1
1 694 . 12 1 1 A 56 56 ASP N N 145 121.936 124.170 -2.234 1
1 695 . 12 1 1 A 57 57 ALA H H 146 8.508 8.616 -0.108 1
1 696 . 12 1 1 A 57 57 ALA HA H 146 3.797 4.015 -0.218 1
1 700 . 12 1 1 A 57 57 ALA C C 146 178.696 179.956 -1.260 1
1 701 . 12 1 1 A 57 57 ALA CA C 146 55.990 55.476 0.514 1
1 702 . 12 1 1 A 57 57 ALA CB C 146 18.840 18.111 0.729 1
1 703 . 12 1 1 A 57 57 ALA N N 146 130.243 129.444 0.799 1
1 704 . 12 1 1 A 58 58 ALA H H 147 8.378 7.617 0.761 1
1 705 . 12 1 1 A 58 58 ALA HA H 147 4.078 4.230 -0.152 1
1 709 . 12 1 1 A 58 58 ALA C C 147 181.091 179.496 1.595 1
1 710 . 12 1 1 A 58 58 ALA CA C 147 54.770 54.958 -0.188 1
1 711 . 12 1 1 A 58 58 ALA CB C 147 17.700 18.449 -0.749 1
1 712 . 12 1 1 A 58 58 ALA N N 147 121.997 119.208 2.789 1
1 713 . 12 1 1 A 59 59 ALA H H 148 9.138 7.784 1.354 1
1 714 . 12 1 1 A 59 59 ALA HA H 148 3.975 4.080 -0.105 1
1 718 . 12 1 1 A 59 59 ALA C C 148 180.508 180.126 0.382 1
1 719 . 12 1 1 A 59 59 ALA CA C 148 54.840 55.062 -0.222 1
1 720 . 12 1 1 A 59 59 ALA CB C 148 18.600 18.507 0.093 1
1 721 . 12 1 1 A 59 59 ALA N N 148 123.595 120.154 3.441 1
1 722 . 12 1 1 A 60 60 PHE H H 149 8.814 8.104 0.710 1
1 723 . 12 1 1 A 60 60 PHE HA H 149 3.722 4.060 -0.338 1
1 731 . 12 1 1 A 60 60 PHE C C 149 176.773 177.522 -0.749 1
1 732 . 12 1 1 A 60 60 PHE CA C 149 62.030 61.416 0.614 1
1 733 . 12 1 1 A 60 60 PHE CB C 149 39.960 38.785 1.175 1
1 737 . 12 1 1 A 60 60 PHE N N 149 120.354 119.952 0.402 1
1 738 . 12 1 1 A 61 61 SER H H 150 8.276 8.138 0.138 1
1 739 . 12 1 1 A 61 61 SER HA H 150 3.880 4.193 -0.313 1
1 742 . 12 1 1 A 61 61 SER C C 150 177.691 176.972 0.719 1
1 743 . 12 1 1 A 61 61 SER CA C 150 62.190 61.168 1.022 1
1 744 . 12 1 1 A 61 61 SER CB C 150 63.016 63.217 -0.201 1
1 745 . 12 1 1 A 61 61 SER N N 150 112.086 114.328 -2.242 1
1 746 . 12 1 1 A 62 62 ARG H H 151 7.829 7.776 0.053 1
1 747 . 12 1 1 A 62 62 ARG HA H 151 3.971 4.004 -0.033 1
1 754 . 12 1 1 A 62 62 ARG C C 151 178.287 178.626 -0.339 1
1 755 . 12 1 1 A 62 62 ARG CA C 151 59.340 59.407 -0.067 1
1 756 . 12 1 1 A 62 62 ARG CB C 151 29.760 29.974 -0.214 1
1 759 . 12 1 1 A 62 62 ARG N N 151 121.090 121.693 -0.603 1
1 760 . 12 1 1 A 63 63 LEU H H 152 7.390 7.612 -0.222 1
1 761 . 12 1 1 A 63 63 LEU HA H 152 3.791 3.925 -0.134 1
1 771 . 12 1 1 A 63 63 LEU C C 152 179.106 178.918 0.188 1
1 772 . 12 1 1 A 63 63 LEU CA C 152 58.900 57.903 0.997 1
1 773 . 12 1 1 A 63 63 LEU CB C 152 41.140 41.376 -0.236 1
1 777 . 12 1 1 A 63 63 LEU N N 152 121.129 119.454 1.675 1
1 778 . 12 1 1 A 64 64 VAL H H 153 7.552 8.019 -0.467 1
1 779 . 12 1 1 A 64 64 VAL HA H 153 3.411 3.453 -0.042 1
1 787 . 12 1 1 A 64 64 VAL C C 153 180.595 177.934 2.661 1
1 788 . 12 1 1 A 64 64 VAL CA C 153 65.644 66.555 -0.911 1
1 789 . 12 1 1 A 64 64 VAL CB C 153 31.410 31.310 0.100 1
1 792 . 12 1 1 A 64 64 VAL N N 153 118.280 118.170 0.110 1
1 793 . 12 1 1 A 65 65 GLY H H 154 8.061 7.948 0.113 1
1 794 . 12 1 1 A 65 65 GLY HA2 H 154 3.846 3.717 0.129 1
1 795 . 12 1 1 A 65 65 GLY HA3 H 154 3.809 3.719 0.090 1
1 796 . 12 1 1 A 65 65 GLY C C 154 175.235 176.140 -0.905 1
1 797 . 12 1 1 A 65 65 GLY CA C 154 46.630 47.235 -0.605 1
1 798 . 12 1 1 A 65 65 GLY N N 154 108.622 107.605 1.017 1
1 799 . 12 1 1 A 66 66 GLU H H 155 7.528 7.699 -0.171 1
1 800 . 12 1 1 A 66 66 GLU HA H 155 4.228 4.208 0.020 1
1 805 . 12 1 1 A 66 66 GLU C C 155 176.761 176.898 -0.137 1
1 806 . 12 1 1 A 66 66 GLU CA C 155 56.590 56.986 -0.396 1
1 807 . 12 1 1 A 66 66 GLU CB C 155 30.490 29.939 0.551 1
1 809 . 12 1 1 A 66 66 GLU N N 155 118.361 119.799 -1.438 1
1 810 . 12 1 1 A 67 67 GLY H H 156 7.884 7.758 0.126 1
1 811 . 12 1 1 A 67 67 GLY HA2 H 156 3.918 3.919 -0.001 1
1 812 . 12 1 1 A 67 67 GLY HA3 H 156 3.747 3.931 -0.184 1
1 813 . 12 1 1 A 67 67 GLY C C 156 174.788 174.360 0.428 1
1 814 . 12 1 1 A 67 67 GLY CA C 156 45.890 45.570 0.320 1
1 815 . 12 1 1 A 67 67 GLY N N 156 108.465 107.815 0.650 1
1 816 . 12 1 1 A 68 68 LEU H H 157 7.332 8.128 -0.796 1
1 817 . 12 1 1 A 68 68 LEU HA H 157 4.361 4.587 -0.226 1
1 827 . 12 1 1 A 68 68 LEU CA C 157 53.060 52.091 0.969 1
1 828 . 12 1 1 A 68 68 LEU CB C 157 41.100 41.640 -0.540 1
1 832 . 12 1 1 A 68 68 LEU N N 157 121.920 121.788 0.132 1
1 833 . 12 1 1 A 69 69 PRO HA H 158 4.485 4.578 -0.093 1
1 840 . 12 1 1 A 69 69 PRO C C 158 174.602 176.205 -1.603 1
1 841 . 12 1 1 A 69 69 PRO CA C 158 61.556 62.219 -0.663 1
1 842 . 12 1 1 A 69 69 PRO CB C 158 32.370 32.732 -0.362 1
1 845 . 12 1 1 A 70 70 HIS H H 159 8.759 8.613 0.146 1
1 846 . 12 1 1 A 70 70 HIS HA H 159 3.947 4.430 -0.483 1
1 852 . 12 1 1 A 70 70 HIS CA C 159 56.250 55.199 1.051 1
1 853 . 12 1 1 A 70 70 HIS CB C 159 32.280 30.970 1.310 1
1 856 . 12 1 1 A 70 70 HIS N N 159 119.423 120.498 -1.075 1
1 857 . 12 1 1 A 71 71 PRO HA H 160 4.424 4.403 0.021 1
1 864 . 12 1 1 A 71 71 PRO C C 160 177.567 177.637 -0.070 1
1 865 . 12 1 1 A 71 71 PRO CA C 160 64.574 64.409 0.165 1
1 866 . 12 1 1 A 71 71 PRO CB C 160 32.340 31.788 0.552 1
1 869 . 12 1 1 A 72 72 LEU H H 161 10.123 7.685 2.438 1
1 870 . 12 1 1 A 72 72 LEU HA H 161 4.778 4.350 0.428 1
1 880 . 12 1 1 A 72 72 LEU C C 161 178.721 178.104 0.617 1
1 881 . 12 1 1 A 72 72 LEU CA C 161 55.800 56.901 -1.101 1
1 882 . 12 1 1 A 72 72 LEU CB C 161 42.440 43.519 -1.079 1
1 886 . 12 1 1 A 72 72 LEU N N 161 117.374 117.357 0.017 1
1 887 . 12 1 1 A 73 73 THR H H 162 7.523 8.005 -0.482 1
1 888 . 12 1 1 A 73 73 THR HA H 162 4.291 4.511 -0.220 1
1 893 . 12 1 1 A 73 73 THR C C 162 175.557 174.415 1.142 1
1 894 . 12 1 1 A 73 73 THR CA C 162 61.440 62.652 -1.212 1
1 895 . 12 1 1 A 73 73 THR CB C 162 70.500 69.740 0.760 1
1 897 . 12 1 1 A 73 73 THR N N 162 107.787 112.480 -4.693 1
1 898 . 12 1 1 A 74 74 ARG H H 163 8.361 7.919 0.442 1
1 899 . 12 1 1 A 74 74 ARG HA H 163 3.836 4.363 -0.527 1
1 906 . 12 1 1 A 74 74 ARG C C 163 174.701 175.118 -0.417 1
1 907 . 12 1 1 A 74 74 ARG CA C 163 57.980 57.605 0.375 1
1 908 . 12 1 1 A 74 74 ARG CB C 163 26.770 27.104 -0.334 1
1 911 . 12 1 1 A 74 74 ARG N N 163 115.130 118.721 -3.591 1
1 912 . 12 1 1 A 75 75 GLU H H 164 7.430 8.082 -0.652 1
1 913 . 12 1 1 A 75 75 GLU HA H 164 4.636 4.479 0.157 1
1 918 . 12 1 1 A 75 75 GLU CA C 164 53.699 54.807 -1.108 1
1 919 . 12 1 1 A 75 75 GLU CB C 164 29.550 28.718 0.832 1
1 921 . 12 1 1 A 75 75 GLU N N 164 120.076 119.036 1.040 1
1 922 . 12 1 1 A 76 76 PRO HA H 165 4.272 4.417 -0.145 1
1 929 . 12 1 1 A 76 76 PRO C C 165 176.649 176.895 -0.246 1
1 930 . 12 1 1 A 76 76 PRO CA C 165 63.204 63.181 0.023 1
1 931 . 12 1 1 A 76 76 PRO CB C 165 31.680 31.778 -0.098 1
1 934 . 12 1 1 A 77 77 ILE H H 166 8.812 8.242 0.570 1
1 935 . 12 1 1 A 77 77 ILE HA H 166 3.838 4.310 -0.472 1
1 945 . 12 1 1 A 77 77 ILE C C 166 175.235 175.938 -0.703 1
1 946 . 12 1 1 A 77 77 ILE CA C 166 62.816 61.019 1.797 1
1 947 . 12 1 1 A 77 77 ILE CB C 166 37.750 37.439 0.311 1
1 951 . 12 1 1 A 77 77 ILE N N 166 123.831 123.892 -0.061 1
1 952 . 12 1 1 A 78 78 THR H H 167 6.625 8.640 -2.015 1
1 953 . 12 1 1 A 78 78 THR HA H 167 4.632 5.077 -0.445 1
1 958 . 12 1 1 A 78 78 THR C C 167 174.143 174.416 -0.273 1
1 959 . 12 1 1 A 78 78 THR CA C 167 58.750 60.257 -1.507 1
1 960 . 12 1 1 A 78 78 THR CB C 167 71.320 71.176 0.144 1
1 962 . 12 1 1 A 78 78 THR N N 167 115.293 118.586 -3.293 1
1 963 . 12 1 1 A 79 79 ALA H H 168 9.088 9.001 0.087 1
1 964 . 12 1 1 A 79 79 ALA HA H 168 3.916 4.116 -0.200 1
1 968 . 12 1 1 A 79 79 ALA C C 168 179.788 179.383 0.405 1
1 969 . 12 1 1 A 79 79 ALA CA C 168 55.480 54.907 0.573 1
1 970 . 12 1 1 A 79 79 ALA CB C 168 17.630 18.538 -0.908 1
1 971 . 12 1 1 A 79 79 ALA N N 168 122.102 127.808 -5.706 1
1 972 . 12 1 1 A 80 80 SER H H 169 7.988 7.683 0.305 1
1 973 . 12 1 1 A 80 80 SER HA H 169 4.058 4.202 -0.144 1
1 976 . 12 1 1 A 80 80 SER C C 169 176.029 176.397 -0.368 1
1 977 . 12 1 1 A 80 80 SER CA C 169 60.750 61.398 -0.648 1
1 978 . 12 1 1 A 80 80 SER CB C 169 62.510 62.928 -0.418 1
1 979 . 12 1 1 A 80 80 SER N N 169 109.541 112.896 -3.355 1
1 980 . 12 1 1 A 81 81 ILE H H 170 6.968 7.258 -0.290 1
1 981 . 12 1 1 A 81 81 ILE HA H 170 4.315 4.423 -0.108 1
1 991 . 12 1 1 A 81 81 ILE C C 170 174.242 175.497 -1.255 1
1 992 . 12 1 1 A 81 81 ILE CA C 170 62.296 61.676 0.620 1
1 993 . 12 1 1 A 81 81 ILE CB C 170 37.686 38.258 -0.572 1
1 997 . 12 1 1 A 81 81 ILE N N 170 112.476 112.220 0.256 1
1 998 . 12 1 1 A 82 82 ILE H H 171 7.345 7.023 0.322 1
1 999 . 12 1 1 A 82 82 ILE HA H 171 4.339 4.613 -0.274 1
1 1009 . 12 1 1 A 82 82 ILE C C 171 174.999 174.616 0.383 1
1 1010 . 12 1 1 A 82 82 ILE CA C 171 61.150 60.413 0.737 1
1 1011 . 12 1 1 A 82 82 ILE CB C 171 37.230 40.370 -3.140 1
1 1015 . 12 1 1 A 82 82 ILE N N 171 124.260 124.599 -0.339 1
1 1016 . 12 1 1 A 83 83 VAL H H 172 7.923 8.953 -1.030 1
1 1017 . 12 1 1 A 83 83 VAL HA H 172 4.673 5.041 -0.368 1
1 1025 . 12 1 1 A 83 83 VAL C C 172 174.887 175.391 -0.504 1
1 1026 . 12 1 1 A 83 83 VAL CA C 172 59.340 58.922 0.418 1
1 1027 . 12 1 1 A 83 83 VAL CB C 172 34.840 35.645 -0.805 1
1 1030 . 12 1 1 A 83 83 VAL N N 172 120.931 122.064 -1.133 1
1 1031 . 12 1 1 A 84 84 LYS H H 173 8.406 8.758 -0.352 1
1 1032 . 12 1 1 A 84 84 LYS HA H 173 4.410 4.657 -0.247 1
1 1041 . 12 1 1 A 84 84 LYS C C 173 178.734 178.536 0.198 1
1 1042 . 12 1 1 A 84 84 LYS CA C 173 56.360 55.395 0.965 1
1 1043 . 12 1 1 A 84 84 LYS CB C 173 33.100 33.064 0.036 1
1 1047 . 12 1 1 A 84 84 LYS N N 173 121.251 120.949 0.302 1
1 1048 . 12 1 1 A 85 85 HIS H H 174 9.221 9.120 0.101 1
1 1049 . 12 1 1 A 85 85 HIS HA H 174 4.024 4.495 -0.471 1
1 1053 . 12 1 1 A 85 85 HIS C C 174 177.183 177.125 0.058 1
1 1054 . 12 1 1 A 85 85 HIS CA C 174 59.460 59.249 0.211 1
1 1055 . 12 1 1 A 85 85 HIS CB C 174 27.920 29.892 -1.972 1
1 1057 . 12 1 1 A 85 85 HIS N N 174 121.545 122.398 -0.853 1
1 1058 . 12 1 1 A 86 86 GLU H H 175 8.699 8.180 0.519 1
1 1059 . 12 1 1 A 86 86 GLU HA H 175 3.900 3.841 0.059 1
1 1064 . 12 1 1 A 86 86 GLU C C 175 177.220 178.004 -0.784 1
1 1065 . 12 1 1 A 86 86 GLU CA C 175 58.420 59.238 -0.818 1
1 1066 . 12 1 1 A 86 86 GLU CB C 175 28.690 29.445 -0.755 1
1 1068 . 12 1 1 A 86 86 GLU N N 175 118.011 118.663 -0.652 1
1 1069 . 12 1 1 A 87 87 GLU H H 176 7.621 7.684 -0.063 1
1 1070 . 12 1 1 A 87 87 GLU HA H 176 4.177 4.392 -0.215 1
1 1075 . 12 1 1 A 87 87 GLU C C 176 175.222 176.021 -0.799 1
1 1076 . 12 1 1 A 87 87 GLU CA C 176 56.390 55.941 0.449 1
1 1077 . 12 1 1 A 87 87 GLU CB C 176 30.430 30.338 0.092 1
1 1079 . 12 1 1 A 87 87 GLU N N 176 116.753 117.809 -1.056 1
1 1080 . 12 1 1 A 88 88 CYS H H 177 7.239 7.693 -0.454 1
1 1081 . 12 1 1 A 88 88 CYS HA H 177 5.148 5.163 -0.015 1
1 1084 . 12 1 1 A 88 88 CYS C C 177 173.249 172.962 0.287 1
1 1085 . 12 1 1 A 88 88 CYS CA C 177 57.240 56.990 0.250 1
1 1086 . 12 1 1 A 88 88 CYS CB C 177 31.020 31.114 -0.094 1
1 1087 . 12 1 1 A 88 88 CYS N N 177 116.096 117.060 -0.964 1
1 1088 . 12 1 1 A 89 89 ILE H H 178 8.912 8.587 0.325 1
1 1089 . 12 1 1 A 89 89 ILE HA H 178 4.580 5.004 -0.424 1
1 1099 . 12 1 1 A 89 89 ILE C C 178 173.386 174.093 -0.707 1
1 1100 . 12 1 1 A 89 89 ILE CA C 178 59.270 58.960 0.310 1
1 1101 . 12 1 1 A 89 89 ILE CB C 178 42.990 41.806 1.184 1
1 1105 . 12 1 1 A 89 89 ILE N N 178 119.490 119.745 -0.255 1
1 1106 . 12 1 1 A 90 90 TYR H H 179 9.047 8.551 0.496 1
1 1107 . 12 1 1 A 90 90 TYR HA H 179 3.753 3.979 -0.226 1
1 1112 . 12 1 1 A 90 90 TYR C C 179 173.932 174.124 -0.192 1
1 1113 . 12 1 1 A 90 90 TYR CA C 179 59.860 57.358 2.502 1
1 1114 . 12 1 1 A 90 90 TYR CB C 179 37.530 38.507 -0.977 1
1 1116 . 12 1 1 A 90 90 TYR N N 179 126.270 121.764 4.506 1
1 1117 . 12 1 1 A 91 91 ASP H H 180 7.462 8.199 -0.737 1
1 1118 . 12 1 1 A 91 91 ASP HA H 180 4.639 4.657 -0.018 1
1 1121 . 12 1 1 A 91 91 ASP C C 180 175.297 176.366 -1.069 1
1 1122 . 12 1 1 A 91 91 ASP CA C 180 52.496 52.718 -0.222 1
1 1123 . 12 1 1 A 91 91 ASP CB C 180 43.380 42.550 0.830 1
1 1124 . 12 1 1 A 91 91 ASP N N 180 129.593 124.707 4.886 1
1 1125 . 12 1 1 A 92 92 ASP H H 181 8.719 9.215 -0.496 1
1 1126 . 12 1 1 A 92 92 ASP HA H 181 4.109 4.354 -0.245 1
1 1129 . 12 1 1 A 92 92 ASP C C 181 177.555 177.471 0.084 1
1 1130 . 12 1 1 A 92 92 ASP CA C 181 56.390 56.550 -0.160 1
1 1131 . 12 1 1 A 92 92 ASP CB C 181 41.330 40.546 0.784 1
1 1132 . 12 1 1 A 92 92 ASP N N 181 125.691 127.666 -1.975 1
1 1133 . 12 1 1 A 93 93 THR H H 182 8.271 7.719 0.552 1
1 1134 . 12 1 1 A 93 93 THR HA H 182 4.036 4.033 0.003 1
1 1139 . 12 1 1 A 93 93 THR C C 182 176.289 176.321 -0.032 1
1 1140 . 12 1 1 A 93 93 THR CA C 182 65.054 64.768 0.286 1
1 1141 . 12 1 1 A 93 93 THR CB C 182 68.560 68.943 -0.383 1
1 1143 . 12 1 1 A 93 93 THR N N 182 114.813 113.634 1.179 1
1 1144 . 12 1 1 A 94 94 ARG H H 183 7.753 7.442 0.311 1
1 1145 . 12 1 1 A 94 94 ARG HA H 183 4.139 4.316 -0.177 1
1 1152 . 12 1 1 A 94 94 ARG C C 183 176.897 177.219 -0.322 1
1 1153 . 12 1 1 A 94 94 ARG CA C 183 55.350 56.179 -0.829 1
1 1154 . 12 1 1 A 94 94 ARG CB C 183 30.930 31.156 -0.226 1
1 1157 . 12 1 1 A 94 94 ARG N N 183 120.101 117.781 2.320 1
1 1158 . 12 1 1 A 95 95 GLY H H 184 8.112 8.830 -0.718 1
1 1159 . 12 1 1 A 95 95 GLY HA2 H 184 3.838 3.897 -0.059 1
1 1160 . 12 1 1 A 95 95 GLY HA3 H 184 3.670 3.899 -0.229 1
1 1161 . 12 1 1 A 95 95 GLY C C 184 173.659 173.400 0.259 1
1 1162 . 12 1 1 A 95 95 GLY CA C 184 46.040 45.874 0.166 1
1 1163 . 12 1 1 A 95 95 GLY N N 184 108.106 108.672 -0.566 1
1 1164 . 12 1 1 A 96 96 ASN H H 185 6.833 7.486 -0.653 1
1 1165 . 12 1 1 A 96 96 ASN HA H 185 4.944 5.279 -0.335 1
1 1170 . 12 1 1 A 96 96 ASN C C 185 174.267 174.350 -0.083 1
1 1171 . 12 1 1 A 96 96 ASN CA C 185 52.560 51.248 1.312 1
1 1172 . 12 1 1 A 96 96 ASN CB C 185 45.890 42.748 3.142 1
1 1173 . 12 1 1 A 96 96 ASN N N 185 113.392 117.410 -4.018 1
1 1175 . 12 1 1 A 97 97 PHE H H 186 9.108 8.836 0.272 1
1 1176 . 12 1 1 A 97 97 PHE HA H 186 4.782 4.791 -0.009 1
1 1183 . 12 1 1 A 97 97 PHE C C 186 174.862 175.598 -0.736 1
1 1184 . 12 1 1 A 97 97 PHE CA C 186 60.056 59.501 0.555 1
1 1185 . 12 1 1 A 97 97 PHE CB C 186 40.180 39.065 1.115 1
1 1188 . 12 1 1 A 97 97 PHE N N 186 118.741 120.012 -1.271 1
1 1189 . 12 1 1 A 98 98 ILE H H 187 8.933 8.599 0.334 1
1 1190 . 12 1 1 A 98 98 ILE HA H 187 5.458 4.948 0.510 1
1 1200 . 12 1 1 A 98 98 ILE C C 187 176.041 175.258 0.783 1
1 1201 . 12 1 1 A 98 98 ILE CA C 187 57.610 58.938 -1.328 1
1 1202 . 12 1 1 A 98 98 ILE CB C 187 42.070 41.782 0.288 1
1 1206 . 12 1 1 A 98 98 ILE N N 187 117.857 119.292 -1.435 1
1 1207 . 12 1 1 A 99 99 ILE H H 188 8.284 8.106 0.178 1
1 1208 . 12 1 1 A 99 99 ILE HA H 188 4.341 4.177 0.164 1
1 1218 . 12 1 1 A 99 99 ILE C C 188 176.413 176.708 -0.295 1
1 1219 . 12 1 1 A 99 99 ILE CA C 188 59.190 61.665 -2.475 1
1 1220 . 12 1 1 A 99 99 ILE CB C 188 37.940 38.190 -0.250 1
1 1224 . 12 1 1 A 99 99 ILE N N 188 121.796 122.882 -1.086 1
1 1225 . 12 1 1 A 100 100 LYS H H 189 8.463 8.527 -0.064 1
1 1226 . 12 1 1 A 100 100 LYS HA H 189 4.040 4.227 -0.187 1
1 1235 . 12 1 1 A 100 100 LYS C C 189 176.848 177.035 -0.187 1
1 1236 . 12 1 1 A 100 100 LYS CA C 189 57.241 56.286 0.955 1
1 1237 . 12 1 1 A 100 100 LYS CB C 189 33.400 32.844 0.556 1
1 1241 . 12 1 1 A 100 100 LYS N N 189 127.995 124.297 3.698 1
1 1242 . 12 1 1 A 101 101 GLY H H 190 8.346 8.322 0.024 1
1 1243 . 12 1 1 A 101 101 GLY HA2 H 190 3.947 3.977 -0.030 1
1 1244 . 12 1 1 A 101 101 GLY HA3 H 190 3.813 3.985 -0.172 1
1 1245 . 12 1 1 A 101 101 GLY C C 190 172.902 173.617 -0.715 1
1 1246 . 12 1 1 A 101 101 GLY CA C 190 44.920 46.033 -1.113 1
1 1247 . 12 1 1 A 101 101 GLY N N 190 110.882 112.959 -2.077 1
1 7 . 13 1 1 A 2 2 GLN H H 91 8.786 8.273 0.513 1
1 8 . 13 1 1 A 2 2 GLN HA H 91 4.005 3.945 0.060 1
1 15 . 13 1 1 A 2 2 GLN C C 91 177.270 178.209 -0.939 1
1 16 . 13 1 1 A 2 2 GLN CA C 91 58.220 59.027 -0.807 1
1 17 . 13 1 1 A 2 2 GLN CB C 91 28.650 28.756 -0.106 1
1 19 . 13 1 1 A 2 2 GLN N N 91 121.993 121.910 0.083 1
1 21 . 13 1 1 A 3 3 GLU H H 92 8.430 8.303 0.127 1
1 22 . 13 1 1 A 3 3 GLU HA H 92 4.007 4.099 -0.092 1
1 27 . 13 1 1 A 3 3 GLU C C 92 178.287 178.777 -0.490 1
1 28 . 13 1 1 A 3 3 GLU CA C 92 59.490 59.258 0.232 1
1 29 . 13 1 1 A 3 3 GLU CB C 92 29.506 29.367 0.139 1
1 31 . 13 1 1 A 3 3 GLU N N 92 120.195 118.709 1.486 1
1 32 . 13 1 1 A 4 4 SER H H 93 8.209 7.786 0.423 1
1 33 . 13 1 1 A 4 4 SER HA H 93 4.272 4.296 -0.024 1
1 36 . 13 1 1 A 4 4 SER C C 93 177.369 177.478 -0.109 1
1 37 . 13 1 1 A 4 4 SER CA C 93 61.044 61.361 -0.317 1
1 38 . 13 1 1 A 4 4 SER CB C 93 62.950 63.005 -0.055 1
1 39 . 13 1 1 A 4 4 SER N N 93 115.524 115.267 0.257 1
1 40 . 13 1 1 A 5 5 ILE H H 94 8.080 7.759 0.321 1
1 41 . 13 1 1 A 5 5 ILE HA H 94 3.530 3.579 -0.049 1
1 51 . 13 1 1 A 5 5 ILE C C 94 177.778 177.758 0.020 1
1 52 . 13 1 1 A 5 5 ILE CA C 94 65.710 65.278 0.432 1
1 53 . 13 1 1 A 5 5 ILE CB C 94 37.800 37.551 0.249 1
1 57 . 13 1 1 A 5 5 ILE N N 94 124.148 121.380 2.768 1
1 58 . 13 1 1 A 6 6 GLN H H 95 8.374 8.230 0.144 1
1 59 . 13 1 1 A 6 6 GLN HA H 95 4.125 4.193 -0.068 1
1 66 . 13 1 1 A 6 6 GLN C C 95 179.726 178.931 0.795 1
1 67 . 13 1 1 A 6 6 GLN CA C 95 59.190 58.880 0.310 1
1 68 . 13 1 1 A 6 6 GLN CB C 95 27.060 27.826 -0.766 1
1 70 . 13 1 1 A 6 6 GLN N N 95 118.257 118.181 0.076 1
1 72 . 13 1 1 A 7 7 ASN H H 96 8.456 7.851 0.605 1
1 73 . 13 1 1 A 7 7 ASN HA H 96 4.446 4.519 -0.073 1
1 78 . 13 1 1 A 7 7 ASN C C 96 177.257 178.380 -1.123 1
1 79 . 13 1 1 A 7 7 ASN CA C 96 56.020 56.123 -0.103 1
1 80 . 13 1 1 A 7 7 ASN CB C 96 38.126 37.682 0.444 1
1 81 . 13 1 1 A 7 7 ASN N N 96 118.597 118.725 -0.128 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 4.054 0.075 1
1 93 . 13 1 1 A 8 8 LYS C C 97 179.143 179.604 -0.461 1
1 94 . 13 1 1 A 8 8 LYS CA C 97 59.126 59.429 -0.303 1
1 95 . 13 1 1 A 8 8 LYS CB C 97 32.070 32.430 -0.360 1
1 99 . 13 1 1 A 8 8 LYS N N 97 122.381 119.105 3.276 1
1 100 . 13 1 1 A 9 9 ILE H H 98 8.452 8.042 0.410 1
1 101 . 13 1 1 A 9 9 ILE HA H 98 3.480 3.845 -0.365 1
1 111 . 13 1 1 A 9 9 ILE C C 98 177.406 178.346 -0.940 1
1 112 . 13 1 1 A 9 9 ILE CA C 98 66.430 64.921 1.509 1
1 113 . 13 1 1 A 9 9 ILE CB C 98 37.980 37.409 0.571 1
1 117 . 13 1 1 A 9 9 ILE N N 98 119.950 121.107 -1.157 1
1 118 . 13 1 1 A 10 10 SER H H 99 7.924 8.012 -0.088 1
1 119 . 13 1 1 A 10 10 SER HA H 99 3.983 4.192 -0.209 1
1 122 . 13 1 1 A 10 10 SER C C 99 176.327 177.171 -0.844 1
1 123 . 13 1 1 A 10 10 SER CA C 99 61.990 61.233 0.757 1
1 124 . 13 1 1 A 10 10 SER CB C 99 62.790 63.016 -0.226 1
1 125 . 13 1 1 A 10 10 SER N N 99 113.568 116.820 -3.252 1
1 126 . 13 1 1 A 11 11 GLN H H 100 7.832 7.307 0.525 1
1 127 . 13 1 1 A 11 11 GLN HA H 100 4.238 4.093 0.145 1
1 134 . 13 1 1 A 11 11 GLN C C 100 178.088 179.023 -0.935 1
1 135 . 13 1 1 A 11 11 GLN CA C 100 57.900 58.540 -0.640 1
1 136 . 13 1 1 A 11 11 GLN CB C 100 29.790 28.946 0.844 1
1 138 . 13 1 1 A 11 11 GLN N N 100 117.487 121.086 -3.599 1
1 140 . 13 1 1 A 12 12 CYS H H 101 7.920 8.456 -0.536 1
1 141 . 13 1 1 A 12 12 CYS HA H 101 4.657 4.504 0.153 1
1 144 . 13 1 1 A 12 12 CYS C C 101 175.446 174.946 0.500 1
1 145 . 13 1 1 A 12 12 CYS CA C 101 60.654 62.212 -1.558 1
1 146 . 13 1 1 A 12 12 CYS CB C 101 29.310 26.703 2.607 1
1 147 . 13 1 1 A 12 12 CYS N N 101 114.221 118.615 -4.394 1
1 148 . 13 1 1 A 13 13 LYS H H 102 8.029 7.203 0.826 1
1 149 . 13 1 1 A 13 13 LYS HA H 102 5.069 4.731 0.338 1
1 158 . 13 1 1 A 13 13 LYS C C 102 174.800 176.342 -1.542 1
1 159 . 13 1 1 A 13 13 LYS CA C 102 56.394 56.059 0.335 1
1 160 . 13 1 1 A 13 13 LYS CB C 102 32.770 33.428 -0.658 1
1 164 . 13 1 1 A 13 13 LYS N N 102 124.129 119.237 4.892 1
1 165 . 13 1 1 A 14 14 PHE H H 103 8.737 8.705 0.032 1
1 166 . 13 1 1 A 14 14 PHE HA H 103 5.059 5.084 -0.025 1
1 174 . 13 1 1 A 14 14 PHE C C 103 173.560 173.341 0.219 1
1 175 . 13 1 1 A 14 14 PHE CA C 103 55.470 56.117 -0.647 1
1 176 . 13 1 1 A 14 14 PHE CB C 103 41.760 40.924 0.836 1
1 180 . 13 1 1 A 14 14 PHE N N 103 118.661 116.440 2.221 1
1 181 . 13 1 1 A 15 15 SER H H 104 8.826 8.420 0.406 1
1 182 . 13 1 1 A 15 15 SER HA H 104 4.602 4.610 -0.008 1
1 185 . 13 1 1 A 15 15 SER C C 104 173.795 173.762 0.033 1
1 186 . 13 1 1 A 15 15 SER CA C 104 58.610 58.142 0.468 1
1 187 . 13 1 1 A 15 15 SER CB C 104 62.690 62.886 -0.196 1
1 188 . 13 1 1 A 15 15 SER N N 104 117.781 115.001 2.780 1
1 189 . 13 1 1 A 16 16 VAL H H 105 7.784 8.086 -0.302 1
1 190 . 13 1 1 A 16 16 VAL HA H 105 3.370 3.991 -0.621 1
1 198 . 13 1 1 A 16 16 VAL C C 105 174.987 175.269 -0.282 1
1 199 . 13 1 1 A 16 16 VAL CA C 105 63.580 62.567 1.013 1
1 200 . 13 1 1 A 16 16 VAL CB C 105 31.410 30.499 0.911 1
1 203 . 13 1 1 A 16 16 VAL N N 105 129.075 125.997 3.078 1
1 204 . 13 1 1 A 17 17 CYS H H 106 8.536 8.328 0.208 1
1 205 . 13 1 1 A 17 17 CYS HA H 106 5.011 4.894 0.117 1
1 208 . 13 1 1 A 17 17 CYS CA C 106 55.260 56.550 -1.290 1
1 209 . 13 1 1 A 17 17 CYS CB C 106 28.210 28.569 -0.359 1
1 210 . 13 1 1 A 17 17 CYS N N 106 130.045 127.259 2.786 1
1 211 . 13 1 1 A 18 18 PRO HA H 107 3.991 4.335 -0.344 1
1 218 . 13 1 1 A 18 18 PRO C C 107 178.188 178.433 -0.245 1
1 219 . 13 1 1 A 18 18 PRO CA C 107 65.940 64.822 1.118 1
1 220 . 13 1 1 A 18 18 PRO CB C 107 32.000 32.103 -0.103 1
1 223 . 13 1 1 A 19 19 GLU H H 108 9.260 9.027 0.233 1
1 224 . 13 1 1 A 19 19 GLU HA H 108 4.119 4.120 -0.001 1
1 229 . 13 1 1 A 19 19 GLU C C 108 178.721 178.981 -0.260 1
1 230 . 13 1 1 A 19 19 GLU CA C 108 59.300 58.794 0.506 1
1 231 . 13 1 1 A 19 19 GLU CB C 108 28.920 28.732 0.188 1
1 233 . 13 1 1 A 19 19 GLU N N 108 118.270 116.025 2.245 1
1 234 . 13 1 1 A 20 20 ARG H H 109 7.672 7.827 -0.155 1
1 235 . 13 1 1 A 20 20 ARG HA H 109 4.331 4.182 0.149 1
1 242 . 13 1 1 A 20 20 ARG C C 109 177.977 178.667 -0.690 1
1 243 . 13 1 1 A 20 20 ARG CA C 109 57.350 58.442 -1.092 1
1 244 . 13 1 1 A 20 20 ARG CB C 109 30.820 29.694 1.126 1
1 247 . 13 1 1 A 20 20 ARG N N 109 118.357 120.285 -1.928 1
1 248 . 13 1 1 A 21 21 LEU H H 110 7.601 7.857 -0.256 1
1 249 . 13 1 1 A 21 21 LEU HA H 110 4.380 4.266 0.114 1
1 259 . 13 1 1 A 21 21 LEU C C 110 176.562 176.239 0.323 1
1 260 . 13 1 1 A 21 21 LEU CA C 110 56.096 55.368 0.728 1
1 261 . 13 1 1 A 21 21 LEU CB C 110 44.016 42.033 1.983 1
1 265 . 13 1 1 A 21 21 LEU N N 110 118.626 117.971 0.655 1
1 266 . 13 1 1 A 22 22 GLN H H 111 7.750 7.500 0.250 1
1 267 . 13 1 1 A 22 22 GLN HA H 111 3.870 3.929 -0.059 1
1 274 . 13 1 1 A 22 22 GLN C C 111 173.336 174.212 -0.876 1
1 275 . 13 1 1 A 22 22 GLN CA C 111 56.510 57.256 -0.746 1
1 276 . 13 1 1 A 22 22 GLN CB C 111 26.800 26.409 0.391 1
1 278 . 13 1 1 A 22 22 GLN N N 111 113.926 115.580 -1.654 1
1 280 . 13 1 1 A 23 23 CYS H H 112 7.407 7.358 0.049 1
1 281 . 13 1 1 A 23 23 CYS HA H 112 4.469 4.928 -0.459 1
1 284 . 13 1 1 A 23 23 CYS CA C 112 52.650 57.081 -4.431 1
1 285 . 13 1 1 A 23 23 CYS CB C 112 29.750 28.445 1.305 1
1 286 . 13 1 1 A 23 23 CYS N N 112 112.681 117.883 -5.202 1
1 287 . 13 1 1 A 24 24 PRO HA H 113 4.408 4.631 -0.223 1
1 294 . 13 1 1 A 24 24 PRO C C 113 178.175 177.429 0.746 1
1 295 . 13 1 1 A 24 24 PRO CA C 113 62.040 62.731 -0.691 1
1 296 . 13 1 1 A 24 24 PRO CB C 113 31.920 32.778 -0.858 1
1 299 . 13 1 1 A 25 25 LEU H H 114 8.593 8.422 0.171 1
1 300 . 13 1 1 A 25 25 LEU HA H 114 3.765 3.922 -0.157 1
1 310 . 13 1 1 A 25 25 LEU C C 114 179.950 178.876 1.074 1
1 311 . 13 1 1 A 25 25 LEU CA C 114 57.674 57.695 -0.021 1
1 312 . 13 1 1 A 25 25 LEU CB C 114 40.690 41.526 -0.836 1
1 316 . 13 1 1 A 25 25 LEU N N 114 123.729 123.649 0.080 1
1 317 . 13 1 1 A 26 26 GLU H H 115 9.108 8.610 0.498 1
1 318 . 13 1 1 A 26 26 GLU HA H 115 3.876 4.035 -0.159 1
1 323 . 13 1 1 A 26 26 GLU C C 115 177.505 178.509 -1.004 1
1 324 . 13 1 1 A 26 26 GLU CA C 115 59.410 59.118 0.292 1
1 325 . 13 1 1 A 26 26 GLU CB C 115 28.460 29.474 -1.014 1
1 327 . 13 1 1 A 26 26 GLU N N 115 116.817 117.351 -0.534 1
1 328 . 13 1 1 A 27 27 ALA H H 116 7.360 7.639 -0.279 1
1 329 . 13 1 1 A 27 27 ALA HA H 116 4.408 4.149 0.259 1
1 333 . 13 1 1 A 27 27 ALA C C 116 177.046 177.848 -0.802 1
1 334 . 13 1 1 A 27 27 ALA CA C 116 52.970 54.290 -1.320 1
1 335 . 13 1 1 A 27 27 ALA CB C 116 19.916 18.492 1.424 1
1 336 . 13 1 1 A 27 27 ALA N N 116 118.966 120.709 -1.743 1
1 337 . 13 1 1 A 28 28 ILE H H 117 7.168 6.888 0.280 1
1 338 . 13 1 1 A 28 28 ILE HA H 117 4.432 4.352 0.080 1
1 348 . 13 1 1 A 28 28 ILE C C 117 172.641 175.592 -2.951 1
1 349 . 13 1 1 A 28 28 ILE CA C 117 59.980 59.488 0.492 1
1 350 . 13 1 1 A 28 28 ILE CB C 117 37.350 37.699 -0.349 1
1 354 . 13 1 1 A 28 28 ILE N N 117 108.913 109.461 -0.548 1
1 355 . 13 1 1 A 29 29 GLN H H 118 6.562 7.189 -0.627 1
1 356 . 13 1 1 A 29 29 GLN HA H 118 3.922 4.407 -0.485 1
1 363 . 13 1 1 A 29 29 GLN C C 118 175.049 175.624 -0.575 1
1 364 . 13 1 1 A 29 29 GLN CA C 118 54.596 55.564 -0.968 1
1 365 . 13 1 1 A 29 29 GLN CB C 118 29.570 29.871 -0.301 1
1 367 . 13 1 1 A 29 29 GLN N N 118 116.455 123.063 -6.608 1
1 369 . 13 1 1 A 30 30 CYS H H 119 8.138 8.524 -0.386 1
1 370 . 13 1 1 A 30 30 CYS HA H 119 4.580 4.748 -0.168 1
1 373 . 13 1 1 A 30 30 CYS CA C 119 57.810 56.817 0.993 1
1 374 . 13 1 1 A 30 30 CYS CB C 119 30.200 28.637 1.563 1
1 375 . 13 1 1 A 30 30 CYS N N 119 134.136 125.523 8.613 1
1 376 . 13 1 1 A 31 31 PRO HA H 120 4.424 4.460 -0.036 1
1 383 . 13 1 1 A 31 31 PRO C C 120 177.431 177.425 0.006 1
1 384 . 13 1 1 A 31 31 PRO CA C 120 64.060 63.830 0.230 1
1 385 . 13 1 1 A 31 31 PRO CB C 120 32.776 31.811 0.965 1
1 388 . 13 1 1 A 32 32 ILE H H 121 11.318 7.389 3.929 1
1 389 . 13 1 1 A 32 32 ILE HA H 121 4.038 4.006 0.032 1
1 399 . 13 1 1 A 32 32 ILE C C 121 178.485 178.205 0.280 1
1 400 . 13 1 1 A 32 32 ILE CA C 121 64.060 63.792 0.268 1
1 401 . 13 1 1 A 32 32 ILE CB C 121 39.340 38.259 1.081 1
1 405 . 13 1 1 A 32 32 ILE N N 121 124.500 117.141 7.359 1
1 406 . 13 1 1 A 33 33 THR H H 122 9.928 7.490 2.438 1
1 407 . 13 1 1 A 33 33 THR HA H 122 4.048 4.290 -0.242 1
1 412 . 13 1 1 A 33 33 THR C C 122 175.793 175.103 0.690 1
1 413 . 13 1 1 A 33 33 THR CA C 122 62.990 62.355 0.635 1
1 414 . 13 1 1 A 33 33 THR CB C 122 70.300 70.248 0.052 1
1 416 . 13 1 1 A 33 33 THR N N 122 115.136 109.638 5.498 1
1 417 . 13 1 1 A 34 34 LEU H H 123 8.439 7.842 0.597 1
1 418 . 13 1 1 A 34 34 LEU HA H 123 3.912 3.791 0.121 1
1 428 . 13 1 1 A 34 34 LEU C C 123 175.495 175.117 0.378 1
1 429 . 13 1 1 A 34 34 LEU CA C 123 56.290 56.228 0.062 1
1 430 . 13 1 1 A 34 34 LEU CB C 123 38.500 39.745 -1.245 1
1 434 . 13 1 1 A 34 34 LEU N N 123 117.230 118.768 -1.538 1
1 435 . 13 1 1 A 35 35 GLU H H 124 7.816 6.963 0.853 1
1 436 . 13 1 1 A 35 35 GLU HA H 124 4.634 4.729 -0.095 1
1 441 . 13 1 1 A 35 35 GLU C C 124 174.838 174.041 0.797 1
1 442 . 13 1 1 A 35 35 GLU CA C 124 53.780 54.883 -1.103 1
1 443 . 13 1 1 A 35 35 GLU CB C 124 33.710 32.483 1.227 1
1 445 . 13 1 1 A 35 35 GLU N N 124 116.577 114.050 2.527 1
1 446 . 13 1 1 A 36 36 GLN H H 125 8.532 8.400 0.132 1
1 447 . 13 1 1 A 36 36 GLN HA H 125 4.958 4.327 0.631 1
1 454 . 13 1 1 A 36 36 GLN CA C 125 53.350 53.462 -0.112 1
1 455 . 13 1 1 A 36 36 GLN CB C 125 29.950 29.405 0.545 1
1 457 . 13 1 1 A 36 36 GLN N N 125 123.034 123.593 -0.559 1
1 459 . 13 1 1 A 37 37 PRO HA H 126 4.458 4.678 -0.220 1
1 466 . 13 1 1 A 37 37 PRO C C 126 176.314 176.398 -0.084 1
1 467 . 13 1 1 A 37 37 PRO CA C 126 62.816 62.628 0.188 1
1 468 . 13 1 1 A 37 37 PRO CB C 126 33.070 32.935 0.135 1
1 471 . 13 1 1 A 38 38 GLU H H 127 8.626 8.323 0.303 1
1 472 . 13 1 1 A 38 38 GLU HA H 127 4.274 4.250 0.024 1
1 477 . 13 1 1 A 38 38 GLU C C 127 177.877 176.187 1.690 1
1 478 . 13 1 1 A 38 38 GLU CA C 127 58.730 56.962 1.768 1
1 479 . 13 1 1 A 38 38 GLU CB C 127 30.340 30.334 0.006 1
1 481 . 13 1 1 A 38 38 GLU N N 127 120.691 118.973 1.718 1
1 482 . 13 1 1 A 39 39 LYS H H 128 7.861 7.572 0.289 1
1 483 . 13 1 1 A 39 39 LYS HA H 128 4.889 4.738 0.151 1
1 492 . 13 1 1 A 39 39 LYS C C 128 175.446 174.983 0.463 1
1 493 . 13 1 1 A 39 39 LYS CA C 128 53.670 54.755 -1.085 1
1 494 . 13 1 1 A 39 39 LYS CB C 128 33.630 35.859 -2.229 1
1 498 . 13 1 1 A 39 39 LYS N N 128 117.878 117.402 0.476 1
1 499 . 13 1 1 A 40 40 GLY H H 129 8.426 8.027 0.399 1
1 500 . 13 1 1 A 40 40 GLY HA2 H 129 4.970 4.045 0.925 1
1 501 . 13 1 1 A 40 40 GLY HA3 H 129 2.458 4.174 -1.716 1
1 502 . 13 1 1 A 40 40 GLY C C 129 170.048 172.237 -2.189 1
1 503 . 13 1 1 A 40 40 GLY CA C 129 42.910 45.111 -2.201 1
1 504 . 13 1 1 A 40 40 GLY N N 129 112.604 105.737 6.867 1
1 505 . 13 1 1 A 41 41 ILE H H 130 8.596 9.100 -0.504 1
1 506 . 13 1 1 A 41 41 ILE HA H 130 4.636 5.210 -0.574 1
1 516 . 13 1 1 A 41 41 ILE C C 130 172.691 174.270 -1.579 1
1 517 . 13 1 1 A 41 41 ILE CA C 130 58.500 58.624 -0.124 1
1 518 . 13 1 1 A 41 41 ILE CB C 130 43.320 41.590 1.730 1
1 522 . 13 1 1 A 41 41 ILE N N 130 113.363 116.056 -2.693 1
1 523 . 13 1 1 A 42 42 PHE H H 131 8.994 8.910 0.084 1
1 524 . 13 1 1 A 42 42 PHE HA H 131 5.075 5.440 -0.365 1
1 532 . 13 1 1 A 42 42 PHE C C 131 175.111 175.058 0.053 1
1 533 . 13 1 1 A 42 42 PHE CA C 131 58.680 57.057 1.623 1
1 534 . 13 1 1 A 42 42 PHE CB C 131 42.220 40.787 1.433 1
1 538 . 13 1 1 A 42 42 PHE N N 131 125.156 121.894 3.262 1
1 539 . 13 1 1 A 43 43 VAL H H 132 8.399 9.239 -0.840 1
1 540 . 13 1 1 A 43 43 VAL HA H 132 4.920 4.818 0.102 1
1 548 . 13 1 1 A 43 43 VAL C C 132 178.175 175.192 2.983 1
1 549 . 13 1 1 A 43 43 VAL CA C 132 59.600 60.773 -1.173 1
1 550 . 13 1 1 A 43 43 VAL CB C 132 35.920 35.115 0.805 1
1 553 . 13 1 1 A 43 43 VAL N N 132 119.371 122.758 -3.387 1
1 554 . 13 1 1 A 44 44 LYS H H 133 10.041 8.489 1.552 1
1 555 . 13 1 1 A 44 44 LYS HA H 133 4.920 4.346 0.574 1
1 564 . 13 1 1 A 44 44 LYS C C 133 177.195 175.595 1.600 1
1 565 . 13 1 1 A 44 44 LYS CA C 133 57.310 56.515 0.795 1
1 566 . 13 1 1 A 44 44 LYS CB C 133 34.410 32.536 1.874 1
1 570 . 13 1 1 A 44 44 LYS N N 133 130.928 126.680 4.248 1
1 571 . 13 1 1 A 45 45 ASN H H 134 8.534 8.859 -0.325 1
1 572 . 13 1 1 A 45 45 ASN HA H 134 4.151 4.677 -0.526 1
1 577 . 13 1 1 A 45 45 ASN C C 134 174.217 175.232 -1.015 1
1 578 . 13 1 1 A 45 45 ASN CA C 134 55.290 52.373 2.917 1
1 579 . 13 1 1 A 45 45 ASN CB C 134 37.530 38.219 -0.689 1
1 580 . 13 1 1 A 45 45 ASN N N 134 119.452 124.204 -4.752 1
1 582 . 13 1 1 A 46 46 SER H H 135 7.570 8.057 -0.487 1
1 583 . 13 1 1 A 46 46 SER HA H 135 4.220 4.120 0.100 1
1 586 . 13 1 1 A 46 46 SER C C 135 174.490 176.819 -2.329 1
1 587 . 13 1 1 A 46 46 SER CA C 135 57.090 61.270 -4.180 1
1 588 . 13 1 1 A 46 46 SER CB C 135 64.126 62.878 1.248 1
1 589 . 13 1 1 A 46 46 SER N N 135 105.613 121.408 -15.795 1
1 590 . 13 1 1 A 47 47 ASP H H 136 9.113 8.067 1.046 1
1 591 . 13 1 1 A 47 47 ASP HA H 136 4.220 4.324 -0.104 1
1 594 . 13 1 1 A 47 47 ASP CA C 136 57.610 57.040 0.570 1
1 595 . 13 1 1 A 47 47 ASP CB C 136 40.810 40.319 0.491 1
1 596 . 13 1 1 A 47 47 ASP N N 136 120.995 121.057 -0.062 1
1 597 . 13 1 1 A 48 48 GLY H H 137 8.172 8.079 0.093 1
1 598 . 13 1 1 A 48 48 GLY HA2 H 137 4.096 3.763 0.333 1
1 599 . 13 1 1 A 48 48 GLY HA3 H 137 3.664 3.772 -0.108 1
1 600 . 13 1 1 A 48 48 GLY C C 137 173.990 175.488 -1.498 1
1 601 . 13 1 1 A 48 48 GLY CA C 137 45.130 47.429 -2.299 1
1 602 . 13 1 1 A 48 48 GLY N N 137 105.838 107.225 -1.387 1
1 603 . 13 1 1 A 49 49 SER H H 138 7.252 7.758 -0.506 1
1 604 . 13 1 1 A 49 49 SER HA H 138 4.503 4.725 -0.222 1
1 607 . 13 1 1 A 49 49 SER C C 138 173.857 173.961 -0.104 1
1 608 . 13 1 1 A 49 49 SER CA C 138 57.340 57.153 0.187 1
1 609 . 13 1 1 A 49 49 SER CB C 138 65.370 64.332 1.038 1
1 610 . 13 1 1 A 49 49 SER N N 138 114.942 112.256 2.686 1
1 611 . 13 1 1 A 50 50 ASP H H 139 8.276 7.983 0.293 1
1 612 . 13 1 1 A 50 50 ASP HA H 139 4.618 4.196 0.422 1
1 615 . 13 1 1 A 50 50 ASP C C 139 174.577 174.948 -0.371 1
1 616 . 13 1 1 A 50 50 ASP CA C 139 53.116 55.606 -2.490 1
1 617 . 13 1 1 A 50 50 ASP CB C 139 40.520 39.331 1.189 1
1 618 . 13 1 1 A 50 50 ASP N N 139 122.088 117.046 5.042 1
1 619 . 13 1 1 A 51 51 VAL H H 140 8.192 7.504 0.688 1
1 620 . 13 1 1 A 51 51 VAL HA H 140 4.299 4.201 0.098 1
1 628 . 13 1 1 A 51 51 VAL C C 140 175.867 175.277 0.590 1
1 629 . 13 1 1 A 51 51 VAL CA C 140 62.950 62.207 0.743 1
1 630 . 13 1 1 A 51 51 VAL CB C 140 33.230 32.643 0.587 1
1 632 . 13 1 1 A 51 51 VAL N N 140 121.167 119.278 1.889 1
1 633 . 13 1 1 A 52 52 CYS H H 141 8.391 8.880 -0.489 1
1 634 . 13 1 1 A 52 52 CYS HA H 141 5.247 5.155 0.092 1
1 637 . 13 1 1 A 52 52 CYS C C 141 172.778 174.400 -1.622 1
1 638 . 13 1 1 A 52 52 CYS CA C 141 56.480 58.233 -1.753 1
1 639 . 13 1 1 A 52 52 CYS CB C 141 31.960 29.009 2.951 1
1 640 . 13 1 1 A 52 52 CYS N N 141 121.884 127.002 -5.118 1
1 641 . 13 1 1 A 53 53 THR H H 142 8.777 8.923 -0.146 1
1 642 . 13 1 1 A 53 53 THR HA H 142 4.489 4.962 -0.473 1
1 648 . 13 1 1 A 53 53 THR C C 142 171.885 172.342 -0.457 1
1 649 . 13 1 1 A 53 53 THR CA C 142 62.070 61.289 0.781 1
1 650 . 13 1 1 A 53 53 THR CB C 142 71.390 71.567 -0.177 1
1 652 . 13 1 1 A 53 53 THR N N 142 118.132 118.645 -0.513 1
1 653 . 13 1 1 A 54 54 LEU H H 143 8.409 8.296 0.113 1
1 654 . 13 1 1 A 54 54 LEU HA H 143 4.276 4.443 -0.167 1
1 664 . 13 1 1 A 54 54 LEU C C 143 174.366 174.078 0.288 1
1 665 . 13 1 1 A 54 54 LEU CA C 143 54.330 53.008 1.322 1
1 666 . 13 1 1 A 54 54 LEU CB C 143 42.396 42.551 -0.155 1
1 670 . 13 1 1 A 54 54 LEU N N 143 127.980 127.787 0.193 1
1 671 . 13 1 1 A 55 55 PHE H H 144 8.646 8.784 -0.138 1
1 672 . 13 1 1 A 55 55 PHE HA H 144 5.455 4.848 0.607 1
1 680 . 13 1 1 A 55 55 PHE C C 144 176.054 174.801 1.253 1
1 681 . 13 1 1 A 55 55 PHE CA C 144 55.250 56.069 -0.819 1
1 682 . 13 1 1 A 55 55 PHE CB C 144 44.100 41.831 2.269 1
1 686 . 13 1 1 A 55 55 PHE N N 144 122.010 126.687 -4.677 1
1 687 . 13 1 1 A 56 56 ASP H H 145 11.575 8.367 3.208 1
1 688 . 13 1 1 A 56 56 ASP HA H 145 4.416 4.454 -0.038 1
1 691 . 13 1 1 A 56 56 ASP C C 145 176.748 177.476 -0.728 1
1 692 . 13 1 1 A 56 56 ASP CA C 145 55.840 54.825 1.015 1
1 693 . 13 1 1 A 56 56 ASP CB C 145 44.390 42.194 2.196 1
1 694 . 13 1 1 A 56 56 ASP N N 145 121.936 124.265 -2.329 1
1 695 . 13 1 1 A 57 57 ALA H H 146 8.508 8.573 -0.065 1
1 696 . 13 1 1 A 57 57 ALA HA H 146 3.797 4.022 -0.225 1
1 700 . 13 1 1 A 57 57 ALA C C 146 178.696 179.980 -1.284 1
1 701 . 13 1 1 A 57 57 ALA CA C 146 55.990 55.453 0.537 1
1 702 . 13 1 1 A 57 57 ALA CB C 146 18.840 18.079 0.761 1
1 703 . 13 1 1 A 57 57 ALA N N 146 130.243 129.361 0.882 1
1 704 . 13 1 1 A 58 58 ALA H H 147 8.378 7.616 0.762 1
1 705 . 13 1 1 A 58 58 ALA HA H 147 4.078 4.234 -0.156 1
1 709 . 13 1 1 A 58 58 ALA C C 147 181.091 179.298 1.793 1
1 710 . 13 1 1 A 58 58 ALA CA C 147 54.770 54.998 -0.228 1
1 711 . 13 1 1 A 58 58 ALA CB C 147 17.700 18.465 -0.765 1
1 712 . 13 1 1 A 58 58 ALA N N 147 121.997 119.282 2.715 1
1 713 . 13 1 1 A 59 59 ALA H H 148 9.138 7.947 1.191 1
1 714 . 13 1 1 A 59 59 ALA HA H 148 3.975 4.016 -0.041 1
1 718 . 13 1 1 A 59 59 ALA C C 148 180.508 179.917 0.591 1
1 719 . 13 1 1 A 59 59 ALA CA C 148 54.840 55.232 -0.392 1
1 720 . 13 1 1 A 59 59 ALA CB C 148 18.600 18.648 -0.048 1
1 721 . 13 1 1 A 59 59 ALA N N 148 123.595 120.520 3.075 1
1 722 . 13 1 1 A 60 60 PHE H H 149 8.814 8.208 0.606 1
1 723 . 13 1 1 A 60 60 PHE HA H 149 3.722 4.004 -0.282 1
1 731 . 13 1 1 A 60 60 PHE C C 149 176.773 177.507 -0.734 1
1 732 . 13 1 1 A 60 60 PHE CA C 149 62.030 61.617 0.413 1
1 733 . 13 1 1 A 60 60 PHE CB C 149 39.960 38.861 1.099 1
1 737 . 13 1 1 A 60 60 PHE N N 149 120.354 119.697 0.657 1
1 738 . 13 1 1 A 61 61 SER H H 150 8.276 8.040 0.236 1
1 739 . 13 1 1 A 61 61 SER HA H 150 3.880 4.091 -0.211 1
1 742 . 13 1 1 A 61 61 SER C C 150 177.691 177.384 0.307 1
1 743 . 13 1 1 A 61 61 SER CA C 150 62.190 61.430 0.760 1
1 744 . 13 1 1 A 61 61 SER CB C 150 63.016 63.068 -0.052 1
1 745 . 13 1 1 A 61 61 SER N N 150 112.086 114.067 -1.981 1
1 746 . 13 1 1 A 62 62 ARG H H 151 7.829 7.773 0.056 1
1 747 . 13 1 1 A 62 62 ARG HA H 151 3.971 4.089 -0.118 1
1 754 . 13 1 1 A 62 62 ARG C C 151 178.287 178.707 -0.420 1
1 755 . 13 1 1 A 62 62 ARG CA C 151 59.340 59.051 0.289 1
1 756 . 13 1 1 A 62 62 ARG CB C 151 29.760 29.901 -0.141 1
1 759 . 13 1 1 A 62 62 ARG N N 151 121.090 121.525 -0.435 1
1 760 . 13 1 1 A 63 63 LEU H H 152 7.390 7.699 -0.309 1
1 761 . 13 1 1 A 63 63 LEU HA H 152 3.791 3.977 -0.186 1
1 771 . 13 1 1 A 63 63 LEU C C 152 179.106 179.091 0.015 1
1 772 . 13 1 1 A 63 63 LEU CA C 152 58.900 57.927 0.973 1
1 773 . 13 1 1 A 63 63 LEU CB C 152 41.140 41.452 -0.312 1
1 777 . 13 1 1 A 63 63 LEU N N 152 121.129 119.634 1.495 1
1 778 . 13 1 1 A 64 64 VAL H H 153 7.552 7.891 -0.339 1
1 779 . 13 1 1 A 64 64 VAL HA H 153 3.411 3.527 -0.116 1
1 787 . 13 1 1 A 64 64 VAL C C 153 180.595 178.075 2.520 1
1 788 . 13 1 1 A 64 64 VAL CA C 153 65.644 66.289 -0.645 1
1 789 . 13 1 1 A 64 64 VAL CB C 153 31.410 31.499 -0.089 1
1 792 . 13 1 1 A 64 64 VAL N N 153 118.280 118.646 -0.366 1
1 793 . 13 1 1 A 65 65 GLY H H 154 8.061 8.211 -0.150 1
1 794 . 13 1 1 A 65 65 GLY HA2 H 154 3.846 3.736 0.110 1
1 795 . 13 1 1 A 65 65 GLY HA3 H 154 3.809 3.738 0.071 1
1 796 . 13 1 1 A 65 65 GLY C C 154 175.235 176.476 -1.241 1
1 797 . 13 1 1 A 65 65 GLY CA C 154 46.630 47.142 -0.512 1
1 798 . 13 1 1 A 65 65 GLY N N 154 108.622 107.764 0.858 1
1 799 . 13 1 1 A 66 66 GLU H H 155 7.528 7.636 -0.108 1
1 800 . 13 1 1 A 66 66 GLU HA H 155 4.228 4.292 -0.064 1
1 805 . 13 1 1 A 66 66 GLU C C 155 176.761 176.735 0.026 1
1 806 . 13 1 1 A 66 66 GLU CA C 155 56.590 56.504 0.086 1
1 807 . 13 1 1 A 66 66 GLU CB C 155 30.490 30.223 0.267 1
1 809 . 13 1 1 A 66 66 GLU N N 155 118.361 119.042 -0.681 1
1 810 . 13 1 1 A 67 67 GLY H H 156 7.884 7.731 0.153 1
1 811 . 13 1 1 A 67 67 GLY HA2 H 156 3.918 3.932 -0.014 1
1 812 . 13 1 1 A 67 67 GLY HA3 H 156 3.747 3.943 -0.196 1
1 813 . 13 1 1 A 67 67 GLY C C 156 174.788 174.343 0.445 1
1 814 . 13 1 1 A 67 67 GLY CA C 156 45.890 45.357 0.533 1
1 815 . 13 1 1 A 67 67 GLY N N 156 108.465 107.787 0.678 1
1 816 . 13 1 1 A 68 68 LEU H H 157 7.332 7.943 -0.611 1
1 817 . 13 1 1 A 68 68 LEU HA H 157 4.361 4.555 -0.194 1
1 827 . 13 1 1 A 68 68 LEU CA C 157 53.060 52.358 0.702 1
1 828 . 13 1 1 A 68 68 LEU CB C 157 41.100 41.516 -0.416 1
1 832 . 13 1 1 A 68 68 LEU N N 157 121.920 121.778 0.142 1
1 833 . 13 1 1 A 69 69 PRO HA H 158 4.485 4.543 -0.058 1
1 840 . 13 1 1 A 69 69 PRO C C 158 174.602 176.179 -1.577 1
1 841 . 13 1 1 A 69 69 PRO CA C 158 61.556 62.189 -0.633 1
1 842 . 13 1 1 A 69 69 PRO CB C 158 32.370 32.405 -0.035 1
1 845 . 13 1 1 A 70 70 HIS H H 159 8.759 8.657 0.102 1
1 846 . 13 1 1 A 70 70 HIS HA H 159 3.947 4.361 -0.414 1
1 852 . 13 1 1 A 70 70 HIS CA C 159 56.250 55.180 1.070 1
1 853 . 13 1 1 A 70 70 HIS CB C 159 32.280 30.742 1.538 1
1 856 . 13 1 1 A 70 70 HIS N N 159 119.423 121.671 -2.248 1
1 857 . 13 1 1 A 71 71 PRO HA H 160 4.424 4.302 0.122 1
1 864 . 13 1 1 A 71 71 PRO C C 160 177.567 178.343 -0.776 1
1 865 . 13 1 1 A 71 71 PRO CA C 160 64.574 64.849 -0.275 1
1 866 . 13 1 1 A 71 71 PRO CB C 160 32.340 32.054 0.286 1
1 869 . 13 1 1 A 72 72 LEU H H 161 10.123 7.701 2.422 1
1 870 . 13 1 1 A 72 72 LEU HA H 161 4.778 4.312 0.466 1
1 880 . 13 1 1 A 72 72 LEU C C 161 178.721 177.900 0.821 1
1 881 . 13 1 1 A 72 72 LEU CA C 161 55.800 57.115 -1.315 1
1 882 . 13 1 1 A 72 72 LEU CB C 161 42.440 43.130 -0.690 1
1 886 . 13 1 1 A 72 72 LEU N N 161 117.374 117.055 0.319 1
1 887 . 13 1 1 A 73 73 THR H H 162 7.523 7.782 -0.259 1
1 888 . 13 1 1 A 73 73 THR HA H 162 4.291 4.516 -0.225 1
1 893 . 13 1 1 A 73 73 THR C C 162 175.557 174.353 1.204 1
1 894 . 13 1 1 A 73 73 THR CA C 162 61.440 62.330 -0.890 1
1 895 . 13 1 1 A 73 73 THR CB C 162 70.500 69.715 0.785 1
1 897 . 13 1 1 A 73 73 THR N N 162 107.787 111.379 -3.592 1
1 898 . 13 1 1 A 74 74 ARG H H 163 8.361 7.842 0.519 1
1 899 . 13 1 1 A 74 74 ARG HA H 163 3.836 4.198 -0.362 1
1 906 . 13 1 1 A 74 74 ARG C C 163 174.701 175.059 -0.358 1
1 907 . 13 1 1 A 74 74 ARG CA C 163 57.980 57.281 0.699 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 163 115.130 118.403 -3.273 1
1 912 . 13 1 1 A 75 75 GLU H H 164 7.430 8.021 -0.591 1
1 913 . 13 1 1 A 75 75 GLU HA H 164 4.636 4.521 0.115 1
1 918 . 13 1 1 A 75 75 GLU CA C 164 53.699 54.972 -1.273 1
1 919 . 13 1 1 A 75 75 GLU CB C 164 29.550 28.325 1.225 1
1 921 . 13 1 1 A 75 75 GLU N N 164 120.076 118.933 1.143 1
1 922 . 13 1 1 A 76 76 PRO HA H 165 4.272 4.601 -0.329 1
1 929 . 13 1 1 A 76 76 PRO C C 165 176.649 176.929 -0.280 1
1 930 . 13 1 1 A 76 76 PRO CA C 165 63.204 62.820 0.384 1
1 931 . 13 1 1 A 76 76 PRO CB C 165 31.680 31.636 0.044 1
1 934 . 13 1 1 A 77 77 ILE H H 166 8.812 8.233 0.579 1
1 935 . 13 1 1 A 77 77 ILE HA H 166 3.838 4.319 -0.481 1
1 945 . 13 1 1 A 77 77 ILE C C 166 175.235 175.993 -0.758 1
1 946 . 13 1 1 A 77 77 ILE CA C 166 62.816 61.224 1.592 1
1 947 . 13 1 1 A 77 77 ILE CB C 166 37.750 37.927 -0.177 1
1 951 . 13 1 1 A 77 77 ILE N N 166 123.831 124.109 -0.278 1
1 952 . 13 1 1 A 78 78 THR H H 167 6.625 8.592 -1.967 1
1 953 . 13 1 1 A 78 78 THR HA H 167 4.632 5.048 -0.416 1
1 958 . 13 1 1 A 78 78 THR C C 167 174.143 174.382 -0.239 1
1 959 . 13 1 1 A 78 78 THR CA C 167 58.750 60.141 -1.391 1
1 960 . 13 1 1 A 78 78 THR CB C 167 71.320 70.867 0.453 1
1 962 . 13 1 1 A 78 78 THR N N 167 115.293 117.872 -2.579 1
1 963 . 13 1 1 A 79 79 ALA H H 168 9.088 8.978 0.110 1
1 964 . 13 1 1 A 79 79 ALA HA H 168 3.916 4.115 -0.199 1
1 968 . 13 1 1 A 79 79 ALA C C 168 179.788 179.449 0.339 1
1 969 . 13 1 1 A 79 79 ALA CA C 168 55.480 55.032 0.448 1
1 970 . 13 1 1 A 79 79 ALA CB C 168 17.630 18.523 -0.893 1
1 971 . 13 1 1 A 79 79 ALA N N 168 122.102 127.640 -5.538 1
1 972 . 13 1 1 A 80 80 SER H H 169 7.988 7.546 0.442 1
1 973 . 13 1 1 A 80 80 SER HA H 169 4.058 4.196 -0.138 1
1 976 . 13 1 1 A 80 80 SER C C 169 176.029 176.589 -0.560 1
1 977 . 13 1 1 A 80 80 SER CA C 169 60.750 61.505 -0.755 1
1 978 . 13 1 1 A 80 80 SER CB C 169 62.510 62.882 -0.372 1
1 979 . 13 1 1 A 80 80 SER N N 169 109.541 112.985 -3.444 1
1 980 . 13 1 1 A 81 81 ILE H H 170 6.968 7.624 -0.656 1
1 981 . 13 1 1 A 81 81 ILE HA H 170 4.315 4.339 -0.024 1
1 991 . 13 1 1 A 81 81 ILE C C 170 174.242 175.553 -1.311 1
1 992 . 13 1 1 A 81 81 ILE CA C 170 62.296 61.850 0.446 1
1 993 . 13 1 1 A 81 81 ILE CB C 170 37.686 38.229 -0.543 1
1 997 . 13 1 1 A 81 81 ILE N N 170 112.476 113.017 -0.541 1
1 998 . 13 1 1 A 82 82 ILE H H 171 7.345 7.423 -0.078 1
1 999 . 13 1 1 A 82 82 ILE HA H 171 4.339 4.686 -0.347 1
1 1009 . 13 1 1 A 82 82 ILE C C 171 174.999 174.648 0.351 1
1 1010 . 13 1 1 A 82 82 ILE CA C 171 61.150 60.243 0.907 1
1 1011 . 13 1 1 A 82 82 ILE CB C 171 37.230 40.470 -3.240 1
1 1015 . 13 1 1 A 82 82 ILE N N 171 124.260 124.597 -0.337 1
1 1016 . 13 1 1 A 83 83 VAL H H 172 7.923 9.172 -1.249 1
1 1017 . 13 1 1 A 83 83 VAL HA H 172 4.673 5.132 -0.459 1
1 1025 . 13 1 1 A 83 83 VAL C C 172 174.887 175.078 -0.191 1
1 1026 . 13 1 1 A 83 83 VAL CA C 172 59.340 59.211 0.129 1
1 1027 . 13 1 1 A 83 83 VAL CB C 172 34.840 36.153 -1.313 1
1 1030 . 13 1 1 A 83 83 VAL N N 172 120.931 122.143 -1.212 1
1 1031 . 13 1 1 A 84 84 LYS H H 173 8.406 8.572 -0.166 1
1 1032 . 13 1 1 A 84 84 LYS HA H 173 4.410 4.833 -0.423 1
1 1041 . 13 1 1 A 84 84 LYS C C 173 178.734 177.885 0.849 1
1 1042 . 13 1 1 A 84 84 LYS CA C 173 56.360 54.555 1.805 1
1 1043 . 13 1 1 A 84 84 LYS CB C 173 33.100 34.671 -1.571 1
1 1047 . 13 1 1 A 84 84 LYS N N 173 121.251 120.508 0.743 1
1 1048 . 13 1 1 A 85 85 HIS H H 174 9.221 9.210 0.011 1
1 1049 . 13 1 1 A 85 85 HIS HA H 174 4.024 3.986 0.038 1
1 1053 . 13 1 1 A 85 85 HIS C C 174 177.183 176.549 0.634 1
1 1054 . 13 1 1 A 85 85 HIS CA C 174 59.460 58.349 1.111 1
1 1055 . 13 1 1 A 85 85 HIS CB C 174 27.920 28.726 -0.806 1
1 1057 . 13 1 1 A 85 85 HIS N N 174 121.545 120.649 0.896 1
1 1058 . 13 1 1 A 86 86 GLU H H 175 8.699 7.864 0.835 1
1 1059 . 13 1 1 A 86 86 GLU HA H 175 3.900 3.898 0.002 1
1 1064 . 13 1 1 A 86 86 GLU C C 175 177.220 178.990 -1.770 1
1 1065 . 13 1 1 A 86 86 GLU CA C 175 58.420 58.896 -0.476 1
1 1066 . 13 1 1 A 86 86 GLU CB C 175 28.690 29.247 -0.557 1
1 1068 . 13 1 1 A 86 86 GLU N N 175 118.011 121.184 -3.173 1
1 1069 . 13 1 1 A 87 87 GLU H H 176 7.621 7.741 -0.120 1
1 1070 . 13 1 1 A 87 87 GLU HA H 176 4.177 4.078 0.099 1
1 1075 . 13 1 1 A 87 87 GLU C C 176 175.222 175.979 -0.757 1
1 1076 . 13 1 1 A 87 87 GLU CA C 176 56.390 58.318 -1.928 1
1 1077 . 13 1 1 A 87 87 GLU CB C 176 30.430 30.119 0.311 1
1 1079 . 13 1 1 A 87 87 GLU N N 176 116.753 118.403 -1.650 1
1 1080 . 13 1 1 A 88 88 CYS H H 177 7.239 7.612 -0.373 1
1 1081 . 13 1 1 A 88 88 CYS HA H 177 5.148 5.160 -0.012 1
1 1084 . 13 1 1 A 88 88 CYS C C 177 173.249 173.279 -0.030 1
1 1085 . 13 1 1 A 88 88 CYS CA C 177 57.240 56.920 0.320 1
1 1086 . 13 1 1 A 88 88 CYS CB C 177 31.020 30.675 0.345 1
1 1087 . 13 1 1 A 88 88 CYS N N 177 116.096 115.367 0.729 1
1 1088 . 13 1 1 A 89 89 ILE H H 178 8.912 8.870 0.042 1
1 1089 . 13 1 1 A 89 89 ILE HA H 178 4.580 5.066 -0.486 1
1 1099 . 13 1 1 A 89 89 ILE C C 178 173.386 174.394 -1.008 1
1 1100 . 13 1 1 A 89 89 ILE CA C 178 59.270 59.184 0.086 1
1 1101 . 13 1 1 A 89 89 ILE CB C 178 42.990 41.991 0.999 1
1 1105 . 13 1 1 A 89 89 ILE N N 178 119.490 119.690 -0.200 1
1 1106 . 13 1 1 A 90 90 TYR H H 179 9.047 8.932 0.115 1
1 1107 . 13 1 1 A 90 90 TYR HA H 179 3.753 4.281 -0.528 1
1 1112 . 13 1 1 A 90 90 TYR C C 179 173.932 174.070 -0.138 1
1 1113 . 13 1 1 A 90 90 TYR CA C 179 59.860 57.377 2.483 1
1 1114 . 13 1 1 A 90 90 TYR CB C 179 37.530 39.006 -1.476 1
1 1116 . 13 1 1 A 90 90 TYR N N 179 126.270 122.021 4.249 1
1 1117 . 13 1 1 A 91 91 ASP H H 180 7.462 8.326 -0.864 1
1 1118 . 13 1 1 A 91 91 ASP HA H 180 4.639 4.944 -0.305 1
1 1121 . 13 1 1 A 91 91 ASP C C 180 175.297 176.075 -0.778 1
1 1122 . 13 1 1 A 91 91 ASP CA C 180 52.496 52.545 -0.049 1
1 1123 . 13 1 1 A 91 91 ASP CB C 180 43.380 43.270 0.110 1
1 1124 . 13 1 1 A 91 91 ASP N N 180 129.593 122.972 6.621 1
1 1125 . 13 1 1 A 92 92 ASP H H 181 8.719 8.876 -0.157 1
1 1126 . 13 1 1 A 92 92 ASP HA H 181 4.109 4.312 -0.203 1
1 1129 . 13 1 1 A 92 92 ASP C C 181 177.555 177.401 0.154 1
1 1130 . 13 1 1 A 92 92 ASP CA C 181 56.390 57.680 -1.290 1
1 1131 . 13 1 1 A 92 92 ASP CB C 181 41.330 41.143 0.187 1
1 1132 . 13 1 1 A 92 92 ASP N N 181 125.691 126.751 -1.060 1
1 1133 . 13 1 1 A 93 93 THR H H 182 8.271 7.458 0.813 1
1 1134 . 13 1 1 A 93 93 THR HA H 182 4.036 3.976 0.060 1
1 1139 . 13 1 1 A 93 93 THR C C 182 176.289 176.314 -0.025 1
1 1140 . 13 1 1 A 93 93 THR CA C 182 65.054 64.838 0.216 1
1 1141 . 13 1 1 A 93 93 THR CB C 182 68.560 68.888 -0.328 1
1 1143 . 13 1 1 A 93 93 THR N N 182 114.813 113.606 1.207 1
1 1144 . 13 1 1 A 94 94 ARG H H 183 7.753 7.558 0.195 1
1 1145 . 13 1 1 A 94 94 ARG HA H 183 4.139 4.249 -0.110 1
1 1152 . 13 1 1 A 94 94 ARG C C 183 176.897 177.307 -0.410 1
1 1153 . 13 1 1 A 94 94 ARG CA C 183 55.350 56.466 -1.116 1
1 1154 . 13 1 1 A 94 94 ARG CB C 183 30.930 30.989 -0.059 1
1 1157 . 13 1 1 A 94 94 ARG N N 183 120.101 117.787 2.314 1
1 1158 . 13 1 1 A 95 95 GLY H H 184 8.112 8.652 -0.540 1
1 1159 . 13 1 1 A 95 95 GLY HA2 H 184 3.838 3.911 -0.073 1
1 1160 . 13 1 1 A 95 95 GLY HA3 H 184 3.670 3.922 -0.252 1
1 1161 . 13 1 1 A 95 95 GLY C C 184 173.659 173.446 0.213 1
1 1162 . 13 1 1 A 95 95 GLY CA C 184 46.040 46.001 0.039 1
1 1163 . 13 1 1 A 95 95 GLY N N 184 108.106 108.598 -0.492 1
1 1164 . 13 1 1 A 96 96 ASN H H 185 6.833 7.496 -0.663 1
1 1165 . 13 1 1 A 96 96 ASN HA H 185 4.944 5.227 -0.283 1
1 1170 . 13 1 1 A 96 96 ASN C C 185 174.267 174.104 0.163 1
1 1171 . 13 1 1 A 96 96 ASN CA C 185 52.560 51.327 1.233 1
1 1172 . 13 1 1 A 96 96 ASN CB C 185 45.890 42.699 3.191 1
1 1173 . 13 1 1 A 96 96 ASN N N 185 113.392 117.360 -3.968 1
1 1175 . 13 1 1 A 97 97 PHE H H 186 9.108 8.718 0.390 1
1 1176 . 13 1 1 A 97 97 PHE HA H 186 4.782 4.808 -0.026 1
1 1183 . 13 1 1 A 97 97 PHE C C 186 174.862 175.772 -0.910 1
1 1184 . 13 1 1 A 97 97 PHE CA C 186 60.056 59.490 0.566 1
1 1185 . 13 1 1 A 97 97 PHE CB C 186 40.180 39.252 0.928 1
1 1188 . 13 1 1 A 97 97 PHE N N 186 118.741 120.710 -1.969 1
1 1189 . 13 1 1 A 98 98 ILE H H 187 8.933 8.900 0.033 1
1 1190 . 13 1 1 A 98 98 ILE HA H 187 5.458 4.998 0.460 1
1 1200 . 13 1 1 A 98 98 ILE C C 187 176.041 175.230 0.811 1
1 1201 . 13 1 1 A 98 98 ILE CA C 187 57.610 59.094 -1.484 1
1 1202 . 13 1 1 A 98 98 ILE CB C 187 42.070 41.896 0.174 1
1 1206 . 13 1 1 A 98 98 ILE N N 187 117.857 119.427 -1.570 1
1 1207 . 13 1 1 A 99 99 ILE H H 188 8.284 8.695 -0.411 1
1 1208 . 13 1 1 A 99 99 ILE HA H 188 4.341 4.333 0.008 1
1 1218 . 13 1 1 A 99 99 ILE C C 188 176.413 176.438 -0.025 1
1 1219 . 13 1 1 A 99 99 ILE CA C 188 59.190 60.608 -1.418 1
1 1220 . 13 1 1 A 99 99 ILE CB C 188 37.940 38.249 -0.309 1
1 1224 . 13 1 1 A 99 99 ILE N N 188 121.796 122.516 -0.720 1
1 1225 . 13 1 1 A 100 100 LYS H H 189 8.463 8.129 0.334 1
1 1226 . 13 1 1 A 100 100 LYS HA H 189 4.040 4.132 -0.092 1
1 1235 . 13 1 1 A 100 100 LYS C C 189 176.848 177.455 -0.607 1
1 1236 . 13 1 1 A 100 100 LYS CA C 189 57.241 56.702 0.539 1
1 1237 . 13 1 1 A 100 100 LYS CB C 189 33.400 33.012 0.388 1
1 1241 . 13 1 1 A 100 100 LYS N N 189 127.995 124.387 3.608 1
1 1242 . 13 1 1 A 101 101 GLY H H 190 8.346 8.783 -0.437 1
1 1243 . 13 1 1 A 101 101 GLY HA2 H 190 3.947 3.932 0.015 1
1 1244 . 13 1 1 A 101 101 GLY HA3 H 190 3.813 3.937 -0.124 1
1 1245 . 13 1 1 A 101 101 GLY C C 190 172.902 174.594 -1.692 1
1 1246 . 13 1 1 A 101 101 GLY CA C 190 44.920 46.870 -1.950 1
1 1247 . 13 1 1 A 101 101 GLY N N 190 110.882 110.366 0.516 1
1 7 . 14 1 1 A 2 2 GLN H H 91 8.786 8.206 0.580 1
1 8 . 14 1 1 A 2 2 GLN HA H 91 4.005 3.944 0.061 1
1 15 . 14 1 1 A 2 2 GLN C C 91 177.270 178.202 -0.932 1
1 16 . 14 1 1 A 2 2 GLN CA C 91 58.220 58.822 -0.602 1
1 17 . 14 1 1 A 2 2 GLN CB C 91 28.650 28.415 0.235 1
1 19 . 14 1 1 A 2 2 GLN N N 91 121.993 121.725 0.268 1
1 21 . 14 1 1 A 3 3 GLU H H 92 8.430 8.277 0.153 1
1 22 . 14 1 1 A 3 3 GLU HA H 92 4.007 4.119 -0.112 1
1 27 . 14 1 1 A 3 3 GLU C C 92 178.287 179.030 -0.743 1
1 28 . 14 1 1 A 3 3 GLU CA C 92 59.490 59.224 0.266 1
1 29 . 14 1 1 A 3 3 GLU CB C 92 29.506 29.342 0.164 1
1 31 . 14 1 1 A 3 3 GLU N N 92 120.195 118.480 1.715 1
1 32 . 14 1 1 A 4 4 SER H H 93 8.209 7.421 0.788 1
1 33 . 14 1 1 A 4 4 SER HA H 93 4.272 4.265 0.007 1
1 36 . 14 1 1 A 4 4 SER C C 93 177.369 177.495 -0.126 1
1 37 . 14 1 1 A 4 4 SER CA C 93 61.044 61.313 -0.269 1
1 38 . 14 1 1 A 4 4 SER CB C 93 62.950 62.837 0.113 1
1 39 . 14 1 1 A 4 4 SER N N 93 115.524 114.925 0.599 1
1 40 . 14 1 1 A 5 5 ILE H H 94 8.080 7.556 0.524 1
1 41 . 14 1 1 A 5 5 ILE HA H 94 3.530 3.628 -0.098 1
1 51 . 14 1 1 A 5 5 ILE C C 94 177.778 177.627 0.151 1
1 52 . 14 1 1 A 5 5 ILE CA C 94 65.710 65.438 0.272 1
1 53 . 14 1 1 A 5 5 ILE CB C 94 37.800 37.570 0.230 1
1 57 . 14 1 1 A 5 5 ILE N N 94 124.148 121.915 2.233 1
1 58 . 14 1 1 A 6 6 GLN H H 95 8.374 8.414 -0.040 1
1 59 . 14 1 1 A 6 6 GLN HA H 95 4.125 3.950 0.175 1
1 66 . 14 1 1 A 6 6 GLN C C 95 179.726 179.375 0.351 1
1 67 . 14 1 1 A 6 6 GLN CA C 95 59.190 59.007 0.183 1
1 68 . 14 1 1 A 6 6 GLN CB C 95 27.060 28.692 -1.632 1
1 70 . 14 1 1 A 6 6 GLN N N 95 118.257 119.013 -0.756 1
1 72 . 14 1 1 A 7 7 ASN H H 96 8.456 7.911 0.545 1
1 73 . 14 1 1 A 7 7 ASN HA H 96 4.446 4.555 -0.109 1
1 78 . 14 1 1 A 7 7 ASN C C 96 177.257 178.310 -1.053 1
1 79 . 14 1 1 A 7 7 ASN CA C 96 56.020 56.198 -0.178 1
1 80 . 14 1 1 A 7 7 ASN CB C 96 38.126 37.666 0.460 1
1 81 . 14 1 1 A 7 7 ASN N N 96 118.597 118.390 0.207 1
1 83 . 14 1 1 A 8 8 LYS H H 97 7.732 7.580 0.152 1
1 84 . 14 1 1 A 8 8 LYS HA H 97 4.129 4.107 0.022 1
1 93 . 14 1 1 A 8 8 LYS C C 97 179.143 179.548 -0.405 1
1 94 . 14 1 1 A 8 8 LYS CA C 97 59.126 59.515 -0.389 1
1 95 . 14 1 1 A 8 8 LYS CB C 97 32.070 32.395 -0.325 1
1 99 . 14 1 1 A 8 8 LYS N N 97 122.381 118.690 3.691 1
1 100 . 14 1 1 A 9 9 ILE H H 98 8.452 8.293 0.159 1
1 101 . 14 1 1 A 9 9 ILE HA H 98 3.480 3.718 -0.238 1
1 111 . 14 1 1 A 9 9 ILE C C 98 177.406 178.306 -0.900 1
1 112 . 14 1 1 A 9 9 ILE CA C 98 66.430 65.577 0.853 1
1 113 . 14 1 1 A 9 9 ILE CB C 98 37.980 37.703 0.277 1
1 117 . 14 1 1 A 9 9 ILE N N 98 119.950 121.114 -1.164 1
1 118 . 14 1 1 A 10 10 SER H H 99 7.924 7.890 0.034 1
1 119 . 14 1 1 A 10 10 SER HA H 99 3.983 4.154 -0.171 1
1 122 . 14 1 1 A 10 10 SER C C 99 176.327 176.702 -0.375 1
1 123 . 14 1 1 A 10 10 SER CA C 99 61.990 61.443 0.547 1
1 124 . 14 1 1 A 10 10 SER CB C 99 62.790 62.996 -0.206 1
1 125 . 14 1 1 A 10 10 SER N N 99 113.568 116.347 -2.779 1
1 126 . 14 1 1 A 11 11 GLN H H 100 7.832 7.573 0.259 1
1 127 . 14 1 1 A 11 11 GLN HA H 100 4.238 4.240 -0.002 1
1 134 . 14 1 1 A 11 11 GLN C C 100 178.088 176.836 1.252 1
1 135 . 14 1 1 A 11 11 GLN CA C 100 57.900 58.243 -0.343 1
1 136 . 14 1 1 A 11 11 GLN CB C 100 29.790 28.554 1.236 1
1 138 . 14 1 1 A 11 11 GLN N N 100 117.487 120.083 -2.596 1
1 140 . 14 1 1 A 12 12 CYS H H 101 7.920 7.838 0.082 1
1 141 . 14 1 1 A 12 12 CYS HA H 101 4.657 4.679 -0.022 1
1 144 . 14 1 1 A 12 12 CYS C C 101 175.446 174.697 0.749 1
1 145 . 14 1 1 A 12 12 CYS CA C 101 60.654 58.567 2.087 1
1 146 . 14 1 1 A 12 12 CYS CB C 101 29.310 28.049 1.261 1
1 147 . 14 1 1 A 12 12 CYS N N 101 114.221 116.807 -2.586 1
1 148 . 14 1 1 A 13 13 LYS H H 102 8.029 7.309 0.720 1
1 149 . 14 1 1 A 13 13 LYS HA H 102 5.069 4.817 0.252 1
1 158 . 14 1 1 A 13 13 LYS C C 102 174.800 176.476 -1.676 1
1 159 . 14 1 1 A 13 13 LYS CA C 102 56.394 56.056 0.338 1
1 160 . 14 1 1 A 13 13 LYS CB C 102 32.770 33.365 -0.595 1
1 164 . 14 1 1 A 13 13 LYS N N 102 124.129 119.423 4.706 1
1 165 . 14 1 1 A 14 14 PHE H H 103 8.737 8.650 0.087 1
1 166 . 14 1 1 A 14 14 PHE HA H 103 5.059 5.128 -0.069 1
1 174 . 14 1 1 A 14 14 PHE C C 103 173.560 173.296 0.264 1
1 175 . 14 1 1 A 14 14 PHE CA C 103 55.470 56.033 -0.563 1
1 176 . 14 1 1 A 14 14 PHE CB C 103 41.760 41.670 0.090 1
1 180 . 14 1 1 A 14 14 PHE N N 103 118.661 116.547 2.114 1
1 181 . 14 1 1 A 15 15 SER H H 104 8.826 8.629 0.197 1
1 182 . 14 1 1 A 15 15 SER HA H 104 4.602 4.583 0.019 1
1 185 . 14 1 1 A 15 15 SER C C 104 173.795 174.431 -0.636 1
1 186 . 14 1 1 A 15 15 SER CA C 104 58.610 57.790 0.820 1
1 187 . 14 1 1 A 15 15 SER CB C 104 62.690 63.286 -0.596 1
1 188 . 14 1 1 A 15 15 SER N N 104 117.781 114.666 3.115 1
1 189 . 14 1 1 A 16 16 VAL H H 105 7.784 8.207 -0.423 1
1 190 . 14 1 1 A 16 16 VAL HA H 105 3.370 4.048 -0.678 1
1 198 . 14 1 1 A 16 16 VAL C C 105 174.987 175.356 -0.369 1
1 199 . 14 1 1 A 16 16 VAL CA C 105 63.580 62.983 0.597 1
1 200 . 14 1 1 A 16 16 VAL CB C 105 31.410 31.933 -0.523 1
1 203 . 14 1 1 A 16 16 VAL N N 105 129.075 125.932 3.143 1
1 204 . 14 1 1 A 17 17 CYS H H 106 8.536 8.519 0.017 1
1 205 . 14 1 1 A 17 17 CYS HA H 106 5.011 5.122 -0.111 1
1 208 . 14 1 1 A 17 17 CYS CA C 106 55.260 56.217 -0.957 1
1 209 . 14 1 1 A 17 17 CYS CB C 106 28.210 28.083 0.127 1
1 210 . 14 1 1 A 17 17 CYS N N 106 130.045 126.712 3.333 1
1 211 . 14 1 1 A 18 18 PRO HA H 107 3.991 4.339 -0.348 1
1 218 . 14 1 1 A 18 18 PRO C C 107 178.188 178.518 -0.330 1
1 219 . 14 1 1 A 18 18 PRO CA C 107 65.940 65.318 0.622 1
1 220 . 14 1 1 A 18 18 PRO CB C 107 32.000 31.811 0.189 1
1 223 . 14 1 1 A 19 19 GLU H H 108 9.260 9.075 0.185 1
1 224 . 14 1 1 A 19 19 GLU HA H 108 4.119 4.065 0.054 1
1 229 . 14 1 1 A 19 19 GLU C C 108 178.721 178.556 0.165 1
1 230 . 14 1 1 A 19 19 GLU CA C 108 59.300 59.445 -0.145 1
1 231 . 14 1 1 A 19 19 GLU CB C 108 28.920 28.925 -0.005 1
1 233 . 14 1 1 A 19 19 GLU N N 108 118.270 116.495 1.775 1
1 234 . 14 1 1 A 20 20 ARG H H 109 7.672 7.529 0.143 1
1 235 . 14 1 1 A 20 20 ARG HA H 109 4.331 4.111 0.220 1
1 242 . 14 1 1 A 20 20 ARG C C 109 177.977 178.744 -0.767 1
1 243 . 14 1 1 A 20 20 ARG CA C 109 57.350 58.687 -1.337 1
1 244 . 14 1 1 A 20 20 ARG CB C 109 30.820 30.270 0.550 1
1 247 . 14 1 1 A 20 20 ARG N N 109 118.357 119.611 -1.254 1
1 248 . 14 1 1 A 21 21 LEU H H 110 7.601 7.766 -0.165 1
1 249 . 14 1 1 A 21 21 LEU HA H 110 4.380 4.199 0.181 1
1 259 . 14 1 1 A 21 21 LEU C C 110 176.562 176.312 0.250 1
1 260 . 14 1 1 A 21 21 LEU CA C 110 56.096 55.422 0.674 1
1 261 . 14 1 1 A 21 21 LEU CB C 110 44.016 42.148 1.868 1
1 265 . 14 1 1 A 21 21 LEU N N 110 118.626 118.790 -0.164 1
1 266 . 14 1 1 A 22 22 GLN H H 111 7.750 7.426 0.324 1
1 267 . 14 1 1 A 22 22 GLN HA H 111 3.870 3.953 -0.083 1
1 274 . 14 1 1 A 22 22 GLN C C 111 173.336 174.874 -1.538 1
1 275 . 14 1 1 A 22 22 GLN CA C 111 56.510 57.607 -1.097 1
1 276 . 14 1 1 A 22 22 GLN CB C 111 26.800 26.566 0.234 1
1 278 . 14 1 1 A 22 22 GLN N N 111 113.926 115.318 -1.392 1
1 280 . 14 1 1 A 23 23 CYS H H 112 7.407 7.847 -0.440 1
1 281 . 14 1 1 A 23 23 CYS HA H 112 4.469 4.720 -0.251 1
1 284 . 14 1 1 A 23 23 CYS CA C 112 52.650 57.768 -5.118 1
1 285 . 14 1 1 A 23 23 CYS CB C 112 29.750 28.439 1.311 1
1 286 . 14 1 1 A 23 23 CYS N N 112 112.681 118.665 -5.984 1
1 287 . 14 1 1 A 24 24 PRO HA H 113 4.408 4.547 -0.139 1
1 294 . 14 1 1 A 24 24 PRO C C 113 178.175 177.354 0.821 1
1 295 . 14 1 1 A 24 24 PRO CA C 113 62.040 62.749 -0.709 1
1 296 . 14 1 1 A 24 24 PRO CB C 113 31.920 32.645 -0.725 1
1 299 . 14 1 1 A 25 25 LEU H H 114 8.593 8.416 0.177 1
1 300 . 14 1 1 A 25 25 LEU HA H 114 3.765 3.899 -0.134 1
1 310 . 14 1 1 A 25 25 LEU C C 114 179.950 178.906 1.044 1
1 311 . 14 1 1 A 25 25 LEU CA C 114 57.674 57.745 -0.071 1
1 312 . 14 1 1 A 25 25 LEU CB C 114 40.690 41.572 -0.882 1
1 316 . 14 1 1 A 25 25 LEU N N 114 123.729 123.380 0.349 1
1 317 . 14 1 1 A 26 26 GLU H H 115 9.108 8.550 0.558 1
1 318 . 14 1 1 A 26 26 GLU HA H 115 3.876 4.024 -0.148 1
1 323 . 14 1 1 A 26 26 GLU C C 115 177.505 178.420 -0.915 1
1 324 . 14 1 1 A 26 26 GLU CA C 115 59.410 59.200 0.210 1
1 325 . 14 1 1 A 26 26 GLU CB C 115 28.460 29.399 -0.939 1
1 327 . 14 1 1 A 26 26 GLU N N 115 116.817 117.487 -0.670 1
1 328 . 14 1 1 A 27 27 ALA H H 116 7.360 7.666 -0.306 1
1 329 . 14 1 1 A 27 27 ALA HA H 116 4.408 4.112 0.296 1
1 333 . 14 1 1 A 27 27 ALA C C 116 177.046 177.883 -0.837 1
1 334 . 14 1 1 A 27 27 ALA CA C 116 52.970 54.187 -1.217 1
1 335 . 14 1 1 A 27 27 ALA CB C 116 19.916 18.435 1.481 1
1 336 . 14 1 1 A 27 27 ALA N N 116 118.966 120.931 -1.965 1
1 337 . 14 1 1 A 28 28 ILE H H 117 7.168 7.083 0.085 1
1 338 . 14 1 1 A 28 28 ILE HA H 117 4.432 4.371 0.061 1
1 348 . 14 1 1 A 28 28 ILE C C 117 172.641 175.556 -2.915 1
1 349 . 14 1 1 A 28 28 ILE CA C 117 59.980 59.609 0.371 1
1 350 . 14 1 1 A 28 28 ILE CB C 117 37.350 38.206 -0.856 1
1 354 . 14 1 1 A 28 28 ILE N N 117 108.913 108.762 0.151 1
1 355 . 14 1 1 A 29 29 GLN H H 118 6.562 7.200 -0.638 1
1 356 . 14 1 1 A 29 29 GLN HA H 118 3.922 4.058 -0.136 1
1 363 . 14 1 1 A 29 29 GLN C C 118 175.049 175.380 -0.331 1
1 364 . 14 1 1 A 29 29 GLN CA C 118 54.596 56.323 -1.727 1
1 365 . 14 1 1 A 29 29 GLN CB C 118 29.570 28.961 0.609 1
1 367 . 14 1 1 A 29 29 GLN N N 118 116.455 123.527 -7.072 1
1 369 . 14 1 1 A 30 30 CYS H H 119 8.138 8.398 -0.260 1
1 370 . 14 1 1 A 30 30 CYS HA H 119 4.580 4.482 0.098 1
1 373 . 14 1 1 A 30 30 CYS CA C 119 57.810 57.272 0.538 1
1 374 . 14 1 1 A 30 30 CYS CB C 119 30.200 28.679 1.521 1
1 375 . 14 1 1 A 30 30 CYS N N 119 134.136 125.275 8.861 1
1 376 . 14 1 1 A 31 31 PRO HA H 120 4.424 4.448 -0.024 1
1 383 . 14 1 1 A 31 31 PRO C C 120 177.431 177.662 -0.231 1
1 384 . 14 1 1 A 31 31 PRO CA C 120 64.060 64.022 0.038 1
1 385 . 14 1 1 A 31 31 PRO CB C 120 32.776 31.785 0.991 1
1 388 . 14 1 1 A 32 32 ILE H H 121 11.318 7.762 3.556 1
1 389 . 14 1 1 A 32 32 ILE HA H 121 4.038 3.978 0.060 1
1 399 . 14 1 1 A 32 32 ILE C C 121 178.485 177.751 0.734 1
1 400 . 14 1 1 A 32 32 ILE CA C 121 64.060 64.103 -0.043 1
1 401 . 14 1 1 A 32 32 ILE CB C 121 39.340 38.481 0.859 1
1 405 . 14 1 1 A 32 32 ILE N N 121 124.500 117.093 7.407 1
1 406 . 14 1 1 A 33 33 THR H H 122 9.928 7.762 2.166 1
1 407 . 14 1 1 A 33 33 THR HA H 122 4.048 4.411 -0.363 1
1 412 . 14 1 1 A 33 33 THR C C 122 175.793 174.736 1.057 1
1 413 . 14 1 1 A 33 33 THR CA C 122 62.990 61.636 1.354 1
1 414 . 14 1 1 A 33 33 THR CB C 122 70.300 69.794 0.506 1
1 416 . 14 1 1 A 33 33 THR N N 122 115.136 109.042 6.094 1
1 417 . 14 1 1 A 34 34 LEU H H 123 8.439 7.730 0.709 1
1 418 . 14 1 1 A 34 34 LEU HA H 123 3.912 3.833 0.079 1
1 428 . 14 1 1 A 34 34 LEU C C 123 175.495 175.080 0.415 1
1 429 . 14 1 1 A 34 34 LEU CA C 123 56.290 56.213 0.077 1
1 430 . 14 1 1 A 34 34 LEU CB C 123 38.500 39.830 -1.330 1
1 434 . 14 1 1 A 34 34 LEU N N 123 117.230 118.776 -1.546 1
1 435 . 14 1 1 A 35 35 GLU H H 124 7.816 7.454 0.362 1
1 436 . 14 1 1 A 35 35 GLU HA H 124 4.634 4.806 -0.172 1
1 441 . 14 1 1 A 35 35 GLU C C 124 174.838 173.974 0.864 1
1 442 . 14 1 1 A 35 35 GLU CA C 124 53.780 54.666 -0.886 1
1 443 . 14 1 1 A 35 35 GLU CB C 124 33.710 32.494 1.216 1
1 445 . 14 1 1 A 35 35 GLU N N 124 116.577 114.156 2.421 1
1 446 . 14 1 1 A 36 36 GLN H H 125 8.532 8.415 0.117 1
1 447 . 14 1 1 A 36 36 GLN HA H 125 4.958 4.372 0.586 1
1 454 . 14 1 1 A 36 36 GLN CA C 125 53.350 53.657 -0.307 1
1 455 . 14 1 1 A 36 36 GLN CB C 125 29.950 29.473 0.477 1
1 457 . 14 1 1 A 36 36 GLN N N 125 123.034 123.628 -0.594 1
1 459 . 14 1 1 A 37 37 PRO HA H 126 4.458 4.612 -0.154 1
1 466 . 14 1 1 A 37 37 PRO C C 126 176.314 177.096 -0.782 1
1 467 . 14 1 1 A 37 37 PRO CA C 126 62.816 62.584 0.232 1
1 468 . 14 1 1 A 37 37 PRO CB C 126 33.070 32.462 0.608 1
1 471 . 14 1 1 A 38 38 GLU H H 127 8.626 8.369 0.257 1
1 472 . 14 1 1 A 38 38 GLU HA H 127 4.274 4.140 0.134 1
1 477 . 14 1 1 A 38 38 GLU C C 127 177.877 176.535 1.342 1
1 478 . 14 1 1 A 38 38 GLU CA C 127 58.730 58.159 0.571 1
1 479 . 14 1 1 A 38 38 GLU CB C 127 30.340 30.159 0.181 1
1 481 . 14 1 1 A 38 38 GLU N N 127 120.691 119.046 1.645 1
1 482 . 14 1 1 A 39 39 LYS H H 128 7.861 7.746 0.115 1
1 483 . 14 1 1 A 39 39 LYS HA H 128 4.889 4.993 -0.104 1
1 492 . 14 1 1 A 39 39 LYS C C 128 175.446 174.850 0.596 1
1 493 . 14 1 1 A 39 39 LYS CA C 128 53.670 54.553 -0.883 1
1 494 . 14 1 1 A 39 39 LYS CB C 128 33.630 35.430 -1.800 1
1 498 . 14 1 1 A 39 39 LYS N N 128 117.878 117.184 0.694 1
1 499 . 14 1 1 A 40 40 GLY H H 129 8.426 7.952 0.474 1
1 500 . 14 1 1 A 40 40 GLY HA2 H 129 4.970 4.031 0.939 1
1 501 . 14 1 1 A 40 40 GLY HA3 H 129 2.458 4.185 -1.727 1
1 502 . 14 1 1 A 40 40 GLY C C 129 170.048 172.368 -2.320 1
1 503 . 14 1 1 A 40 40 GLY CA C 129 42.910 44.922 -2.012 1
1 504 . 14 1 1 A 40 40 GLY N N 129 112.604 106.405 6.199 1
1 505 . 14 1 1 A 41 41 ILE H H 130 8.596 9.131 -0.535 1
1 506 . 14 1 1 A 41 41 ILE HA H 130 4.636 5.109 -0.473 1
1 516 . 14 1 1 A 41 41 ILE C C 130 172.691 174.316 -1.625 1
1 517 . 14 1 1 A 41 41 ILE CA C 130 58.500 58.795 -0.295 1
1 518 . 14 1 1 A 41 41 ILE CB C 130 43.320 40.567 2.753 1
1 522 . 14 1 1 A 41 41 ILE N N 130 113.363 117.761 -4.398 1
1 523 . 14 1 1 A 42 42 PHE H H 131 8.994 9.010 -0.016 1
1 524 . 14 1 1 A 42 42 PHE HA H 131 5.075 5.504 -0.429 1
1 532 . 14 1 1 A 42 42 PHE C C 131 175.111 174.930 0.181 1
1 533 . 14 1 1 A 42 42 PHE CA C 131 58.680 57.104 1.576 1
1 534 . 14 1 1 A 42 42 PHE CB C 131 42.220 40.427 1.793 1
1 538 . 14 1 1 A 42 42 PHE N N 131 125.156 122.124 3.032 1
1 539 . 14 1 1 A 43 43 VAL H H 132 8.399 9.200 -0.801 1
1 540 . 14 1 1 A 43 43 VAL HA H 132 4.920 4.704 0.216 1
1 548 . 14 1 1 A 43 43 VAL C C 132 178.175 175.277 2.898 1
1 549 . 14 1 1 A 43 43 VAL CA C 132 59.600 61.049 -1.449 1
1 550 . 14 1 1 A 43 43 VAL CB C 132 35.920 34.082 1.838 1
1 553 . 14 1 1 A 43 43 VAL N N 132 119.371 123.399 -4.028 1
1 554 . 14 1 1 A 44 44 LYS H H 133 10.041 8.647 1.394 1
1 555 . 14 1 1 A 44 44 LYS HA H 133 4.920 4.402 0.518 1
1 564 . 14 1 1 A 44 44 LYS C C 133 177.195 175.731 1.464 1
1 565 . 14 1 1 A 44 44 LYS CA C 133 57.310 56.506 0.804 1
1 566 . 14 1 1 A 44 44 LYS CB C 133 34.410 32.433 1.977 1
1 570 . 14 1 1 A 44 44 LYS N N 133 130.928 126.676 4.252 1
1 571 . 14 1 1 A 45 45 ASN H H 134 8.534 8.871 -0.337 1
1 572 . 14 1 1 A 45 45 ASN HA H 134 4.151 4.618 -0.467 1
1 577 . 14 1 1 A 45 45 ASN C C 134 174.217 175.171 -0.954 1
1 578 . 14 1 1 A 45 45 ASN CA C 134 55.290 52.547 2.743 1
1 579 . 14 1 1 A 45 45 ASN CB C 134 37.530 37.954 -0.424 1
1 580 . 14 1 1 A 45 45 ASN N N 134 119.452 124.364 -4.912 1
1 582 . 14 1 1 A 46 46 SER H H 135 7.570 8.009 -0.439 1
1 583 . 14 1 1 A 46 46 SER HA H 135 4.220 4.074 0.146 1
1 586 . 14 1 1 A 46 46 SER C C 135 174.490 176.606 -2.116 1
1 587 . 14 1 1 A 46 46 SER CA C 135 57.090 61.451 -4.361 1
1 588 . 14 1 1 A 46 46 SER CB C 135 64.126 63.328 0.798 1
1 589 . 14 1 1 A 46 46 SER N N 135 105.613 121.510 -15.897 1
1 590 . 14 1 1 A 47 47 ASP H H 136 9.113 8.319 0.794 1
1 591 . 14 1 1 A 47 47 ASP HA H 136 4.220 4.328 -0.108 1
1 594 . 14 1 1 A 47 47 ASP CA C 136 57.610 57.079 0.531 1
1 595 . 14 1 1 A 47 47 ASP CB C 136 40.810 40.792 0.018 1
1 596 . 14 1 1 A 47 47 ASP N N 136 120.995 120.899 0.096 1
1 597 . 14 1 1 A 48 48 GLY H H 137 8.172 8.161 0.011 1
1 598 . 14 1 1 A 48 48 GLY HA2 H 137 4.096 3.765 0.331 1
1 599 . 14 1 1 A 48 48 GLY HA3 H 137 3.664 3.772 -0.108 1
1 600 . 14 1 1 A 48 48 GLY C C 137 173.990 174.941 -0.951 1
1 601 . 14 1 1 A 48 48 GLY CA C 137 45.130 47.228 -2.098 1
1 602 . 14 1 1 A 48 48 GLY N N 137 105.838 107.524 -1.686 1
1 603 . 14 1 1 A 49 49 SER H H 138 7.252 7.653 -0.401 1
1 604 . 14 1 1 A 49 49 SER HA H 138 4.503 4.671 -0.168 1
1 607 . 14 1 1 A 49 49 SER C C 138 173.857 173.928 -0.071 1
1 608 . 14 1 1 A 49 49 SER CA C 138 57.340 57.577 -0.237 1
1 609 . 14 1 1 A 49 49 SER CB C 138 65.370 64.674 0.696 1
1 610 . 14 1 1 A 49 49 SER N N 138 114.942 112.096 2.846 1
1 611 . 14 1 1 A 50 50 ASP H H 139 8.276 8.084 0.192 1
1 612 . 14 1 1 A 50 50 ASP HA H 139 4.618 4.261 0.357 1
1 615 . 14 1 1 A 50 50 ASP C C 139 174.577 174.635 -0.058 1
1 616 . 14 1 1 A 50 50 ASP CA C 139 53.116 55.454 -2.338 1
1 617 . 14 1 1 A 50 50 ASP CB C 139 40.520 40.139 0.381 1
1 618 . 14 1 1 A 50 50 ASP N N 139 122.088 120.380 1.708 1
1 619 . 14 1 1 A 51 51 VAL H H 140 8.192 7.457 0.735 1
1 620 . 14 1 1 A 51 51 VAL HA H 140 4.299 4.431 -0.132 1
1 628 . 14 1 1 A 51 51 VAL C C 140 175.867 175.038 0.829 1
1 629 . 14 1 1 A 51 51 VAL CA C 140 62.950 61.316 1.634 1
1 630 . 14 1 1 A 51 51 VAL CB C 140 33.230 33.354 -0.124 1
1 632 . 14 1 1 A 51 51 VAL N N 140 121.167 118.824 2.343 1
1 633 . 14 1 1 A 52 52 CYS H H 141 8.391 9.045 -0.654 1
1 634 . 14 1 1 A 52 52 CYS HA H 141 5.247 5.200 0.047 1
1 637 . 14 1 1 A 52 52 CYS C C 141 172.778 175.059 -2.281 1
1 638 . 14 1 1 A 52 52 CYS CA C 141 56.480 58.416 -1.936 1
1 639 . 14 1 1 A 52 52 CYS CB C 141 31.960 28.524 3.436 1
1 640 . 14 1 1 A 52 52 CYS N N 141 121.884 125.858 -3.974 1
1 641 . 14 1 1 A 53 53 THR H H 142 8.777 8.984 -0.207 1
1 642 . 14 1 1 A 53 53 THR HA H 142 4.489 4.946 -0.457 1
1 648 . 14 1 1 A 53 53 THR C C 142 171.885 172.347 -0.462 1
1 649 . 14 1 1 A 53 53 THR CA C 142 62.070 61.384 0.686 1
1 650 . 14 1 1 A 53 53 THR CB C 142 71.390 71.712 -0.322 1
1 652 . 14 1 1 A 53 53 THR N N 142 118.132 117.864 0.268 1
1 653 . 14 1 1 A 54 54 LEU H H 143 8.409 8.376 0.033 1
1 654 . 14 1 1 A 54 54 LEU HA H 143 4.276 4.397 -0.121 1
1 664 . 14 1 1 A 54 54 LEU C C 143 174.366 174.140 0.226 1
1 665 . 14 1 1 A 54 54 LEU CA C 143 54.330 53.188 1.142 1
1 666 . 14 1 1 A 54 54 LEU CB C 143 42.396 42.762 -0.366 1
1 670 . 14 1 1 A 54 54 LEU N N 143 127.980 127.798 0.182 1
1 671 . 14 1 1 A 55 55 PHE H H 144 8.646 8.732 -0.086 1
1 672 . 14 1 1 A 55 55 PHE HA H 144 5.455 4.789 0.666 1
1 680 . 14 1 1 A 55 55 PHE C C 144 176.054 175.404 0.650 1
1 681 . 14 1 1 A 55 55 PHE CA C 144 55.250 56.931 -1.681 1
1 682 . 14 1 1 A 55 55 PHE CB C 144 44.100 40.507 3.593 1
1 686 . 14 1 1 A 55 55 PHE N N 144 122.010 126.851 -4.841 1
1 687 . 14 1 1 A 56 56 ASP H H 145 11.575 8.335 3.240 1
1 688 . 14 1 1 A 56 56 ASP HA H 145 4.416 4.505 -0.089 1
1 691 . 14 1 1 A 56 56 ASP C C 145 176.748 177.410 -0.662 1
1 692 . 14 1 1 A 56 56 ASP CA C 145 55.840 54.667 1.173 1
1 693 . 14 1 1 A 56 56 ASP CB C 145 44.390 42.106 2.284 1
1 694 . 14 1 1 A 56 56 ASP N N 145 121.936 123.814 -1.878 1
1 695 . 14 1 1 A 57 57 ALA H H 146 8.508 8.842 -0.334 1
1 696 . 14 1 1 A 57 57 ALA HA H 146 3.797 4.084 -0.287 1
1 700 . 14 1 1 A 57 57 ALA C C 146 178.696 180.053 -1.357 1
1 701 . 14 1 1 A 57 57 ALA CA C 146 55.990 55.640 0.350 1
1 702 . 14 1 1 A 57 57 ALA CB C 146 18.840 18.097 0.743 1
1 703 . 14 1 1 A 57 57 ALA N N 146 130.243 129.178 1.065 1
1 704 . 14 1 1 A 58 58 ALA H H 147 8.378 7.782 0.596 1
1 705 . 14 1 1 A 58 58 ALA HA H 147 4.078 4.207 -0.129 1
1 709 . 14 1 1 A 58 58 ALA C C 147 181.091 179.702 1.389 1
1 710 . 14 1 1 A 58 58 ALA CA C 147 54.770 54.947 -0.177 1
1 711 . 14 1 1 A 58 58 ALA CB C 147 17.700 18.381 -0.681 1
1 712 . 14 1 1 A 58 58 ALA N N 147 121.997 119.902 2.095 1
1 713 . 14 1 1 A 59 59 ALA H H 148 9.138 7.928 1.210 1
1 714 . 14 1 1 A 59 59 ALA HA H 148 3.975 4.075 -0.100 1
1 718 . 14 1 1 A 59 59 ALA C C 148 180.508 179.970 0.538 1
1 719 . 14 1 1 A 59 59 ALA CA C 148 54.840 55.075 -0.235 1
1 720 . 14 1 1 A 59 59 ALA CB C 148 18.600 18.577 0.023 1
1 721 . 14 1 1 A 59 59 ALA N N 148 123.595 120.351 3.244 1
1 722 . 14 1 1 A 60 60 PHE H H 149 8.814 8.053 0.761 1
1 723 . 14 1 1 A 60 60 PHE HA H 149 3.722 4.037 -0.315 1
1 731 . 14 1 1 A 60 60 PHE C C 149 176.773 177.440 -0.667 1
1 732 . 14 1 1 A 60 60 PHE CA C 149 62.030 61.508 0.522 1
1 733 . 14 1 1 A 60 60 PHE CB C 149 39.960 38.756 1.204 1
1 737 . 14 1 1 A 60 60 PHE N N 149 120.354 119.983 0.371 1
1 738 . 14 1 1 A 61 61 SER H H 150 8.276 8.178 0.098 1
1 739 . 14 1 1 A 61 61 SER HA H 150 3.880 4.209 -0.329 1
1 742 . 14 1 1 A 61 61 SER C C 150 177.691 177.050 0.641 1
1 743 . 14 1 1 A 61 61 SER CA C 150 62.190 61.173 1.017 1
1 744 . 14 1 1 A 61 61 SER CB C 150 63.016 63.230 -0.214 1
1 745 . 14 1 1 A 61 61 SER N N 150 112.086 114.094 -2.008 1
1 746 . 14 1 1 A 62 62 ARG H H 151 7.829 7.665 0.164 1
1 747 . 14 1 1 A 62 62 ARG HA H 151 3.971 4.080 -0.109 1
1 754 . 14 1 1 A 62 62 ARG C C 151 178.287 178.823 -0.536 1
1 755 . 14 1 1 A 62 62 ARG CA C 151 59.340 59.033 0.307 1
1 756 . 14 1 1 A 62 62 ARG CB C 151 29.760 29.733 0.027 1
1 759 . 14 1 1 A 62 62 ARG N N 151 121.090 121.708 -0.618 1
1 760 . 14 1 1 A 63 63 LEU H H 152 7.390 7.738 -0.348 1
1 761 . 14 1 1 A 63 63 LEU HA H 152 3.791 3.957 -0.166 1
1 771 . 14 1 1 A 63 63 LEU C C 152 179.106 178.973 0.133 1
1 772 . 14 1 1 A 63 63 LEU CA C 152 58.900 57.894 1.006 1
1 773 . 14 1 1 A 63 63 LEU CB C 152 41.140 41.367 -0.227 1
1 777 . 14 1 1 A 63 63 LEU N N 152 121.129 119.242 1.887 1
1 778 . 14 1 1 A 64 64 VAL H H 153 7.552 7.966 -0.414 1
1 779 . 14 1 1 A 64 64 VAL HA H 153 3.411 3.529 -0.118 1
1 787 . 14 1 1 A 64 64 VAL C C 153 180.595 178.986 1.609 1
1 788 . 14 1 1 A 64 64 VAL CA C 153 65.644 66.159 -0.515 1
1 789 . 14 1 1 A 64 64 VAL CB C 153 31.410 31.422 -0.012 1
1 792 . 14 1 1 A 64 64 VAL N N 153 118.280 118.545 -0.265 1
1 793 . 14 1 1 A 65 65 GLY H H 154 8.061 8.180 -0.119 1
1 794 . 14 1 1 A 65 65 GLY HA2 H 154 3.846 3.873 -0.027 1
1 795 . 14 1 1 A 65 65 GLY HA3 H 154 3.809 3.874 -0.065 1
1 796 . 14 1 1 A 65 65 GLY C C 154 175.235 174.954 0.281 1
1 797 . 14 1 1 A 65 65 GLY CA C 154 46.630 46.613 0.017 1
1 798 . 14 1 1 A 65 65 GLY N N 154 108.622 107.719 0.903 1
1 799 . 14 1 1 A 66 66 GLU H H 155 7.528 7.431 0.097 1
1 800 . 14 1 1 A 66 66 GLU HA H 155 4.228 4.373 -0.145 1
1 805 . 14 1 1 A 66 66 GLU C C 155 176.761 176.947 -0.186 1
1 806 . 14 1 1 A 66 66 GLU CA C 155 56.590 56.199 0.391 1
1 807 . 14 1 1 A 66 66 GLU CB C 155 30.490 30.742 -0.252 1
1 809 . 14 1 1 A 66 66 GLU N N 155 118.361 118.170 0.191 1
1 810 . 14 1 1 A 67 67 GLY H H 156 7.884 7.860 0.024 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 3.897 -0.150 1
1 813 . 14 1 1 A 67 67 GLY C C 156 174.788 174.283 0.505 1
1 814 . 14 1 1 A 67 67 GLY CA C 156 45.890 45.486 0.404 1
1 815 . 14 1 1 A 67 67 GLY N N 156 108.465 109.181 -0.716 1
1 816 . 14 1 1 A 68 68 LEU H H 157 7.332 7.843 -0.511 1
1 817 . 14 1 1 A 68 68 LEU HA H 157 4.361 4.463 -0.102 1
1 827 . 14 1 1 A 68 68 LEU CA C 157 53.060 52.357 0.703 1
1 828 . 14 1 1 A 68 68 LEU CB C 157 41.100 41.864 -0.764 1
1 832 . 14 1 1 A 68 68 LEU N N 157 121.920 121.773 0.147 1
1 833 . 14 1 1 A 69 69 PRO HA H 158 4.485 4.599 -0.114 1
1 840 . 14 1 1 A 69 69 PRO C C 158 174.602 176.208 -1.606 1
1 841 . 14 1 1 A 69 69 PRO CA C 158 61.556 62.245 -0.689 1
1 842 . 14 1 1 A 69 69 PRO CB C 158 32.370 32.775 -0.405 1
1 845 . 14 1 1 A 70 70 HIS H H 159 8.759 8.564 0.195 1
1 846 . 14 1 1 A 70 70 HIS HA H 159 3.947 4.490 -0.543 1
1 852 . 14 1 1 A 70 70 HIS CA C 159 56.250 55.199 1.051 1
1 853 . 14 1 1 A 70 70 HIS CB C 159 32.280 30.983 1.297 1
1 856 . 14 1 1 A 70 70 HIS N N 159 119.423 120.503 -1.080 1
1 857 . 14 1 1 A 71 71 PRO HA H 160 4.424 4.394 0.030 1
1 864 . 14 1 1 A 71 71 PRO C C 160 177.567 178.157 -0.590 1
1 865 . 14 1 1 A 71 71 PRO CA C 160 64.574 64.572 0.002 1
1 866 . 14 1 1 A 71 71 PRO CB C 160 32.340 31.864 0.476 1
1 869 . 14 1 1 A 72 72 LEU H H 161 10.123 7.548 2.575 1
1 870 . 14 1 1 A 72 72 LEU HA H 161 4.778 4.357 0.421 1
1 880 . 14 1 1 A 72 72 LEU C C 161 178.721 178.312 0.409 1
1 881 . 14 1 1 A 72 72 LEU CA C 161 55.800 56.709 -0.909 1
1 882 . 14 1 1 A 72 72 LEU CB C 161 42.440 42.916 -0.476 1
1 886 . 14 1 1 A 72 72 LEU N N 161 117.374 117.458 -0.084 1
1 887 . 14 1 1 A 73 73 THR H H 162 7.523 7.992 -0.469 1
1 888 . 14 1 1 A 73 73 THR HA H 162 4.291 4.499 -0.208 1
1 893 . 14 1 1 A 73 73 THR C C 162 175.557 174.285 1.272 1
1 894 . 14 1 1 A 73 73 THR CA C 162 61.440 63.140 -1.700 1
1 895 . 14 1 1 A 73 73 THR CB C 162 70.500 69.444 1.056 1
1 897 . 14 1 1 A 73 73 THR N N 162 107.787 111.844 -4.057 1
1 898 . 14 1 1 A 74 74 ARG H H 163 8.361 7.929 0.432 1
1 899 . 14 1 1 A 74 74 ARG HA H 163 3.836 4.276 -0.440 1
1 906 . 14 1 1 A 74 74 ARG C C 163 174.701 175.021 -0.320 1
1 907 . 14 1 1 A 74 74 ARG CA C 163 57.980 57.621 0.359 1
1 908 . 14 1 1 A 74 74 ARG CB C 163 26.770 27.141 -0.371 1
1 911 . 14 1 1 A 74 74 ARG N N 163 115.130 118.357 -3.227 1
1 912 . 14 1 1 A 75 75 GLU H H 164 7.430 8.051 -0.621 1
1 913 . 14 1 1 A 75 75 GLU HA H 164 4.636 4.604 0.032 1
1 918 . 14 1 1 A 75 75 GLU CA C 164 53.699 54.800 -1.101 1
1 919 . 14 1 1 A 75 75 GLU CB C 164 29.550 28.339 1.211 1
1 921 . 14 1 1 A 75 75 GLU N N 164 120.076 118.510 1.566 1
1 922 . 14 1 1 A 76 76 PRO HA H 165 4.272 4.496 -0.224 1
1 929 . 14 1 1 A 76 76 PRO C C 165 176.649 176.969 -0.320 1
1 930 . 14 1 1 A 76 76 PRO CA C 165 63.204 63.109 0.095 1
1 931 . 14 1 1 A 76 76 PRO CB C 165 31.680 31.712 -0.032 1
1 934 . 14 1 1 A 77 77 ILE H H 166 8.812 8.237 0.575 1
1 935 . 14 1 1 A 77 77 ILE HA H 166 3.838 4.312 -0.474 1
1 945 . 14 1 1 A 77 77 ILE C C 166 175.235 175.991 -0.756 1
1 946 . 14 1 1 A 77 77 ILE CA C 166 62.816 61.425 1.391 1
1 947 . 14 1 1 A 77 77 ILE CB C 166 37.750 38.736 -0.986 1
1 951 . 14 1 1 A 77 77 ILE N N 166 123.831 123.931 -0.100 1
1 952 . 14 1 1 A 78 78 THR H H 167 6.625 8.576 -1.951 1
1 953 . 14 1 1 A 78 78 THR HA H 167 4.632 4.993 -0.361 1
1 958 . 14 1 1 A 78 78 THR C C 167 174.143 173.960 0.183 1
1 959 . 14 1 1 A 78 78 THR CA C 167 58.750 60.361 -1.611 1
1 960 . 14 1 1 A 78 78 THR CB C 167 71.320 70.504 0.816 1
1 962 . 14 1 1 A 78 78 THR N N 167 115.293 117.410 -2.117 1
1 963 . 14 1 1 A 79 79 ALA H H 168 9.088 8.949 0.139 1
1 964 . 14 1 1 A 79 79 ALA HA H 168 3.916 4.115 -0.199 1
1 968 . 14 1 1 A 79 79 ALA C C 168 179.788 179.435 0.353 1
1 969 . 14 1 1 A 79 79 ALA CA C 168 55.480 55.025 0.455 1
1 970 . 14 1 1 A 79 79 ALA CB C 168 17.630 18.451 -0.821 1
1 971 . 14 1 1 A 79 79 ALA N N 168 122.102 127.597 -5.495 1
1 972 . 14 1 1 A 80 80 SER H H 169 7.988 7.492 0.496 1
1 973 . 14 1 1 A 80 80 SER HA H 169 4.058 4.194 -0.136 1
1 976 . 14 1 1 A 80 80 SER C C 169 176.029 176.577 -0.548 1
1 977 . 14 1 1 A 80 80 SER CA C 169 60.750 61.512 -0.762 1
1 978 . 14 1 1 A 80 80 SER CB C 169 62.510 62.935 -0.425 1
1 979 . 14 1 1 A 80 80 SER N N 169 109.541 113.146 -3.605 1
1 980 . 14 1 1 A 81 81 ILE H H 170 6.968 7.604 -0.636 1
1 981 . 14 1 1 A 81 81 ILE HA H 170 4.315 4.324 -0.009 1
1 991 . 14 1 1 A 81 81 ILE C C 170 174.242 175.566 -1.324 1
1 992 . 14 1 1 A 81 81 ILE CA C 170 62.296 62.096 0.200 1
1 993 . 14 1 1 A 81 81 ILE CB C 170 37.686 38.266 -0.580 1
1 997 . 14 1 1 A 81 81 ILE N N 170 112.476 113.617 -1.141 1
1 998 . 14 1 1 A 82 82 ILE H H 171 7.345 7.427 -0.082 1
1 999 . 14 1 1 A 82 82 ILE HA H 171 4.339 4.667 -0.328 1
1 1009 . 14 1 1 A 82 82 ILE C C 171 174.999 174.630 0.369 1
1 1010 . 14 1 1 A 82 82 ILE CA C 171 61.150 60.248 0.902 1
1 1011 . 14 1 1 A 82 82 ILE CB C 171 37.230 40.648 -3.418 1
1 1015 . 14 1 1 A 82 82 ILE N N 171 124.260 124.542 -0.282 1
1 1016 . 14 1 1 A 83 83 VAL H H 172 7.923 9.081 -1.158 1
1 1017 . 14 1 1 A 83 83 VAL HA H 172 4.673 5.022 -0.349 1
1 1025 . 14 1 1 A 83 83 VAL C C 172 174.887 175.227 -0.340 1
1 1026 . 14 1 1 A 83 83 VAL CA C 172 59.340 58.991 0.349 1
1 1027 . 14 1 1 A 83 83 VAL CB C 172 34.840 36.061 -1.221 1
1 1030 . 14 1 1 A 83 83 VAL N N 172 120.931 121.926 -0.995 1
1 1031 . 14 1 1 A 84 84 LYS H H 173 8.406 8.710 -0.304 1
1 1032 . 14 1 1 A 84 84 LYS HA H 173 4.410 4.610 -0.200 1
1 1041 . 14 1 1 A 84 84 LYS C C 173 178.734 177.840 0.894 1
1 1042 . 14 1 1 A 84 84 LYS CA C 173 56.360 55.269 1.091 1
1 1043 . 14 1 1 A 84 84 LYS CB C 173 33.100 32.998 0.102 1
1 1047 . 14 1 1 A 84 84 LYS N N 173 121.251 120.781 0.470 1
1 1048 . 14 1 1 A 85 85 HIS H H 174 9.221 9.010 0.211 1
1 1049 . 14 1 1 A 85 85 HIS HA H 174 4.024 4.243 -0.219 1
1 1053 . 14 1 1 A 85 85 HIS C C 174 177.183 176.941 0.242 1
1 1054 . 14 1 1 A 85 85 HIS CA C 174 59.460 58.998 0.462 1
1 1055 . 14 1 1 A 85 85 HIS CB C 174 27.920 29.151 -1.231 1
1 1057 . 14 1 1 A 85 85 HIS N N 174 121.545 120.534 1.011 1
1 1058 . 14 1 1 A 86 86 GLU H H 175 8.699 7.752 0.947 1
1 1059 . 14 1 1 A 86 86 GLU HA H 175 3.900 3.834 0.066 1
1 1064 . 14 1 1 A 86 86 GLU C C 175 177.220 178.245 -1.025 1
1 1065 . 14 1 1 A 86 86 GLU CA C 175 58.420 58.774 -0.354 1
1 1066 . 14 1 1 A 86 86 GLU CB C 175 28.690 29.235 -0.545 1
1 1068 . 14 1 1 A 86 86 GLU N N 175 118.011 120.156 -2.145 1
1 1069 . 14 1 1 A 87 87 GLU H H 176 7.621 7.770 -0.149 1
1 1070 . 14 1 1 A 87 87 GLU HA H 176 4.177 4.069 0.108 1
1 1075 . 14 1 1 A 87 87 GLU C C 176 175.222 176.074 -0.852 1
1 1076 . 14 1 1 A 87 87 GLU CA C 176 56.390 58.414 -2.024 1
1 1077 . 14 1 1 A 87 87 GLU CB C 176 30.430 30.129 0.301 1
1 1079 . 14 1 1 A 87 87 GLU N N 176 116.753 117.974 -1.221 1
1 1080 . 14 1 1 A 88 88 CYS H H 177 7.239 7.341 -0.102 1
1 1081 . 14 1 1 A 88 88 CYS HA H 177 5.148 4.891 0.257 1
1 1084 . 14 1 1 A 88 88 CYS C C 177 173.249 173.946 -0.697 1
1 1085 . 14 1 1 A 88 88 CYS CA C 177 57.240 56.898 0.342 1
1 1086 . 14 1 1 A 88 88 CYS CB C 177 31.020 30.954 0.066 1
1 1087 . 14 1 1 A 88 88 CYS N N 177 116.096 115.447 0.649 1
1 1088 . 14 1 1 A 89 89 ILE H H 178 8.912 8.680 0.232 1
1 1089 . 14 1 1 A 89 89 ILE HA H 178 4.580 4.956 -0.376 1
1 1099 . 14 1 1 A 89 89 ILE C C 178 173.386 174.097 -0.711 1
1 1100 . 14 1 1 A 89 89 ILE CA C 178 59.270 59.145 0.125 1
1 1101 . 14 1 1 A 89 89 ILE CB C 178 42.990 41.769 1.221 1
1 1105 . 14 1 1 A 89 89 ILE N N 178 119.490 116.977 2.513 1
1 1106 . 14 1 1 A 90 90 TYR H H 179 9.047 8.616 0.431 1
1 1107 . 14 1 1 A 90 90 TYR HA H 179 3.753 3.918 -0.165 1
1 1112 . 14 1 1 A 90 90 TYR C C 179 173.932 174.088 -0.156 1
1 1113 . 14 1 1 A 90 90 TYR CA C 179 59.860 57.387 2.473 1
1 1114 . 14 1 1 A 90 90 TYR CB C 179 37.530 38.477 -0.947 1
1 1116 . 14 1 1 A 90 90 TYR N N 179 126.270 122.080 4.190 1
1 1117 . 14 1 1 A 91 91 ASP H H 180 7.462 8.372 -0.910 1
1 1118 . 14 1 1 A 91 91 ASP HA H 180 4.639 4.671 -0.032 1
1 1121 . 14 1 1 A 91 91 ASP C C 180 175.297 176.217 -0.920 1
1 1122 . 14 1 1 A 91 91 ASP CA C 180 52.496 52.279 0.217 1
1 1123 . 14 1 1 A 91 91 ASP CB C 180 43.380 41.659 1.721 1
1 1124 . 14 1 1 A 91 91 ASP N N 180 129.593 124.677 4.916 1
1 1125 . 14 1 1 A 92 92 ASP H H 181 8.719 8.965 -0.246 1
1 1126 . 14 1 1 A 92 92 ASP HA H 181 4.109 4.537 -0.428 1
1 1129 . 14 1 1 A 92 92 ASP C C 181 177.555 177.651 -0.096 1
1 1130 . 14 1 1 A 92 92 ASP CA C 181 56.390 56.052 0.338 1
1 1131 . 14 1 1 A 92 92 ASP CB C 181 41.330 40.259 1.071 1
1 1132 . 14 1 1 A 92 92 ASP N N 181 125.691 126.179 -0.488 1
1 1133 . 14 1 1 A 93 93 THR H H 182 8.271 7.887 0.384 1
1 1134 . 14 1 1 A 93 93 THR HA H 182 4.036 4.071 -0.035 1
1 1139 . 14 1 1 A 93 93 THR C C 182 176.289 176.590 -0.301 1
1 1140 . 14 1 1 A 93 93 THR CA C 182 65.054 64.682 0.372 1
1 1141 . 14 1 1 A 93 93 THR CB C 182 68.560 69.053 -0.493 1
1 1143 . 14 1 1 A 93 93 THR N N 182 114.813 114.997 -0.184 1
1 1144 . 14 1 1 A 94 94 ARG H H 183 7.753 7.455 0.298 1
1 1145 . 14 1 1 A 94 94 ARG HA H 183 4.139 4.280 -0.141 1
1 1152 . 14 1 1 A 94 94 ARG C C 183 176.897 176.958 -0.061 1
1 1153 . 14 1 1 A 94 94 ARG CA C 183 55.350 56.200 -0.850 1
1 1154 . 14 1 1 A 94 94 ARG CB C 183 30.930 30.918 0.012 1
1 1157 . 14 1 1 A 94 94 ARG N N 183 120.101 117.892 2.209 1
1 1158 . 14 1 1 A 95 95 GLY H H 184 8.112 9.030 -0.918 1
1 1159 . 14 1 1 A 95 95 GLY HA2 H 184 3.838 3.834 0.004 1
1 1160 . 14 1 1 A 95 95 GLY HA3 H 184 3.670 3.840 -0.170 1
1 1161 . 14 1 1 A 95 95 GLY C C 184 173.659 173.421 0.238 1
1 1162 . 14 1 1 A 95 95 GLY CA C 184 46.040 45.603 0.437 1
1 1163 . 14 1 1 A 95 95 GLY N N 184 108.106 109.229 -1.123 1
1 1164 . 14 1 1 A 96 96 ASN H H 185 6.833 7.531 -0.698 1
1 1165 . 14 1 1 A 96 96 ASN HA H 185 4.944 5.356 -0.412 1
1 1170 . 14 1 1 A 96 96 ASN C C 185 174.267 174.271 -0.004 1
1 1171 . 14 1 1 A 96 96 ASN CA C 185 52.560 51.317 1.243 1
1 1172 . 14 1 1 A 96 96 ASN CB C 185 45.890 43.069 2.821 1
1 1173 . 14 1 1 A 96 96 ASN N N 185 113.392 117.573 -4.181 1
1 1175 . 14 1 1 A 97 97 PHE H H 186 9.108 8.917 0.191 1
1 1176 . 14 1 1 A 97 97 PHE HA H 186 4.782 4.795 -0.013 1
1 1183 . 14 1 1 A 97 97 PHE C C 186 174.862 175.816 -0.954 1
1 1184 . 14 1 1 A 97 97 PHE CA C 186 60.056 59.609 0.447 1
1 1185 . 14 1 1 A 97 97 PHE CB C 186 40.180 39.624 0.556 1
1 1188 . 14 1 1 A 97 97 PHE N N 186 118.741 119.584 -0.843 1
1 1189 . 14 1 1 A 98 98 ILE H H 187 8.933 8.793 0.140 1
1 1190 . 14 1 1 A 98 98 ILE HA H 187 5.458 4.900 0.558 1
1 1200 . 14 1 1 A 98 98 ILE C C 187 176.041 175.020 1.021 1
1 1201 . 14 1 1 A 98 98 ILE CA C 187 57.610 59.118 -1.508 1
1 1202 . 14 1 1 A 98 98 ILE CB C 187 42.070 42.140 -0.070 1
1 1206 . 14 1 1 A 98 98 ILE N N 187 117.857 118.244 -0.387 1
1 1207 . 14 1 1 A 99 99 ILE H H 188 8.284 8.714 -0.430 1
1 1208 . 14 1 1 A 99 99 ILE HA H 188 4.341 4.199 0.142 1
1 1218 . 14 1 1 A 99 99 ILE C C 188 176.413 176.376 0.037 1
1 1219 . 14 1 1 A 99 99 ILE CA C 188 59.190 61.144 -1.954 1
1 1220 . 14 1 1 A 99 99 ILE CB C 188 37.940 38.140 -0.200 1
1 1224 . 14 1 1 A 99 99 ILE N N 188 121.796 122.816 -1.020 1
1 1225 . 14 1 1 A 100 100 LYS H H 189 8.463 8.279 0.184 1
1 1226 . 14 1 1 A 100 100 LYS HA H 189 4.040 4.216 -0.176 1
1 1235 . 14 1 1 A 100 100 LYS C C 189 176.848 176.639 0.209 1
1 1236 . 14 1 1 A 100 100 LYS CA C 189 57.241 57.022 0.219 1
1 1237 . 14 1 1 A 100 100 LYS CB C 189 33.400 33.537 -0.137 1
1 1241 . 14 1 1 A 100 100 LYS N N 189 127.995 125.164 2.831 1
1 1242 . 14 1 1 A 101 101 GLY H H 190 8.346 8.234 0.112 1
1 1243 . 14 1 1 A 101 101 GLY HA2 H 190 3.947 4.074 -0.127 1
1 1244 . 14 1 1 A 101 101 GLY HA3 H 190 3.813 4.077 -0.264 1
1 1245 . 14 1 1 A 101 101 GLY C C 190 172.902 173.556 -0.654 1
1 1246 . 14 1 1 A 101 101 GLY CA C 190 44.920 45.921 -1.001 1
1 1247 . 14 1 1 A 101 101 GLY N N 190 110.882 109.209 1.673 1
1 7 . 15 1 1 A 2 2 GLN H H 91 8.786 8.278 0.508 1
1 8 . 15 1 1 A 2 2 GLN HA H 91 4.005 4.092 -0.087 1
1 15 . 15 1 1 A 2 2 GLN C C 91 177.270 178.588 -1.318 1
1 16 . 15 1 1 A 2 2 GLN CA C 91 58.220 58.804 -0.584 1
1 17 . 15 1 1 A 2 2 GLN CB C 91 28.650 28.160 0.490 1
1 19 . 15 1 1 A 2 2 GLN N N 91 121.993 122.531 -0.538 1
1 21 . 15 1 1 A 3 3 GLU H H 92 8.430 8.268 0.162 1
1 22 . 15 1 1 A 3 3 GLU HA H 92 4.007 4.120 -0.113 1
1 27 . 15 1 1 A 3 3 GLU C C 92 178.287 178.737 -0.450 1
1 28 . 15 1 1 A 3 3 GLU CA C 92 59.490 59.149 0.341 1
1 29 . 15 1 1 A 3 3 GLU CB C 92 29.506 29.518 -0.012 1
1 31 . 15 1 1 A 3 3 GLU N N 92 120.195 118.677 1.518 1
1 32 . 15 1 1 A 4 4 SER H H 93 8.209 7.814 0.395 1
1 33 . 15 1 1 A 4 4 SER HA H 93 4.272 4.265 0.007 1
1 36 . 15 1 1 A 4 4 SER C C 93 177.369 177.515 -0.146 1
1 37 . 15 1 1 A 4 4 SER CA C 93 61.044 61.438 -0.394 1
1 38 . 15 1 1 A 4 4 SER CB C 93 62.950 62.865 0.085 1
1 39 . 15 1 1 A 4 4 SER N N 93 115.524 114.796 0.728 1
1 40 . 15 1 1 A 5 5 ILE H H 94 8.080 7.623 0.457 1
1 41 . 15 1 1 A 5 5 ILE HA H 94 3.530 3.618 -0.088 1
1 51 . 15 1 1 A 5 5 ILE C C 94 177.778 177.709 0.069 1
1 52 . 15 1 1 A 5 5 ILE CA C 94 65.710 65.185 0.525 1
1 53 . 15 1 1 A 5 5 ILE CB C 94 37.800 37.317 0.483 1
1 57 . 15 1 1 A 5 5 ILE N N 94 124.148 121.824 2.324 1
1 58 . 15 1 1 A 6 6 GLN H H 95 8.374 8.329 0.045 1
1 59 . 15 1 1 A 6 6 GLN HA H 95 4.125 3.949 0.176 1
1 66 . 15 1 1 A 6 6 GLN C C 95 179.726 179.002 0.724 1
1 67 . 15 1 1 A 6 6 GLN CA C 95 59.190 58.993 0.197 1
1 68 . 15 1 1 A 6 6 GLN CB C 95 27.060 28.367 -1.307 1
1 70 . 15 1 1 A 6 6 GLN N N 95 118.257 118.919 -0.662 1
1 72 . 15 1 1 A 7 7 ASN H H 96 8.456 8.004 0.452 1
1 73 . 15 1 1 A 7 7 ASN HA H 96 4.446 4.558 -0.112 1
1 78 . 15 1 1 A 7 7 ASN C C 96 177.257 178.528 -1.271 1
1 79 . 15 1 1 A 7 7 ASN CA C 96 56.020 55.971 0.049 1
1 80 . 15 1 1 A 7 7 ASN CB C 96 38.126 37.953 0.173 1
1 81 . 15 1 1 A 7 7 ASN N N 96 118.597 118.624 -0.027 1
1 83 . 15 1 1 A 8 8 LYS H H 97 7.732 7.736 -0.004 1
1 84 . 15 1 1 A 8 8 LYS HA H 97 4.129 4.065 0.064 1
1 93 . 15 1 1 A 8 8 LYS C C 97 179.143 179.284 -0.141 1
1 94 . 15 1 1 A 8 8 LYS CA C 97 59.126 59.629 -0.503 1
1 95 . 15 1 1 A 8 8 LYS CB C 97 32.070 32.624 -0.554 1
1 99 . 15 1 1 A 8 8 LYS N N 97 122.381 120.285 2.096 1
1 100 . 15 1 1 A 9 9 ILE H H 98 8.452 8.129 0.323 1
1 101 . 15 1 1 A 9 9 ILE HA H 98 3.480 3.813 -0.333 1
1 111 . 15 1 1 A 9 9 ILE C C 98 177.406 178.314 -0.908 1
1 112 . 15 1 1 A 9 9 ILE CA C 98 66.430 65.115 1.315 1
1 113 . 15 1 1 A 9 9 ILE CB C 98 37.980 37.607 0.373 1
1 117 . 15 1 1 A 9 9 ILE N N 98 119.950 120.972 -1.022 1
1 118 . 15 1 1 A 10 10 SER H H 99 7.924 7.953 -0.029 1
1 119 . 15 1 1 A 10 10 SER HA H 99 3.983 4.175 -0.192 1
1 122 . 15 1 1 A 10 10 SER C C 99 176.327 176.114 0.213 1
1 123 . 15 1 1 A 10 10 SER CA C 99 61.990 61.235 0.755 1
1 124 . 15 1 1 A 10 10 SER CB C 99 62.790 63.164 -0.374 1
1 125 . 15 1 1 A 10 10 SER N N 99 113.568 116.354 -2.786 1
1 126 . 15 1 1 A 11 11 GLN H H 100 7.832 7.489 0.343 1
1 127 . 15 1 1 A 11 11 GLN HA H 100 4.238 4.265 -0.027 1
1 134 . 15 1 1 A 11 11 GLN C C 100 178.088 177.003 1.085 1
1 135 . 15 1 1 A 11 11 GLN CA C 100 57.900 58.032 -0.132 1
1 136 . 15 1 1 A 11 11 GLN CB C 100 29.790 28.802 0.988 1
1 138 . 15 1 1 A 11 11 GLN N N 100 117.487 118.912 -1.425 1
1 140 . 15 1 1 A 12 12 CYS H H 101 7.920 7.859 0.061 1
1 141 . 15 1 1 A 12 12 CYS HA H 101 4.657 4.667 -0.010 1
1 144 . 15 1 1 A 12 12 CYS C C 101 175.446 174.701 0.745 1
1 145 . 15 1 1 A 12 12 CYS CA C 101 60.654 58.651 2.003 1
1 146 . 15 1 1 A 12 12 CYS CB C 101 29.310 27.866 1.444 1
1 147 . 15 1 1 A 12 12 CYS N N 101 114.221 116.561 -2.340 1
1 148 . 15 1 1 A 13 13 LYS H H 102 8.029 7.277 0.752 1
1 149 . 15 1 1 A 13 13 LYS HA H 102 5.069 4.797 0.272 1
1 158 . 15 1 1 A 13 13 LYS C C 102 174.800 176.287 -1.487 1
1 159 . 15 1 1 A 13 13 LYS CA C 102 56.394 55.938 0.456 1
1 160 . 15 1 1 A 13 13 LYS CB C 102 32.770 33.377 -0.607 1
1 164 . 15 1 1 A 13 13 LYS N N 102 124.129 119.417 4.712 1
1 165 . 15 1 1 A 14 14 PHE H H 103 8.737 8.565 0.172 1
1 166 . 15 1 1 A 14 14 PHE HA H 103 5.059 5.124 -0.065 1
1 174 . 15 1 1 A 14 14 PHE C C 103 173.560 173.464 0.096 1
1 175 . 15 1 1 A 14 14 PHE CA C 103 55.470 56.185 -0.715 1
1 176 . 15 1 1 A 14 14 PHE CB C 103 41.760 41.313 0.447 1
1 180 . 15 1 1 A 14 14 PHE N N 103 118.661 116.602 2.059 1
1 181 . 15 1 1 A 15 15 SER H H 104 8.826 8.533 0.293 1
1 182 . 15 1 1 A 15 15 SER HA H 104 4.602 4.561 0.041 1
1 185 . 15 1 1 A 15 15 SER C C 104 173.795 173.875 -0.080 1
1 186 . 15 1 1 A 15 15 SER CA C 104 58.610 57.945 0.665 1
1 187 . 15 1 1 A 15 15 SER CB C 104 62.690 62.476 0.214 1
1 188 . 15 1 1 A 15 15 SER N N 104 117.781 115.481 2.300 1
1 189 . 15 1 1 A 16 16 VAL H H 105 7.784 8.085 -0.301 1
1 190 . 15 1 1 A 16 16 VAL HA H 105 3.370 4.160 -0.790 1
1 198 . 15 1 1 A 16 16 VAL C C 105 174.987 175.275 -0.288 1
1 199 . 15 1 1 A 16 16 VAL CA C 105 63.580 62.756 0.824 1
1 200 . 15 1 1 A 16 16 VAL CB C 105 31.410 30.784 0.626 1
1 203 . 15 1 1 A 16 16 VAL N N 105 129.075 126.268 2.807 1
1 204 . 15 1 1 A 17 17 CYS H H 106 8.536 8.628 -0.092 1
1 205 . 15 1 1 A 17 17 CYS HA H 106 5.011 4.959 0.052 1
1 208 . 15 1 1 A 17 17 CYS CA C 106 55.260 56.440 -1.180 1
1 209 . 15 1 1 A 17 17 CYS CB C 106 28.210 28.711 -0.501 1
1 210 . 15 1 1 A 17 17 CYS N N 106 130.045 127.116 2.929 1
1 211 . 15 1 1 A 18 18 PRO HA H 107 3.991 4.368 -0.377 1
1 218 . 15 1 1 A 18 18 PRO C C 107 178.188 178.255 -0.067 1
1 219 . 15 1 1 A 18 18 PRO CA C 107 65.940 64.894 1.046 1
1 220 . 15 1 1 A 18 18 PRO CB C 107 32.000 31.975 0.025 1
1 223 . 15 1 1 A 19 19 GLU H H 108 9.260 9.006 0.254 1
1 224 . 15 1 1 A 19 19 GLU HA H 108 4.119 4.083 0.036 1
1 229 . 15 1 1 A 19 19 GLU C C 108 178.721 179.096 -0.375 1
1 230 . 15 1 1 A 19 19 GLU CA C 108 59.300 59.298 0.002 1
1 231 . 15 1 1 A 19 19 GLU CB C 108 28.920 28.872 0.048 1
1 233 . 15 1 1 A 19 19 GLU N N 108 118.270 115.968 2.302 1
1 234 . 15 1 1 A 20 20 ARG H H 109 7.672 7.611 0.061 1
1 235 . 15 1 1 A 20 20 ARG HA H 109 4.331 4.120 0.211 1
1 242 . 15 1 1 A 20 20 ARG C C 109 177.977 178.742 -0.765 1
1 243 . 15 1 1 A 20 20 ARG CA C 109 57.350 58.685 -1.335 1
1 244 . 15 1 1 A 20 20 ARG CB C 109 30.820 30.555 0.265 1
1 247 . 15 1 1 A 20 20 ARG N N 109 118.357 119.188 -0.831 1
1 248 . 15 1 1 A 21 21 LEU H H 110 7.601 7.866 -0.265 1
1 249 . 15 1 1 A 21 21 LEU HA H 110 4.380 4.252 0.128 1
1 259 . 15 1 1 A 21 21 LEU C C 110 176.562 176.374 0.188 1
1 260 . 15 1 1 A 21 21 LEU CA C 110 56.096 55.586 0.510 1
1 261 . 15 1 1 A 21 21 LEU CB C 110 44.016 42.002 2.014 1
1 265 . 15 1 1 A 21 21 LEU N N 110 118.626 118.316 0.310 1
1 266 . 15 1 1 A 22 22 GLN H H 111 7.750 7.807 -0.057 1
1 267 . 15 1 1 A 22 22 GLN HA H 111 3.870 3.908 -0.038 1
1 274 . 15 1 1 A 22 22 GLN C C 111 173.336 174.032 -0.696 1
1 275 . 15 1 1 A 22 22 GLN CA C 111 56.510 56.928 -0.418 1
1 276 . 15 1 1 A 22 22 GLN CB C 111 26.800 26.181 0.619 1
1 278 . 15 1 1 A 22 22 GLN N N 111 113.926 115.533 -1.607 1
1 280 . 15 1 1 A 23 23 CYS H H 112 7.407 7.900 -0.493 1
1 281 . 15 1 1 A 23 23 CYS HA H 112 4.469 4.948 -0.479 1
1 284 . 15 1 1 A 23 23 CYS CA C 112 52.650 56.699 -4.049 1
1 285 . 15 1 1 A 23 23 CYS CB C 112 29.750 28.941 0.809 1
1 286 . 15 1 1 A 23 23 CYS N N 112 112.681 117.756 -5.075 1
1 287 . 15 1 1 A 24 24 PRO HA H 113 4.408 4.599 -0.191 1
1 294 . 15 1 1 A 24 24 PRO C C 113 178.175 177.419 0.756 1
1 295 . 15 1 1 A 24 24 PRO CA C 113 62.040 62.618 -0.578 1
1 296 . 15 1 1 A 24 24 PRO CB C 113 31.920 32.657 -0.737 1
1 299 . 15 1 1 A 25 25 LEU H H 114 8.593 8.426 0.167 1
1 300 . 15 1 1 A 25 25 LEU HA H 114 3.765 3.895 -0.130 1
1 310 . 15 1 1 A 25 25 LEU C C 114 179.950 178.993 0.957 1
1 311 . 15 1 1 A 25 25 LEU CA C 114 57.674 57.806 -0.132 1
1 312 . 15 1 1 A 25 25 LEU CB C 114 40.690 41.584 -0.894 1
1 316 . 15 1 1 A 25 25 LEU N N 114 123.729 123.519 0.210 1
1 317 . 15 1 1 A 26 26 GLU H H 115 9.108 8.624 0.484 1
1 318 . 15 1 1 A 26 26 GLU HA H 115 3.876 3.996 -0.120 1
1 323 . 15 1 1 A 26 26 GLU C C 115 177.505 178.525 -1.020 1
1 324 . 15 1 1 A 26 26 GLU CA C 115 59.410 58.986 0.424 1
1 325 . 15 1 1 A 26 26 GLU CB C 115 28.460 28.857 -0.397 1
1 327 . 15 1 1 A 26 26 GLU N N 115 116.817 117.608 -0.791 1
1 328 . 15 1 1 A 27 27 ALA H H 116 7.360 7.507 -0.147 1
1 329 . 15 1 1 A 27 27 ALA HA H 116 4.408 4.119 0.289 1
1 333 . 15 1 1 A 27 27 ALA C C 116 177.046 177.893 -0.847 1
1 334 . 15 1 1 A 27 27 ALA CA C 116 52.970 54.412 -1.442 1
1 335 . 15 1 1 A 27 27 ALA CB C 116 19.916 18.305 1.611 1
1 336 . 15 1 1 A 27 27 ALA N N 116 118.966 121.526 -2.560 1
1 337 . 15 1 1 A 28 28 ILE H H 117 7.168 7.023 0.145 1
1 338 . 15 1 1 A 28 28 ILE HA H 117 4.432 4.349 0.083 1
1 348 . 15 1 1 A 28 28 ILE C C 117 172.641 175.513 -2.872 1
1 349 . 15 1 1 A 28 28 ILE CA C 117 59.980 59.603 0.377 1
1 350 . 15 1 1 A 28 28 ILE CB C 117 37.350 37.621 -0.271 1
1 354 . 15 1 1 A 28 28 ILE N N 117 108.913 108.805 0.108 1
1 355 . 15 1 1 A 29 29 GLN H H 118 6.562 7.239 -0.677 1
1 356 . 15 1 1 A 29 29 GLN HA H 118 3.922 4.066 -0.144 1
1 363 . 15 1 1 A 29 29 GLN C C 118 175.049 175.406 -0.357 1
1 364 . 15 1 1 A 29 29 GLN CA C 118 54.596 56.391 -1.795 1
1 365 . 15 1 1 A 29 29 GLN CB C 118 29.570 28.692 0.878 1
1 367 . 15 1 1 A 29 29 GLN N N 118 116.455 123.242 -6.787 1
1 369 . 15 1 1 A 30 30 CYS H H 119 8.138 8.419 -0.281 1
1 370 . 15 1 1 A 30 30 CYS HA H 119 4.580 4.457 0.123 1
1 373 . 15 1 1 A 30 30 CYS CA C 119 57.810 57.269 0.541 1
1 374 . 15 1 1 A 30 30 CYS CB C 119 30.200 28.746 1.454 1
1 375 . 15 1 1 A 30 30 CYS N N 119 134.136 125.253 8.883 1
1 376 . 15 1 1 A 31 31 PRO HA H 120 4.424 4.425 -0.001 1
1 383 . 15 1 1 A 31 31 PRO C C 120 177.431 177.178 0.253 1
1 384 . 15 1 1 A 31 31 PRO CA C 120 64.060 63.988 0.072 1
1 385 . 15 1 1 A 31 31 PRO CB C 120 32.776 32.441 0.335 1
1 388 . 15 1 1 A 32 32 ILE H H 121 11.318 7.795 3.523 1
1 389 . 15 1 1 A 32 32 ILE HA H 121 4.038 4.004 0.034 1
1 399 . 15 1 1 A 32 32 ILE C C 121 178.485 177.840 0.645 1
1 400 . 15 1 1 A 32 32 ILE CA C 121 64.060 63.826 0.234 1
1 401 . 15 1 1 A 32 32 ILE CB C 121 39.340 38.500 0.840 1
1 405 . 15 1 1 A 32 32 ILE N N 121 124.500 117.161 7.339 1
1 406 . 15 1 1 A 33 33 THR H H 122 9.928 7.796 2.132 1
1 407 . 15 1 1 A 33 33 THR HA H 122 4.048 4.353 -0.305 1
1 412 . 15 1 1 A 33 33 THR C C 122 175.793 174.821 0.972 1
1 413 . 15 1 1 A 33 33 THR CA C 122 62.990 61.752 1.238 1
1 414 . 15 1 1 A 33 33 THR CB C 122 70.300 70.062 0.238 1
1 416 . 15 1 1 A 33 33 THR N N 122 115.136 109.170 5.966 1
1 417 . 15 1 1 A 34 34 LEU H H 123 8.439 7.749 0.690 1
1 418 . 15 1 1 A 34 34 LEU HA H 123 3.912 3.822 0.090 1
1 428 . 15 1 1 A 34 34 LEU C C 123 175.495 175.140 0.355 1
1 429 . 15 1 1 A 34 34 LEU CA C 123 56.290 56.229 0.061 1
1 430 . 15 1 1 A 34 34 LEU CB C 123 38.500 39.896 -1.396 1
1 434 . 15 1 1 A 34 34 LEU N N 123 117.230 119.148 -1.918 1
1 435 . 15 1 1 A 35 35 GLU H H 124 7.816 6.960 0.856 1
1 436 . 15 1 1 A 35 35 GLU HA H 124 4.634 4.804 -0.170 1
1 441 . 15 1 1 A 35 35 GLU C C 124 174.838 173.944 0.894 1
1 442 . 15 1 1 A 35 35 GLU CA C 124 53.780 54.785 -1.005 1
1 443 . 15 1 1 A 35 35 GLU CB C 124 33.710 32.380 1.330 1
1 445 . 15 1 1 A 35 35 GLU N N 124 116.577 114.293 2.284 1
1 446 . 15 1 1 A 36 36 GLN H H 125 8.532 8.537 -0.005 1
1 447 . 15 1 1 A 36 36 GLN HA H 125 4.958 4.413 0.545 1
1 454 . 15 1 1 A 36 36 GLN CA C 125 53.350 53.505 -0.155 1
1 455 . 15 1 1 A 36 36 GLN CB C 125 29.950 29.273 0.677 1
1 457 . 15 1 1 A 36 36 GLN N N 125 123.034 123.167 -0.133 1
1 459 . 15 1 1 A 37 37 PRO HA H 126 4.458 4.659 -0.201 1
1 466 . 15 1 1 A 37 37 PRO C C 126 176.314 176.507 -0.193 1
1 467 . 15 1 1 A 37 37 PRO CA C 126 62.816 62.555 0.261 1
1 468 . 15 1 1 A 37 37 PRO CB C 126 33.070 32.615 0.455 1
1 471 . 15 1 1 A 38 38 GLU H H 127 8.626 8.401 0.225 1
1 472 . 15 1 1 A 38 38 GLU HA H 127 4.274 4.263 0.011 1
1 477 . 15 1 1 A 38 38 GLU C C 127 177.877 176.398 1.479 1
1 478 . 15 1 1 A 38 38 GLU CA C 127 58.730 57.173 1.557 1
1 479 . 15 1 1 A 38 38 GLU CB C 127 30.340 30.622 -0.282 1
1 481 . 15 1 1 A 38 38 GLU N N 127 120.691 117.981 2.710 1
1 482 . 15 1 1 A 39 39 LYS H H 128 7.861 7.813 0.048 1
1 483 . 15 1 1 A 39 39 LYS HA H 128 4.889 4.869 0.020 1
1 492 . 15 1 1 A 39 39 LYS C C 128 175.446 174.954 0.492 1
1 493 . 15 1 1 A 39 39 LYS CA C 128 53.670 54.620 -0.950 1
1 494 . 15 1 1 A 39 39 LYS CB C 128 33.630 35.965 -2.335 1
1 498 . 15 1 1 A 39 39 LYS N N 128 117.878 117.001 0.877 1
1 499 . 15 1 1 A 40 40 GLY H H 129 8.426 7.948 0.478 1
1 500 . 15 1 1 A 40 40 GLY HA2 H 129 4.970 3.979 0.991 1
1 501 . 15 1 1 A 40 40 GLY HA3 H 129 2.458 4.124 -1.666 1
1 502 . 15 1 1 A 40 40 GLY C C 129 170.048 172.286 -2.238 1
1 503 . 15 1 1 A 40 40 GLY CA C 129 42.910 44.927 -2.017 1
1 504 . 15 1 1 A 40 40 GLY N N 129 112.604 105.982 6.622 1
1 505 . 15 1 1 A 41 41 ILE H H 130 8.596 9.067 -0.471 1
1 506 . 15 1 1 A 41 41 ILE HA H 130 4.636 5.066 -0.430 1
1 516 . 15 1 1 A 41 41 ILE C C 130 172.691 174.743 -2.052 1
1 517 . 15 1 1 A 41 41 ILE CA C 130 58.500 58.910 -0.410 1
1 518 . 15 1 1 A 41 41 ILE CB C 130 43.320 40.443 2.877 1
1 522 . 15 1 1 A 41 41 ILE N N 130 113.363 117.156 -3.793 1
1 523 . 15 1 1 A 42 42 PHE H H 131 8.994 9.135 -0.141 1
1 524 . 15 1 1 A 42 42 PHE HA H 131 5.075 5.269 -0.194 1
1 532 . 15 1 1 A 42 42 PHE C C 131 175.111 175.414 -0.303 1
1 533 . 15 1 1 A 42 42 PHE CA C 131 58.680 57.332 1.348 1
1 534 . 15 1 1 A 42 42 PHE CB C 131 42.220 40.544 1.676 1
1 538 . 15 1 1 A 42 42 PHE N N 131 125.156 122.368 2.788 1
1 539 . 15 1 1 A 43 43 VAL H H 132 8.399 9.405 -1.006 1
1 540 . 15 1 1 A 43 43 VAL HA H 132 4.920 4.783 0.137 1
1 548 . 15 1 1 A 43 43 VAL C C 132 178.175 175.272 2.903 1
1 549 . 15 1 1 A 43 43 VAL CA C 132 59.600 60.707 -1.107 1
1 550 . 15 1 1 A 43 43 VAL CB C 132 35.920 35.264 0.656 1
1 553 . 15 1 1 A 43 43 VAL N N 132 119.371 122.563 -3.192 1
1 554 . 15 1 1 A 44 44 LYS H H 133 10.041 8.454 1.587 1
1 555 . 15 1 1 A 44 44 LYS HA H 133 4.920 4.369 0.551 1
1 564 . 15 1 1 A 44 44 LYS C C 133 177.195 175.609 1.586 1
1 565 . 15 1 1 A 44 44 LYS CA C 133 57.310 56.409 0.901 1
1 566 . 15 1 1 A 44 44 LYS CB C 133 34.410 32.218 2.192 1
1 570 . 15 1 1 A 44 44 LYS N N 133 130.928 126.672 4.256 1
1 571 . 15 1 1 A 45 45 ASN H H 134 8.534 8.966 -0.432 1
1 572 . 15 1 1 A 45 45 ASN HA H 134 4.151 4.791 -0.640 1
1 577 . 15 1 1 A 45 45 ASN C C 134 174.217 175.292 -1.075 1
1 578 . 15 1 1 A 45 45 ASN CA C 134 55.290 52.489 2.801 1
1 579 . 15 1 1 A 45 45 ASN CB C 134 37.530 37.708 -0.178 1
1 580 . 15 1 1 A 45 45 ASN N N 134 119.452 124.401 -4.949 1
1 582 . 15 1 1 A 46 46 SER H H 135 7.570 8.135 -0.565 1
1 583 . 15 1 1 A 46 46 SER HA H 135 4.220 4.104 0.116 1
1 586 . 15 1 1 A 46 46 SER C C 135 174.490 176.943 -2.453 1
1 587 . 15 1 1 A 46 46 SER CA C 135 57.090 61.332 -4.242 1
1 588 . 15 1 1 A 46 46 SER CB C 135 64.126 62.904 1.222 1
1 589 . 15 1 1 A 46 46 SER N N 135 105.613 121.497 -15.884 1
1 590 . 15 1 1 A 47 47 ASP H H 136 9.113 8.287 0.826 1
1 591 . 15 1 1 A 47 47 ASP HA H 136 4.220 4.325 -0.105 1
1 594 . 15 1 1 A 47 47 ASP CA C 136 57.610 57.137 0.473 1
1 595 . 15 1 1 A 47 47 ASP CB C 136 40.810 41.156 -0.346 1
1 596 . 15 1 1 A 47 47 ASP N N 136 120.995 121.003 -0.008 1
1 597 . 15 1 1 A 48 48 GLY H H 137 8.172 7.913 0.259 1
1 598 . 15 1 1 A 48 48 GLY HA2 H 137 4.096 3.816 0.280 1
1 599 . 15 1 1 A 48 48 GLY HA3 H 137 3.664 3.826 -0.162 1
1 600 . 15 1 1 A 48 48 GLY C C 137 173.990 175.421 -1.431 1
1 601 . 15 1 1 A 48 48 GLY CA C 137 45.130 47.420 -2.290 1
1 602 . 15 1 1 A 48 48 GLY N N 137 105.838 107.014 -1.176 1
1 603 . 15 1 1 A 49 49 SER H H 138 7.252 7.551 -0.299 1
1 604 . 15 1 1 A 49 49 SER HA H 138 4.503 4.773 -0.270 1
1 607 . 15 1 1 A 49 49 SER C C 138 173.857 173.586 0.271 1
1 608 . 15 1 1 A 49 49 SER CA C 138 57.340 57.213 0.127 1
1 609 . 15 1 1 A 49 49 SER CB C 138 65.370 64.044 1.326 1
1 610 . 15 1 1 A 49 49 SER N N 138 114.942 112.282 2.660 1
1 611 . 15 1 1 A 50 50 ASP H H 139 8.276 8.188 0.088 1
1 612 . 15 1 1 A 50 50 ASP HA H 139 4.618 4.220 0.398 1
1 615 . 15 1 1 A 50 50 ASP C C 139 174.577 175.252 -0.675 1
1 616 . 15 1 1 A 50 50 ASP CA C 139 53.116 55.489 -2.373 1
1 617 . 15 1 1 A 50 50 ASP CB C 139 40.520 40.203 0.317 1
1 618 . 15 1 1 A 50 50 ASP N N 139 122.088 121.389 0.699 1
1 619 . 15 1 1 A 51 51 VAL H H 140 8.192 7.519 0.673 1
1 620 . 15 1 1 A 51 51 VAL HA H 140 4.299 4.153 0.146 1
1 628 . 15 1 1 A 51 51 VAL C C 140 175.867 175.432 0.435 1
1 629 . 15 1 1 A 51 51 VAL CA C 140 62.950 62.678 0.272 1
1 630 . 15 1 1 A 51 51 VAL CB C 140 33.230 32.232 0.998 1
1 632 . 15 1 1 A 51 51 VAL N N 140 121.167 119.168 1.999 1
1 633 . 15 1 1 A 52 52 CYS H H 141 8.391 8.748 -0.357 1
1 634 . 15 1 1 A 52 52 CYS HA H 141 5.247 5.089 0.158 1
1 637 . 15 1 1 A 52 52 CYS C C 141 172.778 174.653 -1.875 1
1 638 . 15 1 1 A 52 52 CYS CA C 141 56.480 58.158 -1.678 1
1 639 . 15 1 1 A 52 52 CYS CB C 141 31.960 28.608 3.352 1
1 640 . 15 1 1 A 52 52 CYS N N 141 121.884 124.838 -2.954 1
1 641 . 15 1 1 A 53 53 THR H H 142 8.777 9.174 -0.397 1
1 642 . 15 1 1 A 53 53 THR HA H 142 4.489 5.006 -0.517 1
1 648 . 15 1 1 A 53 53 THR C C 142 171.885 172.934 -1.049 1
1 649 . 15 1 1 A 53 53 THR CA C 142 62.070 61.744 0.326 1
1 650 . 15 1 1 A 53 53 THR CB C 142 71.390 70.932 0.458 1
1 652 . 15 1 1 A 53 53 THR N N 142 118.132 119.698 -1.566 1
1 653 . 15 1 1 A 54 54 LEU H H 143 8.409 8.604 -0.195 1
1 654 . 15 1 1 A 54 54 LEU HA H 143 4.276 4.572 -0.296 1
1 664 . 15 1 1 A 54 54 LEU C C 143 174.366 174.220 0.146 1
1 665 . 15 1 1 A 54 54 LEU CA C 143 54.330 53.018 1.312 1
1 666 . 15 1 1 A 54 54 LEU CB C 143 42.396 42.633 -0.237 1
1 670 . 15 1 1 A 54 54 LEU N N 143 127.980 129.307 -1.327 1
1 671 . 15 1 1 A 55 55 PHE H H 144 8.646 8.876 -0.230 1
1 672 . 15 1 1 A 55 55 PHE HA H 144 5.455 4.907 0.548 1
1 680 . 15 1 1 A 55 55 PHE C C 144 176.054 175.066 0.988 1
1 681 . 15 1 1 A 55 55 PHE CA C 144 55.250 56.197 -0.947 1
1 682 . 15 1 1 A 55 55 PHE CB C 144 44.100 41.366 2.734 1
1 686 . 15 1 1 A 55 55 PHE N N 144 122.010 126.848 -4.838 1
1 687 . 15 1 1 A 56 56 ASP H H 145 11.575 8.390 3.185 1
1 688 . 15 1 1 A 56 56 ASP HA H 145 4.416 4.476 -0.060 1
1 691 . 15 1 1 A 56 56 ASP C C 145 176.748 177.525 -0.777 1
1 692 . 15 1 1 A 56 56 ASP CA C 145 55.840 54.479 1.361 1
1 693 . 15 1 1 A 56 56 ASP CB C 145 44.390 42.578 1.812 1
1 694 . 15 1 1 A 56 56 ASP N N 145 121.936 123.077 -1.141 1
1 695 . 15 1 1 A 57 57 ALA H H 146 8.508 8.858 -0.350 1
1 696 . 15 1 1 A 57 57 ALA HA H 146 3.797 4.054 -0.257 1
1 700 . 15 1 1 A 57 57 ALA C C 146 178.696 180.122 -1.426 1
1 701 . 15 1 1 A 57 57 ALA CA C 146 55.990 55.559 0.431 1
1 702 . 15 1 1 A 57 57 ALA CB C 146 18.840 18.064 0.776 1
1 703 . 15 1 1 A 57 57 ALA N N 146 130.243 129.014 1.229 1
1 704 . 15 1 1 A 58 58 ALA H H 147 8.378 7.607 0.771 1
1 705 . 15 1 1 A 58 58 ALA HA H 147 4.078 4.252 -0.174 1
1 709 . 15 1 1 A 58 58 ALA C C 147 181.091 179.435 1.656 1
1 710 . 15 1 1 A 58 58 ALA CA C 147 54.770 55.016 -0.246 1
1 711 . 15 1 1 A 58 58 ALA CB C 147 17.700 18.575 -0.875 1
1 712 . 15 1 1 A 58 58 ALA N N 147 121.997 119.658 2.339 1
1 713 . 15 1 1 A 59 59 ALA H H 148 9.138 7.994 1.144 1
1 714 . 15 1 1 A 59 59 ALA HA H 148 3.975 4.037 -0.062 1
1 718 . 15 1 1 A 59 59 ALA C C 148 180.508 179.585 0.923 1
1 719 . 15 1 1 A 59 59 ALA CA C 148 54.840 55.002 -0.162 1
1 720 . 15 1 1 A 59 59 ALA CB C 148 18.600 18.439 0.161 1
1 721 . 15 1 1 A 59 59 ALA N N 148 123.595 120.482 3.113 1
1 722 . 15 1 1 A 60 60 PHE H H 149 8.814 8.216 0.598 1
1 723 . 15 1 1 A 60 60 PHE HA H 149 3.722 4.000 -0.278 1
1 731 . 15 1 1 A 60 60 PHE C C 149 176.773 177.477 -0.704 1
1 732 . 15 1 1 A 60 60 PHE CA C 149 62.030 61.851 0.179 1
1 733 . 15 1 1 A 60 60 PHE CB C 149 39.960 38.892 1.068 1
1 737 . 15 1 1 A 60 60 PHE N N 149 120.354 119.949 0.405 1
1 738 . 15 1 1 A 61 61 SER H H 150 8.276 8.126 0.150 1
1 739 . 15 1 1 A 61 61 SER HA H 150 3.880 4.122 -0.242 1
1 742 . 15 1 1 A 61 61 SER C C 150 177.691 177.514 0.177 1
1 743 . 15 1 1 A 61 61 SER CA C 150 62.190 61.460 0.730 1
1 744 . 15 1 1 A 61 61 SER CB C 150 63.016 63.075 -0.059 1
1 745 . 15 1 1 A 61 61 SER N N 150 112.086 114.226 -2.140 1
1 746 . 15 1 1 A 62 62 ARG H H 151 7.829 7.533 0.296 1
1 747 . 15 1 1 A 62 62 ARG HA H 151 3.971 4.084 -0.113 1
1 754 . 15 1 1 A 62 62 ARG C C 151 178.287 178.663 -0.376 1
1 755 . 15 1 1 A 62 62 ARG CA C 151 59.340 59.013 0.327 1
1 756 . 15 1 1 A 62 62 ARG CB C 151 29.760 29.831 -0.071 1
1 759 . 15 1 1 A 62 62 ARG N N 151 121.090 121.654 -0.564 1
1 760 . 15 1 1 A 63 63 LEU H H 152 7.390 7.894 -0.504 1
1 761 . 15 1 1 A 63 63 LEU HA H 152 3.791 3.954 -0.163 1
1 771 . 15 1 1 A 63 63 LEU C C 152 179.106 178.927 0.179 1
1 772 . 15 1 1 A 63 63 LEU CA C 152 58.900 57.929 0.971 1
1 773 . 15 1 1 A 63 63 LEU CB C 152 41.140 41.409 -0.269 1
1 777 . 15 1 1 A 63 63 LEU N N 152 121.129 119.437 1.692 1
1 778 . 15 1 1 A 64 64 VAL H H 153 7.552 7.930 -0.378 1
1 779 . 15 1 1 A 64 64 VAL HA H 153 3.411 3.480 -0.069 1
1 787 . 15 1 1 A 64 64 VAL C C 153 180.595 178.333 2.262 1
1 788 . 15 1 1 A 64 64 VAL CA C 153 65.644 66.529 -0.885 1
1 789 . 15 1 1 A 64 64 VAL CB C 153 31.410 31.387 0.023 1
1 792 . 15 1 1 A 64 64 VAL N N 153 118.280 118.364 -0.084 1
1 793 . 15 1 1 A 65 65 GLY H H 154 8.061 8.129 -0.068 1
1 794 . 15 1 1 A 65 65 GLY HA2 H 154 3.846 3.760 0.086 1
1 795 . 15 1 1 A 65 65 GLY HA3 H 154 3.809 3.761 0.048 1
1 796 . 15 1 1 A 65 65 GLY C C 154 175.235 176.585 -1.350 1
1 797 . 15 1 1 A 65 65 GLY CA C 154 46.630 46.975 -0.345 1
1 798 . 15 1 1 A 65 65 GLY N N 154 108.622 107.587 1.035 1
1 799 . 15 1 1 A 66 66 GLU H H 155 7.528 7.736 -0.208 1
1 800 . 15 1 1 A 66 66 GLU HA H 155 4.228 4.294 -0.066 1
1 805 . 15 1 1 A 66 66 GLU C C 155 176.761 176.802 -0.041 1
1 806 . 15 1 1 A 66 66 GLU CA C 155 56.590 56.458 0.132 1
1 807 . 15 1 1 A 66 66 GLU CB C 155 30.490 30.009 0.481 1
1 809 . 15 1 1 A 66 66 GLU N N 155 118.361 119.061 -0.700 1
1 810 . 15 1 1 A 67 67 GLY H H 156 7.884 7.971 -0.087 1
1 811 . 15 1 1 A 67 67 GLY HA2 H 156 3.918 3.896 0.022 1
1 812 . 15 1 1 A 67 67 GLY HA3 H 156 3.747 3.905 -0.158 1
1 813 . 15 1 1 A 67 67 GLY C C 156 174.788 174.447 0.341 1
1 814 . 15 1 1 A 67 67 GLY CA C 156 45.890 45.430 0.460 1
1 815 . 15 1 1 A 67 67 GLY N N 156 108.465 108.563 -0.098 1
1 816 . 15 1 1 A 68 68 LEU H H 157 7.332 7.762 -0.430 1
1 817 . 15 1 1 A 68 68 LEU HA H 157 4.361 4.515 -0.154 1
1 827 . 15 1 1 A 68 68 LEU CA C 157 53.060 52.401 0.659 1
1 828 . 15 1 1 A 68 68 LEU CB C 157 41.100 41.550 -0.450 1
1 832 . 15 1 1 A 68 68 LEU N N 157 121.920 121.596 0.324 1
1 833 . 15 1 1 A 69 69 PRO HA H 158 4.485 4.577 -0.092 1
1 840 . 15 1 1 A 69 69 PRO C C 158 174.602 176.206 -1.604 1
1 841 . 15 1 1 A 69 69 PRO CA C 158 61.556 62.212 -0.656 1
1 842 . 15 1 1 A 69 69 PRO CB C 158 32.370 32.750 -0.380 1
1 845 . 15 1 1 A 70 70 HIS H H 159 8.759 8.602 0.157 1
1 846 . 15 1 1 A 70 70 HIS HA H 159 3.947 4.329 -0.382 1
1 852 . 15 1 1 A 70 70 HIS CA C 159 56.250 55.172 1.078 1
1 853 . 15 1 1 A 70 70 HIS CB C 159 32.280 30.930 1.350 1
1 856 . 15 1 1 A 70 70 HIS N N 159 119.423 120.737 -1.314 1
1 857 . 15 1 1 A 71 71 PRO HA H 160 4.424 4.251 0.173 1
1 864 . 15 1 1 A 71 71 PRO C C 160 177.567 178.185 -0.618 1
1 865 . 15 1 1 A 71 71 PRO CA C 160 64.574 65.166 -0.592 1
1 866 . 15 1 1 A 71 71 PRO CB C 160 32.340 31.984 0.356 1
1 869 . 15 1 1 A 72 72 LEU H H 161 10.123 7.537 2.586 1
1 870 . 15 1 1 A 72 72 LEU HA H 161 4.778 4.362 0.416 1
1 880 . 15 1 1 A 72 72 LEU C C 161 178.721 178.829 -0.108 1
1 881 . 15 1 1 A 72 72 LEU CA C 161 55.800 57.376 -1.576 1
1 882 . 15 1 1 A 72 72 LEU CB C 161 42.440 43.294 -0.854 1
1 886 . 15 1 1 A 72 72 LEU N N 161 117.374 117.005 0.369 1
1 887 . 15 1 1 A 73 73 THR H H 162 7.523 8.254 -0.731 1
1 888 . 15 1 1 A 73 73 THR HA H 162 4.291 4.401 -0.110 1
1 893 . 15 1 1 A 73 73 THR C C 162 175.557 175.281 0.276 1
1 894 . 15 1 1 A 73 73 THR CA C 162 61.440 62.339 -0.899 1
1 895 . 15 1 1 A 73 73 THR CB C 162 70.500 70.347 0.153 1
1 897 . 15 1 1 A 73 73 THR N N 162 107.787 107.903 -0.116 1
1 898 . 15 1 1 A 74 74 ARG H H 163 8.361 7.896 0.465 1
1 899 . 15 1 1 A 74 74 ARG HA H 163 3.836 4.180 -0.344 1
1 906 . 15 1 1 A 74 74 ARG C C 163 174.701 175.119 -0.418 1
1 907 . 15 1 1 A 74 74 ARG CA C 163 57.980 57.599 0.381 1
1 908 . 15 1 1 A 74 74 ARG CB C 163 26.770 27.098 -0.328 1
1 911 . 15 1 1 A 74 74 ARG N N 163 115.130 116.587 -1.457 1
1 912 . 15 1 1 A 75 75 GLU H H 164 7.430 8.092 -0.662 1
1 913 . 15 1 1 A 75 75 GLU HA H 164 4.636 4.472 0.164 1
1 918 . 15 1 1 A 75 75 GLU CA C 164 53.699 54.838 -1.139 1
1 919 . 15 1 1 A 75 75 GLU CB C 164 29.550 28.846 0.704 1
1 921 . 15 1 1 A 75 75 GLU N N 164 120.076 119.097 0.979 1
1 922 . 15 1 1 A 76 76 PRO HA H 165 4.272 4.561 -0.289 1
1 929 . 15 1 1 A 76 76 PRO C C 165 176.649 177.082 -0.433 1
1 930 . 15 1 1 A 76 76 PRO CA C 165 63.204 63.023 0.181 1
1 931 . 15 1 1 A 76 76 PRO CB C 165 31.680 31.628 0.052 1
1 934 . 15 1 1 A 77 77 ILE H H 166 8.812 8.236 0.576 1
1 935 . 15 1 1 A 77 77 ILE HA H 166 3.838 4.315 -0.477 1
1 945 . 15 1 1 A 77 77 ILE C C 166 175.235 176.088 -0.853 1
1 946 . 15 1 1 A 77 77 ILE CA C 166 62.816 61.413 1.403 1
1 947 . 15 1 1 A 77 77 ILE CB C 166 37.750 38.383 -0.633 1
1 951 . 15 1 1 A 77 77 ILE N N 166 123.831 124.107 -0.276 1
1 952 . 15 1 1 A 78 78 THR H H 167 6.625 8.513 -1.888 1
1 953 . 15 1 1 A 78 78 THR HA H 167 4.632 5.025 -0.393 1
1 958 . 15 1 1 A 78 78 THR C C 167 174.143 174.273 -0.130 1
1 959 . 15 1 1 A 78 78 THR CA C 167 58.750 60.222 -1.472 1
1 960 . 15 1 1 A 78 78 THR CB C 167 71.320 70.699 0.621 1
1 962 . 15 1 1 A 78 78 THR N N 167 115.293 117.587 -2.294 1
1 963 . 15 1 1 A 79 79 ALA H H 168 9.088 8.974 0.114 1
1 964 . 15 1 1 A 79 79 ALA HA H 168 3.916 4.104 -0.188 1
1 968 . 15 1 1 A 79 79 ALA C C 168 179.788 179.630 0.158 1
1 969 . 15 1 1 A 79 79 ALA CA C 168 55.480 55.013 0.467 1
1 970 . 15 1 1 A 79 79 ALA CB C 168 17.630 18.450 -0.820 1
1 971 . 15 1 1 A 79 79 ALA N N 168 122.102 127.622 -5.520 1
1 972 . 15 1 1 A 80 80 SER H H 169 7.988 7.698 0.290 1
1 973 . 15 1 1 A 80 80 SER HA H 169 4.058 4.194 -0.136 1
1 976 . 15 1 1 A 80 80 SER C C 169 176.029 175.750 0.279 1
1 977 . 15 1 1 A 80 80 SER CA C 169 60.750 61.767 -1.017 1
1 978 . 15 1 1 A 80 80 SER CB C 169 62.510 63.176 -0.666 1
1 979 . 15 1 1 A 80 80 SER N N 169 109.541 114.838 -5.297 1
1 980 . 15 1 1 A 81 81 ILE H H 170 6.968 7.191 -0.223 1
1 981 . 15 1 1 A 81 81 ILE HA H 170 4.315 4.531 -0.216 1
1 991 . 15 1 1 A 81 81 ILE C C 170 174.242 175.351 -1.109 1
1 992 . 15 1 1 A 81 81 ILE CA C 170 62.296 61.007 1.289 1
1 993 . 15 1 1 A 81 81 ILE CB C 170 37.686 38.555 -0.869 1
1 997 . 15 1 1 A 81 81 ILE N N 170 112.476 112.320 0.156 1
1 998 . 15 1 1 A 82 82 ILE H H 171 7.345 7.472 -0.127 1
1 999 . 15 1 1 A 82 82 ILE HA H 171 4.339 4.620 -0.281 1
1 1009 . 15 1 1 A 82 82 ILE C C 171 174.999 174.649 0.350 1
1 1010 . 15 1 1 A 82 82 ILE CA C 171 61.150 60.441 0.709 1
1 1011 . 15 1 1 A 82 82 ILE CB C 171 37.230 40.377 -3.147 1
1 1015 . 15 1 1 A 82 82 ILE N N 171 124.260 124.604 -0.344 1
1 1016 . 15 1 1 A 83 83 VAL H H 172 7.923 9.185 -1.262 1
1 1017 . 15 1 1 A 83 83 VAL HA H 172 4.673 5.103 -0.430 1
1 1025 . 15 1 1 A 83 83 VAL C C 172 174.887 175.065 -0.178 1
1 1026 . 15 1 1 A 83 83 VAL CA C 172 59.340 58.945 0.395 1
1 1027 . 15 1 1 A 83 83 VAL CB C 172 34.840 36.033 -1.193 1
1 1030 . 15 1 1 A 83 83 VAL N N 172 120.931 122.136 -1.205 1
1 1031 . 15 1 1 A 84 84 LYS H H 173 8.406 8.575 -0.169 1
1 1032 . 15 1 1 A 84 84 LYS HA H 173 4.410 4.810 -0.400 1
1 1041 . 15 1 1 A 84 84 LYS C C 173 178.734 177.890 0.844 1
1 1042 . 15 1 1 A 84 84 LYS CA C 173 56.360 54.628 1.732 1
1 1043 . 15 1 1 A 84 84 LYS CB C 173 33.100 34.643 -1.543 1
1 1047 . 15 1 1 A 84 84 LYS N N 173 121.251 121.247 0.004 1
1 1048 . 15 1 1 A 85 85 HIS H H 174 9.221 9.089 0.132 1
1 1049 . 15 1 1 A 85 85 HIS HA H 174 4.024 4.302 -0.278 1
1 1053 . 15 1 1 A 85 85 HIS C C 174 177.183 176.231 0.952 1
1 1054 . 15 1 1 A 85 85 HIS CA C 174 59.460 58.458 1.002 1
1 1055 . 15 1 1 A 85 85 HIS CB C 174 27.920 28.741 -0.821 1
1 1057 . 15 1 1 A 85 85 HIS N N 174 121.545 120.753 0.792 1
1 1058 . 15 1 1 A 86 86 GLU H H 175 8.699 7.660 1.039 1
1 1059 . 15 1 1 A 86 86 GLU HA H 175 3.900 3.974 -0.074 1
1 1064 . 15 1 1 A 86 86 GLU C C 175 177.220 178.972 -1.752 1
1 1065 . 15 1 1 A 86 86 GLU CA C 175 58.420 57.753 0.667 1
1 1066 . 15 1 1 A 86 86 GLU CB C 175 28.690 29.680 -0.990 1
1 1068 . 15 1 1 A 86 86 GLU N N 175 118.011 120.174 -2.163 1
1 1069 . 15 1 1 A 87 87 GLU H H 176 7.621 7.866 -0.245 1
1 1070 . 15 1 1 A 87 87 GLU HA H 176 4.177 4.082 0.095 1
1 1075 . 15 1 1 A 87 87 GLU C C 176 175.222 176.117 -0.895 1
1 1076 . 15 1 1 A 87 87 GLU CA C 176 56.390 58.847 -2.457 1
1 1077 . 15 1 1 A 87 87 GLU CB C 176 30.430 30.250 0.180 1
1 1079 . 15 1 1 A 87 87 GLU N N 176 116.753 119.075 -2.322 1
1 1080 . 15 1 1 A 88 88 CYS H H 177 7.239 7.255 -0.016 1
1 1081 . 15 1 1 A 88 88 CYS HA H 177 5.148 4.753 0.395 1
1 1084 . 15 1 1 A 88 88 CYS C C 177 173.249 174.048 -0.799 1
1 1085 . 15 1 1 A 88 88 CYS CA C 177 57.240 57.879 -0.639 1
1 1086 . 15 1 1 A 88 88 CYS CB C 177 31.020 29.809 1.211 1
1 1087 . 15 1 1 A 88 88 CYS N N 177 116.096 115.161 0.935 1
1 1088 . 15 1 1 A 89 89 ILE H H 178 8.912 8.712 0.200 1
1 1089 . 15 1 1 A 89 89 ILE HA H 178 4.580 5.018 -0.438 1
1 1099 . 15 1 1 A 89 89 ILE C C 178 173.386 174.251 -0.865 1
1 1100 . 15 1 1 A 89 89 ILE CA C 178 59.270 59.311 -0.041 1
1 1101 . 15 1 1 A 89 89 ILE CB C 178 42.990 42.045 0.945 1
1 1105 . 15 1 1 A 89 89 ILE N N 178 119.490 120.539 -1.049 1
1 1106 . 15 1 1 A 90 90 TYR H H 179 9.047 8.533 0.514 1
1 1107 . 15 1 1 A 90 90 TYR HA H 179 3.753 3.996 -0.243 1
1 1112 . 15 1 1 A 90 90 TYR C C 179 173.932 174.068 -0.136 1
1 1113 . 15 1 1 A 90 90 TYR CA C 179 59.860 57.296 2.564 1
1 1114 . 15 1 1 A 90 90 TYR CB C 179 37.530 38.431 -0.901 1
1 1116 . 15 1 1 A 90 90 TYR N N 179 126.270 122.088 4.182 1
1 1117 . 15 1 1 A 91 91 ASP H H 180 7.462 8.279 -0.817 1
1 1118 . 15 1 1 A 91 91 ASP HA H 180 4.639 4.777 -0.138 1
1 1121 . 15 1 1 A 91 91 ASP C C 180 175.297 176.099 -0.802 1
1 1122 . 15 1 1 A 91 91 ASP CA C 180 52.496 52.653 -0.157 1
1 1123 . 15 1 1 A 91 91 ASP CB C 180 43.380 42.693 0.687 1
1 1124 . 15 1 1 A 91 91 ASP N N 180 129.593 124.040 5.553 1
1 1125 . 15 1 1 A 92 92 ASP H H 181 8.719 9.137 -0.418 1
1 1126 . 15 1 1 A 92 92 ASP HA H 181 4.109 4.352 -0.243 1
1 1129 . 15 1 1 A 92 92 ASP C C 181 177.555 177.525 0.030 1
1 1130 . 15 1 1 A 92 92 ASP CA C 181 56.390 57.262 -0.872 1
1 1131 . 15 1 1 A 92 92 ASP CB C 181 41.330 41.113 0.217 1
1 1132 . 15 1 1 A 92 92 ASP N N 181 125.691 127.035 -1.344 1
1 1133 . 15 1 1 A 93 93 THR H H 182 8.271 7.909 0.362 1
1 1134 . 15 1 1 A 93 93 THR HA H 182 4.036 3.969 0.067 1
1 1139 . 15 1 1 A 93 93 THR C C 182 176.289 176.317 -0.028 1
1 1140 . 15 1 1 A 93 93 THR CA C 182 65.054 64.810 0.244 1
1 1141 . 15 1 1 A 93 93 THR CB C 182 68.560 68.876 -0.316 1
1 1143 . 15 1 1 A 93 93 THR N N 182 114.813 113.519 1.294 1
1 1144 . 15 1 1 A 94 94 ARG H H 183 7.753 7.564 0.189 1
1 1145 . 15 1 1 A 94 94 ARG HA H 183 4.139 4.308 -0.169 1
1 1152 . 15 1 1 A 94 94 ARG C C 183 176.897 177.147 -0.250 1
1 1153 . 15 1 1 A 94 94 ARG CA C 183 55.350 56.384 -1.034 1
1 1154 . 15 1 1 A 94 94 ARG CB C 183 30.930 31.024 -0.094 1
1 1157 . 15 1 1 A 94 94 ARG N N 183 120.101 117.774 2.327 1
1 1158 . 15 1 1 A 95 95 GLY H H 184 8.112 8.948 -0.836 1
1 1159 . 15 1 1 A 95 95 GLY HA2 H 184 3.838 3.893 -0.055 1
1 1160 . 15 1 1 A 95 95 GLY HA3 H 184 3.670 3.895 -0.225 1
1 1161 . 15 1 1 A 95 95 GLY C C 184 173.659 173.349 0.310 1
1 1162 . 15 1 1 A 95 95 GLY CA C 184 46.040 45.951 0.089 1
1 1163 . 15 1 1 A 95 95 GLY N N 184 108.106 108.776 -0.670 1
1 1164 . 15 1 1 A 96 96 ASN H H 185 6.833 7.467 -0.634 1
1 1165 . 15 1 1 A 96 96 ASN HA H 185 4.944 5.052 -0.108 1
1 1170 . 15 1 1 A 96 96 ASN C C 185 174.267 173.401 0.866 1
1 1171 . 15 1 1 A 96 96 ASN CA C 185 52.560 52.459 0.101 1
1 1172 . 15 1 1 A 96 96 ASN CB C 185 45.890 41.631 4.259 1
1 1173 . 15 1 1 A 96 96 ASN N N 185 113.392 116.565 -3.173 1
1 1175 . 15 1 1 A 97 97 PHE H H 186 9.108 8.735 0.373 1
1 1176 . 15 1 1 A 97 97 PHE HA H 186 4.782 4.782 0.000 1
1 1183 . 15 1 1 A 97 97 PHE C C 186 174.862 175.586 -0.724 1
1 1184 . 15 1 1 A 97 97 PHE CA C 186 60.056 59.641 0.415 1
1 1185 . 15 1 1 A 97 97 PHE CB C 186 40.180 39.228 0.952 1
1 1188 . 15 1 1 A 97 97 PHE N N 186 118.741 119.418 -0.677 1
1 1189 . 15 1 1 A 98 98 ILE H H 187 8.933 8.669 0.264 1
1 1190 . 15 1 1 A 98 98 ILE HA H 187 5.458 4.988 0.470 1
1 1200 . 15 1 1 A 98 98 ILE C C 187 176.041 175.467 0.574 1
1 1201 . 15 1 1 A 98 98 ILE CA C 187 57.610 58.727 -1.117 1
1 1202 . 15 1 1 A 98 98 ILE CB C 187 42.070 41.793 0.277 1
1 1206 . 15 1 1 A 98 98 ILE N N 187 117.857 118.774 -0.917 1
1 1207 . 15 1 1 A 99 99 ILE H H 188 8.284 8.643 -0.359 1
1 1208 . 15 1 1 A 99 99 ILE HA H 188 4.341 4.066 0.275 1
1 1218 . 15 1 1 A 99 99 ILE C C 188 176.413 176.719 -0.306 1
1 1219 . 15 1 1 A 99 99 ILE CA C 188 59.190 61.908 -2.718 1
1 1220 . 15 1 1 A 99 99 ILE CB C 188 37.940 38.260 -0.320 1
1 1224 . 15 1 1 A 99 99 ILE N N 188 121.796 123.153 -1.357 1
1 1225 . 15 1 1 A 100 100 LYS H H 189 8.463 8.319 0.144 1
1 1226 . 15 1 1 A 100 100 LYS HA H 189 4.040 4.204 -0.164 1
1 1235 . 15 1 1 A 100 100 LYS C C 189 176.848 177.085 -0.237 1
1 1236 . 15 1 1 A 100 100 LYS CA C 189 57.241 56.420 0.821 1
1 1237 . 15 1 1 A 100 100 LYS CB C 189 33.400 32.890 0.510 1
1 1241 . 15 1 1 A 100 100 LYS N N 189 127.995 124.362 3.633 1
1 1242 . 15 1 1 A 101 101 GLY H H 190 8.346 8.345 0.001 1
1 1243 . 15 1 1 A 101 101 GLY HA2 H 190 3.947 4.100 -0.153 1
1 1244 . 15 1 1 A 101 101 GLY HA3 H 190 3.813 4.105 -0.292 1
1 1245 . 15 1 1 A 101 101 GLY C C 190 172.902 174.044 -1.142 1
1 1246 . 15 1 1 A 101 101 GLY CA C 190 44.920 45.540 -0.620 1
1 1247 . 15 1 1 A 101 101 GLY N N 190 110.882 113.281 -2.399 1
1 7 . 16 1 1 A 2 2 GLN H H 91 8.786 8.266 0.520 1
1 8 . 16 1 1 A 2 2 GLN HA H 91 4.005 3.948 0.057 1
1 15 . 16 1 1 A 2 2 GLN C C 91 177.270 178.350 -1.080 1
1 16 . 16 1 1 A 2 2 GLN CA C 91 58.220 58.864 -0.644 1
1 17 . 16 1 1 A 2 2 GLN CB C 91 28.650 28.542 0.108 1
1 19 . 16 1 1 A 2 2 GLN N N 91 121.993 123.953 -1.960 1
1 21 . 16 1 1 A 3 3 GLU H H 92 8.430 8.390 0.040 1
1 22 . 16 1 1 A 3 3 GLU HA H 92 4.007 4.100 -0.093 1
1 27 . 16 1 1 A 3 3 GLU C C 92 178.287 178.820 -0.533 1
1 28 . 16 1 1 A 3 3 GLU CA C 92 59.490 59.140 0.350 1
1 29 . 16 1 1 A 3 3 GLU CB C 92 29.506 29.067 0.439 1
1 31 . 16 1 1 A 3 3 GLU N N 92 120.195 118.917 1.278 1
1 32 . 16 1 1 A 4 4 SER H H 93 8.209 7.770 0.439 1
1 33 . 16 1 1 A 4 4 SER HA H 93 4.272 4.282 -0.010 1
1 36 . 16 1 1 A 4 4 SER C C 93 177.369 177.489 -0.120 1
1 37 . 16 1 1 A 4 4 SER CA C 93 61.044 61.381 -0.337 1
1 38 . 16 1 1 A 4 4 SER CB C 93 62.950 62.835 0.115 1
1 39 . 16 1 1 A 4 4 SER N N 93 115.524 115.422 0.102 1
1 40 . 16 1 1 A 5 5 ILE H H 94 8.080 7.448 0.632 1
1 41 . 16 1 1 A 5 5 ILE HA H 94 3.530 3.654 -0.124 1
1 51 . 16 1 1 A 5 5 ILE C C 94 177.778 177.677 0.101 1
1 52 . 16 1 1 A 5 5 ILE CA C 94 65.710 65.237 0.473 1
1 53 . 16 1 1 A 5 5 ILE CB C 94 37.800 37.463 0.337 1
1 57 . 16 1 1 A 5 5 ILE N N 94 124.148 121.824 2.324 1
1 58 . 16 1 1 A 6 6 GLN H H 95 8.374 8.388 -0.014 1
1 59 . 16 1 1 A 6 6 GLN HA H 95 4.125 3.983 0.142 1
1 66 . 16 1 1 A 6 6 GLN C C 95 179.726 179.289 0.437 1
1 67 . 16 1 1 A 6 6 GLN CA C 95 59.190 59.114 0.076 1
1 68 . 16 1 1 A 6 6 GLN CB C 95 27.060 28.727 -1.667 1
1 70 . 16 1 1 A 6 6 GLN N N 95 118.257 118.738 -0.481 1
1 72 . 16 1 1 A 7 7 ASN H H 96 8.456 8.106 0.350 1
1 73 . 16 1 1 A 7 7 ASN HA H 96 4.446 4.551 -0.105 1
1 78 . 16 1 1 A 7 7 ASN C C 96 177.257 178.567 -1.310 1
1 79 . 16 1 1 A 7 7 ASN CA C 96 56.020 56.092 -0.072 1
1 80 . 16 1 1 A 7 7 ASN CB C 96 38.126 37.786 0.340 1
1 81 . 16 1 1 A 7 7 ASN N N 96 118.597 118.312 0.285 1
1 83 . 16 1 1 A 8 8 LYS H H 97 7.732 7.709 0.023 1
1 84 . 16 1 1 A 8 8 LYS HA H 97 4.129 4.096 0.033 1
1 93 . 16 1 1 A 8 8 LYS C C 97 179.143 179.524 -0.381 1
1 94 . 16 1 1 A 8 8 LYS CA C 97 59.126 59.133 -0.007 1
1 95 . 16 1 1 A 8 8 LYS CB C 97 32.070 32.070 0.000 1
1 99 . 16 1 1 A 8 8 LYS N N 97 122.381 119.405 2.976 1
1 100 . 16 1 1 A 9 9 ILE H H 98 8.452 8.144 0.308 1
1 101 . 16 1 1 A 9 9 ILE HA H 98 3.480 3.766 -0.286 1
1 111 . 16 1 1 A 9 9 ILE C C 98 177.406 178.167 -0.761 1
1 112 . 16 1 1 A 9 9 ILE CA C 98 66.430 65.147 1.283 1
1 113 . 16 1 1 A 9 9 ILE CB C 98 37.980 37.678 0.302 1
1 117 . 16 1 1 A 9 9 ILE N N 98 119.950 121.170 -1.220 1
1 118 . 16 1 1 A 10 10 SER H H 99 7.924 7.921 0.003 1
1 119 . 16 1 1 A 10 10 SER HA H 99 3.983 4.104 -0.121 1
1 122 . 16 1 1 A 10 10 SER C C 99 176.327 176.223 0.104 1
1 123 . 16 1 1 A 10 10 SER CA C 99 61.990 61.886 0.104 1
1 124 . 16 1 1 A 10 10 SER CB C 99 62.790 62.979 -0.189 1
1 125 . 16 1 1 A 10 10 SER N N 99 113.568 115.880 -2.312 1
1 126 . 16 1 1 A 11 11 GLN H H 100 7.832 7.667 0.165 1
1 127 . 16 1 1 A 11 11 GLN HA H 100 4.238 4.220 0.018 1
1 134 . 16 1 1 A 11 11 GLN C C 100 178.088 176.564 1.524 1
1 135 . 16 1 1 A 11 11 GLN CA C 100 57.900 58.042 -0.142 1
1 136 . 16 1 1 A 11 11 GLN CB C 100 29.790 28.563 1.227 1
1 138 . 16 1 1 A 11 11 GLN N N 100 117.487 119.441 -1.954 1
1 140 . 16 1 1 A 12 12 CYS H H 101 7.920 7.733 0.187 1
1 141 . 16 1 1 A 12 12 CYS HA H 101 4.657 4.658 -0.001 1
1 144 . 16 1 1 A 12 12 CYS C C 101 175.446 174.729 0.717 1
1 145 . 16 1 1 A 12 12 CYS CA C 101 60.654 59.221 1.433 1
1 146 . 16 1 1 A 12 12 CYS CB C 101 29.310 28.768 0.542 1
1 147 . 16 1 1 A 12 12 CYS N N 101 114.221 117.359 -3.138 1
1 148 . 16 1 1 A 13 13 LYS H H 102 8.029 7.290 0.739 1
1 149 . 16 1 1 A 13 13 LYS HA H 102 5.069 4.767 0.302 1
1 158 . 16 1 1 A 13 13 LYS C C 102 174.800 176.215 -1.415 1
1 159 . 16 1 1 A 13 13 LYS CA C 102 56.394 56.011 0.383 1
1 160 . 16 1 1 A 13 13 LYS CB C 102 32.770 33.431 -0.661 1
1 164 . 16 1 1 A 13 13 LYS N N 102 124.129 119.096 5.033 1
1 165 . 16 1 1 A 14 14 PHE H H 103 8.737 8.653 0.084 1
1 166 . 16 1 1 A 14 14 PHE HA H 103 5.059 5.097 -0.038 1
1 174 . 16 1 1 A 14 14 PHE C C 103 173.560 173.393 0.167 1
1 175 . 16 1 1 A 14 14 PHE CA C 103 55.470 56.046 -0.576 1
1 176 . 16 1 1 A 14 14 PHE CB C 103 41.760 41.291 0.469 1
1 180 . 16 1 1 A 14 14 PHE N N 103 118.661 116.559 2.102 1
1 181 . 16 1 1 A 15 15 SER H H 104 8.826 8.515 0.311 1
1 182 . 16 1 1 A 15 15 SER HA H 104 4.602 4.763 -0.161 1
1 185 . 16 1 1 A 15 15 SER C C 104 173.795 173.775 0.020 1
1 186 . 16 1 1 A 15 15 SER CA C 104 58.610 57.844 0.766 1
1 187 . 16 1 1 A 15 15 SER CB C 104 62.690 62.581 0.109 1
1 188 . 16 1 1 A 15 15 SER N N 104 117.781 114.664 3.117 1
1 189 . 16 1 1 A 16 16 VAL H H 105 7.784 8.051 -0.267 1
1 190 . 16 1 1 A 16 16 VAL HA H 105 3.370 3.793 -0.423 1
1 198 . 16 1 1 A 16 16 VAL C C 105 174.987 175.297 -0.310 1
1 199 . 16 1 1 A 16 16 VAL CA C 105 63.580 62.838 0.742 1
1 200 . 16 1 1 A 16 16 VAL CB C 105 31.410 30.873 0.537 1
1 203 . 16 1 1 A 16 16 VAL N N 105 129.075 126.005 3.070 1
1 204 . 16 1 1 A 17 17 CYS H H 106 8.536 8.715 -0.179 1
1 205 . 16 1 1 A 17 17 CYS HA H 106 5.011 4.959 0.052 1
1 208 . 16 1 1 A 17 17 CYS CA C 106 55.260 56.396 -1.136 1
1 209 . 16 1 1 A 17 17 CYS CB C 106 28.210 28.956 -0.746 1
1 210 . 16 1 1 A 17 17 CYS N N 106 130.045 127.170 2.875 1
1 211 . 16 1 1 A 18 18 PRO HA H 107 3.991 4.372 -0.381 1
1 218 . 16 1 1 A 18 18 PRO C C 107 178.188 178.515 -0.327 1
1 219 . 16 1 1 A 18 18 PRO CA C 107 65.940 64.690 1.250 1
1 220 . 16 1 1 A 18 18 PRO CB C 107 32.000 32.144 -0.144 1
1 223 . 16 1 1 A 19 19 GLU H H 108 9.260 9.083 0.177 1
1 224 . 16 1 1 A 19 19 GLU HA H 108 4.119 4.095 0.024 1
1 229 . 16 1 1 A 19 19 GLU C C 108 178.721 178.478 0.243 1
1 230 . 16 1 1 A 19 19 GLU CA C 108 59.300 59.274 0.026 1
1 231 . 16 1 1 A 19 19 GLU CB C 108 28.920 28.559 0.361 1
1 233 . 16 1 1 A 19 19 GLU N N 108 118.270 116.139 2.131 1
1 234 . 16 1 1 A 20 20 ARG H H 109 7.672 7.554 0.118 1
1 235 . 16 1 1 A 20 20 ARG HA H 109 4.331 4.291 0.040 1
1 242 . 16 1 1 A 20 20 ARG C C 109 177.977 178.454 -0.477 1
1 243 . 16 1 1 A 20 20 ARG CA C 109 57.350 58.311 -0.961 1
1 244 . 16 1 1 A 20 20 ARG CB C 109 30.820 30.533 0.287 1
1 247 . 16 1 1 A 20 20 ARG N N 109 118.357 119.127 -0.770 1
1 248 . 16 1 1 A 21 21 LEU H H 110 7.601 7.716 -0.115 1
1 249 . 16 1 1 A 21 21 LEU HA H 110 4.380 4.280 0.100 1
1 259 . 16 1 1 A 21 21 LEU C C 110 176.562 176.314 0.248 1
1 260 . 16 1 1 A 21 21 LEU CA C 110 56.096 55.550 0.546 1
1 261 . 16 1 1 A 21 21 LEU CB C 110 44.016 42.133 1.883 1
1 265 . 16 1 1 A 21 21 LEU N N 110 118.626 118.053 0.573 1
1 266 . 16 1 1 A 22 22 GLN H H 111 7.750 7.526 0.224 1
1 267 . 16 1 1 A 22 22 GLN HA H 111 3.870 3.894 -0.024 1
1 274 . 16 1 1 A 22 22 GLN C C 111 173.336 173.970 -0.634 1
1 275 . 16 1 1 A 22 22 GLN CA C 111 56.510 56.890 -0.380 1
1 276 . 16 1 1 A 22 22 GLN CB C 111 26.800 26.181 0.619 1
1 278 . 16 1 1 A 22 22 GLN N N 111 113.926 115.797 -1.871 1
1 280 . 16 1 1 A 23 23 CYS H H 112 7.407 7.389 0.018 1
1 281 . 16 1 1 A 23 23 CYS HA H 112 4.469 4.903 -0.434 1
1 284 . 16 1 1 A 23 23 CYS CA C 112 52.650 56.697 -4.047 1
1 285 . 16 1 1 A 23 23 CYS CB C 112 29.750 28.850 0.900 1
1 286 . 16 1 1 A 23 23 CYS N N 112 112.681 117.783 -5.102 1
1 287 . 16 1 1 A 24 24 PRO HA H 113 4.408 4.579 -0.171 1
1 294 . 16 1 1 A 24 24 PRO C C 113 178.175 177.373 0.802 1
1 295 . 16 1 1 A 24 24 PRO CA C 113 62.040 62.618 -0.578 1
1 296 . 16 1 1 A 24 24 PRO CB C 113 31.920 32.560 -0.640 1
1 299 . 16 1 1 A 25 25 LEU H H 114 8.593 8.417 0.176 1
1 300 . 16 1 1 A 25 25 LEU HA H 114 3.765 3.906 -0.141 1
1 310 . 16 1 1 A 25 25 LEU C C 114 179.950 178.869 1.081 1
1 311 . 16 1 1 A 25 25 LEU CA C 114 57.674 57.796 -0.122 1
1 312 . 16 1 1 A 25 25 LEU CB C 114 40.690 41.603 -0.913 1
1 316 . 16 1 1 A 25 25 LEU N N 114 123.729 123.492 0.237 1
1 317 . 16 1 1 A 26 26 GLU H H 115 9.108 8.532 0.576 1
1 318 . 16 1 1 A 26 26 GLU HA H 115 3.876 4.055 -0.179 1
1 323 . 16 1 1 A 26 26 GLU C C 115 177.505 178.590 -1.085 1
1 324 . 16 1 1 A 26 26 GLU CA C 115 59.410 59.161 0.249 1
1 325 . 16 1 1 A 26 26 GLU CB C 115 28.460 29.473 -1.013 1
1 327 . 16 1 1 A 26 26 GLU N N 115 116.817 117.479 -0.662 1
1 328 . 16 1 1 A 27 27 ALA H H 116 7.360 7.676 -0.316 1
1 329 . 16 1 1 A 27 27 ALA HA H 116 4.408 4.170 0.238 1
1 333 . 16 1 1 A 27 27 ALA C C 116 177.046 177.945 -0.899 1
1 334 . 16 1 1 A 27 27 ALA CA C 116 52.970 54.304 -1.334 1
1 335 . 16 1 1 A 27 27 ALA CB C 116 19.916 18.503 1.413 1
1 336 . 16 1 1 A 27 27 ALA N N 116 118.966 120.786 -1.820 1
1 337 . 16 1 1 A 28 28 ILE H H 117 7.168 7.061 0.107 1
1 338 . 16 1 1 A 28 28 ILE HA H 117 4.432 4.458 -0.026 1
1 348 . 16 1 1 A 28 28 ILE C C 117 172.641 175.735 -3.094 1
1 349 . 16 1 1 A 28 28 ILE CA C 117 59.980 59.609 0.371 1
1 350 . 16 1 1 A 28 28 ILE CB C 117 37.350 37.766 -0.416 1
1 354 . 16 1 1 A 28 28 ILE N N 117 108.913 109.000 -0.087 1
1 355 . 16 1 1 A 29 29 GLN H H 118 6.562 7.323 -0.761 1
1 356 . 16 1 1 A 29 29 GLN HA H 118 3.922 4.319 -0.397 1
1 363 . 16 1 1 A 29 29 GLN C C 118 175.049 175.539 -0.490 1
1 364 . 16 1 1 A 29 29 GLN CA C 118 54.596 55.812 -1.216 1
1 365 . 16 1 1 A 29 29 GLN CB C 118 29.570 29.502 0.068 1
1 367 . 16 1 1 A 29 29 GLN N N 118 116.455 123.268 -6.813 1
1 369 . 16 1 1 A 30 30 CYS H H 119 8.138 8.320 -0.182 1
1 370 . 16 1 1 A 30 30 CYS HA H 119 4.580 4.699 -0.119 1
1 373 . 16 1 1 A 30 30 CYS CA C 119 57.810 57.160 0.650 1
1 374 . 16 1 1 A 30 30 CYS CB C 119 30.200 28.715 1.485 1
1 375 . 16 1 1 A 30 30 CYS N N 119 134.136 125.170 8.966 1
1 376 . 16 1 1 A 31 31 PRO HA H 120 4.424 4.436 -0.012 1
1 383 . 16 1 1 A 31 31 PRO C C 120 177.431 177.547 -0.116 1
1 384 . 16 1 1 A 31 31 PRO CA C 120 64.060 64.111 -0.051 1
1 385 . 16 1 1 A 31 31 PRO CB C 120 32.776 31.849 0.927 1
1 388 . 16 1 1 A 32 32 ILE H H 121 11.318 7.757 3.561 1
1 389 . 16 1 1 A 32 32 ILE HA H 121 4.038 3.968 0.070 1
1 399 . 16 1 1 A 32 32 ILE C C 121 178.485 177.847 0.638 1
1 400 . 16 1 1 A 32 32 ILE CA C 121 64.060 64.096 -0.036 1
1 401 . 16 1 1 A 32 32 ILE CB C 121 39.340 38.388 0.952 1
1 405 . 16 1 1 A 32 32 ILE N N 121 124.500 117.269 7.231 1
1 406 . 16 1 1 A 33 33 THR H H 122 9.928 7.338 2.590 1
1 407 . 16 1 1 A 33 33 THR HA H 122 4.048 4.323 -0.275 1
1 412 . 16 1 1 A 33 33 THR C C 122 175.793 174.847 0.946 1
1 413 . 16 1 1 A 33 33 THR CA C 122 62.990 61.961 1.029 1
1 414 . 16 1 1 A 33 33 THR CB C 122 70.300 69.928 0.372 1
1 416 . 16 1 1 A 33 33 THR N N 122 115.136 109.605 5.531 1
1 417 . 16 1 1 A 34 34 LEU H H 123 8.439 7.778 0.661 1
1 418 . 16 1 1 A 34 34 LEU HA H 123 3.912 3.837 0.075 1
1 428 . 16 1 1 A 34 34 LEU C C 123 175.495 175.117 0.378 1
1 429 . 16 1 1 A 34 34 LEU CA C 123 56.290 56.278 0.012 1
1 430 . 16 1 1 A 34 34 LEU CB C 123 38.500 39.845 -1.345 1
1 434 . 16 1 1 A 34 34 LEU N N 123 117.230 119.210 -1.980 1
1 435 . 16 1 1 A 35 35 GLU H H 124 7.816 7.036 0.780 1
1 436 . 16 1 1 A 35 35 GLU HA H 124 4.634 4.621 0.013 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 54.943 -1.163 1
1 443 . 16 1 1 A 35 35 GLU CB C 124 33.710 32.115 1.595 1
1 445 . 16 1 1 A 35 35 GLU N N 124 116.577 113.918 2.659 1
1 446 . 16 1 1 A 36 36 GLN H H 125 8.532 8.465 0.067 1
1 447 . 16 1 1 A 36 36 GLN HA H 125 4.958 4.369 0.589 1
1 454 . 16 1 1 A 36 36 GLN CA C 125 53.350 53.660 -0.310 1
1 455 . 16 1 1 A 36 36 GLN CB C 125 29.950 29.458 0.492 1
1 457 . 16 1 1 A 36 36 GLN N N 125 123.034 123.532 -0.498 1
1 459 . 16 1 1 A 37 37 PRO HA H 126 4.458 4.697 -0.239 1
1 466 . 16 1 1 A 37 37 PRO C C 126 176.314 176.688 -0.374 1
1 467 . 16 1 1 A 37 37 PRO CA C 126 62.816 62.472 0.344 1
1 468 . 16 1 1 A 37 37 PRO CB C 126 33.070 32.940 0.130 1
1 471 . 16 1 1 A 38 38 GLU H H 127 8.626 8.345 0.281 1
1 472 . 16 1 1 A 38 38 GLU HA H 127 4.274 4.159 0.115 1
1 477 . 16 1 1 A 38 38 GLU C C 127 177.877 176.307 1.570 1
1 478 . 16 1 1 A 38 38 GLU CA C 127 58.730 57.608 1.122 1
1 479 . 16 1 1 A 38 38 GLU CB C 127 30.340 30.361 -0.021 1
1 481 . 16 1 1 A 38 38 GLU N N 127 120.691 119.235 1.456 1
1 482 . 16 1 1 A 39 39 LYS H H 128 7.861 7.790 0.071 1
1 483 . 16 1 1 A 39 39 LYS HA H 128 4.889 5.009 -0.120 1
1 492 . 16 1 1 A 39 39 LYS C C 128 175.446 174.861 0.585 1
1 493 . 16 1 1 A 39 39 LYS CA C 128 53.670 54.588 -0.918 1
1 494 . 16 1 1 A 39 39 LYS CB C 128 33.630 35.656 -2.026 1
1 498 . 16 1 1 A 39 39 LYS N N 128 117.878 117.207 0.671 1
1 499 . 16 1 1 A 40 40 GLY H H 129 8.426 7.992 0.434 1
1 500 . 16 1 1 A 40 40 GLY HA2 H 129 4.970 4.017 0.953 1
1 501 . 16 1 1 A 40 40 GLY HA3 H 129 2.458 4.168 -1.710 1
1 502 . 16 1 1 A 40 40 GLY C C 129 170.048 172.288 -2.240 1
1 503 . 16 1 1 A 40 40 GLY CA C 129 42.910 44.993 -2.083 1
1 504 . 16 1 1 A 40 40 GLY N N 129 112.604 106.584 6.020 1
1 505 . 16 1 1 A 41 41 ILE H H 130 8.596 9.115 -0.519 1
1 506 . 16 1 1 A 41 41 ILE HA H 130 4.636 5.064 -0.428 1
1 516 . 16 1 1 A 41 41 ILE C C 130 172.691 174.168 -1.477 1
1 517 . 16 1 1 A 41 41 ILE CA C 130 58.500 58.878 -0.378 1
1 518 . 16 1 1 A 41 41 ILE CB C 130 43.320 40.531 2.789 1
1 522 . 16 1 1 A 41 41 ILE N N 130 113.363 117.590 -4.227 1
1 523 . 16 1 1 A 42 42 PHE H H 131 8.994 8.895 0.099 1
1 524 . 16 1 1 A 42 42 PHE HA H 131 5.075 5.530 -0.455 1
1 532 . 16 1 1 A 42 42 PHE C C 131 175.111 174.582 0.529 1
1 533 . 16 1 1 A 42 42 PHE CA C 131 58.680 57.018 1.662 1
1 534 . 16 1 1 A 42 42 PHE CB C 131 42.220 40.458 1.762 1
1 538 . 16 1 1 A 42 42 PHE N N 131 125.156 121.322 3.834 1
1 539 . 16 1 1 A 43 43 VAL H H 132 8.399 9.277 -0.878 1
1 540 . 16 1 1 A 43 43 VAL HA H 132 4.920 4.794 0.126 1
1 548 . 16 1 1 A 43 43 VAL C C 132 178.175 175.180 2.995 1
1 549 . 16 1 1 A 43 43 VAL CA C 132 59.600 61.098 -1.498 1
1 550 . 16 1 1 A 43 43 VAL CB C 132 35.920 34.132 1.788 1
1 553 . 16 1 1 A 43 43 VAL N N 132 119.371 123.314 -3.943 1
1 554 . 16 1 1 A 44 44 LYS H H 133 10.041 8.575 1.466 1
1 555 . 16 1 1 A 44 44 LYS HA H 133 4.920 4.427 0.493 1
1 564 . 16 1 1 A 44 44 LYS C C 133 177.195 175.511 1.684 1
1 565 . 16 1 1 A 44 44 LYS CA C 133 57.310 56.133 1.177 1
1 566 . 16 1 1 A 44 44 LYS CB C 133 34.410 32.230 2.180 1
1 570 . 16 1 1 A 44 44 LYS N N 133 130.928 126.791 4.137 1
1 571 . 16 1 1 A 45 45 ASN H H 134 8.534 8.849 -0.315 1
1 572 . 16 1 1 A 45 45 ASN HA H 134 4.151 4.601 -0.450 1
1 577 . 16 1 1 A 45 45 ASN C C 134 174.217 175.258 -1.041 1
1 578 . 16 1 1 A 45 45 ASN CA C 134 55.290 52.622 2.668 1
1 579 . 16 1 1 A 45 45 ASN CB C 134 37.530 38.031 -0.501 1
1 580 . 16 1 1 A 45 45 ASN N N 134 119.452 124.409 -4.957 1
1 582 . 16 1 1 A 46 46 SER H H 135 7.570 8.075 -0.505 1
1 583 . 16 1 1 A 46 46 SER HA H 135 4.220 4.091 0.129 1
1 586 . 16 1 1 A 46 46 SER C C 135 174.490 176.767 -2.277 1
1 587 . 16 1 1 A 46 46 SER CA C 135 57.090 61.310 -4.220 1
1 588 . 16 1 1 A 46 46 SER CB C 135 64.126 62.898 1.228 1
1 589 . 16 1 1 A 46 46 SER N N 135 105.613 121.579 -15.966 1
1 590 . 16 1 1 A 47 47 ASP H H 136 9.113 8.052 1.061 1
1 591 . 16 1 1 A 47 47 ASP HA H 136 4.220 4.320 -0.100 1
1 594 . 16 1 1 A 47 47 ASP CA C 136 57.610 57.016 0.594 1
1 595 . 16 1 1 A 47 47 ASP CB C 136 40.810 40.541 0.269 1
1 596 . 16 1 1 A 47 47 ASP N N 136 120.995 120.850 0.145 1
1 597 . 16 1 1 A 48 48 GLY H H 137 8.172 7.921 0.251 1
1 598 . 16 1 1 A 48 48 GLY HA2 H 137 4.096 3.753 0.343 1
1 599 . 16 1 1 A 48 48 GLY HA3 H 137 3.664 3.763 -0.099 1
1 600 . 16 1 1 A 48 48 GLY C C 137 173.990 175.231 -1.241 1
1 601 . 16 1 1 A 48 48 GLY CA C 137 45.130 47.387 -2.257 1
1 602 . 16 1 1 A 48 48 GLY N N 137 105.838 106.905 -1.067 1
1 603 . 16 1 1 A 49 49 SER H H 138 7.252 7.622 -0.370 1
1 604 . 16 1 1 A 49 49 SER HA H 138 4.503 4.679 -0.176 1
1 607 . 16 1 1 A 49 49 SER C C 138 173.857 173.413 0.444 1
1 608 . 16 1 1 A 49 49 SER CA C 138 57.340 57.032 0.308 1
1 609 . 16 1 1 A 49 49 SER CB C 138 65.370 64.439 0.931 1
1 610 . 16 1 1 A 49 49 SER N N 138 114.942 112.172 2.770 1
1 611 . 16 1 1 A 50 50 ASP H H 139 8.276 7.973 0.303 1
1 612 . 16 1 1 A 50 50 ASP HA H 139 4.618 4.218 0.400 1
1 615 . 16 1 1 A 50 50 ASP C C 139 174.577 174.852 -0.275 1
1 616 . 16 1 1 A 50 50 ASP CA C 139 53.116 55.615 -2.499 1
1 617 . 16 1 1 A 50 50 ASP CB C 139 40.520 39.453 1.067 1
1 618 . 16 1 1 A 50 50 ASP N N 139 122.088 117.467 4.621 1
1 619 . 16 1 1 A 51 51 VAL H H 140 8.192 7.386 0.806 1
1 620 . 16 1 1 A 51 51 VAL HA H 140 4.299 4.287 0.012 1
1 628 . 16 1 1 A 51 51 VAL C C 140 175.867 175.633 0.234 1
1 629 . 16 1 1 A 51 51 VAL CA C 140 62.950 61.575 1.375 1
1 630 . 16 1 1 A 51 51 VAL CB C 140 33.230 32.432 0.798 1
1 632 . 16 1 1 A 51 51 VAL N N 140 121.167 115.867 5.300 1
1 633 . 16 1 1 A 52 52 CYS H H 141 8.391 8.909 -0.518 1
1 634 . 16 1 1 A 52 52 CYS HA H 141 5.247 5.064 0.183 1
1 637 . 16 1 1 A 52 52 CYS C C 141 172.778 175.021 -2.243 1
1 638 . 16 1 1 A 52 52 CYS CA C 141 56.480 58.170 -1.690 1
1 639 . 16 1 1 A 52 52 CYS CB C 141 31.960 28.567 3.393 1
1 640 . 16 1 1 A 52 52 CYS N N 141 121.884 125.766 -3.882 1
1 641 . 16 1 1 A 53 53 THR H H 142 8.777 9.082 -0.305 1
1 642 . 16 1 1 A 53 53 THR HA H 142 4.489 5.078 -0.589 1
1 648 . 16 1 1 A 53 53 THR C C 142 171.885 172.608 -0.723 1
1 649 . 16 1 1 A 53 53 THR CA C 142 62.070 61.362 0.708 1
1 650 . 16 1 1 A 53 53 THR CB C 142 71.390 71.425 -0.035 1
1 652 . 16 1 1 A 53 53 THR N N 142 118.132 119.026 -0.894 1
1 653 . 16 1 1 A 54 54 LEU H H 143 8.409 8.342 0.067 1
1 654 . 16 1 1 A 54 54 LEU HA H 143 4.276 4.366 -0.090 1
1 664 . 16 1 1 A 54 54 LEU C C 143 174.366 174.049 0.317 1
1 665 . 16 1 1 A 54 54 LEU CA C 143 54.330 53.194 1.136 1
1 666 . 16 1 1 A 54 54 LEU CB C 143 42.396 42.493 -0.097 1
1 670 . 16 1 1 A 54 54 LEU N N 143 127.980 128.245 -0.265 1
1 671 . 16 1 1 A 55 55 PHE H H 144 8.646 8.709 -0.063 1
1 672 . 16 1 1 A 55 55 PHE HA H 144 5.455 4.834 0.621 1
1 680 . 16 1 1 A 55 55 PHE C C 144 176.054 174.797 1.257 1
1 681 . 16 1 1 A 55 55 PHE CA C 144 55.250 56.328 -1.078 1
1 682 . 16 1 1 A 55 55 PHE CB C 144 44.100 41.926 2.174 1
1 686 . 16 1 1 A 55 55 PHE N N 144 122.010 126.694 -4.684 1
1 687 . 16 1 1 A 56 56 ASP H H 145 11.575 8.337 3.238 1
1 688 . 16 1 1 A 56 56 ASP HA H 145 4.416 4.496 -0.080 1
1 691 . 16 1 1 A 56 56 ASP C C 145 176.748 177.531 -0.783 1
1 692 . 16 1 1 A 56 56 ASP CA C 145 55.840 54.767 1.073 1
1 693 . 16 1 1 A 56 56 ASP CB C 145 44.390 42.284 2.106 1
1 694 . 16 1 1 A 56 56 ASP N N 145 121.936 124.237 -2.301 1
1 695 . 16 1 1 A 57 57 ALA H H 146 8.508 8.839 -0.331 1
1 696 . 16 1 1 A 57 57 ALA HA H 146 3.797 4.019 -0.222 1
1 700 . 16 1 1 A 57 57 ALA C C 146 178.696 179.823 -1.127 1
1 701 . 16 1 1 A 57 57 ALA CA C 146 55.990 55.473 0.517 1
1 702 . 16 1 1 A 57 57 ALA CB C 146 18.840 18.088 0.752 1
1 703 . 16 1 1 A 57 57 ALA N N 146 130.243 129.206 1.037 1
1 704 . 16 1 1 A 58 58 ALA H H 147 8.378 7.718 0.660 1
1 705 . 16 1 1 A 58 58 ALA HA H 147 4.078 4.202 -0.124 1
1 709 . 16 1 1 A 58 58 ALA C C 147 181.091 179.686 1.405 1
1 710 . 16 1 1 A 58 58 ALA CA C 147 54.770 54.909 -0.139 1
1 711 . 16 1 1 A 58 58 ALA CB C 147 17.700 18.482 -0.782 1
1 712 . 16 1 1 A 58 58 ALA N N 147 121.997 119.447 2.550 1
1 713 . 16 1 1 A 59 59 ALA H H 148 9.138 7.957 1.181 1
1 714 . 16 1 1 A 59 59 ALA HA H 148 3.975 4.115 -0.140 1
1 718 . 16 1 1 A 59 59 ALA C C 148 180.508 179.771 0.737 1
1 719 . 16 1 1 A 59 59 ALA CA C 148 54.840 55.028 -0.188 1
1 720 . 16 1 1 A 59 59 ALA CB C 148 18.600 18.608 -0.008 1
1 721 . 16 1 1 A 59 59 ALA N N 148 123.595 120.351 3.244 1
1 722 . 16 1 1 A 60 60 PHE H H 149 8.814 8.192 0.622 1
1 723 . 16 1 1 A 60 60 PHE HA H 149 3.722 4.031 -0.309 1
1 731 . 16 1 1 A 60 60 PHE C C 149 176.773 177.435 -0.662 1
1 732 . 16 1 1 A 60 60 PHE CA C 149 62.030 61.576 0.454 1
1 733 . 16 1 1 A 60 60 PHE CB C 149 39.960 38.909 1.051 1
1 737 . 16 1 1 A 60 60 PHE N N 149 120.354 120.080 0.274 1
1 738 . 16 1 1 A 61 61 SER H H 150 8.276 8.161 0.115 1
1 739 . 16 1 1 A 61 61 SER HA H 150 3.880 4.030 -0.150 1
1 742 . 16 1 1 A 61 61 SER C C 150 177.691 177.292 0.399 1
1 743 . 16 1 1 A 61 61 SER CA C 150 62.190 61.517 0.673 1
1 744 . 16 1 1 A 61 61 SER CB C 150 63.016 62.991 0.025 1
1 745 . 16 1 1 A 61 61 SER N N 150 112.086 113.681 -1.595 1
1 746 . 16 1 1 A 62 62 ARG H H 151 7.829 7.820 0.009 1
1 747 . 16 1 1 A 62 62 ARG HA H 151 3.971 4.045 -0.074 1
1 754 . 16 1 1 A 62 62 ARG C C 151 178.287 178.749 -0.462 1
1 755 . 16 1 1 A 62 62 ARG CA C 151 59.340 59.257 0.083 1
1 756 . 16 1 1 A 62 62 ARG CB C 151 29.760 29.778 -0.018 1
1 759 . 16 1 1 A 62 62 ARG N N 151 121.090 120.868 0.222 1
1 760 . 16 1 1 A 63 63 LEU H H 152 7.390 7.613 -0.223 1
1 761 . 16 1 1 A 63 63 LEU HA H 152 3.791 3.945 -0.154 1
1 771 . 16 1 1 A 63 63 LEU C C 152 179.106 178.848 0.258 1
1 772 . 16 1 1 A 63 63 LEU CA C 152 58.900 57.919 0.981 1
1 773 . 16 1 1 A 63 63 LEU CB C 152 41.140 41.550 -0.410 1
1 777 . 16 1 1 A 63 63 LEU N N 152 121.129 119.343 1.786 1
1 778 . 16 1 1 A 64 64 VAL H H 153 7.552 8.029 -0.477 1
1 779 . 16 1 1 A 64 64 VAL HA H 153 3.411 3.464 -0.053 1
1 787 . 16 1 1 A 64 64 VAL C C 153 180.595 177.974 2.621 1
1 788 . 16 1 1 A 64 64 VAL CA C 153 65.644 66.524 -0.880 1
1 789 . 16 1 1 A 64 64 VAL CB C 153 31.410 31.386 0.024 1
1 792 . 16 1 1 A 64 64 VAL N N 153 118.280 118.206 0.074 1
1 793 . 16 1 1 A 65 65 GLY H H 154 8.061 8.133 -0.072 1
1 794 . 16 1 1 A 65 65 GLY HA2 H 154 3.846 3.734 0.112 1
1 795 . 16 1 1 A 65 65 GLY HA3 H 154 3.809 3.736 0.073 1
1 796 . 16 1 1 A 65 65 GLY C C 154 175.235 176.339 -1.104 1
1 797 . 16 1 1 A 65 65 GLY CA C 154 46.630 47.185 -0.555 1
1 798 . 16 1 1 A 65 65 GLY N N 154 108.622 107.743 0.879 1
1 799 . 16 1 1 A 66 66 GLU H H 155 7.528 7.571 -0.043 1
1 800 . 16 1 1 A 66 66 GLU HA H 155 4.228 4.280 -0.052 1
1 805 . 16 1 1 A 66 66 GLU C C 155 176.761 177.143 -0.382 1
1 806 . 16 1 1 A 66 66 GLU CA C 155 56.590 56.537 0.053 1
1 807 . 16 1 1 A 66 66 GLU CB C 155 30.490 30.046 0.444 1
1 809 . 16 1 1 A 66 66 GLU N N 155 118.361 119.754 -1.393 1
1 810 . 16 1 1 A 67 67 GLY H H 156 7.884 7.729 0.155 1
1 811 . 16 1 1 A 67 67 GLY HA2 H 156 3.918 3.851 0.067 1
1 812 . 16 1 1 A 67 67 GLY HA3 H 156 3.747 3.865 -0.118 1
1 813 . 16 1 1 A 67 67 GLY C C 156 174.788 174.811 -0.023 1
1 814 . 16 1 1 A 67 67 GLY CA C 156 45.890 45.723 0.167 1
1 815 . 16 1 1 A 67 67 GLY N N 156 108.465 108.186 0.279 1
1 816 . 16 1 1 A 68 68 LEU H H 157 7.332 8.074 -0.742 1
1 817 . 16 1 1 A 68 68 LEU HA H 157 4.361 4.450 -0.089 1
1 827 . 16 1 1 A 68 68 LEU CA C 157 53.060 52.575 0.485 1
1 828 . 16 1 1 A 68 68 LEU CB C 157 41.100 41.375 -0.275 1
1 832 . 16 1 1 A 68 68 LEU N N 157 121.920 121.686 0.234 1
1 833 . 16 1 1 A 69 69 PRO HA H 158 4.485 4.562 -0.077 1
1 840 . 16 1 1 A 69 69 PRO C C 158 174.602 176.200 -1.598 1
1 841 . 16 1 1 A 69 69 PRO CA C 158 61.556 62.223 -0.667 1
1 842 . 16 1 1 A 69 69 PRO CB C 158 32.370 32.773 -0.403 1
1 845 . 16 1 1 A 70 70 HIS H H 159 8.759 8.652 0.107 1
1 846 . 16 1 1 A 70 70 HIS HA H 159 3.947 4.428 -0.481 1
1 852 . 16 1 1 A 70 70 HIS CA C 159 56.250 55.182 1.068 1
1 853 . 16 1 1 A 70 70 HIS CB C 159 32.280 30.964 1.316 1
1 856 . 16 1 1 A 70 70 HIS N N 159 119.423 120.517 -1.094 1
1 857 . 16 1 1 A 71 71 PRO HA H 160 4.424 4.375 0.049 1
1 864 . 16 1 1 A 71 71 PRO C C 160 177.567 177.034 0.533 1
1 865 . 16 1 1 A 71 71 PRO CA C 160 64.574 64.206 0.368 1
1 866 . 16 1 1 A 71 71 PRO CB C 160 32.340 31.847 0.493 1
1 869 . 16 1 1 A 72 72 LEU H H 161 10.123 7.594 2.529 1
1 870 . 16 1 1 A 72 72 LEU HA H 161 4.778 4.382 0.396 1
1 880 . 16 1 1 A 72 72 LEU C C 161 178.721 178.052 0.669 1
1 881 . 16 1 1 A 72 72 LEU CA C 161 55.800 56.527 -0.727 1
1 882 . 16 1 1 A 72 72 LEU CB C 161 42.440 43.501 -1.061 1
1 886 . 16 1 1 A 72 72 LEU N N 161 117.374 117.884 -0.510 1
1 887 . 16 1 1 A 73 73 THR H H 162 7.523 7.944 -0.421 1
1 888 . 16 1 1 A 73 73 THR HA H 162 4.291 4.538 -0.247 1
1 893 . 16 1 1 A 73 73 THR C C 162 175.557 174.425 1.132 1
1 894 . 16 1 1 A 73 73 THR CA C 162 61.440 62.657 -1.217 1
1 895 . 16 1 1 A 73 73 THR CB C 162 70.500 69.731 0.769 1
1 897 . 16 1 1 A 73 73 THR N N 162 107.787 112.461 -4.674 1
1 898 . 16 1 1 A 74 74 ARG H H 163 8.361 7.969 0.392 1
1 899 . 16 1 1 A 74 74 ARG HA H 163 3.836 4.287 -0.451 1
1 906 . 16 1 1 A 74 74 ARG C C 163 174.701 175.134 -0.433 1
1 907 . 16 1 1 A 74 74 ARG CA C 163 57.980 57.611 0.369 1
1 908 . 16 1 1 A 74 74 ARG CB C 163 26.770 26.976 -0.206 1
1 911 . 16 1 1 A 74 74 ARG N N 163 115.130 118.720 -3.590 1
1 912 . 16 1 1 A 75 75 GLU H H 164 7.430 8.075 -0.645 1
1 913 . 16 1 1 A 75 75 GLU HA H 164 4.636 4.477 0.159 1
1 918 . 16 1 1 A 75 75 GLU CA C 164 53.699 54.833 -1.134 1
1 919 . 16 1 1 A 75 75 GLU CB C 164 29.550 28.674 0.876 1
1 921 . 16 1 1 A 75 75 GLU N N 164 120.076 119.030 1.046 1
1 922 . 16 1 1 A 76 76 PRO HA H 165 4.272 4.489 -0.217 1
1 929 . 16 1 1 A 76 76 PRO C C 165 176.649 176.891 -0.242 1
1 930 . 16 1 1 A 76 76 PRO CA C 165 63.204 63.245 -0.041 1
1 931 . 16 1 1 A 76 76 PRO CB C 165 31.680 31.697 -0.017 1
1 934 . 16 1 1 A 77 77 ILE H H 166 8.812 8.222 0.590 1
1 935 . 16 1 1 A 77 77 ILE HA H 166 3.838 4.295 -0.457 1
1 945 . 16 1 1 A 77 77 ILE C C 166 175.235 175.954 -0.719 1
1 946 . 16 1 1 A 77 77 ILE CA C 166 62.816 61.103 1.713 1
1 947 . 16 1 1 A 77 77 ILE CB C 166 37.750 37.554 0.196 1
1 951 . 16 1 1 A 77 77 ILE N N 166 123.831 123.882 -0.051 1
1 952 . 16 1 1 A 78 78 THR H H 167 6.625 8.549 -1.924 1
1 953 . 16 1 1 A 78 78 THR HA H 167 4.632 5.018 -0.386 1
1 958 . 16 1 1 A 78 78 THR C C 167 174.143 174.213 -0.070 1
1 959 . 16 1 1 A 78 78 THR CA C 167 58.750 60.313 -1.563 1
1 960 . 16 1 1 A 78 78 THR CB C 167 71.320 70.714 0.606 1
1 962 . 16 1 1 A 78 78 THR N N 167 115.293 118.233 -2.940 1
1 963 . 16 1 1 A 79 79 ALA H H 168 9.088 8.957 0.131 1
1 964 . 16 1 1 A 79 79 ALA HA H 168 3.916 4.121 -0.205 1
1 968 . 16 1 1 A 79 79 ALA C C 168 179.788 179.687 0.101 1
1 969 . 16 1 1 A 79 79 ALA CA C 168 55.480 55.005 0.475 1
1 970 . 16 1 1 A 79 79 ALA CB C 168 17.630 18.374 -0.744 1
1 971 . 16 1 1 A 79 79 ALA N N 168 122.102 127.570 -5.468 1
1 972 . 16 1 1 A 80 80 SER H H 169 7.988 7.823 0.165 1
1 973 . 16 1 1 A 80 80 SER HA H 169 4.058 4.208 -0.150 1
1 976 . 16 1 1 A 80 80 SER C C 169 176.029 176.100 -0.071 1
1 977 . 16 1 1 A 80 80 SER CA C 169 60.750 61.919 -1.169 1
1 978 . 16 1 1 A 80 80 SER CB C 169 62.510 63.106 -0.596 1
1 979 . 16 1 1 A 80 80 SER N N 169 109.541 114.223 -4.682 1
1 980 . 16 1 1 A 81 81 ILE H H 170 6.968 7.475 -0.507 1
1 981 . 16 1 1 A 81 81 ILE HA H 170 4.315 4.557 -0.242 1
1 991 . 16 1 1 A 81 81 ILE C C 170 174.242 174.992 -0.750 1
1 992 . 16 1 1 A 81 81 ILE CA C 170 62.296 60.893 1.403 1
1 993 . 16 1 1 A 81 81 ILE CB C 170 37.686 38.206 -0.520 1
1 997 . 16 1 1 A 81 81 ILE N N 170 112.476 112.360 0.116 1
1 998 . 16 1 1 A 82 82 ILE H H 171 7.345 7.447 -0.102 1
1 999 . 16 1 1 A 82 82 ILE HA H 171 4.339 4.704 -0.365 1
1 1009 . 16 1 1 A 82 82 ILE C C 171 174.999 174.483 0.516 1
1 1010 . 16 1 1 A 82 82 ILE CA C 171 61.150 60.021 1.129 1
1 1011 . 16 1 1 A 82 82 ILE CB C 171 37.230 40.783 -3.553 1
1 1015 . 16 1 1 A 82 82 ILE N N 171 124.260 124.851 -0.591 1
1 1016 . 16 1 1 A 83 83 VAL H H 172 7.923 8.935 -1.012 1
1 1017 . 16 1 1 A 83 83 VAL HA H 172 4.673 5.047 -0.374 1
1 1025 . 16 1 1 A 83 83 VAL C C 172 174.887 175.119 -0.232 1
1 1026 . 16 1 1 A 83 83 VAL CA C 172 59.340 58.743 0.597 1
1 1027 . 16 1 1 A 83 83 VAL CB C 172 34.840 35.889 -1.049 1
1 1030 . 16 1 1 A 83 83 VAL N N 172 120.931 121.789 -0.858 1
1 1031 . 16 1 1 A 84 84 LYS H H 173 8.406 8.748 -0.342 1
1 1032 . 16 1 1 A 84 84 LYS HA H 173 4.410 4.593 -0.183 1
1 1041 . 16 1 1 A 84 84 LYS C C 173 178.734 178.521 0.213 1
1 1042 . 16 1 1 A 84 84 LYS CA C 173 56.360 55.549 0.811 1
1 1043 . 16 1 1 A 84 84 LYS CB C 173 33.100 33.077 0.023 1
1 1047 . 16 1 1 A 84 84 LYS N N 173 121.251 121.062 0.189 1
1 1048 . 16 1 1 A 85 85 HIS H H 174 9.221 9.194 0.027 1
1 1049 . 16 1 1 A 85 85 HIS HA H 174 4.024 4.079 -0.055 1
1 1053 . 16 1 1 A 85 85 HIS C C 174 177.183 176.903 0.280 1
1 1054 . 16 1 1 A 85 85 HIS CA C 174 59.460 59.893 -0.433 1
1 1055 . 16 1 1 A 85 85 HIS CB C 174 27.920 29.899 -1.979 1
1 1057 . 16 1 1 A 85 85 HIS N N 174 121.545 122.557 -1.012 1
1 1058 . 16 1 1 A 86 86 GLU H H 175 8.699 8.066 0.633 1
1 1059 . 16 1 1 A 86 86 GLU HA H 175 3.900 3.898 0.002 1
1 1064 . 16 1 1 A 86 86 GLU C C 175 177.220 178.182 -0.962 1
1 1065 . 16 1 1 A 86 86 GLU CA C 175 58.420 58.070 0.350 1
1 1066 . 16 1 1 A 86 86 GLU CB C 175 28.690 29.680 -0.990 1
1 1068 . 16 1 1 A 86 86 GLU N N 175 118.011 118.415 -0.404 1
1 1069 . 16 1 1 A 87 87 GLU H H 176 7.621 7.845 -0.224 1
1 1070 . 16 1 1 A 87 87 GLU HA H 176 4.177 4.085 0.092 1
1 1075 . 16 1 1 A 87 87 GLU C C 176 175.222 175.990 -0.768 1
1 1076 . 16 1 1 A 87 87 GLU CA C 176 56.390 58.360 -1.970 1
1 1077 . 16 1 1 A 87 87 GLU CB C 176 30.430 30.066 0.364 1
1 1079 . 16 1 1 A 87 87 GLU N N 176 116.753 119.009 -2.256 1
1 1080 . 16 1 1 A 88 88 CYS H H 177 7.239 7.410 -0.171 1
1 1081 . 16 1 1 A 88 88 CYS HA H 177 5.148 5.236 -0.088 1
1 1084 . 16 1 1 A 88 88 CYS C C 177 173.249 173.417 -0.168 1
1 1085 . 16 1 1 A 88 88 CYS CA C 177 57.240 56.642 0.598 1
1 1086 . 16 1 1 A 88 88 CYS CB C 177 31.020 31.170 -0.150 1
1 1087 . 16 1 1 A 88 88 CYS N N 177 116.096 115.457 0.639 1
1 1088 . 16 1 1 A 89 89 ILE H H 178 8.912 8.764 0.148 1
1 1089 . 16 1 1 A 89 89 ILE HA H 178 4.580 4.944 -0.364 1
1 1099 . 16 1 1 A 89 89 ILE C C 178 173.386 174.274 -0.888 1
1 1100 . 16 1 1 A 89 89 ILE CA C 178 59.270 59.186 0.084 1
1 1101 . 16 1 1 A 89 89 ILE CB C 178 42.990 41.955 1.035 1
1 1105 . 16 1 1 A 89 89 ILE N N 178 119.490 117.134 2.356 1
1 1106 . 16 1 1 A 90 90 TYR H H 179 9.047 8.817 0.230 1
1 1107 . 16 1 1 A 90 90 TYR HA H 179 3.753 4.049 -0.296 1
1 1112 . 16 1 1 A 90 90 TYR C C 179 173.932 174.028 -0.096 1
1 1113 . 16 1 1 A 90 90 TYR CA C 179 59.860 57.425 2.435 1
1 1114 . 16 1 1 A 90 90 TYR CB C 179 37.530 38.538 -1.008 1
1 1116 . 16 1 1 A 90 90 TYR N N 179 126.270 122.189 4.081 1
1 1117 . 16 1 1 A 91 91 ASP H H 180 7.462 8.309 -0.847 1
1 1118 . 16 1 1 A 91 91 ASP HA H 180 4.639 4.746 -0.107 1
1 1121 . 16 1 1 A 91 91 ASP C C 180 175.297 176.413 -1.116 1
1 1122 . 16 1 1 A 91 91 ASP CA C 180 52.496 52.245 0.251 1
1 1123 . 16 1 1 A 91 91 ASP CB C 180 43.380 42.742 0.638 1
1 1124 . 16 1 1 A 91 91 ASP N N 180 129.593 123.936 5.657 1
1 1125 . 16 1 1 A 92 92 ASP H H 181 8.719 8.864 -0.145 1
1 1126 . 16 1 1 A 92 92 ASP HA H 181 4.109 4.297 -0.188 1
1 1129 . 16 1 1 A 92 92 ASP C C 181 177.555 177.838 -0.283 1
1 1130 . 16 1 1 A 92 92 ASP CA C 181 56.390 56.807 -0.417 1
1 1131 . 16 1 1 A 92 92 ASP CB C 181 41.330 39.567 1.763 1
1 1132 . 16 1 1 A 92 92 ASP N N 181 125.691 125.844 -0.153 1
1 1133 . 16 1 1 A 93 93 THR H H 182 8.271 7.422 0.849 1
1 1134 . 16 1 1 A 93 93 THR HA H 182 4.036 4.078 -0.042 1
1 1139 . 16 1 1 A 93 93 THR C C 182 176.289 176.087 0.202 1
1 1140 . 16 1 1 A 93 93 THR CA C 182 65.054 64.176 0.878 1
1 1141 . 16 1 1 A 93 93 THR CB C 182 68.560 69.015 -0.455 1
1 1143 . 16 1 1 A 93 93 THR N N 182 114.813 114.596 0.217 1
1 1144 . 16 1 1 A 94 94 ARG H H 183 7.753 7.513 0.240 1
1 1145 . 16 1 1 A 94 94 ARG HA H 183 4.139 4.302 -0.163 1
1 1152 . 16 1 1 A 94 94 ARG C C 183 176.897 177.167 -0.270 1
1 1153 . 16 1 1 A 94 94 ARG CA C 183 55.350 56.295 -0.945 1
1 1154 . 16 1 1 A 94 94 ARG CB C 183 30.930 31.037 -0.107 1
1 1157 . 16 1 1 A 94 94 ARG N N 183 120.101 118.300 1.801 1
1 1158 . 16 1 1 A 95 95 GLY H H 184 8.112 8.710 -0.598 1
1 1159 . 16 1 1 A 95 95 GLY HA2 H 184 3.838 3.840 -0.002 1
1 1160 . 16 1 1 A 95 95 GLY HA3 H 184 3.670 3.852 -0.182 1
1 1161 . 16 1 1 A 95 95 GLY C C 184 173.659 173.345 0.314 1
1 1162 . 16 1 1 A 95 95 GLY CA C 184 46.040 45.589 0.451 1
1 1163 . 16 1 1 A 95 95 GLY N N 184 108.106 108.930 -0.824 1
1 1164 . 16 1 1 A 96 96 ASN H H 185 6.833 7.461 -0.628 1
1 1165 . 16 1 1 A 96 96 ASN HA H 185 4.944 5.337 -0.393 1
1 1170 . 16 1 1 A 96 96 ASN C C 185 174.267 174.072 0.195 1
1 1171 . 16 1 1 A 96 96 ASN CA C 185 52.560 51.129 1.431 1
1 1172 . 16 1 1 A 96 96 ASN CB C 185 45.890 42.698 3.192 1
1 1173 . 16 1 1 A 96 96 ASN N N 185 113.392 117.660 -4.268 1
1 1175 . 16 1 1 A 97 97 PHE H H 186 9.108 8.780 0.328 1
1 1176 . 16 1 1 A 97 97 PHE HA H 186 4.782 4.796 -0.014 1
1 1183 . 16 1 1 A 97 97 PHE C C 186 174.862 175.796 -0.934 1
1 1184 . 16 1 1 A 97 97 PHE CA C 186 60.056 59.216 0.840 1
1 1185 . 16 1 1 A 97 97 PHE CB C 186 40.180 39.767 0.413 1
1 1188 . 16 1 1 A 97 97 PHE N N 186 118.741 119.548 -0.807 1
1 1189 . 16 1 1 A 98 98 ILE H H 187 8.933 8.824 0.109 1
1 1190 . 16 1 1 A 98 98 ILE HA H 187 5.458 4.949 0.509 1
1 1200 . 16 1 1 A 98 98 ILE C C 187 176.041 174.968 1.073 1
1 1201 . 16 1 1 A 98 98 ILE CA C 187 57.610 59.202 -1.592 1
1 1202 . 16 1 1 A 98 98 ILE CB C 187 42.070 42.197 -0.127 1
1 1206 . 16 1 1 A 98 98 ILE N N 187 117.857 118.183 -0.326 1
1 1207 . 16 1 1 A 99 99 ILE H H 188 8.284 8.739 -0.455 1
1 1208 . 16 1 1 A 99 99 ILE HA H 188 4.341 4.171 0.170 1
1 1218 . 16 1 1 A 99 99 ILE C C 188 176.413 176.481 -0.068 1
1 1219 . 16 1 1 A 99 99 ILE CA C 188 59.190 61.372 -2.182 1
1 1220 . 16 1 1 A 99 99 ILE CB C 188 37.940 38.153 -0.213 1
1 1224 . 16 1 1 A 99 99 ILE N N 188 121.796 122.701 -0.905 1
1 1225 . 16 1 1 A 100 100 LYS H H 189 8.463 8.382 0.081 1
1 1226 . 16 1 1 A 100 100 LYS HA H 189 4.040 4.287 -0.247 1
1 1235 . 16 1 1 A 100 100 LYS C C 189 176.848 178.167 -1.319 1
1 1236 . 16 1 1 A 100 100 LYS CA C 189 57.241 56.091 1.150 1
1 1237 . 16 1 1 A 100 100 LYS CB C 189 33.400 33.230 0.170 1
1 1241 . 16 1 1 A 100 100 LYS N N 189 127.995 124.350 3.645 1
1 1242 . 16 1 1 A 101 101 GLY H H 190 8.346 8.589 -0.243 1
1 1243 . 16 1 1 A 101 101 GLY HA2 H 190 3.947 3.789 0.158 1
1 1244 . 16 1 1 A 101 101 GLY HA3 H 190 3.813 3.793 0.020 1
1 1245 . 16 1 1 A 101 101 GLY C C 190 172.902 175.703 -2.801 1
1 1246 . 16 1 1 A 101 101 GLY CA C 190 44.920 47.242 -2.322 1
1 1247 . 16 1 1 A 101 101 GLY N N 190 110.882 110.893 -0.011 1
1 7 . 17 1 1 A 2 2 GLN H H 91 8.786 8.976 -0.190 1
1 8 . 17 1 1 A 2 2 GLN HA H 91 4.005 3.940 0.065 1
1 15 . 17 1 1 A 2 2 GLN C C 91 177.270 177.933 -0.663 1
1 16 . 17 1 1 A 2 2 GLN CA C 91 58.220 59.655 -1.435 1
1 17 . 17 1 1 A 2 2 GLN CB C 91 28.650 28.138 0.512 1
1 19 . 17 1 1 A 2 2 GLN N N 91 121.993 126.967 -4.974 1
1 21 . 17 1 1 A 3 3 GLU H H 92 8.430 8.299 0.131 1
1 22 . 17 1 1 A 3 3 GLU HA H 92 4.007 4.121 -0.114 1
1 27 . 17 1 1 A 3 3 GLU C C 92 178.287 178.642 -0.355 1
1 28 . 17 1 1 A 3 3 GLU CA C 92 59.490 59.183 0.307 1
1 29 . 17 1 1 A 3 3 GLU CB C 92 29.506 29.461 0.045 1
1 31 . 17 1 1 A 3 3 GLU N N 92 120.195 118.589 1.606 1
1 32 . 17 1 1 A 4 4 SER H H 93 8.209 8.122 0.087 1
1 33 . 17 1 1 A 4 4 SER HA H 93 4.272 4.143 0.129 1
1 36 . 17 1 1 A 4 4 SER C C 93 177.369 176.737 0.632 1
1 37 . 17 1 1 A 4 4 SER CA C 93 61.044 62.497 -1.453 1
1 38 . 17 1 1 A 4 4 SER CB C 93 62.950 62.879 0.071 1
1 39 . 17 1 1 A 4 4 SER N N 93 115.524 116.080 -0.556 1
1 40 . 17 1 1 A 5 5 ILE H H 94 8.080 8.043 0.037 1
1 41 . 17 1 1 A 5 5 ILE HA H 94 3.530 3.662 -0.132 1
1 51 . 17 1 1 A 5 5 ILE C C 94 177.778 177.781 -0.003 1
1 52 . 17 1 1 A 5 5 ILE CA C 94 65.710 65.200 0.510 1
1 53 . 17 1 1 A 5 5 ILE CB C 94 37.800 37.375 0.425 1
1 57 . 17 1 1 A 5 5 ILE N N 94 124.148 121.677 2.471 1
1 58 . 17 1 1 A 6 6 GLN H H 95 8.374 8.185 0.189 1
1 59 . 17 1 1 A 6 6 GLN HA H 95 4.125 3.973 0.152 1
1 66 . 17 1 1 A 6 6 GLN C C 95 179.726 179.276 0.450 1
1 67 . 17 1 1 A 6 6 GLN CA C 95 59.190 59.007 0.183 1
1 68 . 17 1 1 A 6 6 GLN CB C 95 27.060 28.244 -1.184 1
1 70 . 17 1 1 A 6 6 GLN N N 95 118.257 118.287 -0.030 1
1 72 . 17 1 1 A 7 7 ASN H H 96 8.456 7.819 0.637 1
1 73 . 17 1 1 A 7 7 ASN HA H 96 4.446 4.531 -0.085 1
1 78 . 17 1 1 A 7 7 ASN C C 96 177.257 178.318 -1.061 1
1 79 . 17 1 1 A 7 7 ASN CA C 96 56.020 56.226 -0.206 1
1 80 . 17 1 1 A 7 7 ASN CB C 96 38.126 37.986 0.140 1
1 81 . 17 1 1 A 7 7 ASN N N 96 118.597 118.401 0.196 1
1 83 . 17 1 1 A 8 8 LYS H H 97 7.732 7.641 0.091 1
1 84 . 17 1 1 A 8 8 LYS HA H 97 4.129 4.048 0.081 1
1 93 . 17 1 1 A 8 8 LYS C C 97 179.143 179.424 -0.281 1
1 94 . 17 1 1 A 8 8 LYS CA C 97 59.126 59.074 0.052 1
1 95 . 17 1 1 A 8 8 LYS CB C 97 32.070 32.180 -0.110 1
1 99 . 17 1 1 A 8 8 LYS N N 97 122.381 118.515 3.866 1
1 100 . 17 1 1 A 9 9 ILE H H 98 8.452 8.111 0.341 1
1 101 . 17 1 1 A 9 9 ILE HA H 98 3.480 3.747 -0.267 1
1 111 . 17 1 1 A 9 9 ILE C C 98 177.406 178.206 -0.800 1
1 112 . 17 1 1 A 9 9 ILE CA C 98 66.430 65.170 1.260 1
1 113 . 17 1 1 A 9 9 ILE CB C 98 37.980 37.733 0.247 1
1 117 . 17 1 1 A 9 9 ILE N N 98 119.950 121.160 -1.210 1
1 118 . 17 1 1 A 10 10 SER H H 99 7.924 7.848 0.076 1
1 119 . 17 1 1 A 10 10 SER HA H 99 3.983 4.174 -0.191 1
1 122 . 17 1 1 A 10 10 SER C C 99 176.327 176.826 -0.499 1
1 123 . 17 1 1 A 10 10 SER CA C 99 61.990 61.276 0.714 1
1 124 . 17 1 1 A 10 10 SER CB C 99 62.790 63.129 -0.339 1
1 125 . 17 1 1 A 10 10 SER N N 99 113.568 116.173 -2.605 1
1 126 . 17 1 1 A 11 11 GLN H H 100 7.832 7.402 0.430 1
1 127 . 17 1 1 A 11 11 GLN HA H 100 4.238 4.220 0.018 1
1 134 . 17 1 1 A 11 11 GLN C C 100 178.088 176.871 1.217 1
1 135 . 17 1 1 A 11 11 GLN CA C 100 57.900 58.121 -0.221 1
1 136 . 17 1 1 A 11 11 GLN CB C 100 29.790 28.208 1.582 1
1 138 . 17 1 1 A 11 11 GLN N N 100 117.487 120.318 -2.831 1
1 140 . 17 1 1 A 12 12 CYS H H 101 7.920 7.836 0.084 1
1 141 . 17 1 1 A 12 12 CYS HA H 101 4.657 4.660 -0.003 1
1 144 . 17 1 1 A 12 12 CYS C C 101 175.446 174.775 0.671 1
1 145 . 17 1 1 A 12 12 CYS CA C 101 60.654 59.259 1.395 1
1 146 . 17 1 1 A 12 12 CYS CB C 101 29.310 28.674 0.636 1
1 147 . 17 1 1 A 12 12 CYS N N 101 114.221 116.508 -2.287 1
1 148 . 17 1 1 A 13 13 LYS H H 102 8.029 7.330 0.699 1
1 149 . 17 1 1 A 13 13 LYS HA H 102 5.069 4.865 0.204 1
1 158 . 17 1 1 A 13 13 LYS C C 102 174.800 176.230 -1.430 1
1 159 . 17 1 1 A 13 13 LYS CA C 102 56.394 56.051 0.343 1
1 160 . 17 1 1 A 13 13 LYS CB C 102 32.770 33.463 -0.693 1
1 164 . 17 1 1 A 13 13 LYS N N 102 124.129 119.166 4.963 1
1 165 . 17 1 1 A 14 14 PHE H H 103 8.737 8.452 0.285 1
1 166 . 17 1 1 A 14 14 PHE HA H 103 5.059 5.102 -0.043 1
1 174 . 17 1 1 A 14 14 PHE C C 103 173.560 173.174 0.386 1
1 175 . 17 1 1 A 14 14 PHE CA C 103 55.470 56.055 -0.585 1
1 176 . 17 1 1 A 14 14 PHE CB C 103 41.760 41.075 0.685 1
1 180 . 17 1 1 A 14 14 PHE N N 103 118.661 116.523 2.138 1
1 181 . 17 1 1 A 15 15 SER H H 104 8.826 8.837 -0.011 1
1 182 . 17 1 1 A 15 15 SER HA H 104 4.602 4.590 0.012 1
1 185 . 17 1 1 A 15 15 SER C C 104 173.795 173.681 0.114 1
1 186 . 17 1 1 A 15 15 SER CA C 104 58.610 58.747 -0.137 1
1 187 . 17 1 1 A 15 15 SER CB C 104 62.690 62.327 0.363 1
1 188 . 17 1 1 A 15 15 SER N N 104 117.781 116.975 0.806 1
1 189 . 17 1 1 A 16 16 VAL H H 105 7.784 8.083 -0.299 1
1 190 . 17 1 1 A 16 16 VAL HA H 105 3.370 4.154 -0.784 1
1 198 . 17 1 1 A 16 16 VAL C C 105 174.987 175.383 -0.396 1
1 199 . 17 1 1 A 16 16 VAL CA C 105 63.580 63.128 0.452 1
1 200 . 17 1 1 A 16 16 VAL CB C 105 31.410 31.079 0.331 1
1 203 . 17 1 1 A 16 16 VAL N N 105 129.075 126.591 2.484 1
1 204 . 17 1 1 A 17 17 CYS H H 106 8.536 8.558 -0.022 1
1 205 . 17 1 1 A 17 17 CYS HA H 106 5.011 5.053 -0.042 1
1 208 . 17 1 1 A 17 17 CYS CA C 106 55.260 56.207 -0.947 1
1 209 . 17 1 1 A 17 17 CYS CB C 106 28.210 28.420 -0.210 1
1 210 . 17 1 1 A 17 17 CYS N N 106 130.045 127.705 2.340 1
1 211 . 17 1 1 A 18 18 PRO HA H 107 3.991 4.355 -0.364 1
1 218 . 17 1 1 A 18 18 PRO C C 107 178.188 178.528 -0.340 1
1 219 . 17 1 1 A 18 18 PRO CA C 107 65.940 65.149 0.791 1
1 220 . 17 1 1 A 18 18 PRO CB C 107 32.000 31.868 0.132 1
1 223 . 17 1 1 A 19 19 GLU H H 108 9.260 9.037 0.223 1
1 224 . 17 1 1 A 19 19 GLU HA H 108 4.119 4.078 0.041 1
1 229 . 17 1 1 A 19 19 GLU C C 108 178.721 178.830 -0.109 1
1 230 . 17 1 1 A 19 19 GLU CA C 108 59.300 59.458 -0.158 1
1 231 . 17 1 1 A 19 19 GLU CB C 108 28.920 28.909 0.011 1
1 233 . 17 1 1 A 19 19 GLU N N 108 118.270 116.377 1.893 1
1 234 . 17 1 1 A 20 20 ARG H H 109 7.672 7.961 -0.289 1
1 235 . 17 1 1 A 20 20 ARG HA H 109 4.331 4.174 0.157 1
1 242 . 17 1 1 A 20 20 ARG C C 109 177.977 178.647 -0.670 1
1 243 . 17 1 1 A 20 20 ARG CA C 109 57.350 58.484 -1.134 1
1 244 . 17 1 1 A 20 20 ARG CB C 109 30.820 29.956 0.864 1
1 247 . 17 1 1 A 20 20 ARG N N 109 118.357 120.134 -1.777 1
1 248 . 17 1 1 A 21 21 LEU H H 110 7.601 7.795 -0.194 1
1 249 . 17 1 1 A 21 21 LEU HA H 110 4.380 4.244 0.136 1
1 259 . 17 1 1 A 21 21 LEU C C 110 176.562 176.428 0.134 1
1 260 . 17 1 1 A 21 21 LEU CA C 110 56.096 55.428 0.668 1
1 261 . 17 1 1 A 21 21 LEU CB C 110 44.016 42.105 1.911 1
1 265 . 17 1 1 A 21 21 LEU N N 110 118.626 118.182 0.444 1
1 266 . 17 1 1 A 22 22 GLN H H 111 7.750 7.816 -0.066 1
1 267 . 17 1 1 A 22 22 GLN HA H 111 3.870 3.968 -0.098 1
1 274 . 17 1 1 A 22 22 GLN C C 111 173.336 174.804 -1.468 1
1 275 . 17 1 1 A 22 22 GLN CA C 111 56.510 57.342 -0.832 1
1 276 . 17 1 1 A 22 22 GLN CB C 111 26.800 26.486 0.314 1
1 278 . 17 1 1 A 22 22 GLN N N 111 113.926 115.635 -1.709 1
1 280 . 17 1 1 A 23 23 CYS H H 112 7.407 7.525 -0.118 1
1 281 . 17 1 1 A 23 23 CYS HA H 112 4.469 4.728 -0.259 1
1 284 . 17 1 1 A 23 23 CYS CA C 112 52.650 57.889 -5.239 1
1 285 . 17 1 1 A 23 23 CYS CB C 112 29.750 28.906 0.844 1
1 286 . 17 1 1 A 23 23 CYS N N 112 112.681 118.398 -5.717 1
1 287 . 17 1 1 A 24 24 PRO HA H 113 4.408 4.627 -0.219 1
1 294 . 17 1 1 A 24 24 PRO C C 113 178.175 177.500 0.675 1
1 295 . 17 1 1 A 24 24 PRO CA C 113 62.040 62.887 -0.847 1
1 296 . 17 1 1 A 24 24 PRO CB C 113 31.920 32.739 -0.819 1
1 299 . 17 1 1 A 25 25 LEU H H 114 8.593 8.453 0.140 1
1 300 . 17 1 1 A 25 25 LEU HA H 114 3.765 3.912 -0.147 1
1 310 . 17 1 1 A 25 25 LEU C C 114 179.950 178.985 0.965 1
1 311 . 17 1 1 A 25 25 LEU CA C 114 57.674 57.840 -0.166 1
1 312 . 17 1 1 A 25 25 LEU CB C 114 40.690 41.593 -0.903 1
1 316 . 17 1 1 A 25 25 LEU N N 114 123.729 123.664 0.065 1
1 317 . 17 1 1 A 26 26 GLU H H 115 9.108 8.597 0.511 1
1 318 . 17 1 1 A 26 26 GLU HA H 115 3.876 4.027 -0.151 1
1 323 . 17 1 1 A 26 26 GLU C C 115 177.505 178.270 -0.765 1
1 324 . 17 1 1 A 26 26 GLU CA C 115 59.410 59.298 0.112 1
1 325 . 17 1 1 A 26 26 GLU CB C 115 28.460 29.040 -0.580 1
1 327 . 17 1 1 A 26 26 GLU N N 115 116.817 117.368 -0.551 1
1 328 . 17 1 1 A 27 27 ALA H H 116 7.360 7.518 -0.158 1
1 329 . 17 1 1 A 27 27 ALA HA H 116 4.408 4.175 0.233 1
1 333 . 17 1 1 A 27 27 ALA C C 116 177.046 177.774 -0.728 1
1 334 . 17 1 1 A 27 27 ALA CA C 116 52.970 54.250 -1.280 1
1 335 . 17 1 1 A 27 27 ALA CB C 116 19.916 18.602 1.314 1
1 336 . 17 1 1 A 27 27 ALA N N 116 118.966 120.655 -1.689 1
1 337 . 17 1 1 A 28 28 ILE H H 117 7.168 6.991 0.177 1
1 338 . 17 1 1 A 28 28 ILE HA H 117 4.432 4.291 0.141 1
1 348 . 17 1 1 A 28 28 ILE C C 117 172.641 175.510 -2.869 1
1 349 . 17 1 1 A 28 28 ILE CA C 117 59.980 59.544 0.436 1
1 350 . 17 1 1 A 28 28 ILE CB C 117 37.350 37.953 -0.603 1
1 354 . 17 1 1 A 28 28 ILE N N 117 108.913 109.230 -0.317 1
1 355 . 17 1 1 A 29 29 GLN H H 118 6.562 7.249 -0.687 1
1 356 . 17 1 1 A 29 29 GLN HA H 118 3.922 4.283 -0.361 1
1 363 . 17 1 1 A 29 29 GLN C C 118 175.049 175.640 -0.591 1
1 364 . 17 1 1 A 29 29 GLN CA C 118 54.596 55.906 -1.310 1
1 365 . 17 1 1 A 29 29 GLN CB C 118 29.570 29.586 -0.016 1
1 367 . 17 1 1 A 29 29 GLN N N 118 116.455 123.222 -6.767 1
1 369 . 17 1 1 A 30 30 CYS H H 119 8.138 8.321 -0.183 1
1 370 . 17 1 1 A 30 30 CYS HA H 119 4.580 4.721 -0.141 1
1 373 . 17 1 1 A 30 30 CYS CA C 119 57.810 57.237 0.573 1
1 374 . 17 1 1 A 30 30 CYS CB C 119 30.200 28.717 1.483 1
1 375 . 17 1 1 A 30 30 CYS N N 119 134.136 125.141 8.995 1
1 376 . 17 1 1 A 31 31 PRO HA H 120 4.424 4.433 -0.009 1
1 383 . 17 1 1 A 31 31 PRO C C 120 177.431 177.543 -0.112 1
1 384 . 17 1 1 A 31 31 PRO CA C 120 64.060 63.981 0.079 1
1 385 . 17 1 1 A 31 31 PRO CB C 120 32.776 31.947 0.829 1
1 388 . 17 1 1 A 32 32 ILE H H 121 11.318 7.770 3.548 1
1 389 . 17 1 1 A 32 32 ILE HA H 121 4.038 3.981 0.057 1
1 399 . 17 1 1 A 32 32 ILE C C 121 178.485 177.815 0.670 1
1 400 . 17 1 1 A 32 32 ILE CA C 121 64.060 63.938 0.122 1
1 401 . 17 1 1 A 32 32 ILE CB C 121 39.340 38.433 0.907 1
1 405 . 17 1 1 A 32 32 ILE N N 121 124.500 117.274 7.226 1
1 406 . 17 1 1 A 33 33 THR H H 122 9.928 7.335 2.593 1
1 407 . 17 1 1 A 33 33 THR HA H 122 4.048 4.363 -0.315 1
1 412 . 17 1 1 A 33 33 THR C C 122 175.793 174.459 1.334 1
1 413 . 17 1 1 A 33 33 THR CA C 122 62.990 61.744 1.246 1
1 414 . 17 1 1 A 33 33 THR CB C 122 70.300 69.891 0.409 1
1 416 . 17 1 1 A 33 33 THR N N 122 115.136 109.320 5.816 1
1 417 . 17 1 1 A 34 34 LEU H H 123 8.439 7.749 0.690 1
1 418 . 17 1 1 A 34 34 LEU HA H 123 3.912 3.810 0.102 1
1 428 . 17 1 1 A 34 34 LEU C C 123 175.495 175.109 0.386 1
1 429 . 17 1 1 A 34 34 LEU CA C 123 56.290 56.095 0.195 1
1 430 . 17 1 1 A 34 34 LEU CB C 123 38.500 39.866 -1.366 1
1 434 . 17 1 1 A 34 34 LEU N N 123 117.230 119.262 -2.032 1
1 435 . 17 1 1 A 35 35 GLU H H 124 7.816 6.940 0.876 1
1 436 . 17 1 1 A 35 35 GLU HA H 124 4.634 4.653 -0.019 1
1 441 . 17 1 1 A 35 35 GLU C C 124 174.838 174.003 0.835 1
1 442 . 17 1 1 A 35 35 GLU CA C 124 53.780 54.974 -1.194 1
1 443 . 17 1 1 A 35 35 GLU CB C 124 33.710 32.251 1.459 1
1 445 . 17 1 1 A 35 35 GLU N N 124 116.577 114.228 2.349 1
1 446 . 17 1 1 A 36 36 GLN H H 125 8.532 8.426 0.106 1
1 447 . 17 1 1 A 36 36 GLN HA H 125 4.958 4.378 0.580 1
1 454 . 17 1 1 A 36 36 GLN CA C 125 53.350 53.312 0.038 1
1 455 . 17 1 1 A 36 36 GLN CB C 125 29.950 29.186 0.764 1
1 457 . 17 1 1 A 36 36 GLN N N 125 123.034 123.597 -0.563 1
1 459 . 17 1 1 A 37 37 PRO HA H 126 4.458 4.678 -0.220 1
1 466 . 17 1 1 A 37 37 PRO C C 126 176.314 176.082 0.232 1
1 467 . 17 1 1 A 37 37 PRO CA C 126 62.816 62.677 0.139 1
1 468 . 17 1 1 A 37 37 PRO CB C 126 33.070 32.864 0.206 1
1 471 . 17 1 1 A 38 38 GLU H H 127 8.626 8.341 0.285 1
1 472 . 17 1 1 A 38 38 GLU HA H 127 4.274 4.337 -0.063 1
1 477 . 17 1 1 A 38 38 GLU C C 127 177.877 176.006 1.871 1
1 478 . 17 1 1 A 38 38 GLU CA C 127 58.730 56.581 2.149 1
1 479 . 17 1 1 A 38 38 GLU CB C 127 30.340 30.847 -0.507 1
1 481 . 17 1 1 A 38 38 GLU N N 127 120.691 117.811 2.880 1
1 482 . 17 1 1 A 39 39 LYS H H 128 7.861 7.756 0.105 1
1 483 . 17 1 1 A 39 39 LYS HA H 128 4.889 4.958 -0.069 1
1 492 . 17 1 1 A 39 39 LYS C C 128 175.446 174.853 0.593 1
1 493 . 17 1 1 A 39 39 LYS CA C 128 53.670 54.763 -1.093 1
1 494 . 17 1 1 A 39 39 LYS CB C 128 33.630 35.503 -1.873 1
1 498 . 17 1 1 A 39 39 LYS N N 128 117.878 117.250 0.628 1
1 499 . 17 1 1 A 40 40 GLY H H 129 8.426 7.832 0.594 1
1 500 . 17 1 1 A 40 40 GLY HA2 H 129 4.970 4.032 0.938 1
1 501 . 17 1 1 A 40 40 GLY HA3 H 129 2.458 4.163 -1.705 1
1 502 . 17 1 1 A 40 40 GLY C C 129 170.048 172.312 -2.264 1
1 503 . 17 1 1 A 40 40 GLY CA C 129 42.910 44.935 -2.025 1
1 504 . 17 1 1 A 40 40 GLY N N 129 112.604 107.541 5.063 1
1 505 . 17 1 1 A 41 41 ILE H H 130 8.596 9.098 -0.502 1
1 506 . 17 1 1 A 41 41 ILE HA H 130 4.636 5.259 -0.623 1
1 516 . 17 1 1 A 41 41 ILE C C 130 172.691 174.330 -1.639 1
1 517 . 17 1 1 A 41 41 ILE CA C 130 58.500 58.642 -0.142 1
1 518 . 17 1 1 A 41 41 ILE CB C 130 43.320 41.349 1.971 1
1 522 . 17 1 1 A 41 41 ILE N N 130 113.363 116.549 -3.186 1
1 523 . 17 1 1 A 42 42 PHE H H 131 8.994 9.013 -0.019 1
1 524 . 17 1 1 A 42 42 PHE HA H 131 5.075 5.430 -0.355 1
1 532 . 17 1 1 A 42 42 PHE C C 131 175.111 175.125 -0.014 1
1 533 . 17 1 1 A 42 42 PHE CA C 131 58.680 57.097 1.583 1
1 534 . 17 1 1 A 42 42 PHE CB C 131 42.220 40.431 1.789 1
1 538 . 17 1 1 A 42 42 PHE N N 131 125.156 122.303 2.853 1
1 539 . 17 1 1 A 43 43 VAL H H 132 8.399 9.150 -0.751 1
1 540 . 17 1 1 A 43 43 VAL HA H 132 4.920 4.762 0.158 1
1 548 . 17 1 1 A 43 43 VAL C C 132 178.175 175.461 2.714 1
1 549 . 17 1 1 A 43 43 VAL CA C 132 59.600 60.995 -1.395 1
1 550 . 17 1 1 A 43 43 VAL CB C 132 35.920 34.388 1.532 1
1 553 . 17 1 1 A 43 43 VAL N N 132 119.371 123.397 -4.026 1
1 554 . 17 1 1 A 44 44 LYS H H 133 10.041 8.610 1.431 1
1 555 . 17 1 1 A 44 44 LYS HA H 133 4.920 4.349 0.571 1
1 564 . 17 1 1 A 44 44 LYS C C 133 177.195 175.647 1.548 1
1 565 . 17 1 1 A 44 44 LYS CA C 133 57.310 56.520 0.790 1
1 566 . 17 1 1 A 44 44 LYS CB C 133 34.410 32.650 1.760 1
1 570 . 17 1 1 A 44 44 LYS N N 133 130.928 126.825 4.103 1
1 571 . 17 1 1 A 45 45 ASN H H 134 8.534 8.835 -0.301 1
1 572 . 17 1 1 A 45 45 ASN HA H 134 4.151 4.640 -0.489 1
1 577 . 17 1 1 A 45 45 ASN C C 134 174.217 175.243 -1.026 1
1 578 . 17 1 1 A 45 45 ASN CA C 134 55.290 52.485 2.805 1
1 579 . 17 1 1 A 45 45 ASN CB C 134 37.530 38.064 -0.534 1
1 580 . 17 1 1 A 45 45 ASN N N 134 119.452 124.065 -4.613 1
1 582 . 17 1 1 A 46 46 SER H H 135 7.570 8.109 -0.539 1
1 583 . 17 1 1 A 46 46 SER HA H 135 4.220 4.168 0.052 1
1 586 . 17 1 1 A 46 46 SER C C 135 174.490 176.611 -2.121 1
1 587 . 17 1 1 A 46 46 SER CA C 135 57.090 61.331 -4.241 1
1 588 . 17 1 1 A 46 46 SER CB C 135 64.126 62.959 1.167 1
1 589 . 17 1 1 A 46 46 SER N N 135 105.613 121.521 -15.908 1
1 590 . 17 1 1 A 47 47 ASP H H 136 9.113 8.114 0.999 1
1 591 . 17 1 1 A 47 47 ASP HA H 136 4.220 4.313 -0.093 1
1 594 . 17 1 1 A 47 47 ASP CA C 136 57.610 57.029 0.581 1
1 595 . 17 1 1 A 47 47 ASP CB C 136 40.810 40.523 0.287 1
1 596 . 17 1 1 A 47 47 ASP N N 136 120.995 120.940 0.055 1
1 597 . 17 1 1 A 48 48 GLY H H 137 8.172 7.955 0.217 1
1 598 . 17 1 1 A 48 48 GLY HA2 H 137 4.096 3.753 0.343 1
1 599 . 17 1 1 A 48 48 GLY HA3 H 137 3.664 3.763 -0.099 1
1 600 . 17 1 1 A 48 48 GLY C C 137 173.990 175.202 -1.212 1
1 601 . 17 1 1 A 48 48 GLY CA C 137 45.130 47.283 -2.153 1
1 602 . 17 1 1 A 48 48 GLY N N 137 105.838 107.088 -1.250 1
1 603 . 17 1 1 A 49 49 SER H H 138 7.252 7.575 -0.323 1
1 604 . 17 1 1 A 49 49 SER HA H 138 4.503 4.709 -0.206 1
1 607 . 17 1 1 A 49 49 SER C C 138 173.857 173.431 0.426 1
1 608 . 17 1 1 A 49 49 SER CA C 138 57.340 57.251 0.089 1
1 609 . 17 1 1 A 49 49 SER CB C 138 65.370 64.216 1.154 1
1 610 . 17 1 1 A 49 49 SER N N 138 114.942 112.291 2.651 1
1 611 . 17 1 1 A 50 50 ASP H H 139 8.276 8.023 0.253 1
1 612 . 17 1 1 A 50 50 ASP HA H 139 4.618 4.258 0.360 1
1 615 . 17 1 1 A 50 50 ASP C C 139 174.577 175.320 -0.743 1
1 616 . 17 1 1 A 50 50 ASP CA C 139 53.116 55.552 -2.436 1
1 617 . 17 1 1 A 50 50 ASP CB C 139 40.520 39.861 0.659 1
1 618 . 17 1 1 A 50 50 ASP N N 139 122.088 117.682 4.406 1
1 619 . 17 1 1 A 51 51 VAL H H 140 8.192 7.491 0.701 1
1 620 . 17 1 1 A 51 51 VAL HA H 140 4.299 4.158 0.141 1
1 628 . 17 1 1 A 51 51 VAL C C 140 175.867 175.323 0.544 1
1 629 . 17 1 1 A 51 51 VAL CA C 140 62.950 62.487 0.463 1
1 630 . 17 1 1 A 51 51 VAL CB C 140 33.230 32.107 1.123 1
1 632 . 17 1 1 A 51 51 VAL N N 140 121.167 119.336 1.831 1
1 633 . 17 1 1 A 52 52 CYS H H 141 8.391 8.715 -0.324 1
1 634 . 17 1 1 A 52 52 CYS HA H 141 5.247 5.219 0.028 1
1 637 . 17 1 1 A 52 52 CYS C C 141 172.778 174.254 -1.476 1
1 638 . 17 1 1 A 52 52 CYS CA C 141 56.480 58.234 -1.754 1
1 639 . 17 1 1 A 52 52 CYS CB C 141 31.960 29.284 2.676 1
1 640 . 17 1 1 A 52 52 CYS N N 141 121.884 127.142 -5.258 1
1 641 . 17 1 1 A 53 53 THR H H 142 8.777 8.918 -0.141 1
1 642 . 17 1 1 A 53 53 THR HA H 142 4.489 4.877 -0.388 1
1 648 . 17 1 1 A 53 53 THR C C 142 171.885 172.219 -0.334 1
1 649 . 17 1 1 A 53 53 THR CA C 142 62.070 61.327 0.743 1
1 650 . 17 1 1 A 53 53 THR CB C 142 71.390 71.417 -0.027 1
1 652 . 17 1 1 A 53 53 THR N N 142 118.132 118.744 -0.612 1
1 653 . 17 1 1 A 54 54 LEU H H 143 8.409 8.320 0.089 1
1 654 . 17 1 1 A 54 54 LEU HA H 143 4.276 4.287 -0.011 1
1 664 . 17 1 1 A 54 54 LEU C C 143 174.366 174.064 0.302 1
1 665 . 17 1 1 A 54 54 LEU CA C 143 54.330 52.941 1.389 1
1 666 . 17 1 1 A 54 54 LEU CB C 143 42.396 42.589 -0.193 1
1 670 . 17 1 1 A 54 54 LEU N N 143 127.980 127.877 0.103 1
1 671 . 17 1 1 A 55 55 PHE H H 144 8.646 8.564 0.082 1
1 672 . 17 1 1 A 55 55 PHE HA H 144 5.455 4.829 0.626 1
1 680 . 17 1 1 A 55 55 PHE C C 144 176.054 175.121 0.933 1
1 681 . 17 1 1 A 55 55 PHE CA C 144 55.250 56.924 -1.674 1
1 682 . 17 1 1 A 55 55 PHE CB C 144 44.100 40.674 3.426 1
1 686 . 17 1 1 A 55 55 PHE N N 144 122.010 126.905 -4.895 1
1 687 . 17 1 1 A 56 56 ASP H H 145 11.575 8.299 3.276 1
1 688 . 17 1 1 A 56 56 ASP HA H 145 4.416 4.408 0.008 1
1 691 . 17 1 1 A 56 56 ASP C C 145 176.748 177.514 -0.766 1
1 692 . 17 1 1 A 56 56 ASP CA C 145 55.840 54.734 1.106 1
1 693 . 17 1 1 A 56 56 ASP CB C 145 44.390 42.123 2.267 1
1 694 . 17 1 1 A 56 56 ASP N N 145 121.936 124.206 -2.270 1
1 695 . 17 1 1 A 57 57 ALA H H 146 8.508 8.742 -0.234 1
1 696 . 17 1 1 A 57 57 ALA HA H 146 3.797 4.007 -0.210 1
1 700 . 17 1 1 A 57 57 ALA C C 146 178.696 180.097 -1.401 1
1 701 . 17 1 1 A 57 57 ALA CA C 146 55.990 55.480 0.510 1
1 702 . 17 1 1 A 57 57 ALA CB C 146 18.840 18.141 0.699 1
1 703 . 17 1 1 A 57 57 ALA N N 146 130.243 129.422 0.821 1
1 704 . 17 1 1 A 58 58 ALA H H 147 8.378 7.556 0.822 1
1 705 . 17 1 1 A 58 58 ALA HA H 147 4.078 4.220 -0.142 1
1 709 . 17 1 1 A 58 58 ALA C C 147 181.091 179.023 2.068 1
1 710 . 17 1 1 A 58 58 ALA CA C 147 54.770 54.952 -0.182 1
1 711 . 17 1 1 A 58 58 ALA CB C 147 17.700 18.445 -0.745 1
1 712 . 17 1 1 A 58 58 ALA N N 147 121.997 119.277 2.720 1
1 713 . 17 1 1 A 59 59 ALA H H 148 9.138 7.895 1.243 1
1 714 . 17 1 1 A 59 59 ALA HA H 148 3.975 4.023 -0.048 1
1 718 . 17 1 1 A 59 59 ALA C C 148 180.508 179.842 0.666 1
1 719 . 17 1 1 A 59 59 ALA CA C 148 54.840 55.057 -0.217 1
1 720 . 17 1 1 A 59 59 ALA CB C 148 18.600 18.471 0.129 1
1 721 . 17 1 1 A 59 59 ALA N N 148 123.595 120.477 3.118 1
1 722 . 17 1 1 A 60 60 PHE H H 149 8.814 8.110 0.704 1
1 723 . 17 1 1 A 60 60 PHE HA H 149 3.722 4.018 -0.296 1
1 731 . 17 1 1 A 60 60 PHE C C 149 176.773 177.590 -0.817 1
1 732 . 17 1 1 A 60 60 PHE CA C 149 62.030 61.491 0.539 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 149 120.354 119.709 0.645 1
1 738 . 17 1 1 A 61 61 SER H H 150 8.276 8.097 0.179 1
1 739 . 17 1 1 A 61 61 SER HA H 150 3.880 4.227 -0.347 1
1 742 . 17 1 1 A 61 61 SER C C 150 177.691 177.003 0.688 1
1 743 . 17 1 1 A 61 61 SER CA C 150 62.190 61.171 1.019 1
1 744 . 17 1 1 A 61 61 SER CB C 150 63.016 63.241 -0.225 1
1 745 . 17 1 1 A 61 61 SER N N 150 112.086 114.112 -2.026 1
1 746 . 17 1 1 A 62 62 ARG H H 151 7.829 7.831 -0.002 1
1 747 . 17 1 1 A 62 62 ARG HA H 151 3.971 4.059 -0.088 1
1 754 . 17 1 1 A 62 62 ARG C C 151 178.287 178.661 -0.374 1
1 755 . 17 1 1 A 62 62 ARG CA C 151 59.340 59.164 0.176 1
1 756 . 17 1 1 A 62 62 ARG CB C 151 29.760 29.757 0.003 1
1 759 . 17 1 1 A 62 62 ARG N N 151 121.090 121.754 -0.664 1
1 760 . 17 1 1 A 63 63 LEU H H 152 7.390 7.701 -0.311 1
1 761 . 17 1 1 A 63 63 LEU HA H 152 3.791 3.930 -0.139 1
1 771 . 17 1 1 A 63 63 LEU C C 152 179.106 179.008 0.098 1
1 772 . 17 1 1 A 63 63 LEU CA C 152 58.900 57.890 1.010 1
1 773 . 17 1 1 A 63 63 LEU CB C 152 41.140 41.353 -0.213 1
1 777 . 17 1 1 A 63 63 LEU N N 152 121.129 119.330 1.799 1
1 778 . 17 1 1 A 64 64 VAL H H 153 7.552 8.045 -0.493 1
1 779 . 17 1 1 A 64 64 VAL HA H 153 3.411 3.521 -0.110 1
1 787 . 17 1 1 A 64 64 VAL C C 153 180.595 178.906 1.689 1
1 788 . 17 1 1 A 64 64 VAL CA C 153 65.644 66.308 -0.664 1
1 789 . 17 1 1 A 64 64 VAL CB C 153 31.410 31.510 -0.100 1
1 792 . 17 1 1 A 64 64 VAL N N 153 118.280 118.706 -0.426 1
1 793 . 17 1 1 A 65 65 GLY H H 154 8.061 8.185 -0.124 1
1 794 . 17 1 1 A 65 65 GLY HA2 H 154 3.846 3.881 -0.035 1
1 795 . 17 1 1 A 65 65 GLY HA3 H 154 3.809 3.881 -0.072 1
1 796 . 17 1 1 A 65 65 GLY C C 154 175.235 175.112 0.123 1
1 797 . 17 1 1 A 65 65 GLY CA C 154 46.630 46.701 -0.071 1
1 798 . 17 1 1 A 65 65 GLY N N 154 108.622 107.738 0.884 1
1 799 . 17 1 1 A 66 66 GLU H H 155 7.528 7.506 0.022 1
1 800 . 17 1 1 A 66 66 GLU HA H 155 4.228 4.373 -0.145 1
1 805 . 17 1 1 A 66 66 GLU C C 155 176.761 177.067 -0.306 1
1 806 . 17 1 1 A 66 66 GLU CA C 155 56.590 56.169 0.421 1
1 807 . 17 1 1 A 66 66 GLU CB C 155 30.490 30.686 -0.196 1
1 809 . 17 1 1 A 66 66 GLU N N 155 118.361 118.152 0.209 1
1 810 . 17 1 1 A 67 67 GLY H H 156 7.884 7.819 0.065 1
1 811 . 17 1 1 A 67 67 GLY HA2 H 156 3.918 3.892 0.026 1
1 812 . 17 1 1 A 67 67 GLY HA3 H 156 3.747 3.904 -0.157 1
1 813 . 17 1 1 A 67 67 GLY C C 156 174.788 174.500 0.288 1
1 814 . 17 1 1 A 67 67 GLY CA C 156 45.890 46.385 -0.495 1
1 815 . 17 1 1 A 67 67 GLY N N 156 108.465 109.510 -1.045 1
1 816 . 17 1 1 A 68 68 LEU H H 157 7.332 8.101 -0.769 1
1 817 . 17 1 1 A 68 68 LEU HA H 157 4.361 4.648 -0.287 1
1 827 . 17 1 1 A 68 68 LEU CA C 157 53.060 51.849 1.211 1
1 828 . 17 1 1 A 68 68 LEU CB C 157 41.100 42.439 -1.339 1
1 832 . 17 1 1 A 68 68 LEU N N 157 121.920 121.596 0.324 1
1 833 . 17 1 1 A 69 69 PRO HA H 158 4.485 4.603 -0.118 1
1 840 . 17 1 1 A 69 69 PRO C C 158 174.602 176.282 -1.680 1
1 841 . 17 1 1 A 69 69 PRO CA C 158 61.556 62.188 -0.632 1
1 842 . 17 1 1 A 69 69 PRO CB C 158 32.370 32.811 -0.441 1
1 845 . 17 1 1 A 70 70 HIS H H 159 8.759 8.568 0.191 1
1 846 . 17 1 1 A 70 70 HIS HA H 159 3.947 4.440 -0.493 1
1 852 . 17 1 1 A 70 70 HIS CA C 159 56.250 55.115 1.135 1
1 853 . 17 1 1 A 70 70 HIS CB C 159 32.280 31.042 1.238 1
1 856 . 17 1 1 A 70 70 HIS N N 159 119.423 121.549 -2.126 1
1 857 . 17 1 1 A 71 71 PRO HA H 160 4.424 4.349 0.075 1
1 864 . 17 1 1 A 71 71 PRO C C 160 177.567 177.940 -0.373 1
1 865 . 17 1 1 A 71 71 PRO CA C 160 64.574 64.468 0.106 1
1 866 . 17 1 1 A 71 71 PRO CB C 160 32.340 31.724 0.616 1
1 869 . 17 1 1 A 72 72 LEU H H 161 10.123 7.537 2.586 1
1 870 . 17 1 1 A 72 72 LEU HA H 161 4.778 4.365 0.413 1
1 880 . 17 1 1 A 72 72 LEU C C 161 178.721 178.479 0.242 1
1 881 . 17 1 1 A 72 72 LEU CA C 161 55.800 56.583 -0.783 1
1 882 . 17 1 1 A 72 72 LEU CB C 161 42.440 42.961 -0.521 1
1 886 . 17 1 1 A 72 72 LEU N N 161 117.374 117.375 -0.001 1
1 887 . 17 1 1 A 73 73 THR H H 162 7.523 8.078 -0.555 1
1 888 . 17 1 1 A 73 73 THR HA H 162 4.291 4.491 -0.200 1
1 893 . 17 1 1 A 73 73 THR C C 162 175.557 174.160 1.397 1
1 894 . 17 1 1 A 73 73 THR CA C 162 61.440 63.189 -1.749 1
1 895 . 17 1 1 A 73 73 THR CB C 162 70.500 69.419 1.081 1
1 897 . 17 1 1 A 73 73 THR N N 162 107.787 111.779 -3.992 1
1 898 . 17 1 1 A 74 74 ARG H H 163 8.361 7.981 0.380 1
1 899 . 17 1 1 A 74 74 ARG HA H 163 3.836 4.217 -0.381 1
1 906 . 17 1 1 A 74 74 ARG C C 163 174.701 174.974 -0.273 1
1 907 . 17 1 1 A 74 74 ARG CA C 163 57.980 57.554 0.426 1
1 908 . 17 1 1 A 74 74 ARG CB C 163 26.770 27.083 -0.313 1
1 911 . 17 1 1 A 74 74 ARG N N 163 115.130 118.354 -3.224 1
1 912 . 17 1 1 A 75 75 GLU H H 164 7.430 8.049 -0.619 1
1 913 . 17 1 1 A 75 75 GLU HA H 164 4.636 4.563 0.073 1
1 918 . 17 1 1 A 75 75 GLU CA C 164 53.699 54.708 -1.009 1
1 919 . 17 1 1 A 75 75 GLU CB C 164 29.550 28.767 0.783 1
1 921 . 17 1 1 A 75 75 GLU N N 164 120.076 118.616 1.460 1
1 922 . 17 1 1 A 76 76 PRO HA H 165 4.272 4.529 -0.257 1
1 929 . 17 1 1 A 76 76 PRO C C 165 176.649 177.031 -0.382 1
1 930 . 17 1 1 A 76 76 PRO CA C 165 63.204 62.989 0.215 1
1 931 . 17 1 1 A 76 76 PRO CB C 165 31.680 31.672 0.008 1
1 934 . 17 1 1 A 77 77 ILE H H 166 8.812 8.224 0.588 1
1 935 . 17 1 1 A 77 77 ILE HA H 166 3.838 4.335 -0.497 1
1 945 . 17 1 1 A 77 77 ILE C C 166 175.235 176.142 -0.907 1
1 946 . 17 1 1 A 77 77 ILE CA C 166 62.816 61.577 1.239 1
1 947 . 17 1 1 A 77 77 ILE CB C 166 37.750 38.779 -1.029 1
1 951 . 17 1 1 A 77 77 ILE N N 166 123.831 124.135 -0.304 1
1 952 . 17 1 1 A 78 78 THR H H 167 6.625 8.469 -1.844 1
1 953 . 17 1 1 A 78 78 THR HA H 167 4.632 5.048 -0.416 1
1 958 . 17 1 1 A 78 78 THR C C 167 174.143 174.398 -0.255 1
1 959 . 17 1 1 A 78 78 THR CA C 167 58.750 60.166 -1.416 1
1 960 . 17 1 1 A 78 78 THR CB C 167 71.320 70.773 0.547 1
1 962 . 17 1 1 A 78 78 THR N N 167 115.293 117.355 -2.062 1
1 963 . 17 1 1 A 79 79 ALA H H 168 9.088 8.994 0.094 1
1 964 . 17 1 1 A 79 79 ALA HA H 168 3.916 4.114 -0.198 1
1 968 . 17 1 1 A 79 79 ALA C C 168 179.788 179.464 0.324 1
1 969 . 17 1 1 A 79 79 ALA CA C 168 55.480 55.095 0.385 1
1 970 . 17 1 1 A 79 79 ALA CB C 168 17.630 18.377 -0.747 1
1 971 . 17 1 1 A 79 79 ALA N N 168 122.102 127.750 -5.648 1
1 972 . 17 1 1 A 80 80 SER H H 169 7.988 7.508 0.480 1
1 973 . 17 1 1 A 80 80 SER HA H 169 4.058 4.215 -0.157 1
1 976 . 17 1 1 A 80 80 SER C C 169 176.029 176.748 -0.719 1
1 977 . 17 1 1 A 80 80 SER CA C 169 60.750 61.527 -0.777 1
1 978 . 17 1 1 A 80 80 SER CB C 169 62.510 63.011 -0.501 1
1 979 . 17 1 1 A 80 80 SER N N 169 109.541 113.243 -3.702 1
1 980 . 17 1 1 A 81 81 ILE H H 170 6.968 7.635 -0.667 1
1 981 . 17 1 1 A 81 81 ILE HA H 170 4.315 4.224 0.091 1
1 991 . 17 1 1 A 81 81 ILE C C 170 174.242 175.576 -1.334 1
1 992 . 17 1 1 A 81 81 ILE CA C 170 62.296 62.455 -0.159 1
1 993 . 17 1 1 A 81 81 ILE CB C 170 37.686 37.849 -0.163 1
1 997 . 17 1 1 A 81 81 ILE N N 170 112.476 113.506 -1.030 1
1 998 . 17 1 1 A 82 82 ILE H H 171 7.345 7.429 -0.084 1
1 999 . 17 1 1 A 82 82 ILE HA H 171 4.339 4.689 -0.350 1
1 1009 . 17 1 1 A 82 82 ILE C C 171 174.999 174.597 0.402 1
1 1010 . 17 1 1 A 82 82 ILE CA C 171 61.150 60.174 0.976 1
1 1011 . 17 1 1 A 82 82 ILE CB C 171 37.230 40.576 -3.346 1
1 1015 . 17 1 1 A 82 82 ILE N N 171 124.260 124.593 -0.333 1
1 1016 . 17 1 1 A 83 83 VAL H H 172 7.923 9.068 -1.145 1
1 1017 . 17 1 1 A 83 83 VAL HA H 172 4.673 5.023 -0.350 1
1 1025 . 17 1 1 A 83 83 VAL C C 172 174.887 175.308 -0.421 1
1 1026 . 17 1 1 A 83 83 VAL CA C 172 59.340 59.033 0.307 1
1 1027 . 17 1 1 A 83 83 VAL CB C 172 34.840 35.978 -1.138 1
1 1030 . 17 1 1 A 83 83 VAL N N 172 120.931 122.050 -1.119 1
1 1031 . 17 1 1 A 84 84 LYS H H 173 8.406 8.708 -0.302 1
1 1032 . 17 1 1 A 84 84 LYS HA H 173 4.410 4.664 -0.254 1
1 1041 . 17 1 1 A 84 84 LYS C C 173 178.734 178.518 0.216 1
1 1042 . 17 1 1 A 84 84 LYS CA C 173 56.360 55.062 1.298 1
1 1043 . 17 1 1 A 84 84 LYS CB C 173 33.100 33.225 -0.125 1
1 1047 . 17 1 1 A 84 84 LYS N N 173 121.251 120.738 0.513 1
1 1048 . 17 1 1 A 85 85 HIS H H 174 9.221 9.087 0.134 1
1 1049 . 17 1 1 A 85 85 HIS HA H 174 4.024 3.938 0.086 1
1 1053 . 17 1 1 A 85 85 HIS C C 174 177.183 176.690 0.493 1
1 1054 . 17 1 1 A 85 85 HIS CA C 174 59.460 60.301 -0.841 1
1 1055 . 17 1 1 A 85 85 HIS CB C 174 27.920 29.447 -1.527 1
1 1057 . 17 1 1 A 85 85 HIS N N 174 121.545 122.626 -1.081 1
1 1058 . 17 1 1 A 86 86 GLU H H 175 8.699 8.723 -0.024 1
1 1059 . 17 1 1 A 86 86 GLU HA H 175 3.900 3.973 -0.073 1
1 1064 . 17 1 1 A 86 86 GLU C C 175 177.220 177.368 -0.148 1
1 1065 . 17 1 1 A 86 86 GLU CA C 175 58.420 58.175 0.245 1
1 1066 . 17 1 1 A 86 86 GLU CB C 175 28.690 28.782 -0.092 1
1 1068 . 17 1 1 A 86 86 GLU N N 175 118.011 116.177 1.834 1
1 1069 . 17 1 1 A 87 87 GLU H H 176 7.621 7.673 -0.052 1
1 1070 . 17 1 1 A 87 87 GLU HA H 176 4.177 4.329 -0.152 1
1 1075 . 17 1 1 A 87 87 GLU C C 176 175.222 176.169 -0.947 1
1 1076 . 17 1 1 A 87 87 GLU CA C 176 56.390 56.434 -0.044 1
1 1077 . 17 1 1 A 87 87 GLU CB C 176 30.430 30.168 0.262 1
1 1079 . 17 1 1 A 87 87 GLU N N 176 116.753 119.002 -2.249 1
1 1080 . 17 1 1 A 88 88 CYS H H 177 7.239 7.582 -0.343 1
1 1081 . 17 1 1 A 88 88 CYS HA H 177 5.148 5.099 0.049 1
1 1084 . 17 1 1 A 88 88 CYS C C 177 173.249 172.994 0.255 1
1 1085 . 17 1 1 A 88 88 CYS CA C 177 57.240 56.779 0.461 1
1 1086 . 17 1 1 A 88 88 CYS CB C 177 31.020 30.884 0.136 1
1 1087 . 17 1 1 A 88 88 CYS N N 177 116.096 115.317 0.779 1
1 1088 . 17 1 1 A 89 89 ILE H H 178 8.912 8.511 0.401 1
1 1089 . 17 1 1 A 89 89 ILE HA H 178 4.580 4.850 -0.270 1
1 1099 . 17 1 1 A 89 89 ILE C C 178 173.386 174.149 -0.763 1
1 1100 . 17 1 1 A 89 89 ILE CA C 178 59.270 58.836 0.434 1
1 1101 . 17 1 1 A 89 89 ILE CB C 178 42.990 41.358 1.632 1
1 1105 . 17 1 1 A 89 89 ILE N N 178 119.490 118.654 0.836 1
1 1106 . 17 1 1 A 90 90 TYR H H 179 9.047 8.749 0.298 1
1 1107 . 17 1 1 A 90 90 TYR HA H 179 3.753 4.068 -0.315 1
1 1112 . 17 1 1 A 90 90 TYR C C 179 173.932 174.294 -0.362 1
1 1113 . 17 1 1 A 90 90 TYR CA C 179 59.860 57.433 2.427 1
1 1114 . 17 1 1 A 90 90 TYR CB C 179 37.530 37.759 -0.229 1
1 1116 . 17 1 1 A 90 90 TYR N N 179 126.270 122.193 4.077 1
1 1117 . 17 1 1 A 91 91 ASP H H 180 7.462 8.505 -1.043 1
1 1118 . 17 1 1 A 91 91 ASP HA H 180 4.639 4.618 0.021 1
1 1121 . 17 1 1 A 91 91 ASP C C 180 175.297 176.241 -0.944 1
1 1122 . 17 1 1 A 91 91 ASP CA C 180 52.496 52.966 -0.470 1
1 1123 . 17 1 1 A 91 91 ASP CB C 180 43.380 42.052 1.328 1
1 1124 . 17 1 1 A 91 91 ASP N N 180 129.593 125.912 3.681 1
1 1125 . 17 1 1 A 92 92 ASP H H 181 8.719 9.055 -0.336 1
1 1126 . 17 1 1 A 92 92 ASP HA H 181 4.109 4.311 -0.202 1
1 1129 . 17 1 1 A 92 92 ASP C C 181 177.555 177.475 0.080 1
1 1130 . 17 1 1 A 92 92 ASP CA C 181 56.390 56.462 -0.072 1
1 1131 . 17 1 1 A 92 92 ASP CB C 181 41.330 40.656 0.674 1
1 1132 . 17 1 1 A 92 92 ASP N N 181 125.691 127.992 -2.301 1
1 1133 . 17 1 1 A 93 93 THR H H 182 8.271 7.455 0.816 1
1 1134 . 17 1 1 A 93 93 THR HA H 182 4.036 3.983 0.053 1
1 1139 . 17 1 1 A 93 93 THR C C 182 176.289 176.527 -0.238 1
1 1140 . 17 1 1 A 93 93 THR CA C 182 65.054 64.897 0.157 1
1 1141 . 17 1 1 A 93 93 THR CB C 182 68.560 68.900 -0.340 1
1 1143 . 17 1 1 A 93 93 THR N N 182 114.813 113.939 0.874 1
1 1144 . 17 1 1 A 94 94 ARG H H 183 7.753 7.382 0.371 1
1 1145 . 17 1 1 A 94 94 ARG HA H 183 4.139 4.204 -0.065 1
1 1152 . 17 1 1 A 94 94 ARG C C 183 176.897 177.109 -0.212 1
1 1153 . 17 1 1 A 94 94 ARG CA C 183 55.350 56.354 -1.004 1
1 1154 . 17 1 1 A 94 94 ARG CB C 183 30.930 30.768 0.162 1
1 1157 . 17 1 1 A 94 94 ARG N N 183 120.101 117.917 2.184 1
1 1158 . 17 1 1 A 95 95 GLY H H 184 8.112 8.820 -0.708 1
1 1159 . 17 1 1 A 95 95 GLY HA2 H 184 3.838 3.849 -0.011 1
1 1160 . 17 1 1 A 95 95 GLY HA3 H 184 3.670 3.862 -0.192 1
1 1161 . 17 1 1 A 95 95 GLY C C 184 173.659 173.379 0.280 1
1 1162 . 17 1 1 A 95 95 GLY CA C 184 46.040 45.669 0.371 1
1 1163 . 17 1 1 A 95 95 GLY N N 184 108.106 108.795 -0.689 1
1 1164 . 17 1 1 A 96 96 ASN H H 185 6.833 7.483 -0.650 1
1 1165 . 17 1 1 A 96 96 ASN HA H 185 4.944 5.304 -0.360 1
1 1170 . 17 1 1 A 96 96 ASN C C 185 174.267 173.960 0.307 1
1 1171 . 17 1 1 A 96 96 ASN CA C 185 52.560 51.154 1.406 1
1 1172 . 17 1 1 A 96 96 ASN CB C 185 45.890 42.850 3.040 1
1 1173 . 17 1 1 A 96 96 ASN N N 185 113.392 117.414 -4.022 1
1 1175 . 17 1 1 A 97 97 PHE H H 186 9.108 8.990 0.118 1
1 1176 . 17 1 1 A 97 97 PHE HA H 186 4.782 4.919 -0.137 1
1 1183 . 17 1 1 A 97 97 PHE C C 186 174.862 175.806 -0.944 1
1 1184 . 17 1 1 A 97 97 PHE CA C 186 60.056 59.077 0.979 1
1 1185 . 17 1 1 A 97 97 PHE CB C 186 40.180 39.291 0.889 1
1 1188 . 17 1 1 A 97 97 PHE N N 186 118.741 119.540 -0.799 1
1 1189 . 17 1 1 A 98 98 ILE H H 187 8.933 8.676 0.257 1
1 1190 . 17 1 1 A 98 98 ILE HA H 187 5.458 4.954 0.504 1
1 1200 . 17 1 1 A 98 98 ILE C C 187 176.041 175.146 0.895 1
1 1201 . 17 1 1 A 98 98 ILE CA C 187 57.610 59.132 -1.522 1
1 1202 . 17 1 1 A 98 98 ILE CB C 187 42.070 41.868 0.202 1
1 1206 . 17 1 1 A 98 98 ILE N N 187 117.857 118.889 -1.032 1
1 1207 . 17 1 1 A 99 99 ILE H H 188 8.284 8.614 -0.330 1
1 1208 . 17 1 1 A 99 99 ILE HA H 188 4.341 4.209 0.132 1
1 1218 . 17 1 1 A 99 99 ILE C C 188 176.413 176.423 -0.010 1
1 1219 . 17 1 1 A 99 99 ILE CA C 188 59.190 60.874 -1.684 1
1 1220 . 17 1 1 A 99 99 ILE CB C 188 37.940 38.123 -0.183 1
1 1224 . 17 1 1 A 99 99 ILE N N 188 121.796 122.923 -1.127 1
1 1225 . 17 1 1 A 100 100 LYS H H 189 8.463 8.223 0.240 1
1 1226 . 17 1 1 A 100 100 LYS HA H 189 4.040 4.202 -0.162 1
1 1235 . 17 1 1 A 100 100 LYS C C 189 176.848 177.155 -0.307 1
1 1236 . 17 1 1 A 100 100 LYS CA C 189 57.241 57.414 -0.173 1
1 1237 . 17 1 1 A 100 100 LYS CB C 189 33.400 33.194 0.206 1
1 1241 . 17 1 1 A 100 100 LYS N N 189 127.995 125.140 2.855 1
1 1242 . 17 1 1 A 101 101 GLY H H 190 8.346 8.450 -0.104 1
1 1243 . 17 1 1 A 101 101 GLY HA2 H 190 3.947 4.161 -0.214 1
1 1244 . 17 1 1 A 101 101 GLY HA3 H 190 3.813 4.163 -0.350 1
1 1245 . 17 1 1 A 101 101 GLY C C 190 172.902 173.976 -1.074 1
1 1246 . 17 1 1 A 101 101 GLY CA C 190 44.920 45.694 -0.774 1
1 1247 . 17 1 1 A 101 101 GLY N N 190 110.882 111.920 -1.038 1
1 7 . 18 1 1 A 2 2 GLN H H 91 8.786 8.115 0.671 1
1 8 . 18 1 1 A 2 2 GLN HA H 91 4.005 4.065 -0.060 1
1 15 . 18 1 1 A 2 2 GLN C C 91 177.270 178.450 -1.180 1
1 16 . 18 1 1 A 2 2 GLN CA C 91 58.220 59.056 -0.836 1
1 17 . 18 1 1 A 2 2 GLN CB C 91 28.650 28.582 0.068 1
1 19 . 18 1 1 A 2 2 GLN N N 91 121.993 120.697 1.296 1
1 21 . 18 1 1 A 3 3 GLU H H 92 8.430 8.238 0.192 1
1 22 . 18 1 1 A 3 3 GLU HA H 92 4.007 4.120 -0.113 1
1 27 . 18 1 1 A 3 3 GLU C C 92 178.287 178.511 -0.224 1
1 28 . 18 1 1 A 3 3 GLU CA C 92 59.490 59.149 0.341 1
1 29 . 18 1 1 A 3 3 GLU CB C 92 29.506 29.430 0.076 1
1 31 . 18 1 1 A 3 3 GLU N N 92 120.195 118.632 1.563 1
1 32 . 18 1 1 A 4 4 SER H H 93 8.209 8.001 0.208 1
1 33 . 18 1 1 A 4 4 SER HA H 93 4.272 4.181 0.091 1
1 36 . 18 1 1 A 4 4 SER C C 93 177.369 176.343 1.026 1
1 37 . 18 1 1 A 4 4 SER CA C 93 61.044 62.493 -1.449 1
1 38 . 18 1 1 A 4 4 SER CB C 93 62.950 63.135 -0.185 1
1 39 . 18 1 1 A 4 4 SER N N 93 115.524 116.512 -0.988 1
1 40 . 18 1 1 A 5 5 ILE H H 94 8.080 7.681 0.399 1
1 41 . 18 1 1 A 5 5 ILE HA H 94 3.530 3.627 -0.097 1
1 51 . 18 1 1 A 5 5 ILE C C 94 177.778 177.813 -0.035 1
1 52 . 18 1 1 A 5 5 ILE CA C 94 65.710 65.291 0.419 1
1 53 . 18 1 1 A 5 5 ILE CB C 94 37.800 37.332 0.468 1
1 57 . 18 1 1 A 5 5 ILE N N 94 124.148 121.294 2.854 1
1 58 . 18 1 1 A 6 6 GLN H H 95 8.374 8.427 -0.053 1
1 59 . 18 1 1 A 6 6 GLN HA H 95 4.125 3.966 0.159 1
1 66 . 18 1 1 A 6 6 GLN C C 95 179.726 179.257 0.469 1
1 67 . 18 1 1 A 6 6 GLN CA C 95 59.190 59.214 -0.024 1
1 68 . 18 1 1 A 6 6 GLN CB C 95 27.060 28.274 -1.214 1
1 70 . 18 1 1 A 6 6 GLN N N 95 118.257 118.575 -0.318 1
1 72 . 18 1 1 A 7 7 ASN H H 96 8.456 7.745 0.711 1
1 73 . 18 1 1 A 7 7 ASN HA H 96 4.446 4.502 -0.056 1
1 78 . 18 1 1 A 7 7 ASN C C 96 177.257 178.358 -1.101 1
1 79 . 18 1 1 A 7 7 ASN CA C 96 56.020 56.353 -0.333 1
1 80 . 18 1 1 A 7 7 ASN CB C 96 38.126 37.988 0.138 1
1 81 . 18 1 1 A 7 7 ASN N N 96 118.597 118.358 0.239 1
1 83 . 18 1 1 A 8 8 LYS H H 97 7.732 7.583 0.149 1
1 84 . 18 1 1 A 8 8 LYS HA H 97 4.129 4.111 0.018 1
1 93 . 18 1 1 A 8 8 LYS C C 97 179.143 179.533 -0.390 1
1 94 . 18 1 1 A 8 8 LYS CA C 97 59.126 59.829 -0.703 1
1 95 . 18 1 1 A 8 8 LYS CB C 97 32.070 32.630 -0.560 1
1 99 . 18 1 1 A 8 8 LYS N N 97 122.381 118.515 3.866 1
1 100 . 18 1 1 A 9 9 ILE H H 98 8.452 8.174 0.278 1
1 101 . 18 1 1 A 9 9 ILE HA H 98 3.480 3.786 -0.306 1
1 111 . 18 1 1 A 9 9 ILE C C 98 177.406 178.315 -0.909 1
1 112 . 18 1 1 A 9 9 ILE CA C 98 66.430 65.384 1.046 1
1 113 . 18 1 1 A 9 9 ILE CB C 98 37.980 37.699 0.281 1
1 117 . 18 1 1 A 9 9 ILE N N 98 119.950 120.891 -0.941 1
1 118 . 18 1 1 A 10 10 SER H H 99 7.924 7.797 0.127 1
1 119 . 18 1 1 A 10 10 SER HA H 99 3.983 4.170 -0.187 1
1 122 . 18 1 1 A 10 10 SER C C 99 176.327 176.560 -0.233 1
1 123 . 18 1 1 A 10 10 SER CA C 99 61.990 61.384 0.606 1
1 124 . 18 1 1 A 10 10 SER CB C 99 62.790 63.055 -0.265 1
1 125 . 18 1 1 A 10 10 SER N N 99 113.568 116.599 -3.031 1
1 126 . 18 1 1 A 11 11 GLN H H 100 7.832 7.223 0.609 1
1 127 . 18 1 1 A 11 11 GLN HA H 100 4.238 4.265 -0.027 1
1 134 . 18 1 1 A 11 11 GLN C C 100 178.088 177.092 0.996 1
1 135 . 18 1 1 A 11 11 GLN CA C 100 57.900 58.085 -0.185 1
1 136 . 18 1 1 A 11 11 GLN CB C 100 29.790 28.599 1.191 1
1 138 . 18 1 1 A 11 11 GLN N N 100 117.487 119.881 -2.394 1
1 140 . 18 1 1 A 12 12 CYS H H 101 7.920 7.911 0.009 1
1 141 . 18 1 1 A 12 12 CYS HA H 101 4.657 4.625 0.032 1
1 144 . 18 1 1 A 12 12 CYS C C 101 175.446 174.763 0.683 1
1 145 . 18 1 1 A 12 12 CYS CA C 101 60.654 59.327 1.327 1
1 146 . 18 1 1 A 12 12 CYS CB C 101 29.310 28.512 0.798 1
1 147 . 18 1 1 A 12 12 CYS N N 101 114.221 116.472 -2.251 1
1 148 . 18 1 1 A 13 13 LYS H H 102 8.029 7.303 0.726 1
1 149 . 18 1 1 A 13 13 LYS HA H 102 5.069 4.784 0.285 1
1 158 . 18 1 1 A 13 13 LYS C C 102 174.800 176.203 -1.403 1
1 159 . 18 1 1 A 13 13 LYS CA C 102 56.394 55.921 0.473 1
1 160 . 18 1 1 A 13 13 LYS CB C 102 32.770 33.473 -0.703 1
1 164 . 18 1 1 A 13 13 LYS N N 102 124.129 119.153 4.976 1
1 165 . 18 1 1 A 14 14 PHE H H 103 8.737 8.480 0.257 1
1 166 . 18 1 1 A 14 14 PHE HA H 103 5.059 5.113 -0.054 1
1 174 . 18 1 1 A 14 14 PHE C C 103 173.560 173.278 0.282 1
1 175 . 18 1 1 A 14 14 PHE CA C 103 55.470 55.990 -0.520 1
1 176 . 18 1 1 A 14 14 PHE CB C 103 41.760 41.219 0.541 1
1 180 . 18 1 1 A 14 14 PHE N N 103 118.661 116.596 2.065 1
1 181 . 18 1 1 A 15 15 SER H H 104 8.826 8.842 -0.016 1
1 182 . 18 1 1 A 15 15 SER HA H 104 4.602 4.678 -0.076 1
1 185 . 18 1 1 A 15 15 SER C C 104 173.795 173.688 0.107 1
1 186 . 18 1 1 A 15 15 SER CA C 104 58.610 58.935 -0.325 1
1 187 . 18 1 1 A 15 15 SER CB C 104 62.690 62.341 0.349 1
1 188 . 18 1 1 A 15 15 SER N N 104 117.781 116.948 0.833 1
1 189 . 18 1 1 A 16 16 VAL H H 105 7.784 8.174 -0.390 1
1 190 . 18 1 1 A 16 16 VAL HA H 105 3.370 4.000 -0.630 1
1 198 . 18 1 1 A 16 16 VAL C C 105 174.987 175.351 -0.364 1
1 199 . 18 1 1 A 16 16 VAL CA C 105 63.580 62.981 0.599 1
1 200 . 18 1 1 A 16 16 VAL CB C 105 31.410 30.832 0.578 1
1 203 . 18 1 1 A 16 16 VAL N N 105 129.075 126.581 2.494 1
1 204 . 18 1 1 A 17 17 CYS H H 106 8.536 8.667 -0.131 1
1 205 . 18 1 1 A 17 17 CYS HA H 106 5.011 5.010 0.001 1
1 208 . 18 1 1 A 17 17 CYS CA C 106 55.260 56.316 -1.056 1
1 209 . 18 1 1 A 17 17 CYS CB C 106 28.210 28.606 -0.396 1
1 210 . 18 1 1 A 17 17 CYS N N 106 130.045 127.382 2.663 1
1 211 . 18 1 1 A 18 18 PRO HA H 107 3.991 4.396 -0.405 1
1 218 . 18 1 1 A 18 18 PRO C C 107 178.188 178.348 -0.160 1
1 219 . 18 1 1 A 18 18 PRO CA C 107 65.940 65.158 0.782 1
1 220 . 18 1 1 A 18 18 PRO CB C 107 32.000 32.126 -0.126 1
1 223 . 18 1 1 A 19 19 GLU H H 108 9.260 9.012 0.248 1
1 224 . 18 1 1 A 19 19 GLU HA H 108 4.119 4.080 0.039 1
1 229 . 18 1 1 A 19 19 GLU C C 108 178.721 178.473 0.248 1
1 230 . 18 1 1 A 19 19 GLU CA C 108 59.300 59.440 -0.140 1
1 231 . 18 1 1 A 19 19 GLU CB C 108 28.920 28.983 -0.063 1
1 233 . 18 1 1 A 19 19 GLU N N 108 118.270 116.184 2.086 1
1 234 . 18 1 1 A 20 20 ARG H H 109 7.672 7.526 0.146 1
1 235 . 18 1 1 A 20 20 ARG HA H 109 4.331 4.153 0.178 1
1 242 . 18 1 1 A 20 20 ARG C C 109 177.977 178.225 -0.248 1
1 243 . 18 1 1 A 20 20 ARG CA C 109 57.350 58.905 -1.555 1
1 244 . 18 1 1 A 20 20 ARG CB C 109 30.820 30.071 0.749 1
1 247 . 18 1 1 A 20 20 ARG N N 109 118.357 119.420 -1.063 1
1 248 . 18 1 1 A 21 21 LEU H H 110 7.601 7.863 -0.262 1
1 249 . 18 1 1 A 21 21 LEU HA H 110 4.380 4.309 0.071 1
1 259 . 18 1 1 A 21 21 LEU C C 110 176.562 176.287 0.275 1
1 260 . 18 1 1 A 21 21 LEU CA C 110 56.096 55.474 0.622 1
1 261 . 18 1 1 A 21 21 LEU CB C 110 44.016 42.075 1.941 1
1 265 . 18 1 1 A 21 21 LEU N N 110 118.626 117.803 0.823 1
1 266 . 18 1 1 A 22 22 GLN H H 111 7.750 7.500 0.250 1
1 267 . 18 1 1 A 22 22 GLN HA H 111 3.870 3.878 -0.008 1
1 274 . 18 1 1 A 22 22 GLN C C 111 173.336 174.035 -0.699 1
1 275 . 18 1 1 A 22 22 GLN CA C 111 56.510 57.075 -0.565 1
1 276 . 18 1 1 A 22 22 GLN CB C 111 26.800 26.402 0.398 1
1 278 . 18 1 1 A 22 22 GLN N N 111 113.926 115.576 -1.650 1
1 280 . 18 1 1 A 23 23 CYS H H 112 7.407 7.517 -0.110 1
1 281 . 18 1 1 A 23 23 CYS HA H 112 4.469 4.956 -0.487 1
1 284 . 18 1 1 A 23 23 CYS CA C 112 52.650 56.624 -3.974 1
1 285 . 18 1 1 A 23 23 CYS CB C 112 29.750 28.926 0.824 1
1 286 . 18 1 1 A 23 23 CYS N N 112 112.681 117.503 -4.822 1
1 287 . 18 1 1 A 24 24 PRO HA H 113 4.408 4.551 -0.143 1
1 294 . 18 1 1 A 24 24 PRO C C 113 178.175 177.239 0.936 1
1 295 . 18 1 1 A 24 24 PRO CA C 113 62.040 62.597 -0.557 1
1 296 . 18 1 1 A 24 24 PRO CB C 113 31.920 32.659 -0.739 1
1 299 . 18 1 1 A 25 25 LEU H H 114 8.593 8.410 0.183 1
1 300 . 18 1 1 A 25 25 LEU HA H 114 3.765 3.913 -0.148 1
1 310 . 18 1 1 A 25 25 LEU C C 114 179.950 178.936 1.014 1
1 311 . 18 1 1 A 25 25 LEU CA C 114 57.674 57.718 -0.044 1
1 312 . 18 1 1 A 25 25 LEU CB C 114 40.690 41.524 -0.834 1
1 316 . 18 1 1 A 25 25 LEU N N 114 123.729 123.195 0.534 1
1 317 . 18 1 1 A 26 26 GLU H H 115 9.108 8.537 0.571 1
1 318 . 18 1 1 A 26 26 GLU HA H 115 3.876 4.025 -0.149 1
1 323 . 18 1 1 A 26 26 GLU C C 115 177.505 178.604 -1.099 1
1 324 . 18 1 1 A 26 26 GLU CA C 115 59.410 59.314 0.096 1
1 325 . 18 1 1 A 26 26 GLU CB C 115 28.460 29.110 -0.650 1
1 327 . 18 1 1 A 26 26 GLU N N 115 116.817 117.557 -0.740 1
1 328 . 18 1 1 A 27 27 ALA H H 116 7.360 7.641 -0.281 1
1 329 . 18 1 1 A 27 27 ALA HA H 116 4.408 4.165 0.243 1
1 333 . 18 1 1 A 27 27 ALA C C 116 177.046 177.899 -0.853 1
1 334 . 18 1 1 A 27 27 ALA CA C 116 52.970 54.439 -1.469 1
1 335 . 18 1 1 A 27 27 ALA CB C 116 19.916 18.403 1.513 1
1 336 . 18 1 1 A 27 27 ALA N N 116 118.966 120.688 -1.722 1
1 337 . 18 1 1 A 28 28 ILE H H 117 7.168 6.891 0.277 1
1 338 . 18 1 1 A 28 28 ILE HA H 117 4.432 4.377 0.055 1
1 348 . 18 1 1 A 28 28 ILE C C 117 172.641 175.341 -2.700 1
1 349 . 18 1 1 A 28 28 ILE CA C 117 59.980 59.544 0.436 1
1 350 . 18 1 1 A 28 28 ILE CB C 117 37.350 37.630 -0.280 1
1 354 . 18 1 1 A 28 28 ILE N N 117 108.913 108.826 0.087 1
1 355 . 18 1 1 A 29 29 GLN H H 118 6.562 7.197 -0.635 1
1 356 . 18 1 1 A 29 29 GLN HA H 118 3.922 4.612 -0.690 1
1 363 . 18 1 1 A 29 29 GLN C C 118 175.049 175.709 -0.660 1
1 364 . 18 1 1 A 29 29 GLN CA C 118 54.596 55.406 -0.810 1
1 365 . 18 1 1 A 29 29 GLN CB C 118 29.570 29.864 -0.294 1
1 367 . 18 1 1 A 29 29 GLN N N 118 116.455 123.221 -6.766 1
1 369 . 18 1 1 A 30 30 CYS H H 119 8.138 8.516 -0.378 1
1 370 . 18 1 1 A 30 30 CYS HA H 119 4.580 4.588 -0.008 1
1 373 . 18 1 1 A 30 30 CYS CA C 119 57.810 57.245 0.565 1
1 374 . 18 1 1 A 30 30 CYS CB C 119 30.200 28.703 1.497 1
1 375 . 18 1 1 A 30 30 CYS N N 119 134.136 125.194 8.942 1
1 376 . 18 1 1 A 31 31 PRO HA H 120 4.424 4.443 -0.019 1
1 383 . 18 1 1 A 31 31 PRO C C 120 177.431 177.898 -0.467 1
1 384 . 18 1 1 A 31 31 PRO CA C 120 64.060 64.092 -0.032 1
1 385 . 18 1 1 A 31 31 PRO CB C 120 32.776 31.785 0.991 1
1 388 . 18 1 1 A 32 32 ILE H H 121 11.318 7.581 3.737 1
1 389 . 18 1 1 A 32 32 ILE HA H 121 4.038 3.952 0.086 1
1 399 . 18 1 1 A 32 32 ILE C C 121 178.485 177.828 0.657 1
1 400 . 18 1 1 A 32 32 ILE CA C 121 64.060 64.227 -0.167 1
1 401 . 18 1 1 A 32 32 ILE CB C 121 39.340 38.376 0.964 1
1 405 . 18 1 1 A 32 32 ILE N N 121 124.500 116.981 7.519 1
1 406 . 18 1 1 A 33 33 THR H H 122 9.928 7.337 2.591 1
1 407 . 18 1 1 A 33 33 THR HA H 122 4.048 4.362 -0.314 1
1 412 . 18 1 1 A 33 33 THR C C 122 175.793 175.143 0.650 1
1 413 . 18 1 1 A 33 33 THR CA C 122 62.990 61.768 1.222 1
1 414 . 18 1 1 A 33 33 THR CB C 122 70.300 70.267 0.033 1
1 416 . 18 1 1 A 33 33 THR N N 122 115.136 109.093 6.043 1
1 417 . 18 1 1 A 34 34 LEU H H 123 8.439 7.805 0.634 1
1 418 . 18 1 1 A 34 34 LEU HA H 123 3.912 3.917 -0.005 1
1 428 . 18 1 1 A 34 34 LEU C C 123 175.495 175.042 0.453 1
1 429 . 18 1 1 A 34 34 LEU CA C 123 56.290 56.131 0.159 1
1 430 . 18 1 1 A 34 34 LEU CB C 123 38.500 39.990 -1.490 1
1 434 . 18 1 1 A 34 34 LEU N N 123 117.230 118.738 -1.508 1
1 435 . 18 1 1 A 35 35 GLU H H 124 7.816 7.841 -0.025 1
1 436 . 18 1 1 A 35 35 GLU HA H 124 4.634 4.781 -0.147 1
1 441 . 18 1 1 A 35 35 GLU C C 124 174.838 174.791 0.047 1
1 442 . 18 1 1 A 35 35 GLU CA C 124 53.780 55.025 -1.245 1
1 443 . 18 1 1 A 35 35 GLU CB C 124 33.710 31.476 2.234 1
1 445 . 18 1 1 A 35 35 GLU N N 124 116.577 116.494 0.083 1
1 446 . 18 1 1 A 36 36 GLN H H 125 8.532 8.482 0.050 1
1 447 . 18 1 1 A 36 36 GLN HA H 125 4.958 4.768 0.190 1
1 454 . 18 1 1 A 36 36 GLN CA C 125 53.350 52.260 1.090 1
1 455 . 18 1 1 A 36 36 GLN CB C 125 29.950 29.644 0.306 1
1 457 . 18 1 1 A 36 36 GLN N N 125 123.034 122.559 0.475 1
1 459 . 18 1 1 A 37 37 PRO HA H 126 4.458 4.699 -0.241 1
1 466 . 18 1 1 A 37 37 PRO C C 126 176.314 175.880 0.434 1
1 467 . 18 1 1 A 37 37 PRO CA C 126 62.816 62.654 0.162 1
1 468 . 18 1 1 A 37 37 PRO CB C 126 33.070 33.121 -0.051 1
1 471 . 18 1 1 A 38 38 GLU H H 127 8.626 8.336 0.290 1
1 472 . 18 1 1 A 38 38 GLU HA H 127 4.274 4.305 -0.031 1
1 477 . 18 1 1 A 38 38 GLU C C 127 177.877 175.948 1.929 1
1 478 . 18 1 1 A 38 38 GLU CA C 127 58.730 56.518 2.212 1
1 479 . 18 1 1 A 38 38 GLU CB C 127 30.340 30.703 -0.363 1
1 481 . 18 1 1 A 38 38 GLU N N 127 120.691 117.713 2.978 1
1 482 . 18 1 1 A 39 39 LYS H H 128 7.861 7.835 0.026 1
1 483 . 18 1 1 A 39 39 LYS HA H 128 4.889 4.975 -0.086 1
1 492 . 18 1 1 A 39 39 LYS C C 128 175.446 175.028 0.418 1
1 493 . 18 1 1 A 39 39 LYS CA C 128 53.670 54.601 -0.931 1
1 494 . 18 1 1 A 39 39 LYS CB C 128 33.630 35.797 -2.167 1
1 498 . 18 1 1 A 39 39 LYS N N 128 117.878 117.587 0.291 1
1 499 . 18 1 1 A 40 40 GLY H H 129 8.426 7.806 0.620 1
1 500 . 18 1 1 A 40 40 GLY HA2 H 129 4.970 3.990 0.980 1
1 501 . 18 1 1 A 40 40 GLY HA3 H 129 2.458 4.117 -1.659 1
1 502 . 18 1 1 A 40 40 GLY C C 129 170.048 172.253 -2.205 1
1 503 . 18 1 1 A 40 40 GLY CA C 129 42.910 44.985 -2.075 1
1 504 . 18 1 1 A 40 40 GLY N N 129 112.604 106.461 6.143 1
1 505 . 18 1 1 A 41 41 ILE H H 130 8.596 9.121 -0.525 1
1 506 . 18 1 1 A 41 41 ILE HA H 130 4.636 5.125 -0.489 1
1 516 . 18 1 1 A 41 41 ILE C C 130 172.691 174.252 -1.561 1
1 517 . 18 1 1 A 41 41 ILE CA C 130 58.500 58.924 -0.424 1
1 518 . 18 1 1 A 41 41 ILE CB C 130 43.320 40.559 2.761 1
1 522 . 18 1 1 A 41 41 ILE N N 130 113.363 117.364 -4.001 1
1 523 . 18 1 1 A 42 42 PHE H H 131 8.994 8.961 0.033 1
1 524 . 18 1 1 A 42 42 PHE HA H 131 5.075 5.608 -0.533 1
1 532 . 18 1 1 A 42 42 PHE C C 131 175.111 174.842 0.269 1
1 533 . 18 1 1 A 42 42 PHE CA C 131 58.680 57.101 1.579 1
1 534 . 18 1 1 A 42 42 PHE CB C 131 42.220 40.725 1.495 1
1 538 . 18 1 1 A 42 42 PHE N N 131 125.156 121.443 3.713 1
1 539 . 18 1 1 A 43 43 VAL H H 132 8.399 9.213 -0.814 1
1 540 . 18 1 1 A 43 43 VAL HA H 132 4.920 4.742 0.178 1
1 548 . 18 1 1 A 43 43 VAL C C 132 178.175 175.308 2.867 1
1 549 . 18 1 1 A 43 43 VAL CA C 132 59.600 60.978 -1.378 1
1 550 . 18 1 1 A 43 43 VAL CB C 132 35.920 34.718 1.202 1
1 553 . 18 1 1 A 43 43 VAL N N 132 119.371 123.135 -3.764 1
1 554 . 18 1 1 A 44 44 LYS H H 133 10.041 8.428 1.613 1
1 555 . 18 1 1 A 44 44 LYS HA H 133 4.920 4.360 0.560 1
1 564 . 18 1 1 A 44 44 LYS C C 133 177.195 176.178 1.017 1
1 565 . 18 1 1 A 44 44 LYS CA C 133 57.310 56.495 0.815 1
1 566 . 18 1 1 A 44 44 LYS CB C 133 34.410 32.584 1.826 1
1 570 . 18 1 1 A 44 44 LYS N N 133 130.928 126.572 4.356 1
1 571 . 18 1 1 A 45 45 ASN H H 134 8.534 9.182 -0.648 1
1 572 . 18 1 1 A 45 45 ASN HA H 134 4.151 4.767 -0.616 1
1 577 . 18 1 1 A 45 45 ASN C C 134 174.217 175.358 -1.141 1
1 578 . 18 1 1 A 45 45 ASN CA C 134 55.290 52.374 2.916 1
1 579 . 18 1 1 A 45 45 ASN CB C 134 37.530 36.534 0.996 1
1 580 . 18 1 1 A 45 45 ASN N N 134 119.452 123.679 -4.227 1
1 582 . 18 1 1 A 46 46 SER H H 135 7.570 8.055 -0.485 1
1 583 . 18 1 1 A 46 46 SER HA H 135 4.220 4.113 0.107 1
1 586 . 18 1 1 A 46 46 SER C C 135 174.490 176.860 -2.370 1
1 587 . 18 1 1 A 46 46 SER CA C 135 57.090 61.137 -4.047 1
1 588 . 18 1 1 A 46 46 SER CB C 135 64.126 63.122 1.004 1
1 589 . 18 1 1 A 46 46 SER N N 135 105.613 120.354 -14.741 1
1 590 . 18 1 1 A 47 47 ASP H H 136 9.113 7.957 1.156 1
1 591 . 18 1 1 A 47 47 ASP HA H 136 4.220 4.307 -0.087 1
1 594 . 18 1 1 A 47 47 ASP CA C 136 57.610 57.051 0.559 1
1 595 . 18 1 1 A 47 47 ASP CB C 136 40.810 40.419 0.391 1
1 596 . 18 1 1 A 47 47 ASP N N 136 120.995 121.278 -0.283 1
1 597 . 18 1 1 A 48 48 GLY H H 137 8.172 8.185 -0.013 1
1 598 . 18 1 1 A 48 48 GLY HA2 H 137 4.096 3.736 0.360 1
1 599 . 18 1 1 A 48 48 GLY HA3 H 137 3.664 3.746 -0.082 1
1 600 . 18 1 1 A 48 48 GLY C C 137 173.990 175.412 -1.422 1
1 601 . 18 1 1 A 48 48 GLY CA C 137 45.130 47.408 -2.278 1
1 602 . 18 1 1 A 48 48 GLY N N 137 105.838 107.873 -2.035 1
1 603 . 18 1 1 A 49 49 SER H H 138 7.252 7.790 -0.538 1
1 604 . 18 1 1 A 49 49 SER HA H 138 4.503 4.733 -0.230 1
1 607 . 18 1 1 A 49 49 SER C C 138 173.857 173.618 0.239 1
1 608 . 18 1 1 A 49 49 SER CA C 138 57.340 57.334 0.006 1
1 609 . 18 1 1 A 49 49 SER CB C 138 65.370 63.764 1.606 1
1 610 . 18 1 1 A 49 49 SER N N 138 114.942 112.163 2.779 1
1 611 . 18 1 1 A 50 50 ASP H H 139 8.276 8.034 0.242 1
1 612 . 18 1 1 A 50 50 ASP HA H 139 4.618 4.255 0.363 1
1 615 . 18 1 1 A 50 50 ASP C C 139 174.577 175.468 -0.891 1
1 616 . 18 1 1 A 50 50 ASP CA C 139 53.116 55.569 -2.453 1
1 617 . 18 1 1 A 50 50 ASP CB C 139 40.520 39.480 1.040 1
1 618 . 18 1 1 A 50 50 ASP N N 139 122.088 115.869 6.219 1
1 619 . 18 1 1 A 51 51 VAL H H 140 8.192 7.587 0.605 1
1 620 . 18 1 1 A 51 51 VAL HA H 140 4.299 4.351 -0.052 1
1 628 . 18 1 1 A 51 51 VAL C C 140 175.867 174.863 1.004 1
1 629 . 18 1 1 A 51 51 VAL CA C 140 62.950 62.805 0.145 1
1 630 . 18 1 1 A 51 51 VAL CB C 140 33.230 31.607 1.623 1
1 632 . 18 1 1 A 51 51 VAL N N 140 121.167 119.469 1.698 1
1 633 . 18 1 1 A 52 52 CYS H H 141 8.391 8.807 -0.416 1
1 634 . 18 1 1 A 52 52 CYS HA H 141 5.247 5.421 -0.174 1
1 637 . 18 1 1 A 52 52 CYS C C 141 172.778 174.956 -2.178 1
1 638 . 18 1 1 A 52 52 CYS CA C 141 56.480 58.383 -1.903 1
1 639 . 18 1 1 A 52 52 CYS CB C 141 31.960 28.164 3.796 1
1 640 . 18 1 1 A 52 52 CYS N N 141 121.884 127.133 -5.249 1
1 641 . 18 1 1 A 53 53 THR H H 142 8.777 8.880 -0.103 1
1 642 . 18 1 1 A 53 53 THR HA H 142 4.489 4.869 -0.380 1
1 648 . 18 1 1 A 53 53 THR C C 142 171.885 172.083 -0.198 1
1 649 . 18 1 1 A 53 53 THR CA C 142 62.070 61.139 0.931 1
1 650 . 18 1 1 A 53 53 THR CB C 142 71.390 71.720 -0.330 1
1 652 . 18 1 1 A 53 53 THR N N 142 118.132 117.404 0.728 1
1 653 . 18 1 1 A 54 54 LEU H H 143 8.409 8.176 0.233 1
1 654 . 18 1 1 A 54 54 LEU HA H 143 4.276 4.255 0.021 1
1 664 . 18 1 1 A 54 54 LEU C C 143 174.366 174.057 0.309 1
1 665 . 18 1 1 A 54 54 LEU CA C 143 54.330 53.066 1.264 1
1 666 . 18 1 1 A 54 54 LEU CB C 143 42.396 42.691 -0.295 1
1 670 . 18 1 1 A 54 54 LEU N N 143 127.980 127.226 0.754 1
1 671 . 18 1 1 A 55 55 PHE H H 144 8.646 8.612 0.034 1
1 672 . 18 1 1 A 55 55 PHE HA H 144 5.455 4.819 0.636 1
1 680 . 18 1 1 A 55 55 PHE C C 144 176.054 175.296 0.758 1
1 681 . 18 1 1 A 55 55 PHE CA C 144 55.250 57.181 -1.931 1
1 682 . 18 1 1 A 55 55 PHE CB C 144 44.100 40.470 3.630 1
1 686 . 18 1 1 A 55 55 PHE N N 144 122.010 126.754 -4.744 1
1 687 . 18 1 1 A 56 56 ASP H H 145 11.575 8.225 3.350 1
1 688 . 18 1 1 A 56 56 ASP HA H 145 4.416 4.353 0.063 1
1 691 . 18 1 1 A 56 56 ASP C C 145 176.748 177.498 -0.750 1
1 692 . 18 1 1 A 56 56 ASP CA C 145 55.840 54.776 1.064 1
1 693 . 18 1 1 A 56 56 ASP CB C 145 44.390 42.217 2.173 1
1 694 . 18 1 1 A 56 56 ASP N N 145 121.936 124.175 -2.239 1
1 695 . 18 1 1 A 57 57 ALA H H 146 8.508 8.675 -0.167 1
1 696 . 18 1 1 A 57 57 ALA HA H 146 3.797 4.011 -0.214 1
1 700 . 18 1 1 A 57 57 ALA C C 146 178.696 179.738 -1.042 1
1 701 . 18 1 1 A 57 57 ALA CA C 146 55.990 55.400 0.590 1
1 702 . 18 1 1 A 57 57 ALA CB C 146 18.840 18.114 0.726 1
1 703 . 18 1 1 A 57 57 ALA N N 146 130.243 129.366 0.877 1
1 704 . 18 1 1 A 58 58 ALA H H 147 8.378 7.851 0.527 1
1 705 . 18 1 1 A 58 58 ALA HA H 147 4.078 4.202 -0.124 1
1 709 . 18 1 1 A 58 58 ALA C C 147 181.091 179.438 1.653 1
1 710 . 18 1 1 A 58 58 ALA CA C 147 54.770 54.915 -0.145 1
1 711 . 18 1 1 A 58 58 ALA CB C 147 17.700 18.506 -0.806 1
1 712 . 18 1 1 A 58 58 ALA N N 147 121.997 119.454 2.543 1
1 713 . 18 1 1 A 59 59 ALA H H 148 9.138 7.961 1.177 1
1 714 . 18 1 1 A 59 59 ALA HA H 148 3.975 4.048 -0.073 1
1 718 . 18 1 1 A 59 59 ALA C C 148 180.508 179.971 0.537 1
1 719 . 18 1 1 A 59 59 ALA CA C 148 54.840 55.120 -0.280 1
1 720 . 18 1 1 A 59 59 ALA CB C 148 18.600 18.546 0.054 1
1 721 . 18 1 1 A 59 59 ALA N N 148 123.595 120.390 3.205 1
1 722 . 18 1 1 A 60 60 PHE H H 149 8.814 8.205 0.609 1
1 723 . 18 1 1 A 60 60 PHE HA H 149 3.722 4.012 -0.290 1
1 731 . 18 1 1 A 60 60 PHE C C 149 176.773 177.492 -0.719 1
1 732 . 18 1 1 A 60 60 PHE CA C 149 62.030 61.566 0.464 1
1 733 . 18 1 1 A 60 60 PHE CB C 149 39.960 38.998 0.962 1
1 737 . 18 1 1 A 60 60 PHE N N 149 120.354 119.858 0.496 1
1 738 . 18 1 1 A 61 61 SER H H 150 8.276 8.063 0.213 1
1 739 . 18 1 1 A 61 61 SER HA H 150 3.880 4.161 -0.281 1
1 742 . 18 1 1 A 61 61 SER C C 150 177.691 177.111 0.580 1
1 743 . 18 1 1 A 61 61 SER CA C 150 62.190 61.240 0.950 1
1 744 . 18 1 1 A 61 61 SER CB C 150 63.016 63.207 -0.191 1
1 745 . 18 1 1 A 61 61 SER N N 150 112.086 114.015 -1.929 1
1 746 . 18 1 1 A 62 62 ARG H H 151 7.829 7.692 0.137 1
1 747 . 18 1 1 A 62 62 ARG HA H 151 3.971 4.074 -0.103 1
1 754 . 18 1 1 A 62 62 ARG C C 151 178.287 178.790 -0.503 1
1 755 . 18 1 1 A 62 62 ARG CA C 151 59.340 59.031 0.309 1
1 756 . 18 1 1 A 62 62 ARG CB C 151 29.760 29.777 -0.017 1
1 759 . 18 1 1 A 62 62 ARG N N 151 121.090 121.627 -0.537 1
1 760 . 18 1 1 A 63 63 LEU H H 152 7.390 7.819 -0.429 1
1 761 . 18 1 1 A 63 63 LEU HA H 152 3.791 3.930 -0.139 1
1 771 . 18 1 1 A 63 63 LEU C C 152 179.106 178.826 0.280 1
1 772 . 18 1 1 A 63 63 LEU CA C 152 58.900 57.942 0.958 1
1 773 . 18 1 1 A 63 63 LEU CB C 152 41.140 41.461 -0.321 1
1 777 . 18 1 1 A 63 63 LEU N N 152 121.129 119.318 1.811 1
1 778 . 18 1 1 A 64 64 VAL H H 153 7.552 7.969 -0.417 1
1 779 . 18 1 1 A 64 64 VAL HA H 153 3.411 3.497 -0.086 1
1 787 . 18 1 1 A 64 64 VAL C C 153 180.595 178.794 1.801 1
1 788 . 18 1 1 A 64 64 VAL CA C 153 65.644 66.401 -0.757 1
1 789 . 18 1 1 A 64 64 VAL CB C 153 31.410 31.443 -0.033 1
1 792 . 18 1 1 A 64 64 VAL N N 153 118.280 119.050 -0.770 1
1 793 . 18 1 1 A 65 65 GLY H H 154 8.061 8.236 -0.175 1
1 794 . 18 1 1 A 65 65 GLY HA2 H 154 3.846 3.903 -0.057 1
1 795 . 18 1 1 A 65 65 GLY HA3 H 154 3.809 3.904 -0.095 1
1 796 . 18 1 1 A 65 65 GLY C C 154 175.235 174.812 0.423 1
1 797 . 18 1 1 A 65 65 GLY CA C 154 46.630 46.613 0.017 1
1 798 . 18 1 1 A 65 65 GLY N N 154 108.622 107.772 0.850 1
1 799 . 18 1 1 A 66 66 GLU H H 155 7.528 7.459 0.069 1
1 800 . 18 1 1 A 66 66 GLU HA H 155 4.228 4.383 -0.155 1
1 805 . 18 1 1 A 66 66 GLU C C 155 176.761 177.046 -0.285 1
1 806 . 18 1 1 A 66 66 GLU CA C 155 56.590 55.967 0.623 1
1 807 . 18 1 1 A 66 66 GLU CB C 155 30.490 30.602 -0.112 1
1 809 . 18 1 1 A 66 66 GLU N N 155 118.361 118.043 0.318 1
1 810 . 18 1 1 A 67 67 GLY H H 156 7.884 7.975 -0.091 1
1 811 . 18 1 1 A 67 67 GLY HA2 H 156 3.918 3.898 0.020 1
1 812 . 18 1 1 A 67 67 GLY HA3 H 156 3.747 3.910 -0.163 1
1 813 . 18 1 1 A 67 67 GLY C C 156 174.788 174.773 0.015 1
1 814 . 18 1 1 A 67 67 GLY CA C 156 45.890 46.387 -0.497 1
1 815 . 18 1 1 A 67 67 GLY N N 156 108.465 109.846 -1.381 1
1 816 . 18 1 1 A 68 68 LEU H H 157 7.332 8.072 -0.740 1
1 817 . 18 1 1 A 68 68 LEU HA H 157 4.361 4.587 -0.226 1
1 827 . 18 1 1 A 68 68 LEU CA C 157 53.060 52.029 1.031 1
1 828 . 18 1 1 A 68 68 LEU CB C 157 41.100 41.727 -0.627 1
1 832 . 18 1 1 A 68 68 LEU N N 157 121.920 121.692 0.228 1
1 833 . 18 1 1 A 69 69 PRO HA H 158 4.485 4.589 -0.104 1
1 840 . 18 1 1 A 69 69 PRO C C 158 174.602 176.206 -1.604 1
1 841 . 18 1 1 A 69 69 PRO CA C 158 61.556 62.258 -0.702 1
1 842 . 18 1 1 A 69 69 PRO CB C 158 32.370 32.760 -0.390 1
1 845 . 18 1 1 A 70 70 HIS H H 159 8.759 8.635 0.124 1
1 846 . 18 1 1 A 70 70 HIS HA H 159 3.947 4.361 -0.414 1
1 852 . 18 1 1 A 70 70 HIS CA C 159 56.250 55.179 1.071 1
1 853 . 18 1 1 A 70 70 HIS CB C 159 32.280 30.937 1.343 1
1 856 . 18 1 1 A 70 70 HIS N N 159 119.423 120.533 -1.110 1
1 857 . 18 1 1 A 71 71 PRO HA H 160 4.424 4.341 0.083 1
1 864 . 18 1 1 A 71 71 PRO C C 160 177.567 178.394 -0.827 1
1 865 . 18 1 1 A 71 71 PRO CA C 160 64.574 64.759 -0.185 1
1 866 . 18 1 1 A 71 71 PRO CB C 160 32.340 32.132 0.208 1
1 869 . 18 1 1 A 72 72 LEU H H 161 10.123 7.649 2.474 1
1 870 . 18 1 1 A 72 72 LEU HA H 161 4.778 4.281 0.497 1
1 880 . 18 1 1 A 72 72 LEU C C 161 178.721 177.825 0.896 1
1 881 . 18 1 1 A 72 72 LEU CA C 161 55.800 57.524 -1.724 1
1 882 . 18 1 1 A 72 72 LEU CB C 161 42.440 42.867 -0.427 1
1 886 . 18 1 1 A 72 72 LEU N N 161 117.374 117.361 0.013 1
1 887 . 18 1 1 A 73 73 THR H H 162 7.523 7.783 -0.260 1
1 888 . 18 1 1 A 73 73 THR HA H 162 4.291 4.496 -0.205 1
1 893 . 18 1 1 A 73 73 THR C C 162 175.557 174.341 1.216 1
1 894 . 18 1 1 A 73 73 THR CA C 162 61.440 62.319 -0.879 1
1 895 . 18 1 1 A 73 73 THR CB C 162 70.500 69.902 0.598 1
1 897 . 18 1 1 A 73 73 THR N N 162 107.787 112.021 -4.234 1
1 898 . 18 1 1 A 74 74 ARG H H 163 8.361 7.867 0.494 1
1 899 . 18 1 1 A 74 74 ARG HA H 163 3.836 4.315 -0.479 1
1 906 . 18 1 1 A 74 74 ARG C C 163 174.701 175.230 -0.529 1
1 907 . 18 1 1 A 74 74 ARG CA C 163 57.980 57.620 0.360 1
1 908 . 18 1 1 A 74 74 ARG CB C 163 26.770 27.081 -0.311 1
1 911 . 18 1 1 A 74 74 ARG N N 163 115.130 118.697 -3.567 1
1 912 . 18 1 1 A 75 75 GLU H H 164 7.430 8.060 -0.630 1
1 913 . 18 1 1 A 75 75 GLU HA H 164 4.636 4.470 0.166 1
1 918 . 18 1 1 A 75 75 GLU CA C 164 53.699 54.653 -0.954 1
1 919 . 18 1 1 A 75 75 GLU CB C 164 29.550 29.325 0.225 1
1 921 . 18 1 1 A 75 75 GLU N N 164 120.076 119.105 0.971 1
1 922 . 18 1 1 A 76 76 PRO HA H 165 4.272 4.450 -0.178 1
1 929 . 18 1 1 A 76 76 PRO C C 165 176.649 177.023 -0.374 1
1 930 . 18 1 1 A 76 76 PRO CA C 165 63.204 63.151 0.053 1
1 931 . 18 1 1 A 76 76 PRO CB C 165 31.680 31.643 0.037 1
1 934 . 18 1 1 A 77 77 ILE H H 166 8.812 8.223 0.589 1
1 935 . 18 1 1 A 77 77 ILE HA H 166 3.838 4.263 -0.425 1
1 945 . 18 1 1 A 77 77 ILE C C 166 175.235 176.071 -0.836 1
1 946 . 18 1 1 A 77 77 ILE CA C 166 62.816 61.313 1.503 1
1 947 . 18 1 1 A 77 77 ILE CB C 166 37.750 37.422 0.328 1
1 951 . 18 1 1 A 77 77 ILE N N 166 123.831 124.160 -0.329 1
1 952 . 18 1 1 A 78 78 THR H H 167 6.625 8.609 -1.984 1
1 953 . 18 1 1 A 78 78 THR HA H 167 4.632 5.041 -0.409 1
1 958 . 18 1 1 A 78 78 THR C C 167 174.143 174.331 -0.188 1
1 959 . 18 1 1 A 78 78 THR CA C 167 58.750 60.161 -1.411 1
1 960 . 18 1 1 A 78 78 THR CB C 167 71.320 70.891 0.429 1
1 962 . 18 1 1 A 78 78 THR N N 167 115.293 118.606 -3.313 1
1 963 . 18 1 1 A 79 79 ALA H H 168 9.088 8.974 0.114 1
1 964 . 18 1 1 A 79 79 ALA HA H 168 3.916 4.118 -0.202 1
1 968 . 18 1 1 A 79 79 ALA C C 168 179.788 179.829 -0.041 1
1 969 . 18 1 1 A 79 79 ALA CA C 168 55.480 54.895 0.585 1
1 970 . 18 1 1 A 79 79 ALA CB C 168 17.630 18.538 -0.908 1
1 971 . 18 1 1 A 79 79 ALA N N 168 122.102 127.599 -5.497 1
1 972 . 18 1 1 A 80 80 SER H H 169 7.988 7.703 0.285 1
1 973 . 18 1 1 A 80 80 SER HA H 169 4.058 4.111 -0.053 1
1 976 . 18 1 1 A 80 80 SER C C 169 176.029 176.439 -0.410 1
1 977 . 18 1 1 A 80 80 SER CA C 169 60.750 62.256 -1.506 1
1 978 . 18 1 1 A 80 80 SER CB C 169 62.510 63.194 -0.684 1
1 979 . 18 1 1 A 80 80 SER N N 169 109.541 115.027 -5.486 1
1 980 . 18 1 1 A 81 81 ILE H H 170 6.968 7.566 -0.598 1
1 981 . 18 1 1 A 81 81 ILE HA H 170 4.315 4.362 -0.047 1
1 991 . 18 1 1 A 81 81 ILE C C 170 174.242 175.559 -1.317 1
1 992 . 18 1 1 A 81 81 ILE CA C 170 62.296 61.697 0.599 1
1 993 . 18 1 1 A 81 81 ILE CB C 170 37.686 38.247 -0.561 1
1 997 . 18 1 1 A 81 81 ILE N N 170 112.476 113.204 -0.728 1
1 998 . 18 1 1 A 82 82 ILE H H 171 7.345 7.410 -0.065 1
1 999 . 18 1 1 A 82 82 ILE HA H 171 4.339 4.630 -0.291 1
1 1009 . 18 1 1 A 82 82 ILE C C 171 174.999 174.618 0.381 1
1 1010 . 18 1 1 A 82 82 ILE CA C 171 61.150 60.228 0.922 1
1 1011 . 18 1 1 A 82 82 ILE CB C 171 37.230 40.156 -2.926 1
1 1015 . 18 1 1 A 82 82 ILE N N 171 124.260 124.599 -0.339 1
1 1016 . 18 1 1 A 83 83 VAL H H 172 7.923 9.054 -1.131 1
1 1017 . 18 1 1 A 83 83 VAL HA H 172 4.673 5.109 -0.436 1
1 1025 . 18 1 1 A 83 83 VAL C C 172 174.887 175.129 -0.242 1
1 1026 . 18 1 1 A 83 83 VAL CA C 172 59.340 59.118 0.222 1
1 1027 . 18 1 1 A 83 83 VAL CB C 172 34.840 36.197 -1.357 1
1 1030 . 18 1 1 A 83 83 VAL N N 172 120.931 122.184 -1.253 1
1 1031 . 18 1 1 A 84 84 LYS H H 173 8.406 8.329 0.077 1
1 1032 . 18 1 1 A 84 84 LYS HA H 173 4.410 4.723 -0.313 1
1 1041 . 18 1 1 A 84 84 LYS C C 173 178.734 178.286 0.448 1
1 1042 . 18 1 1 A 84 84 LYS CA C 173 56.360 54.704 1.656 1
1 1043 . 18 1 1 A 84 84 LYS CB C 173 33.100 34.210 -1.110 1
1 1047 . 18 1 1 A 84 84 LYS N N 173 121.251 120.353 0.898 1
1 1048 . 18 1 1 A 85 85 HIS H H 174 9.221 9.091 0.130 1
1 1049 . 18 1 1 A 85 85 HIS HA H 174 4.024 3.776 0.248 1
1 1053 . 18 1 1 A 85 85 HIS C C 174 177.183 176.822 0.361 1
1 1054 . 18 1 1 A 85 85 HIS CA C 174 59.460 59.617 -0.157 1
1 1055 . 18 1 1 A 85 85 HIS CB C 174 27.920 29.769 -1.849 1
1 1057 . 18 1 1 A 85 85 HIS N N 174 121.545 122.514 -0.969 1
1 1058 . 18 1 1 A 86 86 GLU H H 175 8.699 7.951 0.748 1
1 1059 . 18 1 1 A 86 86 GLU HA H 175 3.900 3.914 -0.014 1
1 1064 . 18 1 1 A 86 86 GLU C C 175 177.220 178.041 -0.821 1
1 1065 . 18 1 1 A 86 86 GLU CA C 175 58.420 57.993 0.427 1
1 1066 . 18 1 1 A 86 86 GLU CB C 175 28.690 29.843 -1.153 1
1 1068 . 18 1 1 A 86 86 GLU N N 175 118.011 118.239 -0.228 1
1 1069 . 18 1 1 A 87 87 GLU H H 176 7.621 7.868 -0.247 1
1 1070 . 18 1 1 A 87 87 GLU HA H 176 4.177 4.088 0.089 1
1 1075 . 18 1 1 A 87 87 GLU C C 176 175.222 175.968 -0.746 1
1 1076 . 18 1 1 A 87 87 GLU CA C 176 56.390 58.268 -1.878 1
1 1077 . 18 1 1 A 87 87 GLU CB C 176 30.430 30.447 -0.017 1
1 1079 . 18 1 1 A 87 87 GLU N N 176 116.753 118.796 -2.043 1
1 1080 . 18 1 1 A 88 88 CYS H H 177 7.239 7.543 -0.304 1
1 1081 . 18 1 1 A 88 88 CYS HA H 177 5.148 5.132 0.016 1
1 1084 . 18 1 1 A 88 88 CYS C C 177 173.249 173.396 -0.147 1
1 1085 . 18 1 1 A 88 88 CYS CA C 177 57.240 56.746 0.494 1
1 1086 . 18 1 1 A 88 88 CYS CB C 177 31.020 30.894 0.126 1
1 1087 . 18 1 1 A 88 88 CYS N N 177 116.096 115.436 0.660 1
1 1088 . 18 1 1 A 89 89 ILE H H 178 8.912 8.638 0.274 1
1 1089 . 18 1 1 A 89 89 ILE HA H 178 4.580 4.831 -0.251 1
1 1099 . 18 1 1 A 89 89 ILE C C 178 173.386 174.069 -0.683 1
1 1100 . 18 1 1 A 89 89 ILE CA C 178 59.270 58.953 0.317 1
1 1101 . 18 1 1 A 89 89 ILE CB C 178 42.990 41.714 1.276 1
1 1105 . 18 1 1 A 89 89 ILE N N 178 119.490 118.431 1.059 1
1 1106 . 18 1 1 A 90 90 TYR H H 179 9.047 8.486 0.561 1
1 1107 . 18 1 1 A 90 90 TYR HA H 179 3.753 4.039 -0.286 1
1 1112 . 18 1 1 A 90 90 TYR C C 179 173.932 174.389 -0.457 1
1 1113 . 18 1 1 A 90 90 TYR CA C 179 59.860 57.396 2.464 1
1 1114 . 18 1 1 A 90 90 TYR CB C 179 37.530 37.977 -0.447 1
1 1116 . 18 1 1 A 90 90 TYR N N 179 126.270 121.916 4.354 1
1 1117 . 18 1 1 A 91 91 ASP H H 180 7.462 8.571 -1.109 1
1 1118 . 18 1 1 A 91 91 ASP HA H 180 4.639 4.724 -0.085 1
1 1121 . 18 1 1 A 91 91 ASP C C 180 175.297 176.167 -0.870 1
1 1122 . 18 1 1 A 91 91 ASP CA C 180 52.496 53.489 -0.993 1
1 1123 . 18 1 1 A 91 91 ASP CB C 180 43.380 42.584 0.796 1
1 1124 . 18 1 1 A 91 91 ASP N N 180 129.593 125.600 3.993 1
1 1125 . 18 1 1 A 92 92 ASP H H 181 8.719 9.258 -0.539 1
1 1126 . 18 1 1 A 92 92 ASP HA H 181 4.109 4.315 -0.206 1
1 1129 . 18 1 1 A 92 92 ASP C C 181 177.555 177.554 0.001 1
1 1130 . 18 1 1 A 92 92 ASP CA C 181 56.390 57.641 -1.251 1
1 1131 . 18 1 1 A 92 92 ASP CB C 181 41.330 40.913 0.417 1
1 1132 . 18 1 1 A 92 92 ASP N N 181 125.691 127.750 -2.059 1
1 1133 . 18 1 1 A 93 93 THR H H 182 8.271 7.372 0.899 1
1 1134 . 18 1 1 A 93 93 THR HA H 182 4.036 4.034 0.002 1
1 1139 . 18 1 1 A 93 93 THR C C 182 176.289 176.614 -0.325 1
1 1140 . 18 1 1 A 93 93 THR CA C 182 65.054 64.762 0.292 1
1 1141 . 18 1 1 A 93 93 THR CB C 182 68.560 68.945 -0.385 1
1 1143 . 18 1 1 A 93 93 THR N N 182 114.813 113.407 1.406 1
1 1144 . 18 1 1 A 94 94 ARG H H 183 7.753 7.533 0.220 1
1 1145 . 18 1 1 A 94 94 ARG HA H 183 4.139 4.242 -0.103 1
1 1152 . 18 1 1 A 94 94 ARG C C 183 176.897 176.764 0.133 1
1 1153 . 18 1 1 A 94 94 ARG CA C 183 55.350 56.355 -1.005 1
1 1154 . 18 1 1 A 94 94 ARG CB C 183 30.930 30.753 0.177 1
1 1157 . 18 1 1 A 94 94 ARG N N 183 120.101 117.910 2.191 1
1 1158 . 18 1 1 A 95 95 GLY H H 184 8.112 9.212 -1.100 1
1 1159 . 18 1 1 A 95 95 GLY HA2 H 184 3.838 3.887 -0.049 1
1 1160 . 18 1 1 A 95 95 GLY HA3 H 184 3.670 3.889 -0.219 1
1 1161 . 18 1 1 A 95 95 GLY C C 184 173.659 173.345 0.314 1
1 1162 . 18 1 1 A 95 95 GLY CA C 184 46.040 45.597 0.443 1
1 1163 . 18 1 1 A 95 95 GLY N N 184 108.106 108.556 -0.450 1
1 1164 . 18 1 1 A 96 96 ASN H H 185 6.833 7.458 -0.625 1
1 1165 . 18 1 1 A 96 96 ASN HA H 185 4.944 5.039 -0.095 1
1 1170 . 18 1 1 A 96 96 ASN C C 185 174.267 173.544 0.723 1
1 1171 . 18 1 1 A 96 96 ASN CA C 185 52.560 52.474 0.086 1
1 1172 . 18 1 1 A 96 96 ASN CB C 185 45.890 41.690 4.200 1
1 1173 . 18 1 1 A 96 96 ASN N N 185 113.392 117.434 -4.042 1
1 1175 . 18 1 1 A 97 97 PHE H H 186 9.108 8.755 0.353 1
1 1176 . 18 1 1 A 97 97 PHE HA H 186 4.782 4.924 -0.142 1
1 1183 . 18 1 1 A 97 97 PHE C C 186 174.862 175.782 -0.920 1
1 1184 . 18 1 1 A 97 97 PHE CA C 186 60.056 59.709 0.347 1
1 1185 . 18 1 1 A 97 97 PHE CB C 186 40.180 39.422 0.758 1
1 1188 . 18 1 1 A 97 97 PHE N N 186 118.741 119.239 -0.498 1
1 1189 . 18 1 1 A 98 98 ILE H H 187 8.933 8.732 0.201 1
1 1190 . 18 1 1 A 98 98 ILE HA H 187 5.458 5.096 0.362 1
1 1200 . 18 1 1 A 98 98 ILE C C 187 176.041 175.093 0.948 1
1 1201 . 18 1 1 A 98 98 ILE CA C 187 57.610 59.081 -1.471 1
1 1202 . 18 1 1 A 98 98 ILE CB C 187 42.070 41.887 0.183 1
1 1206 . 18 1 1 A 98 98 ILE N N 187 117.857 119.063 -1.206 1
1 1207 . 18 1 1 A 99 99 ILE H H 188 8.284 8.660 -0.376 1
1 1208 . 18 1 1 A 99 99 ILE HA H 188 4.341 4.032 0.309 1
1 1218 . 18 1 1 A 99 99 ILE C C 188 176.413 176.488 -0.075 1
1 1219 . 18 1 1 A 99 99 ILE CA C 188 59.190 62.104 -2.914 1
1 1220 . 18 1 1 A 99 99 ILE CB C 188 37.940 38.287 -0.347 1
1 1224 . 18 1 1 A 99 99 ILE N N 188 121.796 123.087 -1.291 1
1 1225 . 18 1 1 A 100 100 LYS H H 189 8.463 8.440 0.023 1
1 1226 . 18 1 1 A 100 100 LYS HA H 189 4.040 3.853 0.187 1
1 1235 . 18 1 1 A 100 100 LYS C C 189 176.848 177.506 -0.658 1
1 1236 . 18 1 1 A 100 100 LYS CA C 189 57.241 58.430 -1.189 1
1 1237 . 18 1 1 A 100 100 LYS CB C 189 33.400 32.338 1.062 1
1 1241 . 18 1 1 A 100 100 LYS N N 189 127.995 126.139 1.856 1
1 1242 . 18 1 1 A 101 101 GLY H H 190 8.346 8.839 -0.493 1
1 1243 . 18 1 1 A 101 101 GLY HA2 H 190 3.947 4.074 -0.127 1
1 1244 . 18 1 1 A 101 101 GLY HA3 H 190 3.813 4.080 -0.267 1
1 1245 . 18 1 1 A 101 101 GLY C C 190 172.902 173.661 -0.759 1
1 1246 . 18 1 1 A 101 101 GLY CA C 190 44.920 46.078 -1.158 1
1 1247 . 18 1 1 A 101 101 GLY N N 190 110.882 111.709 -0.827 1
1 7 . 19 1 1 A 2 2 GLN H H 91 8.786 8.304 0.482 1
1 8 . 19 1 1 A 2 2 GLN HA H 91 4.005 3.957 0.048 1
1 15 . 19 1 1 A 2 2 GLN C C 91 177.270 177.963 -0.693 1
1 16 . 19 1 1 A 2 2 GLN CA C 91 58.220 59.015 -0.795 1
1 17 . 19 1 1 A 2 2 GLN CB C 91 28.650 28.648 0.002 1
1 19 . 19 1 1 A 2 2 GLN N N 91 121.993 124.485 -2.492 1
1 21 . 19 1 1 A 3 3 GLU H H 92 8.430 8.243 0.187 1
1 22 . 19 1 1 A 3 3 GLU HA H 92 4.007 4.114 -0.107 1
1 27 . 19 1 1 A 3 3 GLU C C 92 178.287 179.094 -0.807 1
1 28 . 19 1 1 A 3 3 GLU CA C 92 59.490 59.245 0.245 1
1 29 . 19 1 1 A 3 3 GLU CB C 92 29.506 29.276 0.230 1
1 31 . 19 1 1 A 3 3 GLU N N 92 120.195 118.532 1.663 1
1 32 . 19 1 1 A 4 4 SER H H 93 8.209 7.774 0.435 1
1 33 . 19 1 1 A 4 4 SER HA H 93 4.272 4.258 0.014 1
1 36 . 19 1 1 A 4 4 SER C C 93 177.369 177.551 -0.182 1
1 37 . 19 1 1 A 4 4 SER CA C 93 61.044 61.284 -0.240 1
1 38 . 19 1 1 A 4 4 SER CB C 93 62.950 62.826 0.124 1
1 39 . 19 1 1 A 4 4 SER N N 93 115.524 114.897 0.627 1
1 40 . 19 1 1 A 5 5 ILE H H 94 8.080 7.428 0.652 1
1 41 . 19 1 1 A 5 5 ILE HA H 94 3.530 3.631 -0.101 1
1 51 . 19 1 1 A 5 5 ILE C C 94 177.778 177.752 0.026 1
1 52 . 19 1 1 A 5 5 ILE CA C 94 65.710 65.340 0.370 1
1 53 . 19 1 1 A 5 5 ILE CB C 94 37.800 37.427 0.373 1
1 57 . 19 1 1 A 5 5 ILE N N 94 124.148 122.075 2.073 1
1 58 . 19 1 1 A 6 6 GLN H H 95 8.374 8.235 0.139 1
1 59 . 19 1 1 A 6 6 GLN HA H 95 4.125 3.971 0.154 1
1 66 . 19 1 1 A 6 6 GLN C C 95 179.726 179.374 0.352 1
1 67 . 19 1 1 A 6 6 GLN CA C 95 59.190 59.020 0.170 1
1 68 . 19 1 1 A 6 6 GLN CB C 95 27.060 28.691 -1.631 1
1 70 . 19 1 1 A 6 6 GLN N N 95 118.257 118.861 -0.604 1
1 72 . 19 1 1 A 7 7 ASN H H 96 8.456 7.820 0.636 1
1 73 . 19 1 1 A 7 7 ASN HA H 96 4.446 4.539 -0.093 1
1 78 . 19 1 1 A 7 7 ASN C C 96 177.257 178.415 -1.158 1
1 79 . 19 1 1 A 7 7 ASN CA C 96 56.020 56.146 -0.126 1
1 80 . 19 1 1 A 7 7 ASN CB C 96 38.126 37.815 0.311 1
1 81 . 19 1 1 A 7 7 ASN N N 96 118.597 118.323 0.274 1
1 83 . 19 1 1 A 8 8 LYS H H 97 7.732 7.668 0.064 1
1 84 . 19 1 1 A 8 8 LYS HA H 97 4.129 4.054 0.075 1
1 93 . 19 1 1 A 8 8 LYS C C 97 179.143 179.421 -0.278 1
1 94 . 19 1 1 A 8 8 LYS CA C 97 59.126 59.541 -0.415 1
1 95 . 19 1 1 A 8 8 LYS CB C 97 32.070 32.434 -0.364 1
1 99 . 19 1 1 A 8 8 LYS N N 97 122.381 118.537 3.844 1
1 100 . 19 1 1 A 9 9 ILE H H 98 8.452 8.037 0.415 1
1 101 . 19 1 1 A 9 9 ILE HA H 98 3.480 3.842 -0.362 1
1 111 . 19 1 1 A 9 9 ILE C C 98 177.406 178.401 -0.995 1
1 112 . 19 1 1 A 9 9 ILE CA C 98 66.430 64.919 1.511 1
1 113 . 19 1 1 A 9 9 ILE CB C 98 37.980 37.387 0.593 1
1 117 . 19 1 1 A 9 9 ILE N N 98 119.950 121.017 -1.067 1
1 118 . 19 1 1 A 10 10 SER H H 99 7.924 7.926 -0.002 1
1 119 . 19 1 1 A 10 10 SER HA H 99 3.983 4.143 -0.160 1
1 122 . 19 1 1 A 10 10 SER C C 99 176.327 176.781 -0.454 1
1 123 . 19 1 1 A 10 10 SER CA C 99 61.990 61.451 0.539 1
1 124 . 19 1 1 A 10 10 SER CB C 99 62.790 62.956 -0.166 1
1 125 . 19 1 1 A 10 10 SER N N 99 113.568 116.816 -3.248 1
1 126 . 19 1 1 A 11 11 GLN H H 100 7.832 7.175 0.657 1
1 127 . 19 1 1 A 11 11 GLN HA H 100 4.238 4.162 0.076 1
1 134 . 19 1 1 A 11 11 GLN C C 100 178.088 177.836 0.252 1
1 135 . 19 1 1 A 11 11 GLN CA C 100 57.900 58.125 -0.225 1
1 136 . 19 1 1 A 11 11 GLN CB C 100 29.790 28.768 1.022 1
1 138 . 19 1 1 A 11 11 GLN N N 100 117.487 120.453 -2.966 1
1 140 . 19 1 1 A 12 12 CYS H H 101 7.920 8.035 -0.115 1
1 141 . 19 1 1 A 12 12 CYS HA H 101 4.657 4.587 0.070 1
1 144 . 19 1 1 A 12 12 CYS C C 101 175.446 174.697 0.749 1
1 145 . 19 1 1 A 12 12 CYS CA C 101 60.654 59.322 1.332 1
1 146 . 19 1 1 A 12 12 CYS CB C 101 29.310 27.864 1.446 1
1 147 . 19 1 1 A 12 12 CYS N N 101 114.221 116.667 -2.446 1
1 148 . 19 1 1 A 13 13 LYS H H 102 8.029 7.220 0.809 1
1 149 . 19 1 1 A 13 13 LYS HA H 102 5.069 4.807 0.262 1
1 158 . 19 1 1 A 13 13 LYS C C 102 174.800 176.210 -1.410 1
1 159 . 19 1 1 A 13 13 LYS CA C 102 56.394 55.918 0.476 1
1 160 . 19 1 1 A 13 13 LYS CB C 102 32.770 33.400 -0.630 1
1 164 . 19 1 1 A 13 13 LYS N N 102 124.129 119.751 4.378 1
1 165 . 19 1 1 A 14 14 PHE H H 103 8.737 8.608 0.129 1
1 166 . 19 1 1 A 14 14 PHE HA H 103 5.059 5.116 -0.057 1
1 174 . 19 1 1 A 14 14 PHE C C 103 173.560 173.049 0.511 1
1 175 . 19 1 1 A 14 14 PHE CA C 103 55.470 56.049 -0.579 1
1 176 . 19 1 1 A 14 14 PHE CB C 103 41.760 41.085 0.675 1
1 180 . 19 1 1 A 14 14 PHE N N 103 118.661 116.419 2.242 1
1 181 . 19 1 1 A 15 15 SER H H 104 8.826 8.831 -0.005 1
1 182 . 19 1 1 A 15 15 SER HA H 104 4.602 4.422 0.180 1
1 185 . 19 1 1 A 15 15 SER C C 104 173.795 173.683 0.112 1
1 186 . 19 1 1 A 15 15 SER CA C 104 58.610 58.788 -0.178 1
1 187 . 19 1 1 A 15 15 SER CB C 104 62.690 62.510 0.180 1
1 188 . 19 1 1 A 15 15 SER N N 104 117.781 116.946 0.835 1
1 189 . 19 1 1 A 16 16 VAL H H 105 7.784 8.048 -0.264 1
1 190 . 19 1 1 A 16 16 VAL HA H 105 3.370 3.897 -0.527 1
1 198 . 19 1 1 A 16 16 VAL C C 105 174.987 175.275 -0.288 1
1 199 . 19 1 1 A 16 16 VAL CA C 105 63.580 62.996 0.584 1
1 200 . 19 1 1 A 16 16 VAL CB C 105 31.410 30.879 0.531 1
1 203 . 19 1 1 A 16 16 VAL N N 105 129.075 126.362 2.713 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 4.912 0.099 1
1 208 . 19 1 1 A 17 17 CYS CA C 106 55.260 56.230 -0.970 1
1 209 . 19 1 1 A 17 17 CYS CB C 106 28.210 28.872 -0.662 1
1 210 . 19 1 1 A 17 17 CYS N N 106 130.045 127.099 2.946 1
1 211 . 19 1 1 A 18 18 PRO HA H 107 3.991 4.353 -0.362 1
1 218 . 19 1 1 A 18 18 PRO C C 107 178.188 178.331 -0.143 1
1 219 . 19 1 1 A 18 18 PRO CA C 107 65.940 64.958 0.982 1
1 220 . 19 1 1 A 18 18 PRO CB C 107 32.000 32.025 -0.025 1
1 223 . 19 1 1 A 19 19 GLU H H 108 9.260 9.071 0.189 1
1 224 . 19 1 1 A 19 19 GLU HA H 108 4.119 4.160 -0.041 1
1 229 . 19 1 1 A 19 19 GLU C C 108 178.721 178.825 -0.104 1
1 230 . 19 1 1 A 19 19 GLU CA C 108 59.300 58.156 1.144 1
1 231 . 19 1 1 A 19 19 GLU CB C 108 28.920 28.402 0.518 1
1 233 . 19 1 1 A 19 19 GLU N N 108 118.270 116.098 2.172 1
1 234 . 19 1 1 A 20 20 ARG H H 109 7.672 7.703 -0.031 1
1 235 . 19 1 1 A 20 20 ARG HA H 109 4.331 4.147 0.184 1
1 242 . 19 1 1 A 20 20 ARG C C 109 177.977 178.724 -0.747 1
1 243 . 19 1 1 A 20 20 ARG CA C 109 57.350 58.255 -0.905 1
1 244 . 19 1 1 A 20 20 ARG CB C 109 30.820 30.220 0.600 1
1 247 . 19 1 1 A 20 20 ARG N N 109 118.357 120.323 -1.966 1
1 248 . 19 1 1 A 21 21 LEU H H 110 7.601 7.836 -0.235 1
1 249 . 19 1 1 A 21 21 LEU HA H 110 4.380 4.249 0.131 1
1 259 . 19 1 1 A 21 21 LEU C C 110 176.562 176.291 0.271 1
1 260 . 19 1 1 A 21 21 LEU CA C 110 56.096 55.331 0.765 1
1 261 . 19 1 1 A 21 21 LEU CB C 110 44.016 42.221 1.795 1
1 265 . 19 1 1 A 21 21 LEU N N 110 118.626 118.013 0.613 1
1 266 . 19 1 1 A 22 22 GLN H H 111 7.750 7.891 -0.141 1
1 267 . 19 1 1 A 22 22 GLN HA H 111 3.870 3.943 -0.073 1
1 274 . 19 1 1 A 22 22 GLN C C 111 173.336 174.322 -0.986 1
1 275 . 19 1 1 A 22 22 GLN CA C 111 56.510 57.260 -0.750 1
1 276 . 19 1 1 A 22 22 GLN CB C 111 26.800 26.404 0.396 1
1 278 . 19 1 1 A 22 22 GLN N N 111 113.926 115.605 -1.679 1
1 280 . 19 1 1 A 23 23 CYS H H 112 7.407 7.455 -0.048 1
1 281 . 19 1 1 A 23 23 CYS HA H 112 4.469 4.834 -0.365 1
1 284 . 19 1 1 A 23 23 CYS CA C 112 52.650 57.150 -4.500 1
1 285 . 19 1 1 A 23 23 CYS CB C 112 29.750 28.694 1.056 1
1 286 . 19 1 1 A 23 23 CYS N N 112 112.681 117.874 -5.193 1
1 287 . 19 1 1 A 24 24 PRO HA H 113 4.408 4.530 -0.122 1
1 294 . 19 1 1 A 24 24 PRO C C 113 178.175 177.359 0.816 1
1 295 . 19 1 1 A 24 24 PRO CA C 113 62.040 62.564 -0.524 1
1 296 . 19 1 1 A 24 24 PRO CB C 113 31.920 32.846 -0.926 1
1 299 . 19 1 1 A 25 25 LEU H H 114 8.593 8.415 0.178 1
1 300 . 19 1 1 A 25 25 LEU HA H 114 3.765 3.903 -0.138 1
1 310 . 19 1 1 A 25 25 LEU C C 114 179.950 178.851 1.099 1
1 311 . 19 1 1 A 25 25 LEU CA C 114 57.674 57.820 -0.146 1
1 312 . 19 1 1 A 25 25 LEU CB C 114 40.690 41.376 -0.686 1
1 316 . 19 1 1 A 25 25 LEU N N 114 123.729 123.052 0.677 1
1 317 . 19 1 1 A 26 26 GLU H H 115 9.108 8.552 0.556 1
1 318 . 19 1 1 A 26 26 GLU HA H 115 3.876 4.081 -0.205 1
1 323 . 19 1 1 A 26 26 GLU C C 115 177.505 178.567 -1.062 1
1 324 . 19 1 1 A 26 26 GLU CA C 115 59.410 59.144 0.266 1
1 325 . 19 1 1 A 26 26 GLU CB C 115 28.460 29.435 -0.975 1
1 327 . 19 1 1 A 26 26 GLU N N 115 116.817 117.329 -0.512 1
1 328 . 19 1 1 A 27 27 ALA H H 116 7.360 7.655 -0.295 1
1 329 . 19 1 1 A 27 27 ALA HA H 116 4.408 4.188 0.220 1
1 333 . 19 1 1 A 27 27 ALA C C 116 177.046 177.906 -0.860 1
1 334 . 19 1 1 A 27 27 ALA CA C 116 52.970 54.370 -1.400 1
1 335 . 19 1 1 A 27 27 ALA CB C 116 19.916 18.446 1.470 1
1 336 . 19 1 1 A 27 27 ALA N N 116 118.966 120.816 -1.850 1
1 337 . 19 1 1 A 28 28 ILE H H 117 7.168 7.142 0.026 1
1 338 . 19 1 1 A 28 28 ILE HA H 117 4.432 4.401 0.031 1
1 348 . 19 1 1 A 28 28 ILE C C 117 172.641 175.577 -2.936 1
1 349 . 19 1 1 A 28 28 ILE CA C 117 59.980 59.637 0.343 1
1 350 . 19 1 1 A 28 28 ILE CB C 117 37.350 37.834 -0.484 1
1 354 . 19 1 1 A 28 28 ILE N N 117 108.913 109.034 -0.121 1
1 355 . 19 1 1 A 29 29 GLN H H 118 6.562 7.219 -0.657 1
1 356 . 19 1 1 A 29 29 GLN HA H 118 3.922 4.166 -0.244 1
1 363 . 19 1 1 A 29 29 GLN C C 118 175.049 175.470 -0.421 1
1 364 . 19 1 1 A 29 29 GLN CA C 118 54.596 55.936 -1.340 1
1 365 . 19 1 1 A 29 29 GLN CB C 118 29.570 29.100 0.470 1
1 367 . 19 1 1 A 29 29 GLN N N 118 116.455 123.418 -6.963 1
1 369 . 19 1 1 A 30 30 CYS H H 119 8.138 8.465 -0.327 1
1 370 . 19 1 1 A 30 30 CYS HA H 119 4.580 4.631 -0.051 1
1 373 . 19 1 1 A 30 30 CYS CA C 119 57.810 57.049 0.761 1
1 374 . 19 1 1 A 30 30 CYS CB C 119 30.200 28.685 1.515 1
1 375 . 19 1 1 A 30 30 CYS N N 119 134.136 125.316 8.820 1
1 376 . 19 1 1 A 31 31 PRO HA H 120 4.424 4.421 0.003 1
1 383 . 19 1 1 A 31 31 PRO C C 120 177.431 177.452 -0.021 1
1 384 . 19 1 1 A 31 31 PRO CA C 120 64.060 64.067 -0.007 1
1 385 . 19 1 1 A 31 31 PRO CB C 120 32.776 31.963 0.813 1
1 388 . 19 1 1 A 32 32 ILE H H 121 11.318 7.688 3.630 1
1 389 . 19 1 1 A 32 32 ILE HA H 121 4.038 3.937 0.101 1
1 399 . 19 1 1 A 32 32 ILE C C 121 178.485 177.681 0.804 1
1 400 . 19 1 1 A 32 32 ILE CA C 121 64.060 64.149 -0.089 1
1 401 . 19 1 1 A 32 32 ILE CB C 121 39.340 38.329 1.011 1
1 405 . 19 1 1 A 32 32 ILE N N 121 124.500 117.314 7.186 1
1 406 . 19 1 1 A 33 33 THR H H 122 9.928 7.724 2.204 1
1 407 . 19 1 1 A 33 33 THR HA H 122 4.048 4.391 -0.343 1
1 412 . 19 1 1 A 33 33 THR C C 122 175.793 174.773 1.020 1
1 413 . 19 1 1 A 33 33 THR CA C 122 62.990 61.841 1.149 1
1 414 . 19 1 1 A 33 33 THR CB C 122 70.300 70.577 -0.277 1
1 416 . 19 1 1 A 33 33 THR N N 122 115.136 109.115 6.021 1
1 417 . 19 1 1 A 34 34 LEU H H 123 8.439 7.860 0.579 1
1 418 . 19 1 1 A 34 34 LEU HA H 123 3.912 3.763 0.149 1
1 428 . 19 1 1 A 34 34 LEU C C 123 175.495 175.139 0.356 1
1 429 . 19 1 1 A 34 34 LEU CA C 123 56.290 56.179 0.111 1
1 430 . 19 1 1 A 34 34 LEU CB C 123 38.500 39.725 -1.225 1
1 434 . 19 1 1 A 34 34 LEU N N 123 117.230 119.102 -1.872 1
1 435 . 19 1 1 A 35 35 GLU H H 124 7.816 7.009 0.807 1
1 436 . 19 1 1 A 35 35 GLU HA H 124 4.634 4.841 -0.207 1
1 441 . 19 1 1 A 35 35 GLU C C 124 174.838 173.908 0.930 1
1 442 . 19 1 1 A 35 35 GLU CA C 124 53.780 54.608 -0.828 1
1 443 . 19 1 1 A 35 35 GLU CB C 124 33.710 32.249 1.461 1
1 445 . 19 1 1 A 35 35 GLU N N 124 116.577 114.326 2.251 1
1 446 . 19 1 1 A 36 36 GLN H H 125 8.532 8.555 -0.023 1
1 447 . 19 1 1 A 36 36 GLN HA H 125 4.958 4.418 0.540 1
1 454 . 19 1 1 A 36 36 GLN CA C 125 53.350 53.204 0.146 1
1 455 . 19 1 1 A 36 36 GLN CB C 125 29.950 29.321 0.629 1
1 457 . 19 1 1 A 36 36 GLN N N 125 123.034 122.900 0.134 1
1 459 . 19 1 1 A 37 37 PRO HA H 126 4.458 4.585 -0.127 1
1 466 . 19 1 1 A 37 37 PRO C C 126 176.314 176.873 -0.559 1
1 467 . 19 1 1 A 37 37 PRO CA C 126 62.816 62.722 0.094 1
1 468 . 19 1 1 A 37 37 PRO CB C 126 33.070 32.858 0.212 1
1 471 . 19 1 1 A 38 38 GLU H H 127 8.626 8.351 0.275 1
1 472 . 19 1 1 A 38 38 GLU HA H 127 4.274 4.182 0.092 1
1 477 . 19 1 1 A 38 38 GLU C C 127 177.877 176.619 1.258 1
1 478 . 19 1 1 A 38 38 GLU CA C 127 58.730 58.048 0.682 1
1 479 . 19 1 1 A 38 38 GLU CB C 127 30.340 30.413 -0.073 1
1 481 . 19 1 1 A 38 38 GLU N N 127 120.691 118.855 1.836 1
1 482 . 19 1 1 A 39 39 LYS H H 128 7.861 7.755 0.106 1
1 483 . 19 1 1 A 39 39 LYS HA H 128 4.889 4.928 -0.039 1
1 492 . 19 1 1 A 39 39 LYS C C 128 175.446 174.958 0.488 1
1 493 . 19 1 1 A 39 39 LYS CA C 128 53.670 54.524 -0.854 1
1 494 . 19 1 1 A 39 39 LYS CB C 128 33.630 35.572 -1.942 1
1 498 . 19 1 1 A 39 39 LYS N N 128 117.878 116.799 1.079 1
1 499 . 19 1 1 A 40 40 GLY H H 129 8.426 7.913 0.513 1
1 500 . 19 1 1 A 40 40 GLY HA2 H 129 4.970 3.997 0.973 1
1 501 . 19 1 1 A 40 40 GLY HA3 H 129 2.458 4.159 -1.701 1
1 502 . 19 1 1 A 40 40 GLY C C 129 170.048 172.323 -2.275 1
1 503 . 19 1 1 A 40 40 GLY CA C 129 42.910 44.931 -2.021 1
1 504 . 19 1 1 A 40 40 GLY N N 129 112.604 105.912 6.692 1
1 505 . 19 1 1 A 41 41 ILE H H 130 8.596 9.093 -0.497 1
1 506 . 19 1 1 A 41 41 ILE HA H 130 4.636 5.053 -0.417 1
1 516 . 19 1 1 A 41 41 ILE C C 130 172.691 174.585 -1.894 1
1 517 . 19 1 1 A 41 41 ILE CA C 130 58.500 58.906 -0.406 1
1 518 . 19 1 1 A 41 41 ILE CB C 130 43.320 40.497 2.823 1
1 522 . 19 1 1 A 41 41 ILE N N 130 113.363 117.308 -3.945 1
1 523 . 19 1 1 A 42 42 PHE H H 131 8.994 8.931 0.063 1
1 524 . 19 1 1 A 42 42 PHE HA H 131 5.075 5.455 -0.380 1
1 532 . 19 1 1 A 42 42 PHE C C 131 175.111 175.096 0.015 1
1 533 . 19 1 1 A 42 42 PHE CA C 131 58.680 57.088 1.592 1
1 534 . 19 1 1 A 42 42 PHE CB C 131 42.220 40.852 1.368 1
1 538 . 19 1 1 A 42 42 PHE N N 131 125.156 121.559 3.597 1
1 539 . 19 1 1 A 43 43 VAL H H 132 8.399 9.346 -0.947 1
1 540 . 19 1 1 A 43 43 VAL HA H 132 4.920 4.728 0.192 1
1 548 . 19 1 1 A 43 43 VAL C C 132 178.175 175.159 3.016 1
1 549 . 19 1 1 A 43 43 VAL CA C 132 59.600 61.008 -1.408 1
1 550 . 19 1 1 A 43 43 VAL CB C 132 35.920 34.403 1.517 1
1 553 . 19 1 1 A 43 43 VAL N N 132 119.371 122.823 -3.452 1
1 554 . 19 1 1 A 44 44 LYS H H 133 10.041 8.547 1.494 1
1 555 . 19 1 1 A 44 44 LYS HA H 133 4.920 4.396 0.524 1
1 564 . 19 1 1 A 44 44 LYS C C 133 177.195 175.379 1.816 1
1 565 . 19 1 1 A 44 44 LYS CA C 133 57.310 56.254 1.056 1
1 566 . 19 1 1 A 44 44 LYS CB C 133 34.410 32.418 1.992 1
1 570 . 19 1 1 A 44 44 LYS N N 133 130.928 126.587 4.341 1
1 571 . 19 1 1 A 45 45 ASN H H 134 8.534 9.006 -0.472 1
1 572 . 19 1 1 A 45 45 ASN HA H 134 4.151 4.719 -0.568 1
1 577 . 19 1 1 A 45 45 ASN C C 134 174.217 175.326 -1.109 1
1 578 . 19 1 1 A 45 45 ASN CA C 134 55.290 52.483 2.807 1
1 579 . 19 1 1 A 45 45 ASN CB C 134 37.530 37.891 -0.361 1
1 580 . 19 1 1 A 45 45 ASN N N 134 119.452 124.308 -4.856 1
1 582 . 19 1 1 A 46 46 SER H H 135 7.570 8.256 -0.686 1
1 583 . 19 1 1 A 46 46 SER HA H 135 4.220 4.136 0.084 1
1 586 . 19 1 1 A 46 46 SER C C 135 174.490 176.735 -2.245 1
1 587 . 19 1 1 A 46 46 SER CA C 135 57.090 61.167 -4.077 1
1 588 . 19 1 1 A 46 46 SER CB C 135 64.126 63.062 1.064 1
1 589 . 19 1 1 A 46 46 SER N N 135 105.613 121.490 -15.877 1
1 590 . 19 1 1 A 47 47 ASP H H 136 9.113 8.090 1.023 1
1 591 . 19 1 1 A 47 47 ASP HA H 136 4.220 4.312 -0.092 1
1 594 . 19 1 1 A 47 47 ASP CA C 136 57.610 57.071 0.539 1
1 595 . 19 1 1 A 47 47 ASP CB C 136 40.810 40.510 0.300 1
1 596 . 19 1 1 A 47 47 ASP N N 136 120.995 121.245 -0.250 1
1 597 . 19 1 1 A 48 48 GLY H H 137 8.172 8.142 0.030 1
1 598 . 19 1 1 A 48 48 GLY HA2 H 137 4.096 3.782 0.314 1
1 599 . 19 1 1 A 48 48 GLY HA3 H 137 3.664 3.793 -0.129 1
1 600 . 19 1 1 A 48 48 GLY C C 137 173.990 175.413 -1.423 1
1 601 . 19 1 1 A 48 48 GLY CA C 137 45.130 47.437 -2.307 1
1 602 . 19 1 1 A 48 48 GLY N N 137 105.838 107.441 -1.603 1
1 603 . 19 1 1 A 49 49 SER H H 138 7.252 7.714 -0.462 1
1 604 . 19 1 1 A 49 49 SER HA H 138 4.503 4.755 -0.252 1
1 607 . 19 1 1 A 49 49 SER C C 138 173.857 173.463 0.394 1
1 608 . 19 1 1 A 49 49 SER CA C 138 57.340 57.296 0.044 1
1 609 . 19 1 1 A 49 49 SER CB C 138 65.370 63.600 1.770 1
1 610 . 19 1 1 A 49 49 SER N N 138 114.942 112.158 2.784 1
1 611 . 19 1 1 A 50 50 ASP H H 139 8.276 7.894 0.382 1
1 612 . 19 1 1 A 50 50 ASP HA H 139 4.618 4.323 0.295 1
1 615 . 19 1 1 A 50 50 ASP C C 139 174.577 174.969 -0.392 1
1 616 . 19 1 1 A 50 50 ASP CA C 139 53.116 55.497 -2.381 1
1 617 . 19 1 1 A 50 50 ASP CB C 139 40.520 40.678 -0.158 1
1 618 . 19 1 1 A 50 50 ASP N N 139 122.088 120.484 1.604 1
1 619 . 19 1 1 A 51 51 VAL H H 140 8.192 7.546 0.646 1
1 620 . 19 1 1 A 51 51 VAL HA H 140 4.299 4.097 0.202 1
1 628 . 19 1 1 A 51 51 VAL C C 140 175.867 174.824 1.043 1
1 629 . 19 1 1 A 51 51 VAL CA C 140 62.950 62.610 0.340 1
1 630 . 19 1 1 A 51 51 VAL CB C 140 33.230 31.689 1.541 1
1 632 . 19 1 1 A 51 51 VAL N N 140 121.167 120.476 0.691 1
1 633 . 19 1 1 A 52 52 CYS H H 141 8.391 8.736 -0.345 1
1 634 . 19 1 1 A 52 52 CYS HA H 141 5.247 5.349 -0.102 1
1 637 . 19 1 1 A 52 52 CYS C C 141 172.778 174.855 -2.077 1
1 638 . 19 1 1 A 52 52 CYS CA C 141 56.480 58.516 -2.036 1
1 639 . 19 1 1 A 52 52 CYS CB C 141 31.960 28.328 3.632 1
1 640 . 19 1 1 A 52 52 CYS N N 141 121.884 127.014 -5.130 1
1 641 . 19 1 1 A 53 53 THR H H 142 8.777 8.816 -0.039 1
1 642 . 19 1 1 A 53 53 THR HA H 142 4.489 5.057 -0.568 1
1 648 . 19 1 1 A 53 53 THR C C 142 171.885 172.534 -0.649 1
1 649 . 19 1 1 A 53 53 THR CA C 142 62.070 61.468 0.602 1
1 650 . 19 1 1 A 53 53 THR CB C 142 71.390 72.745 -1.355 1
1 652 . 19 1 1 A 53 53 THR N N 142 118.132 117.611 0.521 1
1 653 . 19 1 1 A 54 54 LEU H H 143 8.409 8.345 0.064 1
1 654 . 19 1 1 A 54 54 LEU HA H 143 4.276 4.393 -0.117 1
1 664 . 19 1 1 A 54 54 LEU C C 143 174.366 174.115 0.251 1
1 665 . 19 1 1 A 54 54 LEU CA C 143 54.330 53.213 1.117 1
1 666 . 19 1 1 A 54 54 LEU CB C 143 42.396 43.140 -0.744 1
1 670 . 19 1 1 A 54 54 LEU N N 143 127.980 126.441 1.539 1
1 671 . 19 1 1 A 55 55 PHE H H 144 8.646 8.873 -0.227 1
1 672 . 19 1 1 A 55 55 PHE HA H 144 5.455 4.820 0.635 1
1 680 . 19 1 1 A 55 55 PHE C C 144 176.054 174.656 1.398 1
1 681 . 19 1 1 A 55 55 PHE CA C 144 55.250 56.100 -0.850 1
1 682 . 19 1 1 A 55 55 PHE CB C 144 44.100 42.092 2.008 1
1 686 . 19 1 1 A 55 55 PHE N N 144 122.010 126.533 -4.523 1
1 687 . 19 1 1 A 56 56 ASP H H 145 11.575 8.291 3.284 1
1 688 . 19 1 1 A 56 56 ASP HA H 145 4.416 4.522 -0.106 1
1 691 . 19 1 1 A 56 56 ASP C C 145 176.748 177.343 -0.595 1
1 692 . 19 1 1 A 56 56 ASP CA C 145 55.840 54.757 1.083 1
1 693 . 19 1 1 A 56 56 ASP CB C 145 44.390 42.220 2.170 1
1 694 . 19 1 1 A 56 56 ASP N N 145 121.936 124.118 -2.182 1
1 695 . 19 1 1 A 57 57 ALA H H 146 8.508 8.813 -0.305 1
1 696 . 19 1 1 A 57 57 ALA HA H 146 3.797 4.069 -0.272 1
1 700 . 19 1 1 A 57 57 ALA C C 146 178.696 180.092 -1.396 1
1 701 . 19 1 1 A 57 57 ALA CA C 146 55.990 55.621 0.369 1
1 702 . 19 1 1 A 57 57 ALA CB C 146 18.840 18.121 0.719 1
1 703 . 19 1 1 A 57 57 ALA N N 146 130.243 129.262 0.981 1
1 704 . 19 1 1 A 58 58 ALA H H 147 8.378 7.679 0.699 1
1 705 . 19 1 1 A 58 58 ALA HA H 147 4.078 4.229 -0.151 1
1 709 . 19 1 1 A 58 58 ALA C C 147 181.091 179.448 1.643 1
1 710 . 19 1 1 A 58 58 ALA CA C 147 54.770 54.971 -0.201 1
1 711 . 19 1 1 A 58 58 ALA CB C 147 17.700 18.524 -0.824 1
1 712 . 19 1 1 A 58 58 ALA N N 147 121.997 120.030 1.967 1
1 713 . 19 1 1 A 59 59 ALA H H 148 9.138 7.948 1.190 1
1 714 . 19 1 1 A 59 59 ALA HA H 148 3.975 4.071 -0.096 1
1 718 . 19 1 1 A 59 59 ALA C C 148 180.508 180.019 0.489 1
1 719 . 19 1 1 A 59 59 ALA CA C 148 54.840 55.059 -0.219 1
1 720 . 19 1 1 A 59 59 ALA CB C 148 18.600 18.596 0.004 1
1 721 . 19 1 1 A 59 59 ALA N N 148 123.595 120.404 3.191 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 4.066 -0.344 1
1 731 . 19 1 1 A 60 60 PHE C C 149 176.773 177.487 -0.714 1
1 732 . 19 1 1 A 60 60 PHE CA C 149 62.030 61.474 0.556 1
1 733 . 19 1 1 A 60 60 PHE CB C 149 39.960 38.776 1.184 1
1 737 . 19 1 1 A 60 60 PHE N N 149 120.354 119.885 0.469 1
1 738 . 19 1 1 A 61 61 SER H H 150 8.276 8.210 0.066 1
1 739 . 19 1 1 A 61 61 SER HA H 150 3.880 4.190 -0.310 1
1 742 . 19 1 1 A 61 61 SER C C 150 177.691 177.052 0.639 1
1 743 . 19 1 1 A 61 61 SER CA C 150 62.190 61.224 0.966 1
1 744 . 19 1 1 A 61 61 SER CB C 150 63.016 63.231 -0.215 1
1 745 . 19 1 1 A 61 61 SER N N 150 112.086 114.122 -2.036 1
1 746 . 19 1 1 A 62 62 ARG H H 151 7.829 7.683 0.146 1
1 747 . 19 1 1 A 62 62 ARG HA H 151 3.971 4.080 -0.109 1
1 754 . 19 1 1 A 62 62 ARG C C 151 178.287 178.638 -0.351 1
1 755 . 19 1 1 A 62 62 ARG CA C 151 59.340 59.032 0.308 1
1 756 . 19 1 1 A 62 62 ARG CB C 151 29.760 29.746 0.014 1
1 759 . 19 1 1 A 62 62 ARG N N 151 121.090 121.712 -0.622 1
1 760 . 19 1 1 A 63 63 LEU H H 152 7.390 7.786 -0.396 1
1 761 . 19 1 1 A 63 63 LEU HA H 152 3.791 3.925 -0.134 1
1 771 . 19 1 1 A 63 63 LEU C C 152 179.106 178.908 0.198 1
1 772 . 19 1 1 A 63 63 LEU CA C 152 58.900 57.892 1.008 1
1 773 . 19 1 1 A 63 63 LEU CB C 152 41.140 41.380 -0.240 1
1 777 . 19 1 1 A 63 63 LEU N N 152 121.129 119.312 1.817 1
1 778 . 19 1 1 A 64 64 VAL H H 153 7.552 7.902 -0.350 1
1 779 . 19 1 1 A 64 64 VAL HA H 153 3.411 3.508 -0.097 1
1 787 . 19 1 1 A 64 64 VAL C C 153 180.595 178.633 1.962 1
1 788 . 19 1 1 A 64 64 VAL CA C 153 65.644 66.266 -0.622 1
1 789 . 19 1 1 A 64 64 VAL CB C 153 31.410 31.522 -0.112 1
1 792 . 19 1 1 A 64 64 VAL N N 153 118.280 117.997 0.283 1
1 793 . 19 1 1 A 65 65 GLY H H 154 8.061 8.094 -0.033 1
1 794 . 19 1 1 A 65 65 GLY HA2 H 154 3.846 3.872 -0.026 1
1 795 . 19 1 1 A 65 65 GLY HA3 H 154 3.809 3.872 -0.063 1
1 796 . 19 1 1 A 65 65 GLY C C 154 175.235 175.125 0.110 1
1 797 . 19 1 1 A 65 65 GLY CA C 154 46.630 46.715 -0.085 1
1 798 . 19 1 1 A 65 65 GLY N N 154 108.622 107.520 1.102 1
1 799 . 19 1 1 A 66 66 GLU H H 155 7.528 7.553 -0.025 1
1 800 . 19 1 1 A 66 66 GLU HA H 155 4.228 4.387 -0.159 1
1 805 . 19 1 1 A 66 66 GLU C C 155 176.761 176.932 -0.171 1
1 806 . 19 1 1 A 66 66 GLU CA C 155 56.590 56.141 0.449 1
1 807 . 19 1 1 A 66 66 GLU CB C 155 30.490 30.666 -0.176 1
1 809 . 19 1 1 A 66 66 GLU N N 155 118.361 118.283 0.078 1
1 810 . 19 1 1 A 67 67 GLY H H 156 7.884 7.967 -0.083 1
1 811 . 19 1 1 A 67 67 GLY HA2 H 156 3.918 3.931 -0.013 1
1 812 . 19 1 1 A 67 67 GLY HA3 H 156 3.747 3.941 -0.194 1
1 813 . 19 1 1 A 67 67 GLY C C 156 174.788 174.341 0.447 1
1 814 . 19 1 1 A 67 67 GLY CA C 156 45.890 45.417 0.473 1
1 815 . 19 1 1 A 67 67 GLY N N 156 108.465 108.887 -0.422 1
1 816 . 19 1 1 A 68 68 LEU H H 157 7.332 7.747 -0.415 1
1 817 . 19 1 1 A 68 68 LEU HA H 157 4.361 4.462 -0.101 1
1 827 . 19 1 1 A 68 68 LEU CA C 157 53.060 52.464 0.596 1
1 828 . 19 1 1 A 68 68 LEU CB C 157 41.100 41.784 -0.684 1
1 832 . 19 1 1 A 68 68 LEU N N 157 121.920 121.941 -0.021 1
1 833 . 19 1 1 A 69 69 PRO HA H 158 4.485 4.594 -0.109 1
1 840 . 19 1 1 A 69 69 PRO C C 158 174.602 176.235 -1.633 1
1 841 . 19 1 1 A 69 69 PRO CA C 158 61.556 62.228 -0.672 1
1 842 . 19 1 1 A 69 69 PRO CB C 158 32.370 32.957 -0.587 1
1 845 . 19 1 1 A 70 70 HIS H H 159 8.759 8.695 0.064 1
1 846 . 19 1 1 A 70 70 HIS HA H 159 3.947 4.487 -0.540 1
1 852 . 19 1 1 A 70 70 HIS CA C 159 56.250 55.180 1.070 1
1 853 . 19 1 1 A 70 70 HIS CB C 159 32.280 30.986 1.294 1
1 856 . 19 1 1 A 70 70 HIS N N 159 119.423 120.464 -1.041 1
1 857 . 19 1 1 A 71 71 PRO HA H 160 4.424 4.329 0.095 1
1 864 . 19 1 1 A 71 71 PRO C C 160 177.567 178.473 -0.906 1
1 865 . 19 1 1 A 71 71 PRO CA C 160 64.574 64.714 -0.140 1
1 866 . 19 1 1 A 71 71 PRO CB C 160 32.340 32.112 0.228 1
1 869 . 19 1 1 A 72 72 LEU H H 161 10.123 7.560 2.563 1
1 870 . 19 1 1 A 72 72 LEU HA H 161 4.778 4.189 0.589 1
1 880 . 19 1 1 A 72 72 LEU C C 161 178.721 177.794 0.927 1
1 881 . 19 1 1 A 72 72 LEU CA C 161 55.800 57.627 -1.827 1
1 882 . 19 1 1 A 72 72 LEU CB C 161 42.440 41.898 0.542 1
1 886 . 19 1 1 A 72 72 LEU N N 161 117.374 117.389 -0.015 1
1 887 . 19 1 1 A 73 73 THR H H 162 7.523 7.710 -0.187 1
1 888 . 19 1 1 A 73 73 THR HA H 162 4.291 4.549 -0.258 1
1 893 . 19 1 1 A 73 73 THR C C 162 175.557 174.419 1.138 1
1 894 . 19 1 1 A 73 73 THR CA C 162 61.440 62.531 -1.091 1
1 895 . 19 1 1 A 73 73 THR CB C 162 70.500 69.783 0.717 1
1 897 . 19 1 1 A 73 73 THR N N 162 107.787 111.691 -3.904 1
1 898 . 19 1 1 A 74 74 ARG H H 163 8.361 7.903 0.458 1
1 899 . 19 1 1 A 74 74 ARG HA H 163 3.836 4.338 -0.502 1
1 906 . 19 1 1 A 74 74 ARG C C 163 174.701 175.076 -0.375 1
1 907 . 19 1 1 A 74 74 ARG CA C 163 57.980 57.572 0.408 1
1 908 . 19 1 1 A 74 74 ARG CB C 163 26.770 27.081 -0.311 1
1 911 . 19 1 1 A 74 74 ARG N N 163 115.130 118.409 -3.279 1
1 912 . 19 1 1 A 75 75 GLU H H 164 7.430 8.095 -0.665 1
1 913 . 19 1 1 A 75 75 GLU HA H 164 4.636 4.486 0.150 1
1 918 . 19 1 1 A 75 75 GLU CA C 164 53.699 54.787 -1.088 1
1 919 . 19 1 1 A 75 75 GLU CB C 164 29.550 28.963 0.587 1
1 921 . 19 1 1 A 75 75 GLU N N 164 120.076 119.047 1.029 1
1 922 . 19 1 1 A 76 76 PRO HA H 165 4.272 4.442 -0.170 1
1 929 . 19 1 1 A 76 76 PRO C C 165 176.649 176.845 -0.196 1
1 930 . 19 1 1 A 76 76 PRO CA C 165 63.204 63.102 0.102 1
1 931 . 19 1 1 A 76 76 PRO CB C 165 31.680 31.760 -0.080 1
1 934 . 19 1 1 A 77 77 ILE H H 166 8.812 8.216 0.596 1
1 935 . 19 1 1 A 77 77 ILE HA H 166 3.838 4.263 -0.425 1
1 945 . 19 1 1 A 77 77 ILE C C 166 175.235 175.926 -0.691 1
1 946 . 19 1 1 A 77 77 ILE CA C 166 62.816 61.151 1.665 1
1 947 . 19 1 1 A 77 77 ILE CB C 166 37.750 38.204 -0.454 1
1 951 . 19 1 1 A 77 77 ILE N N 166 123.831 123.839 -0.008 1
1 952 . 19 1 1 A 78 78 THR H H 167 6.625 8.511 -1.886 1
1 953 . 19 1 1 A 78 78 THR HA H 167 4.632 5.070 -0.438 1
1 958 . 19 1 1 A 78 78 THR C C 167 174.143 174.687 -0.544 1
1 959 . 19 1 1 A 78 78 THR CA C 167 58.750 59.998 -1.248 1
1 960 . 19 1 1 A 78 78 THR CB C 167 71.320 71.340 -0.020 1
1 962 . 19 1 1 A 78 78 THR N N 167 115.293 117.463 -2.170 1
1 963 . 19 1 1 A 79 79 ALA H H 168 9.088 9.032 0.056 1
1 964 . 19 1 1 A 79 79 ALA HA H 168 3.916 4.088 -0.172 1
1 968 . 19 1 1 A 79 79 ALA C C 168 179.788 179.485 0.303 1
1 969 . 19 1 1 A 79 79 ALA CA C 168 55.480 55.122 0.358 1
1 970 . 19 1 1 A 79 79 ALA CB C 168 17.630 18.368 -0.738 1
1 971 . 19 1 1 A 79 79 ALA N N 168 122.102 128.061 -5.959 1
1 972 . 19 1 1 A 80 80 SER H H 169 7.988 7.588 0.400 1
1 973 . 19 1 1 A 80 80 SER HA H 169 4.058 4.192 -0.134 1
1 976 . 19 1 1 A 80 80 SER C C 169 176.029 176.488 -0.459 1
1 977 . 19 1 1 A 80 80 SER CA C 169 60.750 61.492 -0.742 1
1 978 . 19 1 1 A 80 80 SER CB C 169 62.510 62.884 -0.374 1
1 979 . 19 1 1 A 80 80 SER N N 169 109.541 113.143 -3.602 1
1 980 . 19 1 1 A 81 81 ILE H H 170 6.968 7.598 -0.630 1
1 981 . 19 1 1 A 81 81 ILE HA H 170 4.315 4.305 0.010 1
1 991 . 19 1 1 A 81 81 ILE C C 170 174.242 175.523 -1.281 1
1 992 . 19 1 1 A 81 81 ILE CA C 170 62.296 61.953 0.343 1
1 993 . 19 1 1 A 81 81 ILE CB C 170 37.686 38.145 -0.459 1
1 997 . 19 1 1 A 81 81 ILE N N 170 112.476 112.998 -0.522 1
1 998 . 19 1 1 A 82 82 ILE H H 171 7.345 7.397 -0.052 1
1 999 . 19 1 1 A 82 82 ILE HA H 171 4.339 4.642 -0.303 1
1 1009 . 19 1 1 A 82 82 ILE C C 171 174.999 174.694 0.305 1
1 1010 . 19 1 1 A 82 82 ILE CA C 171 61.150 60.245 0.905 1
1 1011 . 19 1 1 A 82 82 ILE CB C 171 37.230 40.552 -3.322 1
1 1015 . 19 1 1 A 82 82 ILE N N 171 124.260 124.596 -0.336 1
1 1016 . 19 1 1 A 83 83 VAL H H 172 7.923 9.169 -1.246 1
1 1017 . 19 1 1 A 83 83 VAL HA H 172 4.673 5.073 -0.400 1
1 1025 . 19 1 1 A 83 83 VAL C C 172 174.887 175.013 -0.126 1
1 1026 . 19 1 1 A 83 83 VAL CA C 172 59.340 58.943 0.397 1
1 1027 . 19 1 1 A 83 83 VAL CB C 172 34.840 36.126 -1.286 1
1 1030 . 19 1 1 A 83 83 VAL N N 172 120.931 121.859 -0.928 1
1 1031 . 19 1 1 A 84 84 LYS H H 173 8.406 8.596 -0.190 1
1 1032 . 19 1 1 A 84 84 LYS HA H 173 4.410 4.771 -0.361 1
1 1041 . 19 1 1 A 84 84 LYS C C 173 178.734 177.874 0.860 1
1 1042 . 19 1 1 A 84 84 LYS CA C 173 56.360 54.562 1.798 1
1 1043 . 19 1 1 A 84 84 LYS CB C 173 33.100 34.393 -1.293 1
1 1047 . 19 1 1 A 84 84 LYS N N 173 121.251 120.609 0.642 1
1 1048 . 19 1 1 A 85 85 HIS H H 174 9.221 9.109 0.112 1
1 1049 . 19 1 1 A 85 85 HIS HA H 174 4.024 4.402 -0.378 1
1 1053 . 19 1 1 A 85 85 HIS C C 174 177.183 176.837 0.346 1
1 1054 . 19 1 1 A 85 85 HIS CA C 174 59.460 58.507 0.953 1
1 1055 . 19 1 1 A 85 85 HIS CB C 174 27.920 28.787 -0.867 1
1 1057 . 19 1 1 A 85 85 HIS N N 174 121.545 120.719 0.826 1
1 1058 . 19 1 1 A 86 86 GLU H H 175 8.699 8.033 0.666 1
1 1059 . 19 1 1 A 86 86 GLU HA H 175 3.900 3.746 0.154 1
1 1064 . 19 1 1 A 86 86 GLU C C 175 177.220 178.510 -1.290 1
1 1065 . 19 1 1 A 86 86 GLU CA C 175 58.420 58.668 -0.248 1
1 1066 . 19 1 1 A 86 86 GLU CB C 175 28.690 29.010 -0.320 1
1 1068 . 19 1 1 A 86 86 GLU N N 175 118.011 120.098 -2.087 1
1 1069 . 19 1 1 A 87 87 GLU H H 176 7.621 7.791 -0.170 1
1 1070 . 19 1 1 A 87 87 GLU HA H 176 4.177 4.059 0.118 1
1 1075 . 19 1 1 A 87 87 GLU C C 176 175.222 176.013 -0.791 1
1 1076 . 19 1 1 A 87 87 GLU CA C 176 56.390 58.495 -2.105 1
1 1077 . 19 1 1 A 87 87 GLU CB C 176 30.430 30.360 0.070 1
1 1079 . 19 1 1 A 87 87 GLU N N 176 116.753 117.819 -1.066 1
1 1080 . 19 1 1 A 88 88 CYS H H 177 7.239 7.644 -0.405 1
1 1081 . 19 1 1 A 88 88 CYS HA H 177 5.148 5.140 0.008 1
1 1084 . 19 1 1 A 88 88 CYS C C 177 173.249 173.500 -0.251 1
1 1085 . 19 1 1 A 88 88 CYS CA C 177 57.240 56.665 0.575 1
1 1086 . 19 1 1 A 88 88 CYS CB C 177 31.020 31.074 -0.054 1
1 1087 . 19 1 1 A 88 88 CYS N N 177 116.096 115.250 0.846 1
1 1088 . 19 1 1 A 89 89 ILE H H 178 8.912 8.664 0.248 1
1 1089 . 19 1 1 A 89 89 ILE HA H 178 4.580 4.965 -0.385 1
1 1099 . 19 1 1 A 89 89 ILE C C 178 173.386 174.161 -0.775 1
1 1100 . 19 1 1 A 89 89 ILE CA C 178 59.270 58.960 0.310 1
1 1101 . 19 1 1 A 89 89 ILE CB C 178 42.990 41.835 1.155 1
1 1105 . 19 1 1 A 89 89 ILE N N 178 119.490 117.132 2.358 1
1 1106 . 19 1 1 A 90 90 TYR H H 179 9.047 8.674 0.373 1
1 1107 . 19 1 1 A 90 90 TYR HA H 179 3.753 3.970 -0.217 1
1 1112 . 19 1 1 A 90 90 TYR C C 179 173.932 173.970 -0.038 1
1 1113 . 19 1 1 A 90 90 TYR CA C 179 59.860 57.406 2.454 1
1 1114 . 19 1 1 A 90 90 TYR CB C 179 37.530 38.513 -0.983 1
1 1116 . 19 1 1 A 90 90 TYR N N 179 126.270 121.832 4.438 1
1 1117 . 19 1 1 A 91 91 ASP H H 180 7.462 8.198 -0.736 1
1 1118 . 19 1 1 A 91 91 ASP HA H 180 4.639 4.745 -0.106 1
1 1121 . 19 1 1 A 91 91 ASP C C 180 175.297 176.176 -0.879 1
1 1122 . 19 1 1 A 91 91 ASP CA C 180 52.496 52.680 -0.184 1
1 1123 . 19 1 1 A 91 91 ASP CB C 180 43.380 42.792 0.588 1
1 1124 . 19 1 1 A 91 91 ASP N N 180 129.593 124.463 5.130 1
1 1125 . 19 1 1 A 92 92 ASP H H 181 8.719 9.071 -0.352 1
1 1126 . 19 1 1 A 92 92 ASP HA H 181 4.109 4.354 -0.245 1
1 1129 . 19 1 1 A 92 92 ASP C C 181 177.555 177.539 0.016 1
1 1130 . 19 1 1 A 92 92 ASP CA C 181 56.390 57.369 -0.979 1
1 1131 . 19 1 1 A 92 92 ASP CB C 181 41.330 41.057 0.273 1
1 1132 . 19 1 1 A 92 92 ASP N N 181 125.691 126.729 -1.038 1
1 1133 . 19 1 1 A 93 93 THR H H 182 8.271 7.615 0.656 1
1 1134 . 19 1 1 A 93 93 THR HA H 182 4.036 3.956 0.080 1
1 1139 . 19 1 1 A 93 93 THR C C 182 176.289 176.466 -0.177 1
1 1140 . 19 1 1 A 93 93 THR CA C 182 65.054 65.103 -0.049 1
1 1141 . 19 1 1 A 93 93 THR CB C 182 68.560 68.821 -0.261 1
1 1143 . 19 1 1 A 93 93 THR N N 182 114.813 113.648 1.165 1
1 1144 . 19 1 1 A 94 94 ARG H H 183 7.753 7.521 0.232 1
1 1145 . 19 1 1 A 94 94 ARG HA H 183 4.139 4.225 -0.086 1
1 1152 . 19 1 1 A 94 94 ARG C C 183 176.897 177.095 -0.198 1
1 1153 . 19 1 1 A 94 94 ARG CA C 183 55.350 56.234 -0.884 1
1 1154 . 19 1 1 A 94 94 ARG CB C 183 30.930 30.707 0.223 1
1 1157 . 19 1 1 A 94 94 ARG N N 183 120.101 117.742 2.359 1
1 1158 . 19 1 1 A 95 95 GLY H H 184 8.112 8.785 -0.673 1
1 1159 . 19 1 1 A 95 95 GLY HA2 H 184 3.838 3.885 -0.047 1
1 1160 . 19 1 1 A 95 95 GLY HA3 H 184 3.670 3.887 -0.217 1
1 1161 . 19 1 1 A 95 95 GLY C C 184 173.659 173.313 0.346 1
1 1162 . 19 1 1 A 95 95 GLY CA C 184 46.040 45.903 0.137 1
1 1163 . 19 1 1 A 95 95 GLY N N 184 108.106 109.260 -1.154 1
1 1164 . 19 1 1 A 96 96 ASN H H 185 6.833 7.444 -0.611 1
1 1165 . 19 1 1 A 96 96 ASN HA H 185 4.944 4.999 -0.055 1
1 1170 . 19 1 1 A 96 96 ASN C C 185 174.267 173.557 0.710 1
1 1171 . 19 1 1 A 96 96 ASN CA C 185 52.560 52.426 0.134 1
1 1172 . 19 1 1 A 96 96 ASN CB C 185 45.890 41.546 4.344 1
1 1173 . 19 1 1 A 96 96 ASN N N 185 113.392 116.586 -3.194 1
1 1175 . 19 1 1 A 97 97 PHE H H 186 9.108 8.685 0.423 1
1 1176 . 19 1 1 A 97 97 PHE HA H 186 4.782 4.876 -0.094 1
1 1183 . 19 1 1 A 97 97 PHE C C 186 174.862 175.729 -0.867 1
1 1184 . 19 1 1 A 97 97 PHE CA C 186 60.056 59.779 0.277 1
1 1185 . 19 1 1 A 97 97 PHE CB C 186 40.180 39.620 0.560 1
1 1188 . 19 1 1 A 97 97 PHE N N 186 118.741 119.403 -0.662 1
1 1189 . 19 1 1 A 98 98 ILE H H 187 8.933 8.537 0.396 1
1 1190 . 19 1 1 A 98 98 ILE HA H 187 5.458 4.938 0.520 1
1 1200 . 19 1 1 A 98 98 ILE C C 187 176.041 175.013 1.028 1
1 1201 . 19 1 1 A 98 98 ILE CA C 187 57.610 59.081 -1.471 1
1 1202 . 19 1 1 A 98 98 ILE CB C 187 42.070 42.114 -0.044 1
1 1206 . 19 1 1 A 98 98 ILE N N 187 117.857 118.553 -0.696 1
1 1207 . 19 1 1 A 99 99 ILE H H 188 8.284 8.418 -0.134 1
1 1208 . 19 1 1 A 99 99 ILE HA H 188 4.341 4.122 0.219 1
1 1218 . 19 1 1 A 99 99 ILE C C 188 176.413 176.456 -0.043 1
1 1219 . 19 1 1 A 99 99 ILE CA C 188 59.190 61.696 -2.506 1
1 1220 . 19 1 1 A 99 99 ILE CB C 188 37.940 38.298 -0.358 1
1 1224 . 19 1 1 A 99 99 ILE N N 188 121.796 122.755 -0.959 1
1 1225 . 19 1 1 A 100 100 LYS H H 189 8.463 8.176 0.287 1
1 1226 . 19 1 1 A 100 100 LYS HA H 189 4.040 4.178 -0.138 1
1 1235 . 19 1 1 A 100 100 LYS C C 189 176.848 177.600 -0.752 1
1 1236 . 19 1 1 A 100 100 LYS CA C 189 57.241 56.666 0.575 1
1 1237 . 19 1 1 A 100 100 LYS CB C 189 33.400 32.182 1.218 1
1 1241 . 19 1 1 A 100 100 LYS N N 189 127.995 124.055 3.940 1
1 1242 . 19 1 1 A 101 101 GLY H H 190 8.346 8.722 -0.376 1
1 1243 . 19 1 1 A 101 101 GLY HA2 H 190 3.947 4.016 -0.069 1
1 1244 . 19 1 1 A 101 101 GLY HA3 H 190 3.813 4.019 -0.206 1
1 1245 . 19 1 1 A 101 101 GLY C C 190 172.902 173.960 -1.058 1
1 1246 . 19 1 1 A 101 101 GLY CA C 190 44.920 45.164 -0.244 1
1 1247 . 19 1 1 A 101 101 GLY N N 190 110.882 113.434 -2.552 1
1 7 . 20 1 1 A 2 2 GLN H H 91 8.786 8.221 0.565 1
1 8 . 20 1 1 A 2 2 GLN HA H 91 4.005 3.967 0.038 1
1 15 . 20 1 1 A 2 2 GLN C C 91 177.270 179.091 -1.821 1
1 16 . 20 1 1 A 2 2 GLN CA C 91 58.220 59.009 -0.789 1
1 17 . 20 1 1 A 2 2 GLN CB C 91 28.650 28.319 0.331 1
1 19 . 20 1 1 A 2 2 GLN N N 91 121.993 120.538 1.455 1
1 21 . 20 1 1 A 3 3 GLU H H 92 8.430 8.414 0.016 1
1 22 . 20 1 1 A 3 3 GLU HA H 92 4.007 4.101 -0.094 1
1 27 . 20 1 1 A 3 3 GLU C C 92 178.287 178.790 -0.503 1
1 28 . 20 1 1 A 3 3 GLU CA C 92 59.490 59.121 0.369 1
1 29 . 20 1 1 A 3 3 GLU CB C 92 29.506 28.814 0.692 1
1 31 . 20 1 1 A 3 3 GLU N N 92 120.195 118.875 1.320 1
1 32 . 20 1 1 A 4 4 SER H H 93 8.209 7.763 0.446 1
1 33 . 20 1 1 A 4 4 SER HA H 93 4.272 4.276 -0.004 1
1 36 . 20 1 1 A 4 4 SER C C 93 177.369 177.504 -0.135 1
1 37 . 20 1 1 A 4 4 SER CA C 93 61.044 61.413 -0.369 1
1 38 . 20 1 1 A 4 4 SER CB C 93 62.950 62.956 -0.006 1
1 39 . 20 1 1 A 4 4 SER N N 93 115.524 115.479 0.045 1
1 40 . 20 1 1 A 5 5 ILE H H 94 8.080 7.462 0.618 1
1 41 . 20 1 1 A 5 5 ILE HA H 94 3.530 3.588 -0.058 1
1 51 . 20 1 1 A 5 5 ILE C C 94 177.778 177.624 0.154 1
1 52 . 20 1 1 A 5 5 ILE CA C 94 65.710 65.247 0.463 1
1 53 . 20 1 1 A 5 5 ILE CB C 94 37.800 37.488 0.312 1
1 57 . 20 1 1 A 5 5 ILE N N 94 124.148 121.483 2.665 1
1 58 . 20 1 1 A 6 6 GLN H H 95 8.374 8.354 0.020 1
1 59 . 20 1 1 A 6 6 GLN HA H 95 4.125 4.028 0.097 1
1 66 . 20 1 1 A 6 6 GLN C C 95 179.726 179.039 0.687 1
1 67 . 20 1 1 A 6 6 GLN CA C 95 59.190 59.141 0.049 1
1 68 . 20 1 1 A 6 6 GLN CB C 95 27.060 28.153 -1.093 1
1 70 . 20 1 1 A 6 6 GLN N N 95 118.257 118.439 -0.182 1
1 72 . 20 1 1 A 7 7 ASN H H 96 8.456 7.990 0.466 1
1 73 . 20 1 1 A 7 7 ASN HA H 96 4.446 4.545 -0.099 1
1 78 . 20 1 1 A 7 7 ASN C C 96 177.257 178.439 -1.182 1
1 79 . 20 1 1 A 7 7 ASN CA C 96 56.020 56.192 -0.172 1
1 80 . 20 1 1 A 7 7 ASN CB C 96 38.126 37.730 0.396 1
1 81 . 20 1 1 A 7 7 ASN N N 96 118.597 118.601 -0.004 1
1 83 . 20 1 1 A 8 8 LYS H H 97 7.732 7.505 0.227 1
1 84 . 20 1 1 A 8 8 LYS HA H 97 4.129 4.053 0.076 1
1 93 . 20 1 1 A 8 8 LYS C C 97 179.143 179.517 -0.374 1
1 94 . 20 1 1 A 8 8 LYS CA C 97 59.126 59.774 -0.648 1
1 95 . 20 1 1 A 8 8 LYS CB C 97 32.070 32.589 -0.519 1
1 99 . 20 1 1 A 8 8 LYS N N 97 122.381 119.165 3.216 1
1 100 . 20 1 1 A 9 9 ILE H H 98 8.452 8.180 0.272 1
1 101 . 20 1 1 A 9 9 ILE HA H 98 3.480 3.646 -0.166 1
1 111 . 20 1 1 A 9 9 ILE C C 98 177.406 178.253 -0.847 1
1 112 . 20 1 1 A 9 9 ILE CA C 98 66.430 65.209 1.221 1
1 113 . 20 1 1 A 9 9 ILE CB C 98 37.980 37.726 0.254 1
1 117 . 20 1 1 A 9 9 ILE N N 98 119.950 120.975 -1.025 1
1 118 . 20 1 1 A 10 10 SER H H 99 7.924 8.150 -0.226 1
1 119 . 20 1 1 A 10 10 SER HA H 99 3.983 4.171 -0.188 1
1 122 . 20 1 1 A 10 10 SER C C 99 176.327 176.655 -0.328 1
1 123 . 20 1 1 A 10 10 SER CA C 99 61.990 61.251 0.739 1
1 124 . 20 1 1 A 10 10 SER CB C 99 62.790 63.117 -0.327 1
1 125 . 20 1 1 A 10 10 SER N N 99 113.568 115.734 -2.166 1
1 126 . 20 1 1 A 11 11 GLN H H 100 7.832 7.252 0.580 1
1 127 . 20 1 1 A 11 11 GLN HA H 100 4.238 4.204 0.034 1
1 134 . 20 1 1 A 11 11 GLN C C 100 178.088 177.757 0.331 1
1 135 . 20 1 1 A 11 11 GLN CA C 100 57.900 58.046 -0.146 1
1 136 . 20 1 1 A 11 11 GLN CB C 100 29.790 28.936 0.854 1
1 138 . 20 1 1 A 11 11 GLN N N 100 117.487 120.300 -2.813 1
1 140 . 20 1 1 A 12 12 CYS H H 101 7.920 7.982 -0.062 1
1 141 . 20 1 1 A 12 12 CYS HA H 101 4.657 4.565 0.092 1
1 144 . 20 1 1 A 12 12 CYS C C 101 175.446 174.683 0.763 1
1 145 . 20 1 1 A 12 12 CYS CA C 101 60.654 58.675 1.979 1
1 146 . 20 1 1 A 12 12 CYS CB C 101 29.310 27.333 1.977 1
1 147 . 20 1 1 A 12 12 CYS N N 101 114.221 115.922 -1.701 1
1 148 . 20 1 1 A 13 13 LYS H H 102 8.029 7.363 0.666 1
1 149 . 20 1 1 A 13 13 LYS HA H 102 5.069 4.775 0.294 1
1 158 . 20 1 1 A 13 13 LYS C C 102 174.800 176.280 -1.480 1
1 159 . 20 1 1 A 13 13 LYS CA C 102 56.394 55.947 0.447 1
1 160 . 20 1 1 A 13 13 LYS CB C 102 32.770 33.403 -0.633 1
1 164 . 20 1 1 A 13 13 LYS N N 102 124.129 119.787 4.342 1
1 165 . 20 1 1 A 14 14 PHE H H 103 8.737 8.556 0.181 1
1 166 . 20 1 1 A 14 14 PHE HA H 103 5.059 5.142 -0.083 1
1 174 . 20 1 1 A 14 14 PHE C C 103 173.560 173.407 0.153 1
1 175 . 20 1 1 A 14 14 PHE CA C 103 55.470 56.099 -0.629 1
1 176 . 20 1 1 A 14 14 PHE CB C 103 41.760 41.214 0.546 1
1 180 . 20 1 1 A 14 14 PHE N N 103 118.661 116.606 2.055 1
1 181 . 20 1 1 A 15 15 SER H H 104 8.826 8.692 0.134 1
1 182 . 20 1 1 A 15 15 SER HA H 104 4.602 4.728 -0.126 1
1 185 . 20 1 1 A 15 15 SER C C 104 173.795 173.971 -0.176 1
1 186 . 20 1 1 A 15 15 SER CA C 104 58.610 57.901 0.709 1
1 187 . 20 1 1 A 15 15 SER CB C 104 62.690 63.014 -0.324 1
1 188 . 20 1 1 A 15 15 SER N N 104 117.781 114.759 3.022 1
1 189 . 20 1 1 A 16 16 VAL H H 105 7.784 8.300 -0.516 1
1 190 . 20 1 1 A 16 16 VAL HA H 105 3.370 4.296 -0.926 1
1 198 . 20 1 1 A 16 16 VAL C C 105 174.987 175.187 -0.200 1
1 199 . 20 1 1 A 16 16 VAL CA C 105 63.580 63.223 0.357 1
1 200 . 20 1 1 A 16 16 VAL CB C 105 31.410 31.087 0.323 1
1 203 . 20 1 1 A 16 16 VAL N N 105 129.075 126.215 2.860 1
1 204 . 20 1 1 A 17 17 CYS H H 106 8.536 8.455 0.081 1
1 205 . 20 1 1 A 17 17 CYS HA H 106 5.011 5.045 -0.034 1
1 208 . 20 1 1 A 17 17 CYS CA C 106 55.260 56.105 -0.845 1
1 209 . 20 1 1 A 17 17 CYS CB C 106 28.210 28.663 -0.453 1
1 210 . 20 1 1 A 17 17 CYS N N 106 130.045 126.978 3.067 1
1 211 . 20 1 1 A 18 18 PRO HA H 107 3.991 4.338 -0.347 1
1 218 . 20 1 1 A 18 18 PRO C C 107 178.188 178.381 -0.193 1
1 219 . 20 1 1 A 18 18 PRO CA C 107 65.940 65.185 0.755 1
1 220 . 20 1 1 A 18 18 PRO CB C 107 32.000 31.986 0.014 1
1 223 . 20 1 1 A 19 19 GLU H H 108 9.260 9.070 0.190 1
1 224 . 20 1 1 A 19 19 GLU HA H 108 4.119 4.077 0.042 1
1 229 . 20 1 1 A 19 19 GLU C C 108 178.721 179.014 -0.293 1
1 230 . 20 1 1 A 19 19 GLU CA C 108 59.300 59.391 -0.091 1
1 231 . 20 1 1 A 19 19 GLU CB C 108 28.920 28.785 0.135 1
1 233 . 20 1 1 A 19 19 GLU N N 108 118.270 116.268 2.002 1
1 234 . 20 1 1 A 20 20 ARG H H 109 7.672 7.576 0.096 1
1 235 . 20 1 1 A 20 20 ARG HA H 109 4.331 4.114 0.217 1
1 242 . 20 1 1 A 20 20 ARG C C 109 177.977 178.799 -0.822 1
1 243 . 20 1 1 A 20 20 ARG CA C 109 57.350 58.747 -1.397 1
1 244 . 20 1 1 A 20 20 ARG CB C 109 30.820 30.244 0.576 1
1 247 . 20 1 1 A 20 20 ARG N N 109 118.357 119.285 -0.928 1
1 248 . 20 1 1 A 21 21 LEU H H 110 7.601 7.771 -0.170 1
1 249 . 20 1 1 A 21 21 LEU HA H 110 4.380 4.237 0.143 1
1 259 . 20 1 1 A 21 21 LEU C C 110 176.562 176.757 -0.195 1
1 260 . 20 1 1 A 21 21 LEU CA C 110 56.096 55.454 0.642 1
1 261 . 20 1 1 A 21 21 LEU CB C 110 44.016 41.817 2.199 1
1 265 . 20 1 1 A 21 21 LEU N N 110 118.626 118.438 0.188 1
1 266 . 20 1 1 A 22 22 GLN H H 111 7.750 8.038 -0.288 1
1 267 . 20 1 1 A 22 22 GLN HA H 111 3.870 3.939 -0.069 1
1 274 . 20 1 1 A 22 22 GLN C C 111 173.336 174.435 -1.099 1
1 275 . 20 1 1 A 22 22 GLN CA C 111 56.510 57.186 -0.676 1
1 276 . 20 1 1 A 22 22 GLN CB C 111 26.800 27.226 -0.426 1
1 278 . 20 1 1 A 22 22 GLN N N 111 113.926 117.634 -3.708 1
1 280 . 20 1 1 A 23 23 CYS H H 112 7.407 7.782 -0.375 1
1 281 . 20 1 1 A 23 23 CYS HA H 112 4.469 4.927 -0.458 1
1 284 . 20 1 1 A 23 23 CYS CA C 112 52.650 56.766 -4.116 1
1 285 . 20 1 1 A 23 23 CYS CB C 112 29.750 28.990 0.760 1
1 286 . 20 1 1 A 23 23 CYS N N 112 112.681 118.821 -6.140 1
1 287 . 20 1 1 A 24 24 PRO HA H 113 4.408 4.627 -0.219 1
1 294 . 20 1 1 A 24 24 PRO C C 113 178.175 177.470 0.705 1
1 295 . 20 1 1 A 24 24 PRO CA C 113 62.040 62.731 -0.691 1
1 296 . 20 1 1 A 24 24 PRO CB C 113 31.920 32.678 -0.758 1
1 299 . 20 1 1 A 25 25 LEU H H 114 8.593 8.434 0.159 1
1 300 . 20 1 1 A 25 25 LEU HA H 114 3.765 3.898 -0.133 1
1 310 . 20 1 1 A 25 25 LEU C C 114 179.950 178.970 0.980 1
1 311 . 20 1 1 A 25 25 LEU CA C 114 57.674 57.930 -0.256 1
1 312 . 20 1 1 A 25 25 LEU CB C 114 40.690 41.574 -0.884 1
1 316 . 20 1 1 A 25 25 LEU N N 114 123.729 123.633 0.096 1
1 317 . 20 1 1 A 26 26 GLU H H 115 9.108 8.576 0.532 1
1 318 . 20 1 1 A 26 26 GLU HA H 115 3.876 4.024 -0.148 1
1 323 . 20 1 1 A 26 26 GLU C C 115 177.505 178.426 -0.921 1
1 324 . 20 1 1 A 26 26 GLU CA C 115 59.410 59.292 0.118 1
1 325 . 20 1 1 A 26 26 GLU CB C 115 28.460 29.055 -0.595 1
1 327 . 20 1 1 A 26 26 GLU N N 115 116.817 117.358 -0.541 1
1 328 . 20 1 1 A 27 27 ALA H H 116 7.360 7.586 -0.226 1
1 329 . 20 1 1 A 27 27 ALA HA H 116 4.408 4.125 0.283 1
1 333 . 20 1 1 A 27 27 ALA C C 116 177.046 177.756 -0.710 1
1 334 . 20 1 1 A 27 27 ALA CA C 116 52.970 54.261 -1.291 1
1 335 . 20 1 1 A 27 27 ALA CB C 116 19.916 18.410 1.506 1
1 336 . 20 1 1 A 27 27 ALA N N 116 118.966 120.697 -1.731 1
1 337 . 20 1 1 A 28 28 ILE H H 117 7.168 7.101 0.067 1
1 338 . 20 1 1 A 28 28 ILE HA H 117 4.432 4.389 0.043 1
1 348 . 20 1 1 A 28 28 ILE C C 117 172.641 175.505 -2.864 1
1 349 . 20 1 1 A 28 28 ILE CA C 117 59.980 59.586 0.394 1
1 350 . 20 1 1 A 28 28 ILE CB C 117 37.350 37.645 -0.295 1
1 354 . 20 1 1 A 28 28 ILE N N 117 108.913 108.874 0.039 1
1 355 . 20 1 1 A 29 29 GLN H H 118 6.562 7.255 -0.693 1
1 356 . 20 1 1 A 29 29 GLN HA H 118 3.922 4.135 -0.213 1
1 363 . 20 1 1 A 29 29 GLN C C 118 175.049 175.490 -0.441 1
1 364 . 20 1 1 A 29 29 GLN CA C 118 54.596 56.019 -1.423 1
1 365 . 20 1 1 A 29 29 GLN CB C 118 29.570 28.898 0.672 1
1 367 . 20 1 1 A 29 29 GLN N N 118 116.455 123.304 -6.849 1
1 369 . 20 1 1 A 30 30 CYS H H 119 8.138 8.351 -0.213 1
1 370 . 20 1 1 A 30 30 CYS HA H 119 4.580 4.552 0.028 1
1 373 . 20 1 1 A 30 30 CYS CA C 119 57.810 57.156 0.654 1
1 374 . 20 1 1 A 30 30 CYS CB C 119 30.200 28.791 1.409 1
1 375 . 20 1 1 A 30 30 CYS N N 119 134.136 125.287 8.849 1
1 376 . 20 1 1 A 31 31 PRO HA H 120 4.424 4.465 -0.041 1
1 383 . 20 1 1 A 31 31 PRO C C 120 177.431 177.610 -0.179 1
1 384 . 20 1 1 A 31 31 PRO CA C 120 64.060 64.101 -0.041 1
1 385 . 20 1 1 A 31 31 PRO CB C 120 32.776 31.738 1.038 1
1 388 . 20 1 1 A 32 32 ILE H H 121 11.318 7.792 3.526 1
1 389 . 20 1 1 A 32 32 ILE HA H 121 4.038 3.990 0.048 1
1 399 . 20 1 1 A 32 32 ILE C C 121 178.485 178.070 0.415 1
1 400 . 20 1 1 A 32 32 ILE CA C 121 64.060 64.033 0.027 1
1 401 . 20 1 1 A 32 32 ILE CB C 121 39.340 38.404 0.936 1
1 405 . 20 1 1 A 32 32 ILE N N 121 124.500 117.024 7.476 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 4.339 -0.291 1
1 412 . 20 1 1 A 33 33 THR C C 122 175.793 174.869 0.924 1
1 413 . 20 1 1 A 33 33 THR CA C 122 62.990 61.942 1.048 1
1 414 . 20 1 1 A 33 33 THR CB C 122 70.300 69.996 0.304 1
1 416 . 20 1 1 A 33 33 THR N N 122 115.136 109.368 5.768 1
1 417 . 20 1 1 A 34 34 LEU H H 123 8.439 7.753 0.686 1
1 418 . 20 1 1 A 34 34 LEU HA H 123 3.912 3.800 0.112 1
1 428 . 20 1 1 A 34 34 LEU C C 123 175.495 175.116 0.379 1
1 429 . 20 1 1 A 34 34 LEU CA C 123 56.290 56.233 0.057 1
1 430 . 20 1 1 A 34 34 LEU CB C 123 38.500 39.736 -1.236 1
1 434 . 20 1 1 A 34 34 LEU N N 123 117.230 119.060 -1.830 1
1 435 . 20 1 1 A 35 35 GLU H H 124 7.816 6.949 0.867 1
1 436 . 20 1 1 A 35 35 GLU HA H 124 4.634 4.774 -0.140 1
1 441 . 20 1 1 A 35 35 GLU C C 124 174.838 174.106 0.732 1
1 442 . 20 1 1 A 35 35 GLU CA C 124 53.780 54.734 -0.954 1
1 443 . 20 1 1 A 35 35 GLU CB C 124 33.710 32.630 1.080 1
1 445 . 20 1 1 A 35 35 GLU N N 124 116.577 114.064 2.513 1
1 446 . 20 1 1 A 36 36 GLN H H 125 8.532 8.413 0.119 1
1 447 . 20 1 1 A 36 36 GLN HA H 125 4.958 4.340 0.618 1
1 454 . 20 1 1 A 36 36 GLN CA C 125 53.350 53.678 -0.328 1
1 455 . 20 1 1 A 36 36 GLN CB C 125 29.950 29.370 0.580 1
1 457 . 20 1 1 A 36 36 GLN N N 125 123.034 123.933 -0.899 1
1 459 . 20 1 1 A 37 37 PRO HA H 126 4.458 4.594 -0.136 1
1 466 . 20 1 1 A 37 37 PRO C C 126 176.314 176.611 -0.297 1
1 467 . 20 1 1 A 37 37 PRO CA C 126 62.816 62.600 0.216 1
1 468 . 20 1 1 A 37 37 PRO CB C 126 33.070 32.481 0.589 1
1 471 . 20 1 1 A 38 38 GLU H H 127 8.626 8.400 0.226 1
1 472 . 20 1 1 A 38 38 GLU HA H 127 4.274 4.213 0.061 1
1 477 . 20 1 1 A 38 38 GLU C C 127 177.877 176.059 1.818 1
1 478 . 20 1 1 A 38 38 GLU CA C 127 58.730 57.047 1.683 1
1 479 . 20 1 1 A 38 38 GLU CB C 127 30.340 30.163 0.177 1
1 481 . 20 1 1 A 38 38 GLU N N 127 120.691 119.055 1.636 1
1 482 . 20 1 1 A 39 39 LYS H H 128 7.861 7.610 0.251 1
1 483 . 20 1 1 A 39 39 LYS HA H 128 4.889 4.906 -0.017 1
1 492 . 20 1 1 A 39 39 LYS C C 128 175.446 174.888 0.558 1
1 493 . 20 1 1 A 39 39 LYS CA C 128 53.670 54.883 -1.213 1
1 494 . 20 1 1 A 39 39 LYS CB C 128 33.630 35.634 -2.004 1
1 498 . 20 1 1 A 39 39 LYS N N 128 117.878 116.950 0.928 1
1 499 . 20 1 1 A 40 40 GLY H H 129 8.426 7.978 0.448 1
1 500 . 20 1 1 A 40 40 GLY HA2 H 129 4.970 3.996 0.974 1
1 501 . 20 1 1 A 40 40 GLY HA3 H 129 2.458 4.140 -1.682 1
1 502 . 20 1 1 A 40 40 GLY C C 129 170.048 172.166 -2.118 1
1 503 . 20 1 1 A 40 40 GLY CA C 129 42.910 45.008 -2.098 1
1 504 . 20 1 1 A 40 40 GLY N N 129 112.604 106.965 5.639 1
1 505 . 20 1 1 A 41 41 ILE H H 130 8.596 9.022 -0.426 1
1 506 . 20 1 1 A 41 41 ILE HA H 130 4.636 5.065 -0.429 1
1 516 . 20 1 1 A 41 41 ILE C C 130 172.691 174.290 -1.599 1
1 517 . 20 1 1 A 41 41 ILE CA C 130 58.500 58.640 -0.140 1
1 518 . 20 1 1 A 41 41 ILE CB C 130 43.320 41.074 2.246 1
1 522 . 20 1 1 A 41 41 ILE N N 130 113.363 116.272 -2.909 1
1 523 . 20 1 1 A 42 42 PHE H H 131 8.994 9.008 -0.014 1
1 524 . 20 1 1 A 42 42 PHE HA H 131 5.075 5.497 -0.422 1
1 532 . 20 1 1 A 42 42 PHE C C 131 175.111 175.107 0.004 1
1 533 . 20 1 1 A 42 42 PHE CA C 131 58.680 57.234 1.446 1
1 534 . 20 1 1 A 42 42 PHE CB C 131 42.220 40.481 1.739 1
1 538 . 20 1 1 A 42 42 PHE N N 131 125.156 122.241 2.915 1
1 539 . 20 1 1 A 43 43 VAL H H 132 8.399 9.469 -1.070 1
1 540 . 20 1 1 A 43 43 VAL HA H 132 4.920 4.720 0.200 1
1 548 . 20 1 1 A 43 43 VAL C C 132 178.175 175.391 2.784 1
1 549 . 20 1 1 A 43 43 VAL CA C 132 59.600 60.942 -1.342 1
1 550 . 20 1 1 A 43 43 VAL CB C 132 35.920 34.669 1.251 1
1 553 . 20 1 1 A 43 43 VAL N N 132 119.371 123.162 -3.791 1
1 554 . 20 1 1 A 44 44 LYS H H 133 10.041 8.531 1.510 1
1 555 . 20 1 1 A 44 44 LYS HA H 133 4.920 4.309 0.611 1
1 564 . 20 1 1 A 44 44 LYS C C 133 177.195 175.657 1.538 1
1 565 . 20 1 1 A 44 44 LYS CA C 133 57.310 56.520 0.790 1
1 566 . 20 1 1 A 44 44 LYS CB C 133 34.410 32.640 1.770 1
1 570 . 20 1 1 A 44 44 LYS N N 133 130.928 126.822 4.106 1
1 571 . 20 1 1 A 45 45 ASN H H 134 8.534 8.942 -0.408 1
1 572 . 20 1 1 A 45 45 ASN HA H 134 4.151 4.806 -0.655 1
1 577 . 20 1 1 A 45 45 ASN C C 134 174.217 175.278 -1.061 1
1 578 . 20 1 1 A 45 45 ASN CA C 134 55.290 52.488 2.802 1
1 579 . 20 1 1 A 45 45 ASN CB C 134 37.530 37.853 -0.323 1
1 580 . 20 1 1 A 45 45 ASN N N 134 119.452 124.181 -4.729 1
1 582 . 20 1 1 A 46 46 SER H H 135 7.570 8.101 -0.531 1
1 583 . 20 1 1 A 46 46 SER HA H 135 4.220 4.115 0.105 1
1 586 . 20 1 1 A 46 46 SER C C 135 174.490 176.919 -2.429 1
1 587 . 20 1 1 A 46 46 SER CA C 135 57.090 61.304 -4.214 1
1 588 . 20 1 1 A 46 46 SER CB C 135 64.126 62.907 1.219 1
1 589 . 20 1 1 A 46 46 SER N N 135 105.613 121.524 -15.911 1
1 590 . 20 1 1 A 47 47 ASP H H 136 9.113 8.065 1.048 1
1 591 . 20 1 1 A 47 47 ASP HA H 136 4.220 4.327 -0.107 1
1 594 . 20 1 1 A 47 47 ASP CA C 136 57.610 57.070 0.540 1
1 595 . 20 1 1 A 47 47 ASP CB C 136 40.810 40.662 0.148 1
1 596 . 20 1 1 A 47 47 ASP N N 136 120.995 121.171 -0.176 1
1 597 . 20 1 1 A 48 48 GLY H H 137 8.172 8.160 0.012 1
1 598 . 20 1 1 A 48 48 GLY HA2 H 137 4.096 3.798 0.298 1
1 599 . 20 1 1 A 48 48 GLY HA3 H 137 3.664 3.810 -0.146 1
1 600 . 20 1 1 A 48 48 GLY C C 137 173.990 175.471 -1.481 1
1 601 . 20 1 1 A 48 48 GLY CA C 137 45.130 47.196 -2.066 1
1 602 . 20 1 1 A 48 48 GLY N N 137 105.838 106.982 -1.144 1
1 603 . 20 1 1 A 49 49 SER H H 138 7.252 7.818 -0.566 1
1 604 . 20 1 1 A 49 49 SER HA H 138 4.503 4.734 -0.231 1
1 607 . 20 1 1 A 49 49 SER C C 138 173.857 173.862 -0.005 1
1 608 . 20 1 1 A 49 49 SER CA C 138 57.340 57.221 0.119 1
1 609 . 20 1 1 A 49 49 SER CB C 138 65.370 64.252 1.118 1
1 610 . 20 1 1 A 49 49 SER N N 138 114.942 112.117 2.825 1
1 611 . 20 1 1 A 50 50 ASP H H 139 8.276 8.043 0.233 1
1 612 . 20 1 1 A 50 50 ASP HA H 139 4.618 4.252 0.366 1
1 615 . 20 1 1 A 50 50 ASP C C 139 174.577 175.292 -0.715 1
1 616 . 20 1 1 A 50 50 ASP CA C 139 53.116 55.548 -2.432 1
1 617 . 20 1 1 A 50 50 ASP CB C 139 40.520 39.467 1.053 1
1 618 . 20 1 1 A 50 50 ASP N N 139 122.088 116.794 5.294 1
1 619 . 20 1 1 A 51 51 VAL H H 140 8.192 7.507 0.685 1
1 620 . 20 1 1 A 51 51 VAL HA H 140 4.299 4.114 0.185 1
1 628 . 20 1 1 A 51 51 VAL C C 140 175.867 175.384 0.483 1
1 629 . 20 1 1 A 51 51 VAL CA C 140 62.950 62.733 0.217 1
1 630 . 20 1 1 A 51 51 VAL CB C 140 33.230 31.921 1.309 1
1 632 . 20 1 1 A 51 51 VAL N N 140 121.167 119.351 1.816 1
1 633 . 20 1 1 A 52 52 CYS H H 141 8.391 8.595 -0.204 1
1 634 . 20 1 1 A 52 52 CYS HA H 141 5.247 5.100 0.147 1
1 637 . 20 1 1 A 52 52 CYS C C 141 172.778 174.369 -1.591 1
1 638 . 20 1 1 A 52 52 CYS CA C 141 56.480 58.449 -1.969 1
1 639 . 20 1 1 A 52 52 CYS CB C 141 31.960 28.796 3.164 1
1 640 . 20 1 1 A 52 52 CYS N N 141 121.884 127.149 -5.265 1
1 641 . 20 1 1 A 53 53 THR H H 142 8.777 9.106 -0.329 1
1 642 . 20 1 1 A 53 53 THR HA H 142 4.489 5.033 -0.544 1
1 648 . 20 1 1 A 53 53 THR C C 142 171.885 172.894 -1.009 1
1 649 . 20 1 1 A 53 53 THR CA C 142 62.070 61.615 0.455 1
1 650 . 20 1 1 A 53 53 THR CB C 142 71.390 71.053 0.337 1
1 652 . 20 1 1 A 53 53 THR N N 142 118.132 119.445 -1.313 1
1 653 . 20 1 1 A 54 54 LEU H H 143 8.409 8.574 -0.165 1
1 654 . 20 1 1 A 54 54 LEU HA H 143 4.276 4.604 -0.328 1
1 664 . 20 1 1 A 54 54 LEU C C 143 174.366 174.122 0.244 1
1 665 . 20 1 1 A 54 54 LEU CA C 143 54.330 53.298 1.032 1
1 666 . 20 1 1 A 54 54 LEU CB C 143 42.396 42.788 -0.392 1
1 670 . 20 1 1 A 54 54 LEU N N 143 127.980 129.143 -1.163 1
1 671 . 20 1 1 A 55 55 PHE H H 144 8.646 8.768 -0.122 1
1 672 . 20 1 1 A 55 55 PHE HA H 144 5.455 4.775 0.680 1
1 680 . 20 1 1 A 55 55 PHE C C 144 176.054 175.371 0.683 1
1 681 . 20 1 1 A 55 55 PHE CA C 144 55.250 56.839 -1.589 1
1 682 . 20 1 1 A 55 55 PHE CB C 144 44.100 40.815 3.285 1
1 686 . 20 1 1 A 55 55 PHE N N 144 122.010 126.901 -4.891 1
1 687 . 20 1 1 A 56 56 ASP H H 145 11.575 8.283 3.292 1
1 688 . 20 1 1 A 56 56 ASP HA H 145 4.416 4.379 0.037 1
1 691 . 20 1 1 A 56 56 ASP C C 145 176.748 177.439 -0.691 1
1 692 . 20 1 1 A 56 56 ASP CA C 145 55.840 54.507 1.333 1
1 693 . 20 1 1 A 56 56 ASP CB C 145 44.390 42.174 2.216 1
1 694 . 20 1 1 A 56 56 ASP N N 145 121.936 123.770 -1.834 1
1 695 . 20 1 1 A 57 57 ALA H H 146 8.508 8.582 -0.074 1
1 696 . 20 1 1 A 57 57 ALA HA H 146 3.797 4.021 -0.224 1
1 700 . 20 1 1 A 57 57 ALA C C 146 178.696 179.999 -1.303 1
1 701 . 20 1 1 A 57 57 ALA CA C 146 55.990 55.615 0.375 1
1 702 . 20 1 1 A 57 57 ALA CB C 146 18.840 18.067 0.773 1
1 703 . 20 1 1 A 57 57 ALA N N 146 130.243 129.281 0.962 1
1 704 . 20 1 1 A 58 58 ALA H H 147 8.378 7.647 0.731 1
1 705 . 20 1 1 A 58 58 ALA HA H 147 4.078 4.211 -0.133 1
1 709 . 20 1 1 A 58 58 ALA C C 147 181.091 179.698 1.393 1
1 710 . 20 1 1 A 58 58 ALA CA C 147 54.770 54.946 -0.176 1
1 711 . 20 1 1 A 58 58 ALA CB C 147 17.700 18.408 -0.708 1
1 712 . 20 1 1 A 58 58 ALA N N 147 121.997 119.637 2.360 1
1 713 . 20 1 1 A 59 59 ALA H H 148 9.138 7.882 1.256 1
1 714 . 20 1 1 A 59 59 ALA HA H 148 3.975 4.077 -0.102 1
1 718 . 20 1 1 A 59 59 ALA C C 148 180.508 179.940 0.568 1
1 719 . 20 1 1 A 59 59 ALA CA C 148 54.840 55.082 -0.242 1
1 720 . 20 1 1 A 59 59 ALA CB C 148 18.600 18.579 0.021 1
1 721 . 20 1 1 A 59 59 ALA N N 148 123.595 120.340 3.255 1
1 722 . 20 1 1 A 60 60 PHE H H 149 8.814 8.111 0.703 1
1 723 . 20 1 1 A 60 60 PHE HA H 149 3.722 4.045 -0.323 1
1 731 . 20 1 1 A 60 60 PHE C C 149 176.773 177.471 -0.698 1
1 732 . 20 1 1 A 60 60 PHE CA C 149 62.030 61.526 0.504 1
1 733 . 20 1 1 A 60 60 PHE CB C 149 39.960 38.752 1.208 1
1 737 . 20 1 1 A 60 60 PHE N N 149 120.354 120.032 0.322 1
1 738 . 20 1 1 A 61 61 SER H H 150 8.276 8.262 0.014 1
1 739 . 20 1 1 A 61 61 SER HA H 150 3.880 4.058 -0.178 1
1 742 . 20 1 1 A 61 61 SER C C 150 177.691 177.340 0.351 1
1 743 . 20 1 1 A 61 61 SER CA C 150 62.190 61.519 0.671 1
1 744 . 20 1 1 A 61 61 SER CB C 150 63.016 62.971 0.045 1
1 745 . 20 1 1 A 61 61 SER N N 150 112.086 114.219 -2.133 1
1 746 . 20 1 1 A 62 62 ARG H H 151 7.829 7.860 -0.031 1
1 747 . 20 1 1 A 62 62 ARG HA H 151 3.971 4.088 -0.117 1
1 754 . 20 1 1 A 62 62 ARG C C 151 178.287 178.759 -0.472 1
1 755 . 20 1 1 A 62 62 ARG CA C 151 59.340 59.096 0.244 1
1 756 . 20 1 1 A 62 62 ARG CB C 151 29.760 29.820 -0.060 1
1 759 . 20 1 1 A 62 62 ARG N N 151 121.090 120.966 0.124 1
1 760 . 20 1 1 A 63 63 LEU H H 152 7.390 7.598 -0.208 1
1 761 . 20 1 1 A 63 63 LEU HA H 152 3.791 3.946 -0.155 1
1 771 . 20 1 1 A 63 63 LEU C C 152 179.106 178.946 0.160 1
1 772 . 20 1 1 A 63 63 LEU CA C 152 58.900 57.917 0.983 1
1 773 . 20 1 1 A 63 63 LEU CB C 152 41.140 41.471 -0.331 1
1 777 . 20 1 1 A 63 63 LEU N N 152 121.129 119.405 1.724 1
1 778 . 20 1 1 A 64 64 VAL H H 153 7.552 7.916 -0.364 1
1 779 . 20 1 1 A 64 64 VAL HA H 153 3.411 3.534 -0.123 1
1 787 . 20 1 1 A 64 64 VAL C C 153 180.595 178.249 2.346 1
1 788 . 20 1 1 A 64 64 VAL CA C 153 65.644 66.139 -0.495 1
1 789 . 20 1 1 A 64 64 VAL CB C 153 31.410 31.452 -0.042 1
1 792 . 20 1 1 A 64 64 VAL N N 153 118.280 118.533 -0.253 1
1 793 . 20 1 1 A 65 65 GLY H H 154 8.061 8.174 -0.113 1
1 794 . 20 1 1 A 65 65 GLY HA2 H 154 3.846 3.749 0.097 1
1 795 . 20 1 1 A 65 65 GLY HA3 H 154 3.809 3.750 0.059 1
1 796 . 20 1 1 A 65 65 GLY C C 154 175.235 175.233 0.002 1
1 797 . 20 1 1 A 65 65 GLY CA C 154 46.630 47.205 -0.575 1
1 798 . 20 1 1 A 65 65 GLY N N 154 108.622 107.639 0.983 1
1 799 . 20 1 1 A 66 66 GLU H H 155 7.528 7.611 -0.083 1
1 800 . 20 1 1 A 66 66 GLU HA H 155 4.228 4.361 -0.133 1
1 805 . 20 1 1 A 66 66 GLU C C 155 176.761 176.874 -0.113 1
1 806 . 20 1 1 A 66 66 GLU CA C 155 56.590 56.162 0.428 1
1 807 . 20 1 1 A 66 66 GLU CB C 155 30.490 30.341 0.149 1
1 809 . 20 1 1 A 66 66 GLU N N 155 118.361 119.055 -0.694 1
1 810 . 20 1 1 A 67 67 GLY H H 156 7.884 7.693 0.191 1
1 811 . 20 1 1 A 67 67 GLY HA2 H 156 3.918 3.867 0.051 1
1 812 . 20 1 1 A 67 67 GLY HA3 H 156 3.747 3.881 -0.134 1
1 813 . 20 1 1 A 67 67 GLY C C 156 174.788 174.637 0.151 1
1 814 . 20 1 1 A 67 67 GLY CA C 156 45.890 45.879 0.011 1
1 815 . 20 1 1 A 67 67 GLY N N 156 108.465 109.423 -0.958 1
1 816 . 20 1 1 A 68 68 LEU H H 157 7.332 7.696 -0.364 1
1 817 . 20 1 1 A 68 68 LEU HA H 157 4.361 4.337 0.024 1
1 827 . 20 1 1 A 68 68 LEU CA C 157 53.060 52.871 0.189 1
1 828 . 20 1 1 A 68 68 LEU CB C 157 41.100 42.023 -0.923 1
1 832 . 20 1 1 A 68 68 LEU N N 157 121.920 121.691 0.229 1
1 833 . 20 1 1 A 69 69 PRO HA H 158 4.485 4.600 -0.115 1
1 840 . 20 1 1 A 69 69 PRO C C 158 174.602 176.324 -1.722 1
1 841 . 20 1 1 A 69 69 PRO CA C 158 61.556 62.184 -0.628 1
1 842 . 20 1 1 A 69 69 PRO CB C 158 32.370 32.816 -0.446 1
1 845 . 20 1 1 A 70 70 HIS H H 159 8.759 8.539 0.220 1
1 846 . 20 1 1 A 70 70 HIS HA H 159 3.947 4.417 -0.470 1
1 852 . 20 1 1 A 70 70 HIS CA C 159 56.250 55.193 1.057 1
1 853 . 20 1 1 A 70 70 HIS CB C 159 32.280 30.970 1.310 1
1 856 . 20 1 1 A 70 70 HIS N N 159 119.423 121.669 -2.246 1
1 857 . 20 1 1 A 71 71 PRO HA H 160 4.424 4.271 0.153 1
1 864 . 20 1 1 A 71 71 PRO C C 160 177.567 178.355 -0.788 1
1 865 . 20 1 1 A 71 71 PRO CA C 160 64.574 64.875 -0.301 1
1 866 . 20 1 1 A 71 71 PRO CB C 160 32.340 32.073 0.267 1
1 869 . 20 1 1 A 72 72 LEU H H 161 10.123 7.281 2.842 1
1 870 . 20 1 1 A 72 72 LEU HA H 161 4.778 4.266 0.512 1
1 880 . 20 1 1 A 72 72 LEU C C 161 178.721 177.875 0.846 1
1 881 . 20 1 1 A 72 72 LEU CA C 161 55.800 57.463 -1.663 1
1 882 . 20 1 1 A 72 72 LEU CB C 161 42.440 42.939 -0.499 1
1 886 . 20 1 1 A 72 72 LEU N N 161 117.374 117.097 0.277 1
1 887 . 20 1 1 A 73 73 THR H H 162 7.523 7.639 -0.116 1
1 888 . 20 1 1 A 73 73 THR HA H 162 4.291 4.565 -0.274 1
1 893 . 20 1 1 A 73 73 THR C C 162 175.557 174.366 1.191 1
1 894 . 20 1 1 A 73 73 THR CA C 162 61.440 62.398 -0.958 1
1 895 . 20 1 1 A 73 73 THR CB C 162 70.500 70.029 0.471 1
1 897 . 20 1 1 A 73 73 THR N N 162 107.787 112.862 -5.075 1
1 898 . 20 1 1 A 74 74 ARG H H 163 8.361 8.003 0.358 1
1 899 . 20 1 1 A 74 74 ARG HA H 163 3.836 4.159 -0.323 1
1 906 . 20 1 1 A 74 74 ARG C C 163 174.701 174.996 -0.295 1
1 907 . 20 1 1 A 74 74 ARG CA C 163 57.980 57.376 0.604 1
1 908 . 20 1 1 A 74 74 ARG CB C 163 26.770 26.954 -0.184 1
1 911 . 20 1 1 A 74 74 ARG N N 163 115.130 118.767 -3.637 1
1 912 . 20 1 1 A 75 75 GLU H H 164 7.430 8.040 -0.610 1
1 913 . 20 1 1 A 75 75 GLU HA H 164 4.636 4.537 0.099 1
1 918 . 20 1 1 A 75 75 GLU CA C 164 53.699 54.903 -1.204 1
1 919 . 20 1 1 A 75 75 GLU CB C 164 29.550 28.346 1.204 1
1 921 . 20 1 1 A 75 75 GLU N N 164 120.076 118.873 1.203 1
1 922 . 20 1 1 A 76 76 PRO HA H 165 4.272 4.512 -0.240 1
1 929 . 20 1 1 A 76 76 PRO C C 165 176.649 177.032 -0.383 1
1 930 . 20 1 1 A 76 76 PRO CA C 165 63.204 63.008 0.196 1
1 931 . 20 1 1 A 76 76 PRO CB C 165 31.680 31.596 0.084 1
1 934 . 20 1 1 A 77 77 ILE H H 166 8.812 8.205 0.607 1
1 935 . 20 1 1 A 77 77 ILE HA H 166 3.838 4.238 -0.400 1
1 945 . 20 1 1 A 77 77 ILE C C 166 175.235 175.878 -0.643 1
1 946 . 20 1 1 A 77 77 ILE CA C 166 62.816 61.239 1.577 1
1 947 . 20 1 1 A 77 77 ILE CB C 166 37.750 37.274 0.476 1
1 951 . 20 1 1 A 77 77 ILE N N 166 123.831 123.895 -0.064 1
1 952 . 20 1 1 A 78 78 THR H H 167 6.625 8.587 -1.962 1
1 953 . 20 1 1 A 78 78 THR HA H 167 4.632 5.120 -0.488 1
1 958 . 20 1 1 A 78 78 THR C C 167 174.143 174.706 -0.563 1
1 959 . 20 1 1 A 78 78 THR CA C 167 58.750 59.965 -1.215 1
1 960 . 20 1 1 A 78 78 THR CB C 167 71.320 71.240 0.080 1
1 962 . 20 1 1 A 78 78 THR N N 167 115.293 118.413 -3.120 1
1 963 . 20 1 1 A 79 79 ALA H H 168 9.088 9.009 0.079 1
1 964 . 20 1 1 A 79 79 ALA HA H 168 3.916 4.091 -0.175 1
1 968 . 20 1 1 A 79 79 ALA C C 168 179.788 179.655 0.133 1
1 969 . 20 1 1 A 79 79 ALA CA C 168 55.480 55.035 0.445 1
1 970 . 20 1 1 A 79 79 ALA CB C 168 17.630 18.470 -0.840 1
1 971 . 20 1 1 A 79 79 ALA N N 168 122.102 128.739 -6.637 1
1 972 . 20 1 1 A 80 80 SER H H 169 7.988 7.674 0.314 1
1 973 . 20 1 1 A 80 80 SER HA H 169 4.058 4.151 -0.093 1
1 976 . 20 1 1 A 80 80 SER C C 169 176.029 176.184 -0.155 1
1 977 . 20 1 1 A 80 80 SER CA C 169 60.750 61.999 -1.249 1
1 978 . 20 1 1 A 80 80 SER CB C 169 62.510 62.982 -0.472 1
1 979 . 20 1 1 A 80 80 SER N N 169 109.541 114.815 -5.274 1
1 980 . 20 1 1 A 81 81 ILE H H 170 6.968 7.114 -0.146 1
1 981 . 20 1 1 A 81 81 ILE HA H 170 4.315 4.502 -0.187 1
1 991 . 20 1 1 A 81 81 ILE C C 170 174.242 175.305 -1.063 1
1 992 . 20 1 1 A 81 81 ILE CA C 170 62.296 60.995 1.301 1
1 993 . 20 1 1 A 81 81 ILE CB C 170 37.686 38.193 -0.507 1
1 997 . 20 1 1 A 81 81 ILE N N 170 112.476 112.297 0.179 1
1 998 . 20 1 1 A 82 82 ILE H H 171 7.345 7.416 -0.071 1
1 999 . 20 1 1 A 82 82 ILE HA H 171 4.339 4.668 -0.329 1
1 1009 . 20 1 1 A 82 82 ILE C C 171 174.999 174.653 0.346 1
1 1010 . 20 1 1 A 82 82 ILE CA C 171 61.150 60.249 0.901 1
1 1011 . 20 1 1 A 82 82 ILE CB C 171 37.230 40.346 -3.116 1
1 1015 . 20 1 1 A 82 82 ILE N N 171 124.260 124.856 -0.596 1
1 1016 . 20 1 1 A 83 83 VAL H H 172 7.923 9.156 -1.233 1
1 1017 . 20 1 1 A 83 83 VAL HA H 172 4.673 5.081 -0.408 1
1 1025 . 20 1 1 A 83 83 VAL C C 172 174.887 175.162 -0.275 1
1 1026 . 20 1 1 A 83 83 VAL CA C 172 59.340 59.206 0.134 1
1 1027 . 20 1 1 A 83 83 VAL CB C 172 34.840 36.118 -1.278 1
1 1030 . 20 1 1 A 83 83 VAL N N 172 120.931 122.131 -1.200 1
1 1031 . 20 1 1 A 84 84 LYS H H 173 8.406 8.618 -0.212 1
1 1032 . 20 1 1 A 84 84 LYS HA H 173 4.410 4.707 -0.297 1
1 1041 . 20 1 1 A 84 84 LYS C C 173 178.734 177.778 0.956 1
1 1042 . 20 1 1 A 84 84 LYS CA C 173 56.360 54.698 1.662 1
1 1043 . 20 1 1 A 84 84 LYS CB C 173 33.100 34.150 -1.050 1
1 1047 . 20 1 1 A 84 84 LYS N N 173 121.251 120.709 0.542 1
1 1048 . 20 1 1 A 85 85 HIS H H 174 9.221 8.907 0.314 1
1 1049 . 20 1 1 A 85 85 HIS HA H 174 4.024 4.282 -0.258 1
1 1053 . 20 1 1 A 85 85 HIS C C 174 177.183 177.017 0.166 1
1 1054 . 20 1 1 A 85 85 HIS CA C 174 59.460 58.919 0.541 1
1 1055 . 20 1 1 A 85 85 HIS CB C 174 27.920 28.952 -1.032 1
1 1057 . 20 1 1 A 85 85 HIS N N 174 121.545 120.802 0.743 1
1 1058 . 20 1 1 A 86 86 GLU H H 175 8.699 7.990 0.709 1
1 1059 . 20 1 1 A 86 86 GLU HA H 175 3.900 3.899 0.001 1
1 1064 . 20 1 1 A 86 86 GLU C C 175 177.220 178.515 -1.295 1
1 1065 . 20 1 1 A 86 86 GLU CA C 175 58.420 59.788 -1.368 1
1 1066 . 20 1 1 A 86 86 GLU CB C 175 28.690 29.349 -0.659 1
1 1068 . 20 1 1 A 86 86 GLU N N 175 118.011 121.061 -3.050 1
1 1069 . 20 1 1 A 87 87 GLU H H 176 7.621 7.698 -0.077 1
1 1070 . 20 1 1 A 87 87 GLU HA H 176 4.177 4.072 0.105 1
1 1075 . 20 1 1 A 87 87 GLU C C 176 175.222 175.895 -0.673 1
1 1076 . 20 1 1 A 87 87 GLU CA C 176 56.390 58.253 -1.863 1
1 1077 . 20 1 1 A 87 87 GLU CB C 176 30.430 29.636 0.794 1
1 1079 . 20 1 1 A 87 87 GLU N N 176 116.753 118.547 -1.794 1
1 1080 . 20 1 1 A 88 88 CYS H H 177 7.239 7.553 -0.314 1
1 1081 . 20 1 1 A 88 88 CYS HA H 177 5.148 5.223 -0.075 1
1 1084 . 20 1 1 A 88 88 CYS C C 177 173.249 173.255 -0.006 1
1 1085 . 20 1 1 A 88 88 CYS CA C 177 57.240 56.745 0.495 1
1 1086 . 20 1 1 A 88 88 CYS CB C 177 31.020 30.821 0.199 1
1 1087 . 20 1 1 A 88 88 CYS N N 177 116.096 115.351 0.745 1
1 1088 . 20 1 1 A 89 89 ILE H H 178 8.912 8.718 0.194 1
1 1089 . 20 1 1 A 89 89 ILE HA H 178 4.580 5.022 -0.442 1
1 1099 . 20 1 1 A 89 89 ILE C C 178 173.386 174.246 -0.860 1
1 1100 . 20 1 1 A 89 89 ILE CA C 178 59.270 59.194 0.076 1
1 1101 . 20 1 1 A 89 89 ILE CB C 178 42.990 41.958 1.032 1
1 1105 . 20 1 1 A 89 89 ILE N N 178 119.490 118.335 1.155 1
1 1106 . 20 1 1 A 90 90 TYR H H 179 9.047 8.680 0.367 1
1 1107 . 20 1 1 A 90 90 TYR HA H 179 3.753 3.954 -0.201 1
1 1112 . 20 1 1 A 90 90 TYR C C 179 173.932 174.035 -0.103 1
1 1113 . 20 1 1 A 90 90 TYR CA C 179 59.860 57.377 2.483 1
1 1114 . 20 1 1 A 90 90 TYR CB C 179 37.530 38.530 -1.000 1
1 1116 . 20 1 1 A 90 90 TYR N N 179 126.270 122.240 4.030 1
1 1117 . 20 1 1 A 91 91 ASP H H 180 7.462 8.278 -0.816 1
1 1118 . 20 1 1 A 91 91 ASP HA H 180 4.639 4.727 -0.088 1
1 1121 . 20 1 1 A 91 91 ASP C C 180 175.297 175.957 -0.660 1
1 1122 . 20 1 1 A 91 91 ASP CA C 180 52.496 52.491 0.005 1
1 1123 . 20 1 1 A 91 91 ASP CB C 180 43.380 42.409 0.971 1
1 1124 . 20 1 1 A 91 91 ASP N N 180 129.593 124.274 5.319 1
1 1125 . 20 1 1 A 92 92 ASP H H 181 8.719 9.151 -0.432 1
1 1126 . 20 1 1 A 92 92 ASP HA H 181 4.109 4.307 -0.198 1
1 1129 . 20 1 1 A 92 92 ASP C C 181 177.555 177.331 0.224 1
1 1130 . 20 1 1 A 92 92 ASP CA C 181 56.390 57.549 -1.159 1
1 1131 . 20 1 1 A 92 92 ASP CB C 181 41.330 40.591 0.739 1
1 1132 . 20 1 1 A 92 92 ASP N N 181 125.691 127.833 -2.142 1
1 1133 . 20 1 1 A 93 93 THR H H 182 8.271 7.878 0.393 1
1 1134 . 20 1 1 A 93 93 THR HA H 182 4.036 4.071 -0.035 1
1 1139 . 20 1 1 A 93 93 THR C C 182 176.289 175.940 0.349 1
1 1140 . 20 1 1 A 93 93 THR CA C 182 65.054 64.431 0.623 1
1 1141 . 20 1 1 A 93 93 THR CB C 182 68.560 68.818 -0.258 1
1 1143 . 20 1 1 A 93 93 THR N N 182 114.813 113.691 1.122 1
1 1144 . 20 1 1 A 94 94 ARG H H 183 7.753 7.484 0.269 1
1 1145 . 20 1 1 A 94 94 ARG HA H 183 4.139 4.347 -0.208 1
1 1152 . 20 1 1 A 94 94 ARG C C 183 176.897 177.036 -0.139 1
1 1153 . 20 1 1 A 94 94 ARG CA C 183 55.350 56.155 -0.805 1
1 1154 . 20 1 1 A 94 94 ARG CB C 183 30.930 31.305 -0.375 1
1 1157 . 20 1 1 A 94 94 ARG N N 183 120.101 118.325 1.776 1
1 1158 . 20 1 1 A 95 95 GLY H H 184 8.112 9.017 -0.905 1
1 1159 . 20 1 1 A 95 95 GLY HA2 H 184 3.838 3.860 -0.022 1
1 1160 . 20 1 1 A 95 95 GLY HA3 H 184 3.670 3.864 -0.194 1
1 1161 . 20 1 1 A 95 95 GLY C C 184 173.659 173.328 0.331 1
1 1162 . 20 1 1 A 95 95 GLY CA C 184 46.040 45.698 0.342 1
1 1163 . 20 1 1 A 95 95 GLY N N 184 108.106 109.194 -1.088 1
1 1164 . 20 1 1 A 96 96 ASN H H 185 6.833 7.428 -0.595 1
1 1165 . 20 1 1 A 96 96 ASN HA H 185 4.944 5.126 -0.182 1
1 1170 . 20 1 1 A 96 96 ASN C C 185 174.267 173.344 0.923 1
1 1171 . 20 1 1 A 96 96 ASN CA C 185 52.560 52.341 0.219 1
1 1172 . 20 1 1 A 96 96 ASN CB C 185 45.890 41.897 3.993 1
1 1173 . 20 1 1 A 96 96 ASN N N 185 113.392 117.199 -3.807 1
1 1175 . 20 1 1 A 97 97 PHE H H 186 9.108 8.739 0.369 1
1 1176 . 20 1 1 A 97 97 PHE HA H 186 4.782 4.756 0.026 1
1 1183 . 20 1 1 A 97 97 PHE C C 186 174.862 175.698 -0.836 1
1 1184 . 20 1 1 A 97 97 PHE CA C 186 60.056 59.694 0.362 1
1 1185 . 20 1 1 A 97 97 PHE CB C 186 40.180 39.338 0.842 1
1 1188 . 20 1 1 A 97 97 PHE N N 186 118.741 119.738 -0.997 1
1 1189 . 20 1 1 A 98 98 ILE H H 187 8.933 8.721 0.212 1
1 1190 . 20 1 1 A 98 98 ILE HA H 187 5.458 4.935 0.523 1
1 1200 . 20 1 1 A 98 98 ILE C C 187 176.041 175.164 0.877 1
1 1201 . 20 1 1 A 98 98 ILE CA C 187 57.610 59.089 -1.479 1
1 1202 . 20 1 1 A 98 98 ILE CB C 187 42.070 41.846 0.224 1
1 1206 . 20 1 1 A 98 98 ILE N N 187 117.857 118.615 -0.758 1
1 1207 . 20 1 1 A 99 99 ILE H H 188 8.284 8.121 0.163 1
1 1208 . 20 1 1 A 99 99 ILE HA H 188 4.341 4.197 0.144 1
1 1218 . 20 1 1 A 99 99 ILE C C 188 176.413 176.430 -0.017 1
1 1219 . 20 1 1 A 99 99 ILE CA C 188 59.190 60.895 -1.705 1
1 1220 . 20 1 1 A 99 99 ILE CB C 188 37.940 38.077 -0.137 1
1 1224 . 20 1 1 A 99 99 ILE N N 188 121.796 122.396 -0.600 1
1 1225 . 20 1 1 A 100 100 LYS H H 189 8.463 8.273 0.190 1
1 1226 . 20 1 1 A 100 100 LYS HA H 189 4.040 4.229 -0.189 1
1 1235 . 20 1 1 A 100 100 LYS C C 189 176.848 177.915 -1.067 1
1 1236 . 20 1 1 A 100 100 LYS CA C 189 57.241 56.321 0.920 1
1 1237 . 20 1 1 A 100 100 LYS CB C 189 33.400 32.982 0.418 1
1 1241 . 20 1 1 A 100 100 LYS N N 189 127.995 124.668 3.327 1
1 1242 . 20 1 1 A 101 101 GLY H H 190 8.346 8.539 -0.193 1
1 1243 . 20 1 1 A 101 101 GLY HA2 H 190 3.947 3.931 0.016 1
1 1244 . 20 1 1 A 101 101 GLY HA3 H 190 3.813 3.937 -0.124 1
1 1245 . 20 1 1 A 101 101 GLY C C 190 172.902 173.867 -0.965 1
1 1246 . 20 1 1 A 101 101 GLY CA C 190 44.920 45.335 -0.415 1
1 1247 . 20 1 1 A 101 101 GLY N N 190 110.882 112.432 -1.550 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 1.002 1
2 1 1 1 "RMS(OBS, PRED)" CA 100 1.231 1
3 1 1 1 "RMS(OBS, PRED)" CB 94 1.199 1
4 1 1 1 "RMS(OBS, PRED)" H 93 0.820 1
5 1 1 1 "RMS(OBS, PRED)" HA 106 0.316 1
6 1 1 1 "RMS(OBS, PRED)" N 93 3.402 1
7 1 2 1 "RMS(OBS, PRED)" C 92 0.955 1
8 1 2 1 "RMS(OBS, PRED)" CA 100 1.244 1
9 1 2 1 "RMS(OBS, PRED)" CB 94 1.132 1
10 1 2 1 "RMS(OBS, PRED)" H 93 0.812 1
11 1 2 1 "RMS(OBS, PRED)" HA 106 0.315 1
12 1 2 1 "RMS(OBS, PRED)" N 93 3.414 1
13 1 3 1 "RMS(OBS, PRED)" C 92 1.007 1
14 1 3 1 "RMS(OBS, PRED)" CA 100 1.274 1
15 1 3 1 "RMS(OBS, PRED)" CB 94 1.124 1
16 1 3 1 "RMS(OBS, PRED)" H 93 0.836 1
17 1 3 1 "RMS(OBS, PRED)" HA 106 0.313 1
18 1 3 1 "RMS(OBS, PRED)" N 93 3.426 1
19 1 4 1 "RMS(OBS, PRED)" C 92 0.990 1
20 1 4 1 "RMS(OBS, PRED)" CA 100 1.262 1
21 1 4 1 "RMS(OBS, PRED)" CB 94 1.237 1
22 1 4 1 "RMS(OBS, PRED)" H 93 0.823 1
23 1 4 1 "RMS(OBS, PRED)" HA 106 0.310 1
24 1 4 1 "RMS(OBS, PRED)" N 93 3.577 1
25 1 5 1 "RMS(OBS, PRED)" C 92 1.015 1
26 1 5 1 "RMS(OBS, PRED)" CA 100 1.212 1
27 1 5 1 "RMS(OBS, PRED)" CB 94 1.096 1
28 1 5 1 "RMS(OBS, PRED)" H 93 0.802 1
29 1 5 1 "RMS(OBS, PRED)" HA 106 0.314 1
30 1 5 1 "RMS(OBS, PRED)" N 93 3.247 1
31 1 6 1 "RMS(OBS, PRED)" C 92 1.009 1
32 1 6 1 "RMS(OBS, PRED)" CA 100 1.205 1
33 1 6 1 "RMS(OBS, PRED)" CB 94 1.083 1
34 1 6 1 "RMS(OBS, PRED)" H 93 0.810 1
35 1 6 1 "RMS(OBS, PRED)" HA 106 0.305 1
36 1 6 1 "RMS(OBS, PRED)" N 93 3.430 1
37 1 7 1 "RMS(OBS, PRED)" C 92 0.933 1
38 1 7 1 "RMS(OBS, PRED)" CA 100 1.183 1
39 1 7 1 "RMS(OBS, PRED)" CB 94 1.111 1
40 1 7 1 "RMS(OBS, PRED)" H 93 0.805 1
41 1 7 1 "RMS(OBS, PRED)" HA 106 0.315 1
42 1 7 1 "RMS(OBS, PRED)" N 93 3.370 1
43 1 8 1 "RMS(OBS, PRED)" C 92 1.027 1
44 1 8 1 "RMS(OBS, PRED)" CA 100 1.204 1
45 1 8 1 "RMS(OBS, PRED)" CB 94 1.135 1
46 1 8 1 "RMS(OBS, PRED)" H 93 0.807 1
47 1 8 1 "RMS(OBS, PRED)" HA 106 0.303 1
48 1 8 1 "RMS(OBS, PRED)" N 93 3.313 1
49 1 9 1 "RMS(OBS, PRED)" C 92 1.002 1
50 1 9 1 "RMS(OBS, PRED)" CA 100 1.191 1
51 1 9 1 "RMS(OBS, PRED)" CB 94 1.177 1
52 1 9 1 "RMS(OBS, PRED)" H 93 0.840 1
53 1 9 1 "RMS(OBS, PRED)" HA 106 0.312 1
54 1 9 1 "RMS(OBS, PRED)" N 93 3.151 1
55 1 10 1 "RMS(OBS, PRED)" C 92 0.996 1
56 1 10 1 "RMS(OBS, PRED)" CA 100 1.215 1
57 1 10 1 "RMS(OBS, PRED)" CB 94 1.133 1
58 1 10 1 "RMS(OBS, PRED)" H 93 0.809 1
59 1 10 1 "RMS(OBS, PRED)" HA 106 0.305 1
60 1 10 1 "RMS(OBS, PRED)" N 93 3.304 1
61 1 11 1 "RMS(OBS, PRED)" C 92 0.969 1
62 1 11 1 "RMS(OBS, PRED)" CA 100 1.196 1
63 1 11 1 "RMS(OBS, PRED)" CB 94 1.217 1
64 1 11 1 "RMS(OBS, PRED)" H 93 0.809 1
65 1 11 1 "RMS(OBS, PRED)" HA 106 0.316 1
66 1 11 1 "RMS(OBS, PRED)" N 93 3.446 1
67 1 12 1 "RMS(OBS, PRED)" C 92 0.935 1
68 1 12 1 "RMS(OBS, PRED)" CA 100 1.142 1
69 1 12 1 "RMS(OBS, PRED)" CB 94 1.023 1
70 1 12 1 "RMS(OBS, PRED)" H 93 0.790 1
71 1 12 1 "RMS(OBS, PRED)" HA 106 0.317 1
72 1 12 1 "RMS(OBS, PRED)" N 93 3.179 1
73 1 13 1 "RMS(OBS, PRED)" C 92 1.014 1
74 1 13 1 "RMS(OBS, PRED)" CA 100 1.204 1
75 1 13 1 "RMS(OBS, PRED)" CB 94 1.081 1
76 1 13 1 "RMS(OBS, PRED)" H 93 0.825 1
77 1 13 1 "RMS(OBS, PRED)" HA 106 0.316 1
78 1 13 1 "RMS(OBS, PRED)" N 93 3.398 1
79 1 14 1 "RMS(OBS, PRED)" C 92 0.966 1
80 1 14 1 "RMS(OBS, PRED)" CA 100 1.211 1
81 1 14 1 "RMS(OBS, PRED)" CB 94 1.140 1
82 1 14 1 "RMS(OBS, PRED)" H 93 0.796 1
83 1 14 1 "RMS(OBS, PRED)" HA 106 0.305 1
84 1 14 1 "RMS(OBS, PRED)" N 93 3.331 1
85 1 15 1 "RMS(OBS, PRED)" C 92 1.010 1
86 1 15 1 "RMS(OBS, PRED)" CA 100 1.199 1
87 1 15 1 "RMS(OBS, PRED)" CB 94 1.141 1
88 1 15 1 "RMS(OBS, PRED)" H 93 0.796 1
89 1 15 1 "RMS(OBS, PRED)" HA 106 0.309 1
90 1 15 1 "RMS(OBS, PRED)" N 93 3.250 1
91 1 16 1 "RMS(OBS, PRED)" C 92 1.041 1
92 1 16 1 "RMS(OBS, PRED)" CA 100 1.195 1
93 1 16 1 "RMS(OBS, PRED)" CB 94 1.121 1
94 1 16 1 "RMS(OBS, PRED)" H 93 0.803 1
95 1 16 1 "RMS(OBS, PRED)" HA 106 0.298 1
96 1 16 1 "RMS(OBS, PRED)" N 93 3.404 1
97 1 17 1 "RMS(OBS, PRED)" C 92 0.960 1
98 1 17 1 "RMS(OBS, PRED)" CA 100 1.214 1
99 1 17 1 "RMS(OBS, PRED)" CB 94 1.088 1
100 1 17 1 "RMS(OBS, PRED)" H 93 0.808 1
101 1 17 1 "RMS(OBS, PRED)" HA 106 0.307 1
102 1 17 1 "RMS(OBS, PRED)" N 93 3.335 1
103 1 18 1 "RMS(OBS, PRED)" C 92 0.960 1
104 1 18 1 "RMS(OBS, PRED)" CA 100 1.226 1
105 1 18 1 "RMS(OBS, PRED)" CB 94 1.195 1
106 1 18 1 "RMS(OBS, PRED)" H 93 0.838 1
107 1 18 1 "RMS(OBS, PRED)" HA 106 0.305 1
108 1 18 1 "RMS(OBS, PRED)" N 93 3.324 1
109 1 19 1 "RMS(OBS, PRED)" C 92 1.002 1
110 1 19 1 "RMS(OBS, PRED)" CA 100 1.174 1
111 1 19 1 "RMS(OBS, PRED)" CB 94 1.155 1
112 1 19 1 "RMS(OBS, PRED)" H 93 0.805 1
113 1 19 1 "RMS(OBS, PRED)" HA 106 0.307 1
114 1 19 1 "RMS(OBS, PRED)" N 93 3.335 1
115 1 20 1 "RMS(OBS, PRED)" C 92 0.979 1
116 1 20 1 "RMS(OBS, PRED)" CA 100 1.178 1
117 1 20 1 "RMS(OBS, PRED)" CB 94 1.130 1
118 1 20 1 "RMS(OBS, PRED)" H 93 0.819 1
119 1 20 1 "RMS(OBS, PRED)" HA 106 0.316 1
120 1 20 1 "RMS(OBS, PRED)" N 93 3.436 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 8.340 0.446 2
1 8 . 1 1 A 2 2 GLN HA H 91 4.005 4.007 -0.002 2
1 15 . 1 1 A 2 2 GLN C C 91 177.270 178.296 -1.026 2
1 16 . 1 1 A 2 2 GLN CA C 91 58.220 58.976 -0.756 2
1 17 . 1 1 A 2 2 GLN CB C 91 28.650 28.434 0.216 2
1 19 . 1 1 A 2 2 GLN N N 91 121.993 122.880 -0.887 2
1 21 . 1 1 A 3 3 GLU H H 92 8.430 8.313 0.117 2
1 22 . 1 1 A 3 3 GLU HA H 92 4.007 4.115 -0.108 2
1 27 . 1 1 A 3 3 GLU C C 92 178.287 178.776 -0.489 2
1 28 . 1 1 A 3 3 GLU CA C 92 59.490 59.185 0.304 2
1 29 . 1 1 A 3 3 GLU CB C 92 29.506 29.250 0.256 2
1 31 . 1 1 A 3 3 GLU N N 92 120.195 118.680 1.515 2
1 32 . 1 1 A 4 4 SER H H 93 8.209 7.844 0.365 2
1 33 . 1 1 A 4 4 SER HA H 93 4.272 4.249 0.023 2
1 36 . 1 1 A 4 4 SER C C 93 177.369 177.190 0.179 2
1 37 . 1 1 A 4 4 SER CA C 93 61.044 61.683 -0.639 2
1 38 . 1 1 A 4 4 SER CB C 93 62.950 62.898 0.052 2
1 39 . 1 1 A 4 4 SER N N 93 115.524 115.650 -0.126 2
1 40 . 1 1 A 5 5 ILE H H 94 8.080 7.682 0.398 2
1 41 . 1 1 A 5 5 ILE HA H 94 3.530 3.620 -0.090 2
1 51 . 1 1 A 5 5 ILE C C 94 177.778 177.758 0.020 2
1 52 . 1 1 A 5 5 ILE CA C 94 65.710 65.325 0.385 2
1 53 . 1 1 A 5 5 ILE CB C 94 37.800 37.531 0.269 2
1 57 . 1 1 A 5 5 ILE N N 94 124.148 121.729 2.419 2
1 58 . 1 1 A 6 6 GLN H H 95 8.374 8.278 0.096 2
1 59 . 1 1 A 6 6 GLN HA H 95 4.125 4.020 0.105 2
1 66 . 1 1 A 6 6 GLN C C 95 179.726 179.185 0.541 2
1 67 . 1 1 A 6 6 GLN CA C 95 59.190 59.071 0.119 2
1 68 . 1 1 A 6 6 GLN CB C 95 27.060 28.348 -1.288 2
1 70 . 1 1 A 6 6 GLN N N 95 118.257 118.597 -0.340 2
1 72 . 1 1 A 7 7 ASN H H 96 8.456 7.935 0.521 2
1 73 . 1 1 A 7 7 ASN HA H 96 4.446 4.528 -0.082 2
1 78 . 1 1 A 7 7 ASN C C 96 177.257 178.424 -1.167 2
1 79 . 1 1 A 7 7 ASN CA C 96 56.020 56.163 -0.143 2
1 80 . 1 1 A 7 7 ASN CB C 96 38.126 37.856 0.270 2
1 81 . 1 1 A 7 7 ASN N N 96 118.597 118.490 0.107 2
1 83 . 1 1 A 8 8 LYS H H 97 7.732 7.670 0.062 2
1 84 . 1 1 A 8 8 LYS HA H 97 4.129 4.073 0.056 2
1 93 . 1 1 A 8 8 LYS C C 97 179.143 179.504 -0.361 2
1 94 . 1 1 A 8 8 LYS CA C 97 59.126 59.482 -0.356 2
1 95 . 1 1 A 8 8 LYS CB C 97 32.070 32.354 -0.284 2
1 99 . 1 1 A 8 8 LYS N N 97 122.381 118.895 3.486 2
1 100 . 1 1 A 9 9 ILE H H 98 8.452 8.138 0.314 2
1 101 . 1 1 A 9 9 ILE HA H 98 3.480 3.769 -0.289 2
1 111 . 1 1 A 9 9 ILE C C 98 177.406 178.270 -0.864 2
1 112 . 1 1 A 9 9 ILE CA C 98 66.430 65.202 1.228 2
1 113 . 1 1 A 9 9 ILE CB C 98 37.980 37.659 0.321 2
1 117 . 1 1 A 9 9 ILE N N 98 119.950 121.054 -1.104 2
1 118 . 1 1 A 10 10 SER H H 99 7.924 7.951 -0.027 2
1 119 . 1 1 A 10 10 SER HA H 99 3.983 4.171 -0.188 2
1 122 . 1 1 A 10 10 SER C C 99 176.327 176.588 -0.261 2
1 123 . 1 1 A 10 10 SER CA C 99 61.990 61.405 0.585 2
1 124 . 1 1 A 10 10 SER CB C 99 62.790 63.059 -0.269 2
1 125 . 1 1 A 10 10 SER N N 99 113.568 116.289 -2.721 2
1 126 . 1 1 A 11 11 GLN H H 100 7.832 7.407 0.425 2
1 127 . 1 1 A 11 11 GLN HA H 100 4.238 4.205 0.033 2
1 134 . 1 1 A 11 11 GLN C C 100 178.088 177.498 0.590 2
1 135 . 1 1 A 11 11 GLN CA C 100 57.900 58.127 -0.227 2
1 136 . 1 1 A 11 11 GLN CB C 100 29.790 28.664 1.126 2
1 138 . 1 1 A 11 11 GLN N N 100 117.487 120.177 -2.690 2
1 140 . 1 1 A 12 12 CYS H H 101 7.920 7.995 -0.075 2
1 141 . 1 1 A 12 12 CYS HA H 101 4.657 4.590 0.067 2
1 144 . 1 1 A 12 12 CYS C C 101 175.446 174.812 0.634 2
1 145 . 1 1 A 12 12 CYS CA C 101 60.654 60.036 0.618 2
1 146 . 1 1 A 12 12 CYS CB C 101 29.310 27.990 1.320 2
1 147 . 1 1 A 12 12 CYS N N 101 114.221 117.067 -2.846 2
1 148 . 1 1 A 13 13 LYS H H 102 8.029 7.288 0.741 2
1 149 . 1 1 A 13 13 LYS HA H 102 5.069 4.789 0.280 2
1 158 . 1 1 A 13 13 LYS C C 102 174.800 176.301 -1.501 2
1 159 . 1 1 A 13 13 LYS CA C 102 56.394 56.065 0.329 2
1 160 . 1 1 A 13 13 LYS CB C 102 32.770 33.429 -0.659 2
1 164 . 1 1 A 13 13 LYS N N 102 124.129 119.308 4.821 2
1 165 . 1 1 A 14 14 PHE H H 103 8.737 8.627 0.110 2
1 166 . 1 1 A 14 14 PHE HA H 103 5.059 5.105 -0.046 2
1 174 . 1 1 A 14 14 PHE C C 103 173.560 173.121 0.439 2
1 175 . 1 1 A 14 14 PHE CA C 103 55.470 56.020 -0.550 2
1 176 . 1 1 A 14 14 PHE CB C 103 41.760 41.190 0.570 2
1 180 . 1 1 A 14 14 PHE N N 103 118.661 116.538 2.123 2
1 181 . 1 1 A 15 15 SER H H 104 8.826 8.710 0.116 2
1 182 . 1 1 A 15 15 SER HA H 104 4.602 4.532 0.070 2
1 185 . 1 1 A 15 15 SER C C 104 173.795 173.677 0.118 2
1 186 . 1 1 A 15 15 SER CA C 104 58.610 58.428 0.181 2
1 187 . 1 1 A 15 15 SER CB C 104 62.690 62.715 -0.025 2
1 188 . 1 1 A 15 15 SER N N 104 117.781 115.990 1.791 2
1 189 . 1 1 A 16 16 VAL H H 105 7.784 8.106 -0.322 2
1 190 . 1 1 A 16 16 VAL HA H 105 3.370 4.046 -0.676 2
1 198 . 1 1 A 16 16 VAL C C 105 174.987 175.302 -0.315 2
1 199 . 1 1 A 16 16 VAL CA C 105 63.580 62.844 0.736 2
1 200 . 1 1 A 16 16 VAL CB C 105 31.410 30.916 0.494 2
1 203 . 1 1 A 16 16 VAL N N 105 129.075 126.471 2.604 2
1 204 . 1 1 A 17 17 CYS H H 106 8.536 8.530 0.006 2
1 205 . 1 1 A 17 17 CYS HA H 106 5.011 4.981 0.030 2
1 208 . 1 1 A 17 17 CYS CA C 106 55.260 56.331 -1.071 2
1 209 . 1 1 A 17 17 CYS CB C 106 28.210 28.558 -0.348 2
1 210 . 1 1 A 17 17 CYS N N 106 130.045 127.198 2.847 2
1 211 . 1 1 A 18 18 PRO HA H 107 3.991 4.356 -0.365 2
1 218 . 1 1 A 18 18 PRO C C 107 178.188 178.388 -0.200 2
1 219 . 1 1 A 18 18 PRO CA C 107 65.940 64.957 0.983 2
1 220 . 1 1 A 18 18 PRO CB C 107 32.000 32.006 -0.006 2
1 223 . 1 1 A 19 19 GLU H H 108 9.260 9.058 0.202 2
1 224 . 1 1 A 19 19 GLU HA H 108 4.119 4.099 0.020 2
1 229 . 1 1 A 19 19 GLU C C 108 178.721 178.825 -0.104 2
1 230 . 1 1 A 19 19 GLU CA C 108 59.300 59.106 0.194 2
1 231 . 1 1 A 19 19 GLU CB C 108 28.920 28.734 0.186 2
1 233 . 1 1 A 19 19 GLU N N 108 118.270 116.197 2.073 2
1 234 . 1 1 A 20 20 ARG H H 109 7.672 7.706 -0.034 2
1 235 . 1 1 A 20 20 ARG HA H 109 4.331 4.182 0.149 2
1 242 . 1 1 A 20 20 ARG C C 109 177.977 178.601 -0.624 2
1 243 . 1 1 A 20 20 ARG CA C 109 57.350 58.506 -1.156 2
1 244 . 1 1 A 20 20 ARG CB C 109 30.820 30.369 0.451 2
1 247 . 1 1 A 20 20 ARG N N 109 118.357 119.624 -1.267 2
1 248 . 1 1 A 21 21 LEU H H 110 7.601 7.797 -0.196 2
1 249 . 1 1 A 21 21 LEU HA H 110 4.380 4.266 0.115 2
1 259 . 1 1 A 21 21 LEU C C 110 176.562 176.442 0.120 2
1 260 . 1 1 A 21 21 LEU CA C 110 56.096 55.618 0.478 2
1 261 . 1 1 A 21 21 LEU CB C 110 44.016 42.147 1.869 2
1 265 . 1 1 A 21 21 LEU N N 110 118.626 118.410 0.216 2
1 266 . 1 1 A 22 22 GLN H H 111 7.750 7.673 0.077 2
1 267 . 1 1 A 22 22 GLN HA H 111 3.870 3.942 -0.072 2
1 274 . 1 1 A 22 22 GLN C C 111 173.336 174.480 -1.144 2
1 275 . 1 1 A 22 22 GLN CA C 111 56.510 57.279 -0.769 2
1 276 . 1 1 A 22 22 GLN CB C 111 26.800 26.513 0.287 2
1 278 . 1 1 A 22 22 GLN N N 111 113.926 115.647 -1.721 2
1 280 . 1 1 A 23 23 CYS H H 112 7.407 7.717 -0.310 2
1 281 . 1 1 A 23 23 CYS HA H 112 4.469 4.815 -0.346 2
1 284 . 1 1 A 23 23 CYS CA C 112 52.650 57.354 -4.704 2
1 285 . 1 1 A 23 23 CYS CB C 112 29.750 28.695 1.055 2
1 286 . 1 1 A 23 23 CYS N N 112 112.681 118.250 -5.569 2
1 287 . 1 1 A 24 24 PRO HA H 113 4.408 4.580 -0.172 2
1 294 . 1 1 A 24 24 PRO C C 113 178.175 177.477 0.698 2
1 295 . 1 1 A 24 24 PRO CA C 113 62.040 62.746 -0.706 2
1 296 . 1 1 A 24 24 PRO CB C 113 31.920 32.671 -0.751 2
1 299 . 1 1 A 25 25 LEU H H 114 8.593 8.435 0.158 2
1 300 . 1 1 A 25 25 LEU HA H 114 3.765 3.913 -0.148 2
1 310 . 1 1 A 25 25 LEU C C 114 179.950 178.884 1.066 2
1 311 . 1 1 A 25 25 LEU CA C 114 57.674 57.813 -0.139 2
1 312 . 1 1 A 25 25 LEU CB C 114 40.690 41.500 -0.810 2
1 316 . 1 1 A 25 25 LEU N N 114 123.729 123.458 0.271 2
1 317 . 1 1 A 26 26 GLU H H 115 9.108 8.585 0.523 2
1 318 . 1 1 A 26 26 GLU HA H 115 3.876 4.040 -0.164 2
1 323 . 1 1 A 26 26 GLU C C 115 177.505 178.523 -1.018 2
1 324 . 1 1 A 26 26 GLU CA C 115 59.410 59.211 0.199 2
1 325 . 1 1 A 26 26 GLU CB C 115 28.460 29.316 -0.856 2
1 327 . 1 1 A 26 26 GLU N N 115 116.817 117.477 -0.660 2
1 328 . 1 1 A 27 27 ALA H H 116 7.360 7.634 -0.274 2
1 329 . 1 1 A 27 27 ALA HA H 116 4.408 4.130 0.278 2
1 333 . 1 1 A 27 27 ALA C C 116 177.046 177.873 -0.827 2
1 334 . 1 1 A 27 27 ALA CA C 116 52.970 54.384 -1.414 2
1 335 . 1 1 A 27 27 ALA CB C 116 19.916 18.408 1.508 2
1 336 . 1 1 A 27 27 ALA N N 116 118.966 120.946 -1.980 2
1 337 . 1 1 A 28 28 ILE H H 117 7.168 7.014 0.154 2
1 338 . 1 1 A 28 28 ILE HA H 117 4.432 4.382 0.050 2
1 348 . 1 1 A 28 28 ILE C C 117 172.641 175.497 -2.856 2
1 349 . 1 1 A 28 28 ILE CA C 117 59.980 59.612 0.368 2
1 350 . 1 1 A 28 28 ILE CB C 117 37.350 37.701 -0.351 2
1 354 . 1 1 A 28 28 ILE N N 117 108.913 108.868 0.045 2
1 355 . 1 1 A 29 29 GLN H H 118 6.562 7.259 -0.697 2
1 356 . 1 1 A 29 29 GLN HA H 118 3.922 4.231 -0.309 2
1 363 . 1 1 A 29 29 GLN C C 118 175.049 175.506 -0.457 2
1 364 . 1 1 A 29 29 GLN CA C 118 54.596 55.975 -1.379 2
1 365 . 1 1 A 29 29 GLN CB C 118 29.570 29.256 0.314 2
1 367 . 1 1 A 29 29 GLN N N 118 116.455 123.289 -6.834 2
1 369 . 1 1 A 30 30 CYS H H 119 8.138 8.399 -0.261 2
1 370 . 1 1 A 30 30 CYS HA H 119 4.580 4.588 -0.008 2
1 373 . 1 1 A 30 30 CYS CA C 119 57.810 57.122 0.688 2
1 374 . 1 1 A 30 30 CYS CB C 119 30.200 28.717 1.483 2
1 375 . 1 1 A 30 30 CYS N N 119 134.136 125.315 8.821 2
1 376 . 1 1 A 31 31 PRO HA H 120 4.424 4.442 -0.018 2
1 383 . 1 1 A 31 31 PRO C C 120 177.431 177.582 -0.151 2
1 384 . 1 1 A 31 31 PRO CA C 120 64.060 64.035 0.025 2
1 385 . 1 1 A 31 31 PRO CB C 120 32.776 31.893 0.883 2
1 388 . 1 1 A 32 32 ILE H H 121 11.318 7.663 3.655 2
1 389 . 1 1 A 32 32 ILE HA H 121 4.038 3.982 0.057 2
1 399 . 1 1 A 32 32 ILE C C 121 178.485 177.897 0.588 2
1 400 . 1 1 A 32 32 ILE CA C 121 64.060 63.983 0.077 2
1 401 . 1 1 A 32 32 ILE CB C 121 39.340 38.369 0.971 2
1 405 . 1 1 A 32 32 ILE N N 121 124.500 117.129 7.371 2
1 406 . 1 1 A 33 33 THR H H 122 9.928 7.488 2.440 2
1 407 . 1 1 A 33 33 THR HA H 122 4.048 4.344 -0.296 2
1 412 . 1 1 A 33 33 THR C C 122 175.793 174.826 0.967 2
1 413 . 1 1 A 33 33 THR CA C 122 62.990 61.921 1.069 2
1 414 . 1 1 A 33 33 THR CB C 122 70.300 70.058 0.242 2
1 416 . 1 1 A 33 33 THR N N 122 115.136 109.305 5.831 2
1 417 . 1 1 A 34 34 LEU H H 123 8.439 7.766 0.673 2
1 418 . 1 1 A 34 34 LEU HA H 123 3.912 3.817 0.095 2
1 428 . 1 1 A 34 34 LEU C C 123 175.495 175.096 0.399 2
1 429 . 1 1 A 34 34 LEU CA C 123 56.290 56.212 0.078 2
1 430 . 1 1 A 34 34 LEU CB C 123 38.500 39.818 -1.318 2
1 434 . 1 1 A 34 34 LEU N N 123 117.230 119.045 -1.815 2
1 435 . 1 1 A 35 35 GLU H H 124 7.816 7.156 0.660 2
1 436 . 1 1 A 35 35 GLU HA H 124 4.634 4.768 -0.134 2
1 441 . 1 1 A 35 35 GLU C C 124 174.838 174.054 0.784 2
1 442 . 1 1 A 35 35 GLU CA C 124 53.780 54.750 -0.970 2
1 443 . 1 1 A 35 35 GLU CB C 124 33.710 32.407 1.303 2
1 445 . 1 1 A 35 35 GLU N N 124 116.577 114.342 2.235 2
1 446 . 1 1 A 36 36 GLN H H 125 8.532 8.450 0.082 2
1 447 . 1 1 A 36 36 GLN HA H 125 4.958 4.389 0.569 2
1 454 . 1 1 A 36 36 GLN CA C 125 53.350 53.387 -0.037 2
1 455 . 1 1 A 36 36 GLN CB C 125 29.950 29.352 0.598 2
1 457 . 1 1 A 36 36 GLN N N 125 123.034 123.565 -0.531 2
1 459 . 1 1 A 37 37 PRO HA H 126 4.458 4.649 -0.191 2
1 466 . 1 1 A 37 37 PRO C C 126 176.314 176.700 -0.386 2
1 467 . 1 1 A 37 37 PRO CA C 126 62.816 62.582 0.234 2
1 468 . 1 1 A 37 37 PRO CB C 126 33.070 32.797 0.273 2
1 471 . 1 1 A 38 38 GLU H H 127 8.626 8.372 0.254 2
1 472 . 1 1 A 38 38 GLU HA H 127 4.274 4.199 0.075 2
1 477 . 1 1 A 38 38 GLU C C 127 177.877 176.288 1.589 2
1 478 . 1 1 A 38 38 GLU CA C 127 58.730 57.521 1.209 2
1 479 . 1 1 A 38 38 GLU CB C 127 30.340 30.339 0.001 2
1 481 . 1 1 A 38 38 GLU N N 127 120.691 118.832 1.859 2
1 482 . 1 1 A 39 39 LYS H H 128 7.861 7.718 0.143 2
1 483 . 1 1 A 39 39 LYS HA H 128 4.889 4.850 0.039 2
1 492 . 1 1 A 39 39 LYS C C 128 175.446 174.923 0.523 2
1 493 . 1 1 A 39 39 LYS CA C 128 53.670 54.659 -0.989 2
1 494 . 1 1 A 39 39 LYS CB C 128 33.630 35.762 -2.132 2
1 498 . 1 1 A 39 39 LYS N N 128 117.878 117.001 0.877 2
1 499 . 1 1 A 40 40 GLY H H 129 8.426 7.912 0.514 2
1 500 . 1 1 A 40 40 GLY HA2 H 129 4.970 4.010 0.960 2
1 501 . 1 1 A 40 40 GLY HA3 H 129 2.458 4.151 -1.693 2
1 502 . 1 1 A 40 40 GLY C C 129 170.048 172.272 -2.224 2
1 503 . 1 1 A 40 40 GLY CA C 129 42.910 45.003 -2.093 2
1 504 . 1 1 A 40 40 GLY N N 129 112.604 106.143 6.461 2
1 505 . 1 1 A 41 41 ILE H H 130 8.596 9.053 -0.458 2
1 506 . 1 1 A 41 41 ILE HA H 130 4.636 5.131 -0.495 2
1 516 . 1 1 A 41 41 ILE C C 130 172.691 174.317 -1.626 2
1 517 . 1 1 A 41 41 ILE CA C 130 58.500 58.748 -0.248 2
1 518 . 1 1 A 41 41 ILE CB C 130 43.320 41.077 2.243 2
1 522 . 1 1 A 41 41 ILE N N 130 113.363 116.682 -3.319 2
1 523 . 1 1 A 42 42 PHE H H 131 8.994 8.966 0.027 2
1 524 . 1 1 A 42 42 PHE HA H 131 5.075 5.474 -0.399 2
1 532 . 1 1 A 42 42 PHE C C 131 175.111 174.961 0.150 2
1 533 . 1 1 A 42 42 PHE CA C 131 58.680 57.093 1.587 2
1 534 . 1 1 A 42 42 PHE CB C 131 42.220 40.544 1.676 2
1 538 . 1 1 A 42 42 PHE N N 131 125.156 121.826 3.330 2
1 539 . 1 1 A 43 43 VAL H H 132 8.399 9.278 -0.879 2
1 540 . 1 1 A 43 43 VAL HA H 132 4.920 4.747 0.173 2
1 548 . 1 1 A 43 43 VAL C C 132 178.175 175.283 2.892 2
1 549 . 1 1 A 43 43 VAL CA C 132 59.600 60.962 -1.362 2
1 550 . 1 1 A 43 43 VAL CB C 132 35.920 34.485 1.435 2
1 553 . 1 1 A 43 43 VAL N N 132 119.371 123.130 -3.759 2
1 554 . 1 1 A 44 44 LYS H H 133 10.041 8.524 1.517 2
1 555 . 1 1 A 44 44 LYS HA H 133 4.920 4.398 0.522 2
1 564 . 1 1 A 44 44 LYS C C 133 177.195 175.686 1.509 2
1 565 . 1 1 A 44 44 LYS CA C 133 57.310 56.413 0.897 2
1 566 . 1 1 A 44 44 LYS CB C 133 34.410 32.456 1.954 2
1 570 . 1 1 A 44 44 LYS N N 133 130.928 126.714 4.214 2
1 571 . 1 1 A 45 45 ASN H H 134 8.534 8.935 -0.401 2
1 572 . 1 1 A 45 45 ASN HA H 134 4.151 4.705 -0.554 2
1 577 . 1 1 A 45 45 ASN C C 134 174.217 175.261 -1.044 2
1 578 . 1 1 A 45 45 ASN CA C 134 55.290 52.453 2.837 2
1 579 . 1 1 A 45 45 ASN CB C 134 37.530 37.703 -0.173 2
1 580 . 1 1 A 45 45 ASN N N 134 119.452 124.167 -4.715 2
1 582 . 1 1 A 46 46 SER H H 135 7.570 8.063 -0.493 2
1 583 . 1 1 A 46 46 SER HA H 135 4.220 4.112 0.108 2
1 586 . 1 1 A 46 46 SER C C 135 174.490 176.770 -2.280 2
1 587 . 1 1 A 46 46 SER CA C 135 57.090 61.336 -4.246 2
1 588 . 1 1 A 46 46 SER CB C 135 64.126 63.022 1.105 2
1 589 . 1 1 A 46 46 SER N N 135 105.613 121.148 -15.535 2
1 590 . 1 1 A 47 47 ASP H H 136 9.113 8.141 0.972 2
1 591 . 1 1 A 47 47 ASP HA H 136 4.220 4.323 -0.103 2
1 594 . 1 1 A 47 47 ASP CA C 136 57.610 57.060 0.550 2
1 595 . 1 1 A 47 47 ASP CB C 136 40.810 40.606 0.204 2
1 596 . 1 1 A 47 47 ASP N N 136 120.995 121.063 -0.068 2
1 597 . 1 1 A 48 48 GLY H H 137 8.172 8.026 0.146 2
1 598 . 1 1 A 48 48 GLY HA2 H 137 4.096 3.785 0.311 2
1 599 . 1 1 A 48 48 GLY HA3 H 137 3.664 3.794 -0.130 2
1 600 . 1 1 A 48 48 GLY C C 137 173.990 175.104 -1.114 2
1 601 . 1 1 A 48 48 GLY CA C 137 45.130 47.152 -2.022 2
1 602 . 1 1 A 48 48 GLY N N 137 105.838 107.251 -1.413 2
1 603 . 1 1 A 49 49 SER H H 138 7.252 7.649 -0.397 2
1 604 . 1 1 A 49 49 SER HA H 138 4.503 4.661 -0.158 2
1 607 . 1 1 A 49 49 SER C C 138 173.857 173.661 0.195 2
1 608 . 1 1 A 49 49 SER CA C 138 57.340 57.503 -0.163 2
1 609 . 1 1 A 49 49 SER CB C 138 65.370 63.954 1.416 2
1 610 . 1 1 A 49 49 SER N N 138 114.942 112.211 2.731 2
1 611 . 1 1 A 50 50 ASP H H 139 8.276 8.037 0.239 2
1 612 . 1 1 A 50 50 ASP HA H 139 4.618 4.247 0.372 2
1 615 . 1 1 A 50 50 ASP C C 139 174.577 175.027 -0.450 2
1 616 . 1 1 A 50 50 ASP CA C 139 53.116 55.505 -2.389 2
1 617 . 1 1 A 50 50 ASP CB C 139 40.520 39.907 0.613 2
1 618 . 1 1 A 50 50 ASP N N 139 122.088 118.386 3.702 2
1 619 . 1 1 A 51 51 VAL H H 140 8.192 7.495 0.697 2
1 620 . 1 1 A 51 51 VAL HA H 140 4.299 4.234 0.065 2
1 628 . 1 1 A 51 51 VAL C C 140 175.867 175.228 0.639 2
1 629 . 1 1 A 51 51 VAL CA C 140 62.950 62.288 0.662 2
1 630 . 1 1 A 51 51 VAL CB C 140 33.230 32.374 0.856 2
1 632 . 1 1 A 51 51 VAL N N 140 121.167 119.202 1.965 2
1 633 . 1 1 A 52 52 CYS H H 141 8.391 8.797 -0.406 2
1 634 . 1 1 A 52 52 CYS HA H 141 5.247 5.196 0.051 2
1 637 . 1 1 A 52 52 CYS C C 141 172.778 174.623 -1.845 2
1 638 . 1 1 A 52 52 CYS CA C 141 56.480 58.229 -1.749 2
1 639 . 1 1 A 52 52 CYS CB C 141 31.960 28.837 3.123 2
1 640 . 1 1 A 52 52 CYS N N 141 121.884 126.206 -4.321 2
1 641 . 1 1 A 53 53 THR H H 142 8.777 8.972 -0.195 2
1 642 . 1 1 A 53 53 THR HA H 142 4.489 4.982 -0.493 2
1 648 . 1 1 A 53 53 THR C C 142 171.885 172.553 -0.668 2
1 649 . 1 1 A 53 53 THR CA C 142 62.070 61.403 0.667 2
1 650 . 1 1 A 53 53 THR CB C 142 71.390 71.463 -0.073 2
1 652 . 1 1 A 53 53 THR N N 142 118.132 118.600 -0.468 2
1 653 . 1 1 A 54 54 LEU H H 143 8.409 8.422 -0.013 2
1 654 . 1 1 A 54 54 LEU HA H 143 4.276 4.492 -0.216 2
1 664 . 1 1 A 54 54 LEU C C 143 174.366 174.151 0.215 2
1 665 . 1 1 A 54 54 LEU CA C 143 54.330 53.176 1.154 2
1 666 . 1 1 A 54 54 LEU CB C 143 42.396 42.788 -0.392 2
1 670 . 1 1 A 54 54 LEU N N 143 127.980 128.231 -0.250 2
1 671 . 1 1 A 55 55 PHE H H 144 8.646 8.686 -0.040 2
1 672 . 1 1 A 55 55 PHE HA H 144 5.455 4.815 0.640 2
1 680 . 1 1 A 55 55 PHE C C 144 176.054 175.104 0.950 2
1 681 . 1 1 A 55 55 PHE CA C 144 55.250 56.758 -1.508 2
1 682 . 1 1 A 55 55 PHE CB C 144 44.100 41.096 3.005 2
1 686 . 1 1 A 55 55 PHE N N 144 122.010 126.791 -4.781 2
1 687 . 1 1 A 56 56 ASP H H 145 11.575 8.295 3.280 2
1 688 . 1 1 A 56 56 ASP HA H 145 4.416 4.484 -0.069 2
1 691 . 1 1 A 56 56 ASP C C 145 176.748 177.471 -0.723 2
1 692 . 1 1 A 56 56 ASP CA C 145 55.840 54.716 1.124 2
1 693 . 1 1 A 56 56 ASP CB C 145 44.390 42.227 2.163 2
1 694 . 1 1 A 56 56 ASP N N 145 121.936 123.953 -2.017 2
1 695 . 1 1 A 57 57 ALA H H 146 8.508 8.718 -0.210 2
1 696 . 1 1 A 57 57 ALA HA H 146 3.797 4.032 -0.235 2
1 700 . 1 1 A 57 57 ALA C C 146 178.696 179.940 -1.244 2
1 701 . 1 1 A 57 57 ALA CA C 146 55.990 55.493 0.497 2
1 702 . 1 1 A 57 57 ALA CB C 146 18.840 18.114 0.726 2
1 703 . 1 1 A 57 57 ALA N N 146 130.243 129.288 0.955 2
1 704 . 1 1 A 58 58 ALA H H 147 8.378 7.651 0.727 2
1 705 . 1 1 A 58 58 ALA HA H 147 4.078 4.215 -0.137 2
1 709 . 1 1 A 58 58 ALA C C 147 181.091 179.504 1.587 2
1 710 . 1 1 A 58 58 ALA CA C 147 54.770 54.907 -0.137 2
1 711 . 1 1 A 58 58 ALA CB C 147 17.700 18.454 -0.754 2
1 712 . 1 1 A 58 58 ALA N N 147 121.997 119.540 2.457 2
1 713 . 1 1 A 59 59 ALA H H 148 9.138 7.930 1.208 2
1 714 . 1 1 A 59 59 ALA HA H 148 3.975 4.064 -0.089 2
1 718 . 1 1 A 59 59 ALA C C 148 180.508 179.848 0.660 2
1 719 . 1 1 A 59 59 ALA CA C 148 54.840 55.080 -0.240 2
1 720 . 1 1 A 59 59 ALA CB C 148 18.600 18.556 0.044 2
1 721 . 1 1 A 59 59 ALA N N 148 123.595 120.398 3.196 2
1 722 . 1 1 A 60 60 PHE H H 149 8.814 8.156 0.658 2
1 723 . 1 1 A 60 60 PHE HA H 149 3.722 4.029 -0.308 2
1 731 . 1 1 A 60 60 PHE C C 149 176.773 177.487 -0.714 2
1 732 . 1 1 A 60 60 PHE CA C 149 62.030 61.539 0.491 2
1 733 . 1 1 A 60 60 PHE CB C 149 39.960 38.873 1.087 2
1 737 . 1 1 A 60 60 PHE N N 149 120.354 119.918 0.436 2
1 738 . 1 1 A 61 61 SER H H 150 8.276 8.145 0.131 2
1 739 . 1 1 A 61 61 SER HA H 150 3.880 4.139 -0.260 2
1 742 . 1 1 A 61 61 SER C C 150 177.691 177.211 0.480 2
1 743 . 1 1 A 61 61 SER CA C 150 62.190 61.316 0.874 2
1 744 . 1 1 A 61 61 SER CB C 150 63.016 63.146 -0.130 2
1 745 . 1 1 A 61 61 SER N N 150 112.086 114.036 -1.950 2
1 746 . 1 1 A 62 62 ARG H H 151 7.829 7.723 0.106 2
1 747 . 1 1 A 62 62 ARG HA H 151 3.971 4.059 -0.088 2
1 754 . 1 1 A 62 62 ARG C C 151 178.287 178.723 -0.436 2
1 755 . 1 1 A 62 62 ARG CA C 151 59.340 59.125 0.215 2
1 756 . 1 1 A 62 62 ARG CB C 151 29.760 29.810 -0.050 2
1 759 . 1 1 A 62 62 ARG N N 151 121.090 121.510 -0.420 2
1 760 . 1 1 A 63 63 LEU H H 152 7.390 7.701 -0.311 2
1 761 . 1 1 A 63 63 LEU HA H 152 3.791 3.940 -0.149 2
1 771 . 1 1 A 63 63 LEU C C 152 179.106 178.929 0.177 2
1 772 . 1 1 A 63 63 LEU CA C 152 58.900 57.912 0.988 2
1 773 . 1 1 A 63 63 LEU CB C 152 41.140 41.458 -0.318 2
1 777 . 1 1 A 63 63 LEU N N 152 121.129 119.367 1.762 2
1 778 . 1 1 A 64 64 VAL H H 153 7.552 7.963 -0.410 2
1 779 . 1 1 A 64 64 VAL HA H 153 3.411 3.499 -0.088 2
1 787 . 1 1 A 64 64 VAL C C 153 180.595 178.370 2.225 2
1 788 . 1 1 A 64 64 VAL CA C 153 65.644 66.341 -0.697 2
1 789 . 1 1 A 64 64 VAL CB C 153 31.410 31.437 -0.027 2
1 792 . 1 1 A 64 64 VAL N N 153 118.280 118.622 -0.342 2
1 793 . 1 1 A 65 65 GLY H H 154 8.061 8.146 -0.085 2
1 794 . 1 1 A 65 65 GLY HA2 H 154 3.846 3.793 0.053 2
1 795 . 1 1 A 65 65 GLY HA3 H 154 3.809 3.795 0.014 2
1 796 . 1 1 A 65 65 GLY C C 154 175.235 175.798 -0.563 2
1 797 . 1 1 A 65 65 GLY CA C 154 46.630 46.948 -0.318 2
1 798 . 1 1 A 65 65 GLY N N 154 108.622 107.722 0.900 2
1 799 . 1 1 A 66 66 GLU H H 155 7.528 7.579 -0.051 2
1 800 . 1 1 A 66 66 GLU HA H 155 4.228 4.333 -0.105 2
1 805 . 1 1 A 66 66 GLU C C 155 176.761 176.910 -0.149 2
1 806 . 1 1 A 66 66 GLU CA C 155 56.590 56.332 0.258 2
1 807 . 1 1 A 66 66 GLU CB C 155 30.490 30.361 0.129 2
1 809 . 1 1 A 66 66 GLU N N 155 118.361 118.927 -0.566 2
1 810 . 1 1 A 67 67 GLY H H 156 7.884 7.831 0.053 2
1 811 . 1 1 A 67 67 GLY HA2 H 156 3.918 3.889 0.030 2
1 812 . 1 1 A 67 67 GLY HA3 H 156 3.747 3.901 -0.154 2
1 813 . 1 1 A 67 67 GLY C C 156 174.788 174.525 0.263 2
1 814 . 1 1 A 67 67 GLY CA C 156 45.890 45.693 0.197 2
1 815 . 1 1 A 67 67 GLY N N 156 108.465 108.783 -0.318 2
1 816 . 1 1 A 68 68 LEU H H 157 7.332 7.944 -0.612 2
1 817 . 1 1 A 68 68 LEU HA H 157 4.361 4.496 -0.135 2
1 827 . 1 1 A 68 68 LEU CA C 157 53.060 52.384 0.676 2
1 828 . 1 1 A 68 68 LEU CB C 157 41.100 41.702 -0.602 2
1 832 . 1 1 A 68 68 LEU N N 157 121.920 121.782 0.138 2
1 833 . 1 1 A 69 69 PRO HA H 158 4.485 4.578 -0.093 2
1 840 . 1 1 A 69 69 PRO C C 158 174.602 176.225 -1.623 2
1 841 . 1 1 A 69 69 PRO CA C 158 61.556 62.230 -0.674 2
1 842 . 1 1 A 69 69 PRO CB C 158 32.370 32.755 -0.385 2
1 845 . 1 1 A 70 70 HIS H H 159 8.759 8.626 0.133 2
1 846 . 1 1 A 70 70 HIS HA H 159 3.947 4.438 -0.491 2
1 852 . 1 1 A 70 70 HIS CA C 159 56.250 55.173 1.077 2
1 853 . 1 1 A 70 70 HIS CB C 159 32.280 30.968 1.312 2
1 856 . 1 1 A 70 70 HIS N N 159 119.423 120.730 -1.307 2
1 857 . 1 1 A 71 71 PRO HA H 160 4.424 4.350 0.074 2
1 864 . 1 1 A 71 71 PRO C C 160 177.567 178.026 -0.459 2
1 865 . 1 1 A 71 71 PRO CA C 160 64.574 64.630 -0.056 2
1 866 . 1 1 A 71 71 PRO CB C 160 32.340 31.913 0.427 2
1 869 . 1 1 A 72 72 LEU H H 161 10.123 7.596 2.527 2
1 870 . 1 1 A 72 72 LEU HA H 161 4.778 4.332 0.446 2
1 880 . 1 1 A 72 72 LEU C C 161 178.721 178.099 0.622 2
1 881 . 1 1 A 72 72 LEU CA C 161 55.800 56.949 -1.149 2
1 882 . 1 1 A 72 72 LEU CB C 161 42.440 43.032 -0.592 2
1 886 . 1 1 A 72 72 LEU N N 161 117.374 117.332 0.042 2
1 887 . 1 1 A 73 73 THR H H 162 7.523 7.931 -0.408 2
1 888 . 1 1 A 73 73 THR HA H 162 4.291 4.521 -0.230 2
1 893 . 1 1 A 73 73 THR C C 162 175.557 174.376 1.181 2
1 894 . 1 1 A 73 73 THR CA C 162 61.440 62.593 -1.153 2
1 895 . 1 1 A 73 73 THR CB C 162 70.500 69.737 0.762 2
1 897 . 1 1 A 73 73 THR N N 162 107.787 111.843 -4.056 2
1 898 . 1 1 A 74 74 ARG H H 163 8.361 7.926 0.435 2
1 899 . 1 1 A 74 74 ARG HA H 163 3.836 4.270 -0.434 2
1 906 . 1 1 A 74 74 ARG C C 163 174.701 175.127 -0.426 2
1 907 . 1 1 A 74 74 ARG CA C 163 57.980 57.558 0.422 2
1 908 . 1 1 A 74 74 ARG CB C 163 26.770 27.070 -0.300 2
1 911 . 1 1 A 74 74 ARG N N 163 115.130 118.407 -3.277 2
1 912 . 1 1 A 75 75 GLU H H 164 7.430 8.067 -0.637 2
1 913 . 1 1 A 75 75 GLU HA H 164 4.636 4.499 0.137 2
1 918 . 1 1 A 75 75 GLU CA C 164 53.699 54.831 -1.132 2
1 919 . 1 1 A 75 75 GLU CB C 164 29.550 28.752 0.798 2
1 921 . 1 1 A 75 75 GLU N N 164 120.076 118.937 1.139 2
1 922 . 1 1 A 76 76 PRO HA H 165 4.272 4.503 -0.231 2
1 929 . 1 1 A 76 76 PRO C C 165 176.649 176.973 -0.324 2
1 930 . 1 1 A 76 76 PRO CA C 165 63.204 63.085 0.119 2
1 931 . 1 1 A 76 76 PRO CB C 165 31.680 31.672 0.008 2
1 934 . 1 1 A 77 77 ILE H H 166 8.812 8.227 0.585 2
1 935 . 1 1 A 77 77 ILE HA H 166 3.838 4.290 -0.452 2
1 945 . 1 1 A 77 77 ILE C C 166 175.235 176.025 -0.790 2
1 946 . 1 1 A 77 77 ILE CA C 166 62.816 61.274 1.542 2
1 947 . 1 1 A 77 77 ILE CB C 166 37.750 37.952 -0.202 2
1 951 . 1 1 A 77 77 ILE N N 166 123.831 124.053 -0.222 2
1 952 . 1 1 A 78 78 THR H H 167 6.625 8.565 -1.940 2
1 953 . 1 1 A 78 78 THR HA H 167 4.632 5.044 -0.412 2
1 958 . 1 1 A 78 78 THR C C 167 174.143 174.300 -0.157 2
1 959 . 1 1 A 78 78 THR CA C 167 58.750 60.168 -1.418 2
1 960 . 1 1 A 78 78 THR CB C 167 71.320 70.917 0.403 2
1 962 . 1 1 A 78 78 THR N N 167 115.293 117.988 -2.695 2
1 963 . 1 1 A 79 79 ALA H H 168 9.088 8.980 0.108 2
1 964 . 1 1 A 79 79 ALA HA H 168 3.916 4.125 -0.209 2
1 968 . 1 1 A 79 79 ALA C C 168 179.788 179.566 0.221 2
1 969 . 1 1 A 79 79 ALA CA C 168 55.480 54.932 0.548 2
1 970 . 1 1 A 79 79 ALA CB C 168 17.630 18.478 -0.848 2
1 971 . 1 1 A 79 79 ALA N N 168 122.102 127.750 -5.648 2
1 972 . 1 1 A 80 80 SER H H 169 7.988 7.673 0.315 2
1 973 . 1 1 A 80 80 SER HA H 169 4.058 4.181 -0.123 2
1 976 . 1 1 A 80 80 SER C C 169 176.029 176.315 -0.286 2
1 977 . 1 1 A 80 80 SER CA C 169 60.750 61.771 -1.021 2
1 978 . 1 1 A 80 80 SER CB C 169 62.510 63.059 -0.549 2
1 979 . 1 1 A 80 80 SER N N 169 109.541 113.986 -4.445 2
1 980 . 1 1 A 81 81 ILE H H 170 6.968 7.456 -0.488 2
1 981 . 1 1 A 81 81 ILE HA H 170 4.315 4.408 -0.093 2
1 991 . 1 1 A 81 81 ILE C C 170 174.242 175.377 -1.135 2
1 992 . 1 1 A 81 81 ILE CA C 170 62.296 61.537 0.759 2
1 993 . 1 1 A 81 81 ILE CB C 170 37.686 38.266 -0.580 2
1 997 . 1 1 A 81 81 ILE N N 170 112.476 112.868 -0.392 2
1 998 . 1 1 A 82 82 ILE H H 171 7.345 7.420 -0.075 2
1 999 . 1 1 A 82 82 ILE HA H 171 4.339 4.658 -0.319 2
1 1009 . 1 1 A 82 82 ILE C C 171 174.999 174.622 0.377 2
1 1010 . 1 1 A 82 82 ILE CA C 171 61.150 60.196 0.954 2
1 1011 . 1 1 A 82 82 ILE CB C 171 37.230 40.536 -3.306 2
1 1015 . 1 1 A 82 82 ILE N N 171 124.260 124.722 -0.462 2
1 1016 . 1 1 A 83 83 VAL H H 172 7.923 9.076 -1.153 2
1 1017 . 1 1 A 83 83 VAL HA H 172 4.673 5.063 -0.390 2
1 1025 . 1 1 A 83 83 VAL C C 172 174.887 175.222 -0.335 2
1 1026 . 1 1 A 83 83 VAL CA C 172 59.340 58.994 0.346 2
1 1027 . 1 1 A 83 83 VAL CB C 172 34.840 35.943 -1.103 2
1 1030 . 1 1 A 83 83 VAL N N 172 120.931 122.058 -1.127 2
1 1031 . 1 1 A 84 84 LYS H H 173 8.406 8.598 -0.192 2
1 1032 . 1 1 A 84 84 LYS HA H 173 4.410 4.662 -0.252 2
1 1041 . 1 1 A 84 84 LYS C C 173 178.734 178.165 0.569 2
1 1042 . 1 1 A 84 84 LYS CA C 173 56.360 55.107 1.253 2
1 1043 . 1 1 A 84 84 LYS CB C 173 33.100 33.629 -0.529 2
1 1047 . 1 1 A 84 84 LYS N N 173 121.251 120.907 0.344 2
1 1048 . 1 1 A 85 85 HIS H H 174 9.221 9.019 0.202 2
1 1049 . 1 1 A 85 85 HIS HA H 174 4.024 4.167 -0.143 2
1 1053 . 1 1 A 85 85 HIS C C 174 177.183 176.799 0.384 2
1 1054 . 1 1 A 85 85 HIS CA C 174 59.460 59.383 0.077 2
1 1055 . 1 1 A 85 85 HIS CB C 174 27.920 29.357 -1.437 2
1 1057 . 1 1 A 85 85 HIS N N 174 121.545 121.657 -0.112 2
1 1058 . 1 1 A 86 86 GLU H H 175 8.699 8.023 0.676 2
1 1059 . 1 1 A 86 86 GLU HA H 175 3.900 3.926 -0.026 2
1 1064 . 1 1 A 86 86 GLU C C 175 177.220 178.274 -1.054 2
1 1065 . 1 1 A 86 86 GLU CA C 175 58.420 58.648 -0.228 2
1 1066 . 1 1 A 86 86 GLU CB C 175 28.690 29.303 -0.613 2
1 1068 . 1 1 A 86 86 GLU N N 175 118.011 119.385 -1.374 2
1 1069 . 1 1 A 87 87 GLU H H 176 7.621 7.729 -0.108 2
1 1070 . 1 1 A 87 87 GLU HA H 176 4.177 4.141 0.036 2
1 1075 . 1 1 A 87 87 GLU C C 176 175.222 175.966 -0.744 2
1 1076 . 1 1 A 87 87 GLU CA C 176 56.390 57.964 -1.574 2
1 1077 . 1 1 A 87 87 GLU CB C 176 30.430 30.132 0.298 2
1 1079 . 1 1 A 87 87 GLU N N 176 116.753 118.280 -1.527 2
1 1080 . 1 1 A 88 88 CYS H H 177 7.239 7.425 -0.186 2
1 1081 . 1 1 A 88 88 CYS HA H 177 5.148 5.075 0.073 2
1 1084 . 1 1 A 88 88 CYS C C 177 173.249 173.405 -0.156 2
1 1085 . 1 1 A 88 88 CYS CA C 177 57.240 56.924 0.316 2
1 1086 . 1 1 A 88 88 CYS CB C 177 31.020 30.770 0.250 2
1 1087 . 1 1 A 88 88 CYS N N 177 116.096 115.587 0.509 2
1 1088 . 1 1 A 89 89 ILE H H 178 8.912 8.673 0.239 2
1 1089 . 1 1 A 89 89 ILE HA H 178 4.580 4.954 -0.374 2
1 1099 . 1 1 A 89 89 ILE C C 178 173.386 174.206 -0.820 2
1 1100 . 1 1 A 89 89 ILE CA C 178 59.270 59.087 0.183 2
1 1101 . 1 1 A 89 89 ILE CB C 178 42.990 41.817 1.173 2
1 1105 . 1 1 A 89 89 ILE N N 178 119.490 118.566 0.924 2
1 1106 . 1 1 A 90 90 TYR H H 179 9.047 8.650 0.397 2
1 1107 . 1 1 A 90 90 TYR HA H 179 3.753 4.046 -0.293 2
1 1112 . 1 1 A 90 90 TYR C C 179 173.932 174.083 -0.151 2
1 1113 . 1 1 A 90 90 TYR CA C 179 59.860 57.417 2.443 2
1 1114 . 1 1 A 90 90 TYR CB C 179 37.530 38.486 -0.956 2
1 1116 . 1 1 A 90 90 TYR N N 179 126.270 122.170 4.100 2
1 1117 . 1 1 A 91 91 ASP H H 180 7.462 8.298 -0.836 2
1 1118 . 1 1 A 91 91 ASP HA H 180 4.639 4.740 -0.101 2
1 1121 . 1 1 A 91 91 ASP C C 180 175.297 176.242 -0.945 2
1 1122 . 1 1 A 91 91 ASP CA C 180 52.496 52.713 -0.217 2
1 1123 . 1 1 A 91 91 ASP CB C 180 43.380 42.633 0.747 2
1 1124 . 1 1 A 91 91 ASP N N 180 129.593 124.414 5.179 2
1 1125 . 1 1 A 92 92 ASP H H 181 8.719 9.008 -0.289 2
1 1126 . 1 1 A 92 92 ASP HA H 181 4.109 4.327 -0.218 2
1 1129 . 1 1 A 92 92 ASP C C 181 177.555 177.620 -0.065 2
1 1130 . 1 1 A 92 92 ASP CA C 181 56.390 57.094 -0.704 2
1 1131 . 1 1 A 92 92 ASP CB C 181 41.330 40.608 0.722 2
1 1132 . 1 1 A 92 92 ASP N N 181 125.691 126.960 -1.269 2
1 1133 . 1 1 A 93 93 THR H H 182 8.271 7.643 0.628 2
1 1134 . 1 1 A 93 93 THR HA H 182 4.036 3.992 0.044 2
1 1139 . 1 1 A 93 93 THR C C 182 176.289 176.343 -0.054 2
1 1140 . 1 1 A 93 93 THR CA C 182 65.054 64.924 0.130 2
1 1141 . 1 1 A 93 93 THR CB C 182 68.560 68.874 -0.314 2
1 1143 . 1 1 A 93 93 THR N N 182 114.813 114.020 0.793 2
1 1144 . 1 1 A 94 94 ARG H H 183 7.753 7.515 0.238 2
1 1145 . 1 1 A 94 94 ARG HA H 183 4.139 4.279 -0.140 2
1 1152 . 1 1 A 94 94 ARG C C 183 176.897 177.060 -0.163 2
1 1153 . 1 1 A 94 94 ARG CA C 183 55.350 56.263 -0.913 2
1 1154 . 1 1 A 94 94 ARG CB C 183 30.930 30.948 -0.018 2
1 1157 . 1 1 A 94 94 ARG N N 183 120.101 117.930 2.171 2
1 1158 . 1 1 A 95 95 GLY H H 184 8.112 8.895 -0.783 2
1 1159 . 1 1 A 95 95 GLY HA2 H 184 3.838 3.877 -0.039 2
1 1160 . 1 1 A 95 95 GLY HA3 H 184 3.670 3.883 -0.213 2
1 1161 . 1 1 A 95 95 GLY C C 184 173.659 173.370 0.289 2
1 1162 . 1 1 A 95 95 GLY CA C 184 46.040 45.822 0.218 2
1 1163 . 1 1 A 95 95 GLY N N 184 108.106 108.979 -0.873 2
1 1164 . 1 1 A 96 96 ASN H H 185 6.833 7.451 -0.618 2
1 1165 . 1 1 A 96 96 ASN HA H 185 4.944 5.164 -0.220 2
1 1170 . 1 1 A 96 96 ASN C C 185 174.267 173.748 0.519 2
1 1171 . 1 1 A 96 96 ASN CA C 185 52.560 51.937 0.623 2
1 1172 . 1 1 A 96 96 ASN CB C 185 45.890 42.140 3.750 2
1 1173 . 1 1 A 96 96 ASN N N 185 113.392 117.109 -3.717 2
1 1175 . 1 1 A 97 97 PHE H H 186 9.108 8.780 0.328 2
1 1176 . 1 1 A 97 97 PHE HA H 186 4.782 4.816 -0.035 2
1 1183 . 1 1 A 97 97 PHE C C 186 174.862 175.724 -0.861 2
1 1184 . 1 1 A 97 97 PHE CA C 186 60.056 59.489 0.567 2
1 1185 . 1 1 A 97 97 PHE CB C 186 40.180 39.410 0.770 2
1 1188 . 1 1 A 97 97 PHE N N 186 118.741 119.635 -0.893 2
1 1189 . 1 1 A 98 98 ILE H H 187 8.933 8.721 0.212 2
1 1190 . 1 1 A 98 98 ILE HA H 187 5.458 4.962 0.496 2
1 1200 . 1 1 A 98 98 ILE C C 187 176.041 175.116 0.925 2
1 1201 . 1 1 A 98 98 ILE CA C 187 57.610 59.072 -1.462 2
1 1202 . 1 1 A 98 98 ILE CB C 187 42.070 41.971 0.099 2
1 1206 . 1 1 A 98 98 ILE N N 187 117.857 118.742 -0.885 2
1 1207 . 1 1 A 99 99 ILE H H 188 8.284 8.575 -0.291 2
1 1208 . 1 1 A 99 99 ILE HA H 188 4.341 4.177 0.164 2
1 1218 . 1 1 A 99 99 ILE C C 188 176.413 176.481 -0.067 2
1 1219 . 1 1 A 99 99 ILE CA C 188 59.190 61.279 -2.089 2
1 1220 . 1 1 A 99 99 ILE CB C 188 37.940 38.221 -0.281 2
1 1224 . 1 1 A 99 99 ILE N N 188 121.796 122.760 -0.964 2
1 1225 . 1 1 A 100 100 LYS H H 189 8.463 8.330 0.133 2
1 1226 . 1 1 A 100 100 LYS HA H 189 4.040 4.223 -0.183 2
1 1235 . 1 1 A 100 100 LYS C C 189 176.848 177.415 -0.567 2
1 1236 . 1 1 A 100 100 LYS CA C 189 57.241 56.559 0.682 2
1 1237 . 1 1 A 100 100 LYS CB C 189 33.400 33.040 0.360 2
1 1241 . 1 1 A 100 100 LYS N N 189 127.995 124.639 3.356 2
1 1242 . 1 1 A 101 101 GLY H H 190 8.346 8.532 -0.186 2
1 1243 . 1 1 A 101 101 GLY HA2 H 190 3.947 3.973 -0.026 2
1 1244 . 1 1 A 101 101 GLY HA3 H 190 3.813 3.977 -0.164 2
1 1245 . 1 1 A 101 101 GLY C C 190 172.902 174.062 -1.160 2
1 1246 . 1 1 A 101 101 GLY CA C 190 44.920 46.078 -1.158 2
1 1247 . 1 1 A 101 101 GLY N N 190 110.882 111.513 -0.631 2
stop_
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