data_15628_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15628
_Entry.PDB_ID 2JZV
_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 25
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 4 . 1 1 1 A 2 2 PRO HA H -4 4.403 4.676 -0.273 1
1 11 . 1 1 1 A 2 2 PRO C C -4 176.990 175.491 1.499 1
1 12 . 1 1 1 A 2 2 PRO CA C -4 63.131 62.644 0.487 1
1 13 . 1 1 1 A 2 2 PRO CB C -4 32.342 33.243 -0.901 1
1 16 . 1 1 1 A 3 3 LEU H H -3 8.483 8.668 -0.185 1
1 17 . 1 1 1 A 3 3 LEU HA H -3 4.333 4.821 -0.488 1
1 27 . 1 1 1 A 3 3 LEU C C -3 177.991 175.116 2.875 1
1 28 . 1 1 1 A 3 3 LEU CA C -3 55.314 53.758 1.556 1
1 29 . 1 1 1 A 3 3 LEU CB C -3 42.244 46.119 -3.875 1
1 33 . 1 1 1 A 3 3 LEU N N -3 122.986 121.378 1.608 1
1 34 . 1 1 1 A 4 4 GLY H H -2 8.397 8.953 -0.556 1
1 35 . 1 1 1 A 4 4 GLY HA2 H -2 4.024 4.133 -0.109 1
1 36 . 1 1 1 A 4 4 GLY HA3 H -2 3.976 4.139 -0.163 1
1 37 . 1 1 1 A 4 4 GLY C C -2 174.360 174.292 0.068 1
1 38 . 1 1 1 A 4 4 GLY CA C -2 45.434 45.023 0.411 1
1 39 . 1 1 1 A 4 4 GLY N N -2 110.666 114.817 -4.151 1
1 56 . 1 1 1 A 7 7 SER H H 141 7.913 7.884 0.029 1
1 57 . 1 1 1 A 7 7 SER HA H 141 5.657 5.322 0.335 1
1 60 . 1 1 1 A 7 7 SER C C 141 173.753 172.544 1.209 1
1 61 . 1 1 1 A 7 7 SER CA C 141 56.758 57.752 -0.994 1
1 62 . 1 1 1 A 7 7 SER CB C 141 66.774 65.850 0.924 1
1 63 . 1 1 1 A 7 7 SER N N 141 113.824 112.615 1.209 1
1 64 . 1 1 1 A 8 8 LYS H H 142 8.656 8.645 0.011 1
1 65 . 1 1 1 A 8 8 LYS HA H 142 4.543 5.143 -0.600 1
1 74 . 1 1 1 A 8 8 LYS C C 142 174.403 174.089 0.314 1
1 75 . 1 1 1 A 8 8 LYS CA C 142 55.578 54.779 0.799 1
1 76 . 1 1 1 A 8 8 LYS CB C 142 36.561 36.000 0.561 1
1 80 . 1 1 1 A 8 8 LYS N N 142 123.076 119.292 3.784 1
1 81 . 1 1 1 A 9 9 LYS H H 143 8.623 8.180 0.443 1
1 82 . 1 1 1 A 9 9 LYS HA H 143 4.119 4.474 -0.355 1
1 91 . 1 1 1 A 9 9 LYS C C 143 176.144 175.509 0.635 1
1 92 . 1 1 1 A 9 9 LYS CA C 143 56.683 55.830 0.853 1
1 93 . 1 1 1 A 9 9 LYS CB C 143 32.580 32.859 -0.279 1
1 97 . 1 1 1 A 9 9 LYS N N 143 129.542 122.703 6.839 1
1 98 . 1 1 1 A 10 10 ALA H H 144 8.151 8.686 -0.535 1
1 99 . 1 1 1 A 10 10 ALA HA H 144 5.208 4.893 0.315 1
1 103 . 1 1 1 A 10 10 ALA C C 144 175.577 175.100 0.477 1
1 104 . 1 1 1 A 10 10 ALA CA C 144 51.226 51.147 0.079 1
1 105 . 1 1 1 A 10 10 ALA CB C 144 25.299 24.133 1.166 1
1 106 . 1 1 1 A 10 10 ALA N N 144 127.933 128.001 -0.068 1
1 107 . 1 1 1 A 11 11 SER H H 145 8.679 8.836 -0.157 1
1 108 . 1 1 1 A 11 11 SER HA H 145 5.431 5.782 -0.351 1
1 111 . 1 1 1 A 11 11 SER C C 145 173.072 173.132 -0.060 1
1 112 . 1 1 1 A 11 11 SER CA C 145 57.772 56.693 1.079 1
1 113 . 1 1 1 A 11 11 SER CB C 145 67.301 65.758 1.543 1
1 114 . 1 1 1 A 11 11 SER N N 145 116.245 115.495 0.750 1
1 115 . 1 1 1 A 12 12 HIS H H 146 9.962 9.693 0.269 1
1 116 . 1 1 1 A 12 12 HIS HA H 146 6.332 6.151 0.181 1
1 121 . 1 1 1 A 12 12 HIS C C 146 173.006 172.663 0.343 1
1 122 . 1 1 1 A 12 12 HIS CA C 146 55.020 54.215 0.805 1
1 123 . 1 1 1 A 12 12 HIS CB C 146 37.071 33.766 3.305 1
1 126 . 1 1 1 A 12 12 HIS N N 146 119.181 118.759 0.422 1
1 127 . 1 1 1 A 13 13 ILE H H 147 8.976 8.894 0.082 1
1 128 . 1 1 1 A 13 13 ILE HA H 147 3.528 4.541 -1.013 1
1 138 . 1 1 1 A 13 13 ILE C C 147 173.010 173.566 -0.556 1
1 139 . 1 1 1 A 13 13 ILE CA C 147 61.273 59.440 1.833 1
1 140 . 1 1 1 A 13 13 ILE CB C 147 41.773 41.971 -0.198 1
1 144 . 1 1 1 A 13 13 ILE N N 147 121.873 119.390 2.483 1
1 145 . 1 1 1 A 14 14 LEU H H 148 7.627 8.945 -1.318 1
1 146 . 1 1 1 A 14 14 LEU HA H 148 4.814 4.887 -0.073 1
1 156 . 1 1 1 A 14 14 LEU C C 148 174.112 174.301 -0.189 1
1 157 . 1 1 1 A 14 14 LEU CA C 148 52.574 53.138 -0.564 1
1 158 . 1 1 1 A 14 14 LEU CB C 148 45.643 44.901 0.742 1
1 162 . 1 1 1 A 14 14 LEU N N 148 127.112 129.301 -2.189 1
1 163 . 1 1 1 A 15 15 ILE H H 149 9.524 9.293 0.231 1
1 164 . 1 1 1 A 15 15 ILE HA H 149 4.362 4.628 -0.266 1
1 174 . 1 1 1 A 15 15 ILE C C 149 175.452 175.402 0.050 1
1 175 . 1 1 1 A 15 15 ILE CA C 149 58.516 60.622 -2.106 1
1 176 . 1 1 1 A 15 15 ILE CB C 149 36.560 39.416 -2.856 1
1 180 . 1 1 1 A 15 15 ILE N N 149 128.652 127.304 1.348 1
1 181 . 1 1 1 A 16 16 LYS H H 150 8.035 8.606 -0.571 1
1 182 . 1 1 1 A 16 16 LYS HA H 150 4.319 4.419 -0.100 1
1 191 . 1 1 1 A 16 16 LYS C C 150 175.038 176.400 -1.362 1
1 192 . 1 1 1 A 16 16 LYS CA C 150 57.817 56.580 1.237 1
1 193 . 1 1 1 A 16 16 LYS CB C 150 34.853 32.824 2.029 1
1 197 . 1 1 1 A 16 16 LYS N N 150 129.153 127.826 1.327 1
1 198 . 1 1 1 A 17 17 VAL H H 151 8.016 8.852 -0.836 1
1 199 . 1 1 1 A 17 17 VAL HA H 151 4.873 4.725 0.148 1
1 207 . 1 1 1 A 17 17 VAL C C 151 176.647 175.402 1.245 1
1 208 . 1 1 1 A 17 17 VAL CA C 151 60.088 61.677 -1.589 1
1 209 . 1 1 1 A 17 17 VAL CB C 151 34.082 32.886 1.196 1
1 212 . 1 1 1 A 17 17 VAL N N 151 121.288 124.976 -3.688 1
1 213 . 1 1 1 A 18 18 LYS H H 152 8.443 8.788 -0.345 1
1 214 . 1 1 1 A 18 18 LYS HA H 152 4.334 4.763 -0.429 1
1 223 . 1 1 1 A 18 18 LYS C C 152 176.345 176.889 -0.544 1
1 224 . 1 1 1 A 18 18 LYS CA C 152 57.016 54.545 2.471 1
1 225 . 1 1 1 A 18 18 LYS CB C 152 33.222 34.938 -1.716 1
1 229 . 1 1 1 A 18 18 LYS N N 152 128.408 127.756 0.652 1
1 230 . 1 1 1 A 19 19 SER H H 153 9.067 8.794 0.273 1
1 231 . 1 1 1 A 19 19 SER HA H 153 4.457 4.356 0.101 1
1 234 . 1 1 1 A 19 19 SER C C 153 174.236 175.025 -0.789 1
1 235 . 1 1 1 A 19 19 SER CA C 153 59.642 60.138 -0.496 1
1 236 . 1 1 1 A 19 19 SER CB C 153 64.347 63.581 0.766 1
1 237 . 1 1 1 A 19 19 SER N N 153 121.522 117.583 3.939 1
1 238 . 1 1 1 A 20 20 LYS H H 154 7.961 7.589 0.372 1
1 239 . 1 1 1 A 20 20 LYS HA H 154 4.558 4.401 0.157 1
1 244 . 1 1 1 A 20 20 LYS C C 154 177.256 177.327 -0.071 1
1 245 . 1 1 1 A 20 20 LYS CA C 154 55.249 55.355 -0.106 1
1 246 . 1 1 1 A 20 20 LYS CB C 154 34.531 33.107 1.424 1
1 248 . 1 1 1 A 20 20 LYS N N 154 120.270 122.621 -2.351 1
1 249 . 1 1 1 A 21 21 LYS HA H 155 4.003 4.068 -0.065 1
1 258 . 1 1 1 A 21 21 LYS C C 155 177.015 178.063 -1.048 1
1 259 . 1 1 1 A 21 21 LYS CA C 155 59.091 59.041 0.050 1
1 260 . 1 1 1 A 21 21 LYS CB C 155 32.394 32.225 0.169 1
1 264 . 1 1 1 A 22 22 SER H H 156 7.625 7.599 0.026 1
1 265 . 1 1 1 A 22 22 SER HA H 156 4.293 4.499 -0.206 1
1 268 . 1 1 1 A 22 22 SER C C 156 174.843 174.206 0.637 1
1 269 . 1 1 1 A 22 22 SER CA C 156 57.966 59.175 -1.209 1
1 270 . 1 1 1 A 22 22 SER CB C 156 63.369 64.135 -0.766 1
1 271 . 1 1 1 A 22 22 SER N N 156 109.549 112.948 -3.399 1
1 272 . 1 1 1 A 23 23 ASP H H 157 7.701 7.547 0.154 1
1 273 . 1 1 1 A 23 23 ASP HA H 157 4.548 4.563 -0.015 1
1 276 . 1 1 1 A 23 23 ASP C C 157 176.544 175.822 0.722 1
1 277 . 1 1 1 A 23 23 ASP CA C 157 55.242 54.152 1.090 1
1 278 . 1 1 1 A 23 23 ASP CB C 157 41.103 41.325 -0.222 1
1 279 . 1 1 1 A 23 23 ASP N N 157 124.536 121.103 3.433 1
1 280 . 1 1 1 A 24 24 LYS H H 158 8.583 8.880 -0.297 1
1 281 . 1 1 1 A 24 24 LYS HA H 158 4.252 4.280 -0.028 1
1 290 . 1 1 1 A 24 24 LYS C C 158 176.813 178.100 -1.287 1
1 291 . 1 1 1 A 24 24 LYS CA C 158 57.148 57.245 -0.097 1
1 292 . 1 1 1 A 24 24 LYS CB C 158 33.200 32.403 0.797 1
1 296 . 1 1 1 A 24 24 LYS N N 158 122.372 123.667 -1.295 1
1 297 . 1 1 1 A 25 25 GLU H H 159 8.001 7.859 0.142 1
1 298 . 1 1 1 A 25 25 GLU HA H 159 4.521 4.053 0.468 1
1 303 . 1 1 1 A 25 25 GLU C C 159 175.995 176.601 -0.606 1
1 304 . 1 1 1 A 25 25 GLU CA C 159 55.727 59.119 -3.392 1
1 305 . 1 1 1 A 25 25 GLU CB C 159 31.918 30.108 1.810 1
1 307 . 1 1 1 A 25 25 GLU N N 159 118.705 119.610 -0.905 1
1 308 . 1 1 1 A 26 26 GLY H H 160 8.458 7.695 0.763 1
1 309 . 1 1 1 A 26 26 GLY HA2 H 160 3.946 4.072 -0.126 1
1 310 . 1 1 1 A 26 26 GLY HA3 H 160 3.511 4.081 -0.570 1
1 311 . 1 1 1 A 26 26 GLY C C 160 172.201 172.490 -0.289 1
1 312 . 1 1 1 A 26 26 GLY CA C 160 44.038 45.177 -1.139 1
1 313 . 1 1 1 A 26 26 GLY N N 160 107.642 106.924 0.718 1
1 314 . 1 1 1 A 27 27 LEU H H 161 8.259 8.526 -0.267 1
1 315 . 1 1 1 A 27 27 LEU HA H 161 4.775 5.125 -0.350 1
1 325 . 1 1 1 A 27 27 LEU C C 161 177.422 175.982 1.440 1
1 326 . 1 1 1 A 27 27 LEU CA C 161 53.322 53.194 0.128 1
1 327 . 1 1 1 A 27 27 LEU CB C 161 45.576 44.974 0.602 1
1 331 . 1 1 1 A 27 27 LEU N N 161 119.856 121.805 -1.949 1
1 332 . 1 1 1 A 28 28 ASP H H 162 8.848 8.740 0.108 1
1 333 . 1 1 1 A 28 28 ASP HA H 162 4.644 4.648 -0.004 1
1 336 . 1 1 1 A 28 28 ASP C C 162 176.630 177.594 -0.964 1
1 337 . 1 1 1 A 28 28 ASP CA C 162 55.195 54.545 0.650 1
1 338 . 1 1 1 A 28 28 ASP CB C 162 41.673 41.601 0.072 1
1 339 . 1 1 1 A 28 28 ASP N N 162 122.434 120.811 1.623 1
1 340 . 1 1 1 A 29 29 ASP H H 163 8.720 9.168 -0.448 1
1 341 . 1 1 1 A 29 29 ASP HA H 163 4.386 4.379 0.007 1
1 344 . 1 1 1 A 29 29 ASP C C 163 176.604 178.744 -2.140 1
1 345 . 1 1 1 A 29 29 ASP CA C 163 59.690 57.120 2.570 1
1 346 . 1 1 1 A 29 29 ASP CB C 163 42.964 39.844 3.120 1
1 347 . 1 1 1 A 29 29 ASP N N 163 121.460 122.696 -1.236 1
1 348 . 1 1 1 A 30 30 LYS H H 164 8.434 8.117 0.317 1
1 349 . 1 1 1 A 30 30 LYS HA H 164 3.901 4.062 -0.161 1
1 358 . 1 1 1 A 30 30 LYS C C 164 179.479 178.760 0.719 1
1 359 . 1 1 1 A 30 30 LYS CA C 164 60.047 59.766 0.281 1
1 360 . 1 1 1 A 30 30 LYS CB C 164 32.038 32.078 -0.040 1
1 364 . 1 1 1 A 30 30 LYS N N 164 116.627 118.227 -1.600 1
1 365 . 1 1 1 A 31 31 GLU H H 165 7.755 7.920 -0.165 1
1 366 . 1 1 1 A 31 31 GLU HA H 165 3.998 3.976 0.022 1
1 371 . 1 1 1 A 31 31 GLU C C 165 179.031 179.244 -0.213 1
1 372 . 1 1 1 A 31 31 GLU CA C 165 59.335 59.404 -0.069 1
1 373 . 1 1 1 A 31 31 GLU CB C 165 29.972 29.166 0.806 1
1 375 . 1 1 1 A 31 31 GLU N N 165 120.456 119.554 0.902 1
1 376 . 1 1 1 A 32 32 ALA H H 166 9.060 8.559 0.501 1
1 377 . 1 1 1 A 32 32 ALA HA H 166 3.871 4.066 -0.195 1
1 381 . 1 1 1 A 32 32 ALA C C 166 178.029 178.896 -0.867 1
1 382 . 1 1 1 A 32 32 ALA CA C 166 54.997 55.431 -0.434 1
1 383 . 1 1 1 A 32 32 ALA CB C 166 19.727 18.646 1.081 1
1 384 . 1 1 1 A 32 32 ALA N N 166 124.406 122.485 1.921 1
1 385 . 1 1 1 A 33 33 LYS H H 167 8.228 7.806 0.422 1
1 386 . 1 1 1 A 33 33 LYS HA H 167 2.595 3.189 -0.594 1
1 395 . 1 1 1 A 33 33 LYS C C 167 177.938 178.056 -0.118 1
1 396 . 1 1 1 A 33 33 LYS CA C 167 59.573 59.404 0.169 1
1 397 . 1 1 1 A 33 33 LYS CB C 167 32.098 32.329 -0.231 1
1 401 . 1 1 1 A 33 33 LYS N N 167 119.833 118.403 1.430 1
1 402 . 1 1 1 A 34 34 GLN H H 168 7.392 7.706 -0.314 1
1 403 . 1 1 1 A 34 34 GLN HA H 168 3.943 3.901 0.042 1
1 410 . 1 1 1 A 34 34 GLN C C 168 178.323 178.544 -0.221 1
1 411 . 1 1 1 A 34 34 GLN CA C 168 58.883 59.328 -0.445 1
1 412 . 1 1 1 A 34 34 GLN CB C 168 28.485 28.113 0.372 1
1 414 . 1 1 1 A 34 34 GLN N N 168 117.208 117.749 -0.541 1
1 416 . 1 1 1 A 35 35 LYS H H 169 7.994 8.031 -0.037 1
1 417 . 1 1 1 A 35 35 LYS HA H 169 4.067 3.990 0.077 1
1 426 . 1 1 1 A 35 35 LYS C C 169 178.161 178.539 -0.378 1
1 427 . 1 1 1 A 35 35 LYS CA C 169 58.437 59.245 -0.808 1
1 428 . 1 1 1 A 35 35 LYS CB C 169 31.611 32.248 -0.637 1
1 432 . 1 1 1 A 35 35 LYS N N 169 120.898 119.864 1.034 1
1 433 . 1 1 1 A 36 36 ALA H H 170 8.431 8.337 0.094 1
1 434 . 1 1 1 A 36 36 ALA HA H 170 3.738 4.016 -0.278 1
1 438 . 1 1 1 A 36 36 ALA C C 170 178.862 179.831 -0.969 1
1 439 . 1 1 1 A 36 36 ALA CA C 170 55.351 54.978 0.373 1
1 440 . 1 1 1 A 36 36 ALA CB C 170 18.295 18.472 -0.177 1
1 441 . 1 1 1 A 36 36 ALA N N 170 120.641 119.856 0.785 1
1 442 . 1 1 1 A 37 37 GLU H H 171 8.412 8.150 0.262 1
1 443 . 1 1 1 A 37 37 GLU HA H 171 3.867 3.969 -0.102 1
1 448 . 1 1 1 A 37 37 GLU C C 171 179.255 178.988 0.267 1
1 449 . 1 1 1 A 37 37 GLU CA C 171 59.543 59.443 0.100 1
1 450 . 1 1 1 A 37 37 GLU CB C 171 29.569 29.419 0.150 1
1 452 . 1 1 1 A 37 37 GLU N N 171 118.224 117.876 0.348 1
1 453 . 1 1 1 A 38 38 GLU H H 172 8.019 8.380 -0.361 1
1 454 . 1 1 1 A 38 38 GLU HA H 172 3.952 4.083 -0.131 1
1 459 . 1 1 1 A 38 38 GLU C C 172 180.250 178.283 1.967 1
1 460 . 1 1 1 A 38 38 GLU CA C 172 59.627 59.176 0.451 1
1 461 . 1 1 1 A 38 38 GLU CB C 172 29.368 28.880 0.488 1
1 463 . 1 1 1 A 38 38 GLU N N 172 121.250 118.734 2.516 1
1 464 . 1 1 1 A 39 39 ILE H H 173 8.174 7.507 0.667 1
1 465 . 1 1 1 A 39 39 ILE HA H 173 3.643 3.786 -0.143 1
1 475 . 1 1 1 A 39 39 ILE C C 173 177.568 178.033 -0.465 1
1 476 . 1 1 1 A 39 39 ILE CA C 173 64.869 63.947 0.922 1
1 477 . 1 1 1 A 39 39 ILE CB C 173 38.160 37.370 0.790 1
1 481 . 1 1 1 A 39 39 ILE N N 173 121.527 117.731 3.796 1
1 482 . 1 1 1 A 40 40 GLN H H 174 8.860 8.233 0.627 1
1 483 . 1 1 1 A 40 40 GLN HA H 174 3.533 3.941 -0.408 1
1 490 . 1 1 1 A 40 40 GLN C C 174 179.022 178.345 0.677 1
1 491 . 1 1 1 A 40 40 GLN CA C 174 61.316 59.460 1.856 1
1 492 . 1 1 1 A 40 40 GLN CB C 174 26.604 28.779 -2.175 1
1 494 . 1 1 1 A 40 40 GLN N N 174 121.956 121.012 0.944 1
1 496 . 1 1 1 A 41 41 LYS H H 175 7.879 8.082 -0.203 1
1 497 . 1 1 1 A 41 41 LYS HA H 175 3.777 4.048 -0.271 1
1 506 . 1 1 1 A 41 41 LYS C C 175 178.779 178.465 0.314 1
1 507 . 1 1 1 A 41 41 LYS CA C 175 59.701 58.867 0.834 1
1 508 . 1 1 1 A 41 41 LYS CB C 175 32.581 31.719 0.862 1
1 512 . 1 1 1 A 41 41 LYS N N 175 119.012 118.128 0.884 1
1 513 . 1 1 1 A 42 42 GLU H H 176 7.447 8.130 -0.683 1
1 514 . 1 1 1 A 42 42 GLU HA H 176 4.059 4.156 -0.097 1
1 519 . 1 1 1 A 42 42 GLU C C 176 180.058 178.720 1.338 1
1 520 . 1 1 1 A 42 42 GLU CA C 176 59.456 59.078 0.378 1
1 521 . 1 1 1 A 42 42 GLU CB C 176 29.923 29.707 0.216 1
1 523 . 1 1 1 A 42 42 GLU N N 176 120.054 118.912 1.142 1
1 524 . 1 1 1 A 43 43 VAL H H 177 8.618 8.108 0.510 1
1 525 . 1 1 1 A 43 43 VAL HA H 177 3.986 3.894 0.092 1
1 533 . 1 1 1 A 43 43 VAL C C 177 176.459 178.245 -1.786 1
1 534 . 1 1 1 A 43 43 VAL CA C 177 63.923 64.856 -0.933 1
1 535 . 1 1 1 A 43 43 VAL CB C 177 31.899 31.387 0.512 1
1 538 . 1 1 1 A 43 43 VAL N N 177 114.191 116.958 -2.767 1
1 539 . 1 1 1 A 44 44 SER H H 178 8.052 8.170 -0.118 1
1 540 . 1 1 1 A 44 44 SER HA H 178 4.098 4.243 -0.145 1
1 543 . 1 1 1 A 44 44 SER C C 178 176.548 176.458 0.090 1
1 544 . 1 1 1 A 44 44 SER CA C 178 61.160 61.253 -0.093 1
1 545 . 1 1 1 A 44 44 SER CB C 178 62.959 62.967 -0.008 1
1 546 . 1 1 1 A 44 44 SER N N 178 114.202 117.416 -3.214 1
1 547 . 1 1 1 A 45 45 LYS H H 179 7.083 8.343 -1.260 1
1 548 . 1 1 1 A 45 45 LYS HA H 179 4.140 4.176 -0.036 1
1 557 . 1 1 1 A 45 45 LYS C C 179 177.288 176.145 1.143 1
1 558 . 1 1 1 A 45 45 LYS CA C 179 58.469 58.117 0.352 1
1 559 . 1 1 1 A 45 45 LYS CB C 179 32.671 31.540 1.131 1
1 563 . 1 1 1 A 45 45 LYS N N 179 120.935 117.832 3.103 1
1 564 . 1 1 1 A 46 46 ASP H H 180 7.098 7.873 -0.775 1
1 565 . 1 1 1 A 46 46 ASP HA H 180 4.917 4.960 -0.043 1
1 568 . 1 1 1 A 46 46 ASP CA C 180 51.492 51.525 -0.033 1
1 569 . 1 1 1 A 46 46 ASP CB C 180 40.595 41.557 -0.962 1
1 570 . 1 1 1 A 46 46 ASP N N 180 112.836 119.934 -7.098 1
1 571 . 1 1 1 A 47 47 PRO HA H 181 4.681 4.578 0.103 1
1 578 . 1 1 1 A 47 47 PRO C C 181 179.248 177.470 1.778 1
1 579 . 1 1 1 A 47 47 PRO CA C 181 64.718 64.170 0.548 1
1 580 . 1 1 1 A 47 47 PRO CB C 181 32.159 31.993 0.166 1
1 583 . 1 1 1 A 48 48 SER H H 182 8.248 8.039 0.209 1
1 584 . 1 1 1 A 48 48 SER HA H 182 4.378 4.297 0.081 1
1 587 . 1 1 1 A 48 48 SER C C 182 176.071 176.266 -0.195 1
1 588 . 1 1 1 A 48 48 SER CA C 182 61.377 60.947 0.430 1
1 589 . 1 1 1 A 48 48 SER CB C 182 62.455 63.369 -0.914 1
1 590 . 1 1 1 A 48 48 SER N N 182 116.986 113.262 3.724 1
1 591 . 1 1 1 A 49 49 LYS H H 183 7.842 7.276 0.566 1
1 592 . 1 1 1 A 49 49 LYS HA H 183 4.482 4.272 0.210 1
1 601 . 1 1 1 A 49 49 LYS C C 183 175.605 177.890 -2.285 1
1 602 . 1 1 1 A 49 49 LYS CA C 183 55.824 57.475 -1.651 1
1 603 . 1 1 1 A 49 49 LYS CB C 183 32.834 32.538 0.296 1
1 607 . 1 1 1 A 49 49 LYS N N 183 121.698 119.970 1.728 1
1 608 . 1 1 1 A 50 50 PHE H H 184 7.634 8.165 -0.531 1
1 609 . 1 1 1 A 50 50 PHE HA H 184 3.510 4.274 -0.764 1
1 617 . 1 1 1 A 50 50 PHE C C 184 176.214 177.733 -1.519 1
1 618 . 1 1 1 A 50 50 PHE CA C 184 63.276 61.149 2.127 1
1 619 . 1 1 1 A 50 50 PHE CB C 184 40.948 38.997 1.951 1
1 623 . 1 1 1 A 50 50 PHE N N 184 120.120 121.747 -1.627 1
1 624 . 1 1 1 A 51 51 GLY H H 185 8.855 8.573 0.282 1
1 625 . 1 1 1 A 51 51 GLY HA2 H 185 3.993 3.873 0.120 1
1 626 . 1 1 1 A 51 51 GLY HA3 H 185 3.958 3.932 0.026 1
1 627 . 1 1 1 A 51 51 GLY C C 185 175.169 176.322 -1.153 1
1 628 . 1 1 1 A 51 51 GLY CA C 185 47.475 47.415 0.060 1
1 629 . 1 1 1 A 51 51 GLY N N 185 105.550 105.690 -0.140 1
1 630 . 1 1 1 A 52 52 GLU H H 186 7.917 7.667 0.250 1
1 631 . 1 1 1 A 52 52 GLU HA H 186 4.006 4.078 -0.072 1
1 636 . 1 1 1 A 52 52 GLU C C 186 179.499 179.504 -0.005 1
1 637 . 1 1 1 A 52 52 GLU CA C 186 58.904 59.217 -0.313 1
1 638 . 1 1 1 A 52 52 GLU CB C 186 29.700 29.745 -0.045 1
1 640 . 1 1 1 A 52 52 GLU N N 186 121.929 121.629 0.300 1
1 641 . 1 1 1 A 53 53 ILE H H 187 7.936 8.117 -0.181 1
1 642 . 1 1 1 A 53 53 ILE HA H 187 3.648 3.673 -0.025 1
1 652 . 1 1 1 A 53 53 ILE C C 187 177.886 177.780 0.106 1
1 653 . 1 1 1 A 53 53 ILE CA C 187 64.366 65.239 -0.873 1
1 654 . 1 1 1 A 53 53 ILE CB C 187 36.478 37.891 -1.413 1
1 658 . 1 1 1 A 53 53 ILE N N 187 120.991 121.430 -0.439 1
1 659 . 1 1 1 A 54 54 ALA H H 188 8.895 8.586 0.309 1
1 660 . 1 1 1 A 54 54 ALA HA H 188 3.629 3.774 -0.145 1
1 664 . 1 1 1 A 54 54 ALA C C 188 179.437 179.314 0.123 1
1 665 . 1 1 1 A 54 54 ALA CA C 188 55.974 55.567 0.407 1
1 666 . 1 1 1 A 54 54 ALA CB C 188 17.591 18.426 -0.835 1
1 667 . 1 1 1 A 54 54 ALA N N 188 125.308 122.180 3.128 1
1 668 . 1 1 1 A 55 55 LYS H H 189 8.049 7.857 0.192 1
1 669 . 1 1 1 A 55 55 LYS HA H 189 4.106 3.902 0.204 1
1 678 . 1 1 1 A 55 55 LYS C C 189 178.995 178.550 0.445 1
1 679 . 1 1 1 A 55 55 LYS CA C 189 59.312 59.281 0.031 1
1 680 . 1 1 1 A 55 55 LYS CB C 189 32.647 31.937 0.710 1
1 684 . 1 1 1 A 55 55 LYS N N 189 116.835 118.358 -1.523 1
1 685 . 1 1 1 A 56 56 LYS H H 190 7.215 7.693 -0.478 1
1 686 . 1 1 1 A 56 56 LYS HA H 190 4.172 4.202 -0.030 1
1 695 . 1 1 1 A 56 56 LYS C C 190 177.897 178.189 -0.292 1
1 696 . 1 1 1 A 56 56 LYS CA C 190 58.418 58.788 -0.370 1
1 697 . 1 1 1 A 56 56 LYS CB C 190 34.652 33.264 1.388 1
1 701 . 1 1 1 A 56 56 LYS N N 190 117.170 118.451 -1.281 1
1 702 . 1 1 1 A 57 57 GLU H H 191 8.572 7.813 0.759 1
1 703 . 1 1 1 A 57 57 GLU HA H 191 4.643 4.333 0.310 1
1 708 . 1 1 1 A 57 57 GLU C C 191 177.903 176.134 1.769 1
1 709 . 1 1 1 A 57 57 GLU CA C 191 55.708 56.633 -0.925 1
1 710 . 1 1 1 A 57 57 GLU CB C 191 32.460 30.588 1.872 1
1 712 . 1 1 1 A 57 57 GLU N N 191 113.316 116.806 -3.490 1
1 713 . 1 1 1 A 58 58 SER H H 192 8.550 7.621 0.929 1
1 714 . 1 1 1 A 58 58 SER HA H 192 4.149 4.417 -0.268 1
1 717 . 1 1 1 A 58 58 SER C C 192 176.161 175.268 0.893 1
1 718 . 1 1 1 A 58 58 SER CA C 192 58.403 58.127 0.276 1
1 719 . 1 1 1 A 58 58 SER CB C 192 64.392 64.314 0.078 1
1 720 . 1 1 1 A 58 58 SER N N 192 109.861 115.739 -5.878 1
1 721 . 1 1 1 A 59 59 MET H H 193 9.533 8.761 0.772 1
1 722 . 1 1 1 A 59 59 MET HA H 193 4.457 4.517 -0.060 1
1 730 . 1 1 1 A 59 59 MET C C 193 175.204 175.653 -0.449 1
1 731 . 1 1 1 A 59 59 MET CA C 193 55.781 55.859 -0.078 1
1 732 . 1 1 1 A 59 59 MET CB C 193 32.855 32.971 -0.116 1
1 735 . 1 1 1 A 59 59 MET N N 193 124.493 123.736 0.757 1
1 736 . 1 1 1 A 60 60 ASP H H 194 7.514 7.423 0.091 1
1 737 . 1 1 1 A 60 60 ASP HA H 194 4.886 4.577 0.309 1
1 740 . 1 1 1 A 60 60 ASP C C 194 175.517 176.806 -1.289 1
1 741 . 1 1 1 A 60 60 ASP CA C 194 52.286 53.299 -1.013 1
1 742 . 1 1 1 A 60 60 ASP CB C 194 40.222 40.311 -0.089 1
1 743 . 1 1 1 A 60 60 ASP N N 194 117.785 121.583 -3.798 1
1 744 . 1 1 1 A 61 61 THR H H 195 8.118 7.875 0.243 1
1 745 . 1 1 1 A 61 61 THR HA H 195 3.918 4.006 -0.088 1
1 750 . 1 1 1 A 61 61 THR C C 195 176.269 176.645 -0.376 1
1 751 . 1 1 1 A 61 61 THR CA C 195 65.469 64.808 0.661 1
1 752 . 1 1 1 A 61 61 THR CB C 195 68.741 68.516 0.225 1
1 754 . 1 1 1 A 61 61 THR N N 195 120.765 118.585 2.180 1
1 755 . 1 1 1 A 62 62 GLY H H 196 8.399 8.580 -0.181 1
1 756 . 1 1 1 A 62 62 GLY HA2 H 196 3.932 3.948 -0.016 1
1 757 . 1 1 1 A 62 62 GLY HA3 H 196 3.900 3.949 -0.049 1
1 758 . 1 1 1 A 62 62 GLY C C 196 174.948 174.937 0.011 1
1 759 . 1 1 1 A 62 62 GLY CA C 196 46.768 46.645 0.123 1
1 760 . 1 1 1 A 62 62 GLY N N 196 108.183 111.865 -3.682 1
1 761 . 1 1 1 A 63 63 SER H H 197 7.265 7.719 -0.454 1
1 762 . 1 1 1 A 63 63 SER HA H 197 4.554 4.725 -0.171 1
1 765 . 1 1 1 A 63 63 SER C C 197 177.630 175.843 1.787 1
1 766 . 1 1 1 A 63 63 SER CA C 197 59.550 58.932 0.618 1
1 767 . 1 1 1 A 63 63 SER CB C 197 65.504 64.686 0.818 1
1 768 . 1 1 1 A 63 63 SER N N 197 111.815 112.606 -0.791 1
1 769 . 1 1 1 A 64 64 ALA H H 198 8.675 8.484 0.191 1
1 770 . 1 1 1 A 64 64 ALA HA H 198 3.801 3.956 -0.155 1
1 774 . 1 1 1 A 64 64 ALA C C 198 178.492 179.786 -1.294 1
1 775 . 1 1 1 A 64 64 ALA CA C 198 56.794 55.369 1.425 1
1 776 . 1 1 1 A 64 64 ALA CB C 198 18.951 18.389 0.562 1
1 777 . 1 1 1 A 64 64 ALA N N 198 131.710 124.222 7.488 1
1 778 . 1 1 1 A 65 65 LYS H H 199 7.666 7.527 0.139 1
1 779 . 1 1 1 A 65 65 LYS HA H 199 4.175 4.152 0.023 1
1 788 . 1 1 1 A 65 65 LYS C C 199 177.159 177.987 -0.828 1
1 789 . 1 1 1 A 65 65 LYS CA C 199 57.735 58.193 -0.458 1
1 790 . 1 1 1 A 65 65 LYS CB C 199 31.948 32.300 -0.352 1
1 794 . 1 1 1 A 65 65 LYS N N 199 111.375 117.723 -6.348 1
1 795 . 1 1 1 A 66 66 LYS H H 200 7.545 7.643 -0.098 1
1 796 . 1 1 1 A 66 66 LYS HA H 200 4.612 4.449 0.163 1
1 805 . 1 1 1 A 66 66 LYS C C 200 175.609 174.965 0.644 1
1 806 . 1 1 1 A 66 66 LYS CA C 200 54.468 55.798 -1.330 1
1 807 . 1 1 1 A 66 66 LYS CB C 200 31.525 32.031 -0.506 1
1 811 . 1 1 1 A 66 66 LYS N N 200 121.421 117.573 3.848 1
1 812 . 1 1 1 A 67 67 ASP H H 201 7.630 8.168 -0.538 1
1 813 . 1 1 1 A 67 67 ASP HA H 201 4.306 4.376 -0.070 1
1 816 . 1 1 1 A 67 67 ASP C C 201 175.025 176.336 -1.311 1
1 817 . 1 1 1 A 67 67 ASP CA C 201 56.400 55.373 1.027 1
1 818 . 1 1 1 A 67 67 ASP CB C 201 38.315 39.142 -0.827 1
1 819 . 1 1 1 A 67 67 ASP N N 201 116.216 116.839 -0.623 1
1 820 . 1 1 1 A 68 68 GLY H H 202 8.368 8.749 -0.381 1
1 821 . 1 1 1 A 68 68 GLY HA2 H 202 4.316 3.965 0.351 1
1 822 . 1 1 1 A 68 68 GLY HA3 H 202 3.731 4.059 -0.328 1
1 823 . 1 1 1 A 68 68 GLY C C 202 174.139 174.331 -0.192 1
1 824 . 1 1 1 A 68 68 GLY CA C 202 45.514 45.436 0.078 1
1 825 . 1 1 1 A 68 68 GLY N N 202 105.095 105.016 0.079 1
1 826 . 1 1 1 A 69 69 GLU H H 203 7.534 7.628 -0.094 1
1 827 . 1 1 1 A 69 69 GLU HA H 203 4.479 4.373 0.106 1
1 832 . 1 1 1 A 69 69 GLU C C 203 176.961 176.639 0.322 1
1 833 . 1 1 1 A 69 69 GLU CA C 203 58.549 56.810 1.739 1
1 834 . 1 1 1 A 69 69 GLU CB C 203 30.998 30.559 0.439 1
1 836 . 1 1 1 A 69 69 GLU N N 203 120.426 120.519 -0.093 1
1 837 . 1 1 1 A 70 70 LEU H H 204 8.962 8.880 0.082 1
1 838 . 1 1 1 A 70 70 LEU HA H 204 4.438 4.610 -0.172 1
1 848 . 1 1 1 A 70 70 LEU C C 204 178.648 177.248 1.400 1
1 849 . 1 1 1 A 70 70 LEU CA C 204 53.977 55.044 -1.067 1
1 850 . 1 1 1 A 70 70 LEU CB C 204 43.612 43.662 -0.050 1
1 854 . 1 1 1 A 70 70 LEU N N 204 122.066 125.587 -3.521 1
1 855 . 1 1 1 A 71 71 GLY H H 205 8.104 7.458 0.646 1
1 856 . 1 1 1 A 71 71 GLY HA2 H 205 4.165 4.087 0.078 1
1 857 . 1 1 1 A 71 71 GLY HA3 H 205 3.552 4.159 -0.607 1
1 858 . 1 1 1 A 71 71 GLY C C 205 173.098 173.371 -0.273 1
1 859 . 1 1 1 A 71 71 GLY CA C 205 44.723 45.344 -0.621 1
1 860 . 1 1 1 A 71 71 GLY N N 205 110.168 106.767 3.401 1
1 861 . 1 1 1 A 72 72 TYR H H 206 8.457 8.684 -0.227 1
1 862 . 1 1 1 A 72 72 TYR HA H 206 4.184 4.834 -0.650 1
1 869 . 1 1 1 A 72 72 TYR C C 206 175.975 175.760 0.215 1
1 870 . 1 1 1 A 72 72 TYR CA C 206 59.722 59.051 0.671 1
1 871 . 1 1 1 A 72 72 TYR CB C 206 38.378 38.639 -0.261 1
1 874 . 1 1 1 A 72 72 TYR N N 206 120.171 122.115 -1.944 1
1 875 . 1 1 1 A 73 73 VAL H H 207 8.782 9.167 -0.385 1
1 876 . 1 1 1 A 73 73 VAL HA H 207 4.056 4.486 -0.430 1
1 884 . 1 1 1 A 73 73 VAL C C 207 174.901 175.689 -0.788 1
1 885 . 1 1 1 A 73 73 VAL CA C 207 62.202 62.291 -0.089 1
1 886 . 1 1 1 A 73 73 VAL CB C 207 33.071 32.358 0.713 1
1 889 . 1 1 1 A 73 73 VAL N N 207 128.847 124.296 4.551 1
1 890 . 1 1 1 A 74 74 LEU H H 208 8.146 8.894 -0.748 1
1 891 . 1 1 1 A 74 74 LEU HA H 208 4.944 4.765 0.179 1
1 901 . 1 1 1 A 74 74 LEU C C 208 178.400 177.414 0.986 1
1 902 . 1 1 1 A 74 74 LEU CA C 208 53.520 53.874 -0.354 1
1 903 . 1 1 1 A 74 74 LEU CB C 208 43.499 42.705 0.794 1
1 907 . 1 1 1 A 74 74 LEU N N 208 127.599 129.388 -1.789 1
1 908 . 1 1 1 A 75 75 LYS H H 209 8.403 8.350 0.053 1
1 909 . 1 1 1 A 75 75 LYS HA H 209 3.771 3.763 0.008 1
1 918 . 1 1 1 A 75 75 LYS C C 209 177.536 177.369 0.167 1
1 919 . 1 1 1 A 75 75 LYS CA C 209 58.385 58.811 -0.426 1
1 920 . 1 1 1 A 75 75 LYS CB C 209 32.459 31.957 0.502 1
1 924 . 1 1 1 A 75 75 LYS N N 209 123.798 123.099 0.699 1
1 925 . 1 1 1 A 76 76 GLY H H 210 9.997 9.328 0.669 1
1 926 . 1 1 1 A 76 76 GLY HA2 H 210 4.255 3.978 0.277 1
1 927 . 1 1 1 A 76 76 GLY HA3 H 210 3.791 3.981 -0.190 1
1 928 . 1 1 1 A 76 76 GLY C C 210 175.091 175.697 -0.606 1
1 929 . 1 1 1 A 76 76 GLY CA C 210 45.465 45.460 0.005 1
1 930 . 1 1 1 A 76 76 GLY N N 210 114.705 113.126 1.579 1
1 931 . 1 1 1 A 77 77 GLN H H 211 7.726 7.976 -0.250 1
1 932 . 1 1 1 A 77 77 GLN HA H 211 4.373 4.197 0.176 1
1 939 . 1 1 1 A 77 77 GLN C C 211 176.301 176.149 0.152 1
1 940 . 1 1 1 A 77 77 GLN CA C 211 57.074 57.465 -0.391 1
1 941 . 1 1 1 A 77 77 GLN CB C 211 30.798 29.461 1.337 1
1 943 . 1 1 1 A 77 77 GLN N N 211 118.702 117.992 0.710 1
1 945 . 1 1 1 A 78 78 THR H H 212 8.225 7.489 0.736 1
1 946 . 1 1 1 A 78 78 THR HA H 212 4.620 4.672 -0.052 1
1 951 . 1 1 1 A 78 78 THR C C 212 173.920 174.201 -0.281 1
1 952 . 1 1 1 A 78 78 THR CA C 212 60.087 59.651 0.436 1
1 953 . 1 1 1 A 78 78 THR CB C 212 71.412 71.046 0.366 1
1 955 . 1 1 1 A 78 78 THR N N 212 111.935 110.804 1.131 1
1 956 . 1 1 1 A 79 79 ASP H H 213 8.372 8.538 -0.166 1
1 957 . 1 1 1 A 79 79 ASP HA H 213 4.470 4.563 -0.093 1
1 960 . 1 1 1 A 79 79 ASP C C 213 176.759 177.889 -1.130 1
1 961 . 1 1 1 A 79 79 ASP CA C 213 54.927 54.340 0.587 1
1 962 . 1 1 1 A 79 79 ASP CB C 213 43.859 41.530 2.329 1
1 963 . 1 1 1 A 79 79 ASP N N 213 122.093 121.458 0.635 1
1 964 . 1 1 1 A 80 80 LYS H H 214 8.740 8.796 -0.056 1
1 965 . 1 1 1 A 80 80 LYS HA H 214 4.027 4.063 -0.036 1
1 974 . 1 1 1 A 80 80 LYS C C 214 178.493 178.270 0.223 1
1 975 . 1 1 1 A 80 80 LYS CA C 214 59.802 59.117 0.685 1
1 976 . 1 1 1 A 80 80 LYS CB C 214 32.374 32.054 0.320 1
1 980 . 1 1 1 A 80 80 LYS N N 214 124.685 122.205 2.480 1
1 981 . 1 1 1 A 81 81 ASP H H 215 8.556 8.058 0.498 1
1 982 . 1 1 1 A 81 81 ASP HA H 215 4.566 4.373 0.193 1
1 985 . 1 1 1 A 81 81 ASP C C 215 178.889 178.747 0.142 1
1 986 . 1 1 1 A 81 81 ASP CA C 215 58.046 57.395 0.651 1
1 987 . 1 1 1 A 81 81 ASP CB C 215 40.872 40.671 0.201 1
1 988 . 1 1 1 A 81 81 ASP N N 215 121.413 120.049 1.364 1
1 989 . 1 1 1 A 82 82 PHE H H 216 8.205 8.341 -0.136 1
1 990 . 1 1 1 A 82 82 PHE HA H 216 3.686 4.078 -0.392 1
1 998 . 1 1 1 A 82 82 PHE C C 216 175.919 177.328 -1.409 1
1 999 . 1 1 1 A 82 82 PHE CA C 216 61.648 61.018 0.630 1
1 1000 . 1 1 1 A 82 82 PHE CB C 216 39.743 39.277 0.466 1
1 1004 . 1 1 1 A 82 82 PHE N N 216 124.401 122.126 2.275 1
1 1005 . 1 1 1 A 83 83 GLU H H 217 8.887 8.872 0.015 1
1 1006 . 1 1 1 A 83 83 GLU HA H 217 3.704 4.211 -0.507 1
1 1011 . 1 1 1 A 83 83 GLU C C 217 177.788 178.962 -1.174 1
1 1012 . 1 1 1 A 83 83 GLU CA C 217 60.545 60.198 0.347 1
1 1013 . 1 1 1 A 83 83 GLU CB C 217 30.639 29.281 1.358 1
1 1015 . 1 1 1 A 83 83 GLU N N 217 119.421 119.017 0.404 1
1 1016 . 1 1 1 A 84 84 LYS H H 218 8.055 7.962 0.093 1
1 1017 . 1 1 1 A 84 84 LYS HA H 218 3.947 4.116 -0.169 1
1 1026 . 1 1 1 A 84 84 LYS C C 218 178.783 178.659 0.124 1
1 1027 . 1 1 1 A 84 84 LYS CA C 218 59.327 59.045 0.282 1
1 1028 . 1 1 1 A 84 84 LYS CB C 218 32.539 32.170 0.369 1
1 1032 . 1 1 1 A 84 84 LYS N N 218 117.821 119.752 -1.931 1
1 1033 . 1 1 1 A 85 85 ALA H H 219 7.059 7.751 -0.692 1
1 1034 . 1 1 1 A 85 85 ALA HA H 219 4.040 4.090 -0.050 1
1 1038 . 1 1 1 A 85 85 ALA C C 219 179.794 179.426 0.368 1
1 1039 . 1 1 1 A 85 85 ALA CA C 219 54.407 54.267 0.140 1
1 1040 . 1 1 1 A 85 85 ALA CB C 219 20.130 18.150 1.980 1
1 1041 . 1 1 1 A 85 85 ALA N N 219 118.905 120.826 -1.921 1
1 1042 . 1 1 1 A 86 86 LEU H H 220 8.157 7.906 0.251 1
1 1043 . 1 1 1 A 86 86 LEU HA H 220 3.692 4.088 -0.396 1
1 1053 . 1 1 1 A 86 86 LEU C C 220 178.330 178.489 -0.159 1
1 1054 . 1 1 1 A 86 86 LEU CA C 220 57.752 57.485 0.267 1
1 1055 . 1 1 1 A 86 86 LEU CB C 220 41.464 42.005 -0.541 1
1 1059 . 1 1 1 A 86 86 LEU N N 220 118.606 119.886 -1.280 1
1 1060 . 1 1 1 A 87 87 PHE H H 221 8.349 8.571 -0.222 1
1 1061 . 1 1 1 A 87 87 PHE HA H 221 3.861 4.382 -0.521 1
1 1069 . 1 1 1 A 87 87 PHE C C 221 176.176 177.264 -1.088 1
1 1070 . 1 1 1 A 87 87 PHE CA C 221 61.780 62.006 -0.226 1
1 1071 . 1 1 1 A 87 87 PHE CB C 221 37.549 37.932 -0.383 1
1 1075 . 1 1 1 A 87 87 PHE N N 221 112.449 117.090 -4.641 1
1 1076 . 1 1 1 A 88 88 LYS H H 222 7.061 8.295 -1.234 1
1 1077 . 1 1 1 A 88 88 LYS HA H 222 4.380 4.280 0.100 1
1 1086 . 1 1 1 A 88 88 LYS C C 222 177.089 176.943 0.146 1
1 1087 . 1 1 1 A 88 88 LYS CA C 222 56.726 58.180 -1.454 1
1 1088 . 1 1 1 A 88 88 LYS CB C 222 33.738 31.911 1.827 1
1 1092 . 1 1 1 A 88 88 LYS N N 222 118.308 114.806 3.502 1
1 1093 . 1 1 1 A 89 89 LEU H H 223 7.270 7.172 0.098 1
1 1094 . 1 1 1 A 89 89 LEU HA H 223 4.168 4.176 -0.008 1
1 1104 . 1 1 1 A 89 89 LEU C C 223 177.528 177.203 0.325 1
1 1105 . 1 1 1 A 89 89 LEU CA C 223 55.279 54.835 0.444 1
1 1106 . 1 1 1 A 89 89 LEU CB C 223 43.240 42.246 0.994 1
1 1110 . 1 1 1 A 89 89 LEU N N 223 121.317 121.728 -0.411 1
1 1111 . 1 1 1 A 90 90 LYS H H 224 8.788 8.472 0.316 1
1 1112 . 1 1 1 A 90 90 LYS HA H 224 4.359 4.329 0.030 1
1 1121 . 1 1 1 A 90 90 LYS C C 224 175.839 175.388 0.451 1
1 1122 . 1 1 1 A 90 90 LYS CA C 224 54.772 55.913 -1.141 1
1 1123 . 1 1 1 A 90 90 LYS CB C 224 33.232 33.189 0.043 1
1 1127 . 1 1 1 A 90 90 LYS N N 224 123.558 122.214 1.344 1
1 1128 . 1 1 1 A 91 91 ASP H H 225 8.125 8.628 -0.503 1
1 1129 . 1 1 1 A 91 91 ASP HA H 225 3.958 4.376 -0.418 1
1 1132 . 1 1 1 A 91 91 ASP C C 225 177.452 176.640 0.812 1
1 1133 . 1 1 1 A 91 91 ASP CA C 225 56.642 55.513 1.129 1
1 1134 . 1 1 1 A 91 91 ASP CB C 225 40.269 40.196 0.073 1
1 1135 . 1 1 1 A 91 91 ASP N N 225 119.419 121.368 -1.949 1
1 1136 . 1 1 1 A 92 92 GLY H H 226 8.681 8.598 0.083 1
1 1137 . 1 1 1 A 92 92 GLY HA2 H 226 4.131 3.866 0.265 1
1 1138 . 1 1 1 A 92 92 GLY HA3 H 226 3.579 3.892 -0.313 1
1 1139 . 1 1 1 A 92 92 GLY C C 226 173.614 173.816 -0.202 1
1 1140 . 1 1 1 A 92 92 GLY CA C 226 45.564 45.284 0.280 1
1 1141 . 1 1 1 A 92 92 GLY N N 226 113.802 111.956 1.846 1
1 1142 . 1 1 1 A 93 93 GLU H H 227 8.104 7.934 0.170 1
1 1143 . 1 1 1 A 93 93 GLU HA H 227 4.232 4.437 -0.205 1
1 1148 . 1 1 1 A 93 93 GLU C C 227 174.282 175.604 -1.322 1
1 1149 . 1 1 1 A 93 93 GLU CA C 227 56.651 55.926 0.725 1
1 1150 . 1 1 1 A 93 93 GLU CB C 227 32.190 31.074 1.116 1
1 1152 . 1 1 1 A 93 93 GLU N N 227 121.527 121.775 -0.248 1
1 1153 . 1 1 1 A 94 94 VAL H H 228 7.918 8.539 -0.621 1
1 1154 . 1 1 1 A 94 94 VAL HA H 228 4.857 4.783 0.074 1
1 1162 . 1 1 1 A 94 94 VAL C C 228 176.556 175.962 0.594 1
1 1163 . 1 1 1 A 94 94 VAL CA C 228 60.309 60.549 -0.240 1
1 1164 . 1 1 1 A 94 94 VAL CB C 228 33.847 35.023 -1.176 1
1 1167 . 1 1 1 A 94 94 VAL N N 228 119.768 126.020 -6.252 1
1 1168 . 1 1 1 A 95 95 SER H H 229 9.659 9.284 0.375 1
1 1169 . 1 1 1 A 95 95 SER HA H 229 4.313 4.537 -0.224 1
1 1172 . 1 1 1 A 95 95 SER C C 229 174.641 174.270 0.371 1
1 1173 . 1 1 1 A 95 95 SER CA C 229 59.208 57.985 1.223 1
1 1174 . 1 1 1 A 95 95 SER CB C 229 66.080 63.054 3.026 1
1 1175 . 1 1 1 A 95 95 SER N N 229 124.903 120.134 4.769 1
1 1176 . 1 1 1 A 96 96 GLU H H 230 8.014 7.912 0.102 1
1 1177 . 1 1 1 A 96 96 GLU HA H 230 4.376 4.681 -0.305 1
1 1182 . 1 1 1 A 96 96 GLU C C 230 176.641 174.369 2.272 1
1 1183 . 1 1 1 A 96 96 GLU CA C 230 56.236 55.649 0.587 1
1 1184 . 1 1 1 A 96 96 GLU CB C 230 30.324 31.224 -0.900 1
1 1186 . 1 1 1 A 96 96 GLU N N 230 115.510 120.786 -5.276 1
1 1187 . 1 1 1 A 97 97 VAL H H 231 8.741 8.705 0.036 1
1 1188 . 1 1 1 A 97 97 VAL HA H 231 4.171 4.205 -0.034 1
1 1196 . 1 1 1 A 97 97 VAL C C 231 176.684 175.431 1.253 1
1 1197 . 1 1 1 A 97 97 VAL CA C 231 65.418 63.023 2.395 1
1 1198 . 1 1 1 A 97 97 VAL CB C 231 31.218 31.312 -0.094 1
1 1201 . 1 1 1 A 97 97 VAL N N 231 121.289 121.151 0.138 1
1 1202 . 1 1 1 A 98 98 VAL H H 232 9.218 9.585 -0.367 1
1 1203 . 1 1 1 A 98 98 VAL HA H 232 4.405 4.750 -0.345 1
1 1211 . 1 1 1 A 98 98 VAL C C 232 174.258 174.729 -0.471 1
1 1212 . 1 1 1 A 98 98 VAL CA C 232 60.937 61.424 -0.487 1
1 1213 . 1 1 1 A 98 98 VAL CB C 232 35.825 32.966 2.859 1
1 1216 . 1 1 1 A 98 98 VAL N N 232 130.544 128.736 1.808 1
1 1217 . 1 1 1 A 99 99 LYS H H 233 8.800 8.941 -0.141 1
1 1218 . 1 1 1 A 99 99 LYS HA H 233 4.853 4.909 -0.056 1
1 1227 . 1 1 1 A 99 99 LYS C C 233 175.274 175.480 -0.206 1
1 1228 . 1 1 1 A 99 99 LYS CA C 233 55.499 55.697 -0.198 1
1 1229 . 1 1 1 A 99 99 LYS CB C 233 34.452 33.501 0.951 1
1 1233 . 1 1 1 A 99 99 LYS N N 233 130.477 129.295 1.182 1
1 1234 . 1 1 1 A 100 100 SER H H 234 9.585 8.994 0.591 1
1 1235 . 1 1 1 A 100 100 SER HA H 234 5.150 4.907 0.243 1
1 1238 . 1 1 1 A 100 100 SER C C 234 175.493 174.065 1.428 1
1 1239 . 1 1 1 A 100 100 SER CA C 234 56.927 57.510 -0.583 1
1 1240 . 1 1 1 A 100 100 SER CB C 234 67.309 67.311 -0.002 1
1 1241 . 1 1 1 A 100 100 SER N N 234 125.814 123.541 2.273 1
1 1242 . 1 1 1 A 101 101 SER H H 235 8.631 8.828 -0.197 1
1 1243 . 1 1 1 A 101 101 SER HA H 235 4.106 4.081 0.025 1
1 1246 . 1 1 1 A 101 101 SER C C 235 175.385 175.630 -0.245 1
1 1247 . 1 1 1 A 101 101 SER CA C 235 61.123 61.605 -0.482 1
1 1248 . 1 1 1 A 101 101 SER CB C 235 62.818 62.515 0.303 1
1 1249 . 1 1 1 A 101 101 SER N N 235 115.089 117.098 -2.009 1
1 1250 . 1 1 1 A 102 102 PHE H H 236 8.957 7.667 1.290 1
1 1251 . 1 1 1 A 102 102 PHE HA H 236 4.610 4.606 0.004 1
1 1259 . 1 1 1 A 102 102 PHE C C 236 176.453 175.874 0.579 1
1 1260 . 1 1 1 A 102 102 PHE CA C 236 58.382 58.145 0.237 1
1 1261 . 1 1 1 A 102 102 PHE CB C 236 40.275 39.447 0.828 1
1 1263 . 1 1 1 A 102 102 PHE N N 236 119.917 117.922 1.995 1
1 1264 . 1 1 1 A 103 103 GLY H H 237 7.377 7.462 -0.085 1
1 1265 . 1 1 1 A 103 103 GLY HA2 H 237 4.453 3.904 0.549 1
1 1266 . 1 1 1 A 103 103 GLY HA3 H 237 3.472 4.078 -0.606 1
1 1267 . 1 1 1 A 103 103 GLY C C 237 169.627 172.430 -2.803 1
1 1268 . 1 1 1 A 103 103 GLY CA C 237 45.384 44.607 0.777 1
1 1269 . 1 1 1 A 103 103 GLY N N 237 108.809 106.512 2.297 1
1 1270 . 1 1 1 A 104 104 TYR H H 238 8.632 8.462 0.170 1
1 1271 . 1 1 1 A 104 104 TYR HA H 238 5.322 5.458 -0.136 1
1 1278 . 1 1 1 A 104 104 TYR C C 238 175.043 175.281 -0.238 1
1 1279 . 1 1 1 A 104 104 TYR CA C 238 57.627 56.921 0.706 1
1 1280 . 1 1 1 A 104 104 TYR CB C 238 41.711 41.854 -0.143 1
1 1283 . 1 1 1 A 104 104 TYR N N 238 120.030 121.740 -1.710 1
1 1284 . 1 1 1 A 105 105 HIS H H 239 10.070 9.461 0.609 1
1 1285 . 1 1 1 A 105 105 HIS HA H 239 6.046 5.594 0.452 1
1 1290 . 1 1 1 A 105 105 HIS C C 239 175.734 174.836 0.898 1
1 1291 . 1 1 1 A 105 105 HIS CA C 239 53.945 54.294 -0.349 1
1 1292 . 1 1 1 A 105 105 HIS CB C 239 32.450 34.388 -1.938 1
1 1295 . 1 1 1 A 105 105 HIS N N 239 119.504 119.081 0.423 1
1 1296 . 1 1 1 A 106 106 ILE H H 240 8.660 8.768 -0.108 1
1 1297 . 1 1 1 A 106 106 ILE HA H 240 4.120 4.966 -0.846 1
1 1307 . 1 1 1 A 106 106 ILE C C 240 174.758 175.352 -0.594 1
1 1308 . 1 1 1 A 106 106 ILE CA C 240 63.446 60.071 3.375 1
1 1309 . 1 1 1 A 106 106 ILE CB C 240 40.786 41.486 -0.700 1
1 1313 . 1 1 1 A 106 106 ILE N N 240 120.639 120.186 0.453 1
1 1314 . 1 1 1 A 107 107 ILE H H 241 9.033 8.738 0.295 1
1 1315 . 1 1 1 A 107 107 ILE HA H 241 4.799 5.087 -0.288 1
1 1325 . 1 1 1 A 107 107 ILE C C 241 172.880 173.880 -1.000 1
1 1326 . 1 1 1 A 107 107 ILE CA C 241 60.563 59.634 0.929 1
1 1327 . 1 1 1 A 107 107 ILE CB C 241 41.652 41.529 0.123 1
1 1331 . 1 1 1 A 107 107 ILE N N 241 129.098 127.164 1.934 1
1 1332 . 1 1 1 A 108 108 LYS H H 242 8.692 9.075 -0.383 1
1 1333 . 1 1 1 A 108 108 LYS HA H 242 5.012 5.050 -0.038 1
1 1342 . 1 1 1 A 108 108 LYS C C 242 174.484 175.546 -1.062 1
1 1343 . 1 1 1 A 108 108 LYS CA C 242 54.317 54.034 0.283 1
1 1344 . 1 1 1 A 108 108 LYS CB C 242 35.619 35.609 0.010 1
1 1348 . 1 1 1 A 108 108 LYS N N 242 127.179 127.941 -0.762 1
1 1349 . 1 1 1 A 109 109 ALA H H 243 7.816 9.023 -1.207 1
1 1350 . 1 1 1 A 109 109 ALA HA H 243 4.604 4.639 -0.035 1
1 1354 . 1 1 1 A 109 109 ALA C C 243 176.231 176.338 -0.107 1
1 1355 . 1 1 1 A 109 109 ALA CA C 243 50.505 51.050 -0.545 1
1 1356 . 1 1 1 A 109 109 ALA CB C 243 19.584 19.762 -0.178 1
1 1357 . 1 1 1 A 109 109 ALA N N 243 129.619 128.175 1.444 1
1 1358 . 1 1 1 A 110 110 ASP H H 244 7.578 8.383 -0.805 1
1 1359 . 1 1 1 A 110 110 ASP HA H 244 4.424 4.876 -0.452 1
1 1362 . 1 1 1 A 110 110 ASP C C 244 175.259 176.251 -0.992 1
1 1363 . 1 1 1 A 110 110 ASP CA C 244 54.489 52.534 1.955 1
1 1364 . 1 1 1 A 110 110 ASP CB C 244 42.693 42.754 -0.061 1
1 1365 . 1 1 1 A 110 110 ASP N N 244 125.434 122.000 3.434 1
1 4 . 2 1 1 A 2 2 PRO HA H -4 4.403 4.370 0.033 1
1 11 . 2 1 1 A 2 2 PRO C C -4 176.990 178.286 -1.296 1
1 12 . 2 1 1 A 2 2 PRO CA C -4 63.131 65.054 -1.923 1
1 13 . 2 1 1 A 2 2 PRO CB C -4 32.342 31.681 0.661 1
1 16 . 2 1 1 A 3 3 LEU H H -3 8.483 7.735 0.748 1
1 17 . 2 1 1 A 3 3 LEU HA H -3 4.333 4.124 0.209 1
1 27 . 2 1 1 A 3 3 LEU C C -3 177.991 178.282 -0.291 1
1 28 . 2 1 1 A 3 3 LEU CA C -3 55.314 56.968 -1.654 1
1 29 . 2 1 1 A 3 3 LEU CB C -3 42.244 41.247 0.997 1
1 33 . 2 1 1 A 3 3 LEU N N -3 122.986 117.078 5.908 1
1 34 . 2 1 1 A 4 4 GLY H H -2 8.397 8.061 0.336 1
1 35 . 2 1 1 A 4 4 GLY HA2 H -2 4.024 3.806 0.218 1
1 36 . 2 1 1 A 4 4 GLY HA3 H -2 3.976 3.864 0.112 1
1 37 . 2 1 1 A 4 4 GLY C C -2 174.360 174.736 -0.376 1
1 38 . 2 1 1 A 4 4 GLY CA C -2 45.434 45.405 0.029 1
1 39 . 2 1 1 A 4 4 GLY N N -2 110.666 107.551 3.115 1
1 56 . 2 1 1 A 7 7 SER H H 141 7.913 7.919 -0.006 1
1 57 . 2 1 1 A 7 7 SER HA H 141 5.657 5.411 0.246 1
1 60 . 2 1 1 A 7 7 SER C C 141 173.753 172.494 1.259 1
1 61 . 2 1 1 A 7 7 SER CA C 141 56.758 57.416 -0.658 1
1 62 . 2 1 1 A 7 7 SER CB C 141 66.774 66.567 0.207 1
1 63 . 2 1 1 A 7 7 SER N N 141 113.824 112.667 1.157 1
1 64 . 2 1 1 A 8 8 LYS H H 142 8.656 8.293 0.363 1
1 65 . 2 1 1 A 8 8 LYS HA H 142 4.543 4.780 -0.237 1
1 74 . 2 1 1 A 8 8 LYS C C 142 174.403 175.216 -0.813 1
1 75 . 2 1 1 A 8 8 LYS CA C 142 55.578 54.133 1.445 1
1 76 . 2 1 1 A 8 8 LYS CB C 142 36.561 35.543 1.018 1
1 80 . 2 1 1 A 8 8 LYS N N 142 123.076 119.592 3.484 1
1 81 . 2 1 1 A 9 9 LYS H H 143 8.623 8.448 0.175 1
1 82 . 2 1 1 A 9 9 LYS HA H 143 4.119 4.221 -0.102 1
1 91 . 2 1 1 A 9 9 LYS C C 143 176.144 175.519 0.625 1
1 92 . 2 1 1 A 9 9 LYS CA C 143 56.683 56.190 0.493 1
1 93 . 2 1 1 A 9 9 LYS CB C 143 32.580 32.449 0.131 1
1 97 . 2 1 1 A 9 9 LYS N N 143 129.542 124.261 5.281 1
1 98 . 2 1 1 A 10 10 ALA H H 144 8.151 8.803 -0.652 1
1 99 . 2 1 1 A 10 10 ALA HA H 144 5.208 4.963 0.245 1
1 103 . 2 1 1 A 10 10 ALA C C 144 175.577 175.045 0.532 1
1 104 . 2 1 1 A 10 10 ALA CA C 144 51.226 51.240 -0.014 1
1 105 . 2 1 1 A 10 10 ALA CB C 144 25.299 24.136 1.163 1
1 106 . 2 1 1 A 10 10 ALA N N 144 127.933 128.095 -0.162 1
1 107 . 2 1 1 A 11 11 SER H H 145 8.679 8.846 -0.167 1
1 108 . 2 1 1 A 11 11 SER HA H 145 5.431 5.840 -0.409 1
1 111 . 2 1 1 A 11 11 SER C C 145 173.072 173.252 -0.180 1
1 112 . 2 1 1 A 11 11 SER CA C 145 57.772 56.989 0.783 1
1 113 . 2 1 1 A 11 11 SER CB C 145 67.301 66.222 1.079 1
1 114 . 2 1 1 A 11 11 SER N N 145 116.245 115.534 0.711 1
1 115 . 2 1 1 A 12 12 HIS H H 146 9.962 9.498 0.464 1
1 116 . 2 1 1 A 12 12 HIS HA H 146 6.332 6.073 0.259 1
1 121 . 2 1 1 A 12 12 HIS C C 146 173.006 172.327 0.679 1
1 122 . 2 1 1 A 12 12 HIS CA C 146 55.020 54.261 0.759 1
1 123 . 2 1 1 A 12 12 HIS CB C 146 37.071 33.648 3.423 1
1 126 . 2 1 1 A 12 12 HIS N N 146 119.181 118.743 0.438 1
1 127 . 2 1 1 A 13 13 ILE H H 147 8.976 9.018 -0.042 1
1 128 . 2 1 1 A 13 13 ILE HA H 147 3.528 4.509 -0.981 1
1 138 . 2 1 1 A 13 13 ILE C C 147 173.010 173.793 -0.783 1
1 139 . 2 1 1 A 13 13 ILE CA C 147 61.273 59.648 1.625 1
1 140 . 2 1 1 A 13 13 ILE CB C 147 41.773 41.363 0.410 1
1 144 . 2 1 1 A 13 13 ILE N N 147 121.873 119.359 2.514 1
1 145 . 2 1 1 A 14 14 LEU H H 148 7.627 8.899 -1.272 1
1 146 . 2 1 1 A 14 14 LEU HA H 148 4.814 4.926 -0.112 1
1 156 . 2 1 1 A 14 14 LEU C C 148 174.112 174.322 -0.210 1
1 157 . 2 1 1 A 14 14 LEU CA C 148 52.574 53.127 -0.553 1
1 158 . 2 1 1 A 14 14 LEU CB C 148 45.643 44.950 0.693 1
1 162 . 2 1 1 A 14 14 LEU N N 148 127.112 129.741 -2.629 1
1 163 . 2 1 1 A 15 15 ILE H H 149 9.524 9.300 0.224 1
1 164 . 2 1 1 A 15 15 ILE HA H 149 4.362 4.664 -0.302 1
1 174 . 2 1 1 A 15 15 ILE C C 149 175.452 175.464 -0.012 1
1 175 . 2 1 1 A 15 15 ILE CA C 149 58.516 60.758 -2.242 1
1 176 . 2 1 1 A 15 15 ILE CB C 149 36.560 39.911 -3.351 1
1 180 . 2 1 1 A 15 15 ILE N N 149 128.652 127.260 1.392 1
1 181 . 2 1 1 A 16 16 LYS H H 150 8.035 8.607 -0.572 1
1 182 . 2 1 1 A 16 16 LYS HA H 150 4.319 4.453 -0.134 1
1 191 . 2 1 1 A 16 16 LYS C C 150 175.038 176.269 -1.231 1
1 192 . 2 1 1 A 16 16 LYS CA C 150 57.817 56.658 1.159 1
1 193 . 2 1 1 A 16 16 LYS CB C 150 34.853 32.939 1.914 1
1 197 . 2 1 1 A 16 16 LYS N N 150 129.153 127.879 1.274 1
1 198 . 2 1 1 A 17 17 VAL H H 151 8.016 8.936 -0.920 1
1 199 . 2 1 1 A 17 17 VAL HA H 151 4.873 4.624 0.249 1
1 207 . 2 1 1 A 17 17 VAL C C 151 176.647 175.418 1.229 1
1 208 . 2 1 1 A 17 17 VAL CA C 151 60.088 61.623 -1.535 1
1 209 . 2 1 1 A 17 17 VAL CB C 151 34.082 32.918 1.164 1
1 212 . 2 1 1 A 17 17 VAL N N 151 121.288 124.719 -3.431 1
1 213 . 2 1 1 A 18 18 LYS H H 152 8.443 8.857 -0.414 1
1 214 . 2 1 1 A 18 18 LYS HA H 152 4.334 4.335 -0.001 1
1 223 . 2 1 1 A 18 18 LYS C C 152 176.345 176.994 -0.649 1
1 224 . 2 1 1 A 18 18 LYS CA C 152 57.016 56.412 0.604 1
1 225 . 2 1 1 A 18 18 LYS CB C 152 33.222 32.246 0.976 1
1 229 . 2 1 1 A 18 18 LYS N N 152 128.408 127.605 0.803 1
1 230 . 2 1 1 A 19 19 SER H H 153 9.067 8.722 0.345 1
1 231 . 2 1 1 A 19 19 SER HA H 153 4.457 4.465 -0.008 1
1 234 . 2 1 1 A 19 19 SER C C 153 174.236 174.392 -0.156 1
1 235 . 2 1 1 A 19 19 SER CA C 153 59.642 60.135 -0.493 1
1 236 . 2 1 1 A 19 19 SER CB C 153 64.347 64.266 0.081 1
1 237 . 2 1 1 A 19 19 SER N N 153 121.522 119.454 2.068 1
1 238 . 2 1 1 A 20 20 LYS H H 154 7.961 7.651 0.310 1
1 239 . 2 1 1 A 20 20 LYS HA H 154 4.558 4.792 -0.234 1
1 244 . 2 1 1 A 20 20 LYS C C 154 177.256 176.668 0.588 1
1 245 . 2 1 1 A 20 20 LYS CA C 154 55.249 54.659 0.590 1
1 246 . 2 1 1 A 20 20 LYS CB C 154 34.531 36.485 -1.954 1
1 248 . 2 1 1 A 20 20 LYS N N 154 120.270 117.682 2.588 1
1 249 . 2 1 1 A 21 21 LYS HA H 155 4.003 4.090 -0.087 1
1 258 . 2 1 1 A 21 21 LYS C C 155 177.015 177.461 -0.446 1
1 259 . 2 1 1 A 21 21 LYS CA C 155 59.091 59.035 0.056 1
1 260 . 2 1 1 A 21 21 LYS CB C 155 32.394 32.029 0.365 1
1 264 . 2 1 1 A 22 22 SER H H 156 7.625 7.901 -0.276 1
1 265 . 2 1 1 A 22 22 SER HA H 156 4.293 4.402 -0.109 1
1 268 . 2 1 1 A 22 22 SER C C 156 174.843 174.483 0.360 1
1 269 . 2 1 1 A 22 22 SER CA C 156 57.966 58.348 -0.382 1
1 270 . 2 1 1 A 22 22 SER CB C 156 63.369 63.872 -0.503 1
1 271 . 2 1 1 A 22 22 SER N N 156 109.549 111.319 -1.770 1
1 272 . 2 1 1 A 23 23 ASP H H 157 7.701 7.444 0.257 1
1 273 . 2 1 1 A 23 23 ASP HA H 157 4.548 4.415 0.133 1
1 276 . 2 1 1 A 23 23 ASP C C 157 176.544 177.308 -0.764 1
1 277 . 2 1 1 A 23 23 ASP CA C 157 55.242 54.591 0.651 1
1 278 . 2 1 1 A 23 23 ASP CB C 157 41.103 43.756 -2.653 1
1 279 . 2 1 1 A 23 23 ASP N N 157 124.536 123.935 0.601 1
1 280 . 2 1 1 A 24 24 LYS H H 158 8.583 8.618 -0.035 1
1 281 . 2 1 1 A 24 24 LYS HA H 158 4.252 4.062 0.190 1
1 290 . 2 1 1 A 24 24 LYS C C 158 176.813 176.632 0.181 1
1 291 . 2 1 1 A 24 24 LYS CA C 158 57.148 58.626 -1.478 1
1 292 . 2 1 1 A 24 24 LYS CB C 158 33.200 32.715 0.485 1
1 296 . 2 1 1 A 24 24 LYS N N 158 122.372 124.205 -1.833 1
1 297 . 2 1 1 A 25 25 GLU H H 159 8.001 7.541 0.460 1
1 298 . 2 1 1 A 25 25 GLU HA H 159 4.521 4.689 -0.168 1
1 303 . 2 1 1 A 25 25 GLU C C 159 175.995 175.120 0.875 1
1 304 . 2 1 1 A 25 25 GLU CA C 159 55.727 56.090 -0.363 1
1 305 . 2 1 1 A 25 25 GLU CB C 159 31.918 32.901 -0.983 1
1 307 . 2 1 1 A 25 25 GLU N N 159 118.705 116.148 2.557 1
1 308 . 2 1 1 A 26 26 GLY H H 160 8.458 8.428 0.030 1
1 309 . 2 1 1 A 26 26 GLY HA2 H 160 3.946 4.142 -0.196 1
1 310 . 2 1 1 A 26 26 GLY HA3 H 160 3.511 4.152 -0.641 1
1 311 . 2 1 1 A 26 26 GLY C C 160 172.201 171.976 0.225 1
1 312 . 2 1 1 A 26 26 GLY CA C 160 44.038 45.022 -0.984 1
1 313 . 2 1 1 A 26 26 GLY N N 160 107.642 112.160 -4.518 1
1 314 . 2 1 1 A 27 27 LEU H H 161 8.259 8.426 -0.167 1
1 315 . 2 1 1 A 27 27 LEU HA H 161 4.775 5.156 -0.381 1
1 325 . 2 1 1 A 27 27 LEU C C 161 177.422 176.101 1.321 1
1 326 . 2 1 1 A 27 27 LEU CA C 161 53.322 53.056 0.266 1
1 327 . 2 1 1 A 27 27 LEU CB C 161 45.576 44.497 1.079 1
1 331 . 2 1 1 A 27 27 LEU N N 161 119.856 121.093 -1.237 1
1 332 . 2 1 1 A 28 28 ASP H H 162 8.848 8.731 0.117 1
1 333 . 2 1 1 A 28 28 ASP HA H 162 4.644 4.677 -0.033 1
1 336 . 2 1 1 A 28 28 ASP C C 162 176.630 177.354 -0.724 1
1 337 . 2 1 1 A 28 28 ASP CA C 162 55.195 54.475 0.720 1
1 338 . 2 1 1 A 28 28 ASP CB C 162 41.673 42.002 -0.329 1
1 339 . 2 1 1 A 28 28 ASP N N 162 122.434 121.040 1.394 1
1 340 . 2 1 1 A 29 29 ASP H H 163 8.720 9.212 -0.492 1
1 341 . 2 1 1 A 29 29 ASP HA H 163 4.386 4.425 -0.039 1
1 344 . 2 1 1 A 29 29 ASP C C 163 176.604 178.474 -1.870 1
1 345 . 2 1 1 A 29 29 ASP CA C 163 59.690 57.101 2.589 1
1 346 . 2 1 1 A 29 29 ASP CB C 163 42.964 39.865 3.099 1
1 347 . 2 1 1 A 29 29 ASP N N 163 121.460 122.625 -1.165 1
1 348 . 2 1 1 A 30 30 LYS H H 164 8.434 7.967 0.467 1
1 349 . 2 1 1 A 30 30 LYS HA H 164 3.901 3.981 -0.080 1
1 358 . 2 1 1 A 30 30 LYS C C 164 179.479 179.247 0.232 1
1 359 . 2 1 1 A 30 30 LYS CA C 164 60.047 59.336 0.711 1
1 360 . 2 1 1 A 30 30 LYS CB C 164 32.038 32.242 -0.204 1
1 364 . 2 1 1 A 30 30 LYS N N 164 116.627 119.583 -2.956 1
1 365 . 2 1 1 A 31 31 GLU H H 165 7.755 8.299 -0.544 1
1 366 . 2 1 1 A 31 31 GLU HA H 165 3.998 3.988 0.010 1
1 371 . 2 1 1 A 31 31 GLU C C 165 179.031 179.346 -0.315 1
1 372 . 2 1 1 A 31 31 GLU CA C 165 59.335 59.323 0.012 1
1 373 . 2 1 1 A 31 31 GLU CB C 165 29.972 29.272 0.700 1
1 375 . 2 1 1 A 31 31 GLU N N 165 120.456 119.839 0.617 1
1 376 . 2 1 1 A 32 32 ALA H H 166 9.060 8.647 0.413 1
1 377 . 2 1 1 A 32 32 ALA HA H 166 3.871 4.045 -0.174 1
1 381 . 2 1 1 A 32 32 ALA C C 166 178.029 179.096 -1.067 1
1 382 . 2 1 1 A 32 32 ALA CA C 166 54.997 55.387 -0.390 1
1 383 . 2 1 1 A 32 32 ALA CB C 166 19.727 18.566 1.161 1
1 384 . 2 1 1 A 32 32 ALA N N 166 124.406 122.421 1.985 1
1 385 . 2 1 1 A 33 33 LYS H H 167 8.228 7.478 0.750 1
1 386 . 2 1 1 A 33 33 LYS HA H 167 2.595 2.920 -0.325 1
1 395 . 2 1 1 A 33 33 LYS C C 167 177.938 178.178 -0.240 1
1 396 . 2 1 1 A 33 33 LYS CA C 167 59.573 59.240 0.333 1
1 397 . 2 1 1 A 33 33 LYS CB C 167 32.098 32.093 0.005 1
1 401 . 2 1 1 A 33 33 LYS N N 167 119.833 118.195 1.638 1
1 402 . 2 1 1 A 34 34 GLN H H 168 7.392 7.759 -0.367 1
1 403 . 2 1 1 A 34 34 GLN HA H 168 3.943 3.879 0.064 1
1 410 . 2 1 1 A 34 34 GLN C C 168 178.323 178.495 -0.172 1
1 411 . 2 1 1 A 34 34 GLN CA C 168 58.883 59.511 -0.628 1
1 412 . 2 1 1 A 34 34 GLN CB C 168 28.485 28.077 0.408 1
1 414 . 2 1 1 A 34 34 GLN N N 168 117.208 118.010 -0.802 1
1 416 . 2 1 1 A 35 35 LYS H H 169 7.994 8.075 -0.081 1
1 417 . 2 1 1 A 35 35 LYS HA H 169 4.067 4.006 0.061 1
1 426 . 2 1 1 A 35 35 LYS C C 169 178.161 178.549 -0.388 1
1 427 . 2 1 1 A 35 35 LYS CA C 169 58.437 59.218 -0.781 1
1 428 . 2 1 1 A 35 35 LYS CB C 169 31.611 32.218 -0.607 1
1 432 . 2 1 1 A 35 35 LYS N N 169 120.898 119.877 1.021 1
1 433 . 2 1 1 A 36 36 ALA H H 170 8.431 8.248 0.183 1
1 434 . 2 1 1 A 36 36 ALA HA H 170 3.738 4.038 -0.300 1
1 438 . 2 1 1 A 36 36 ALA C C 170 178.862 179.820 -0.958 1
1 439 . 2 1 1 A 36 36 ALA CA C 170 55.351 55.044 0.307 1
1 440 . 2 1 1 A 36 36 ALA CB C 170 18.295 18.566 -0.271 1
1 441 . 2 1 1 A 36 36 ALA N N 170 120.641 120.220 0.421 1
1 442 . 2 1 1 A 37 37 GLU H H 171 8.412 8.170 0.242 1
1 443 . 2 1 1 A 37 37 GLU HA H 171 3.867 3.948 -0.081 1
1 448 . 2 1 1 A 37 37 GLU C C 171 179.255 179.317 -0.062 1
1 449 . 2 1 1 A 37 37 GLU CA C 171 59.543 59.613 -0.070 1
1 450 . 2 1 1 A 37 37 GLU CB C 171 29.569 29.633 -0.064 1
1 452 . 2 1 1 A 37 37 GLU N N 171 118.224 117.646 0.578 1
1 453 . 2 1 1 A 38 38 GLU H H 172 8.019 8.389 -0.370 1
1 454 . 2 1 1 A 38 38 GLU HA H 172 3.952 4.087 -0.135 1
1 459 . 2 1 1 A 38 38 GLU C C 172 180.250 178.279 1.971 1
1 460 . 2 1 1 A 38 38 GLU CA C 172 59.627 59.180 0.447 1
1 461 . 2 1 1 A 38 38 GLU CB C 172 29.368 28.837 0.531 1
1 463 . 2 1 1 A 38 38 GLU N N 172 121.250 118.562 2.688 1
1 464 . 2 1 1 A 39 39 ILE H H 173 8.174 7.441 0.733 1
1 465 . 2 1 1 A 39 39 ILE HA H 173 3.643 3.801 -0.158 1
1 475 . 2 1 1 A 39 39 ILE C C 173 177.568 178.052 -0.484 1
1 476 . 2 1 1 A 39 39 ILE CA C 173 64.869 63.985 0.884 1
1 477 . 2 1 1 A 39 39 ILE CB C 173 38.160 37.435 0.725 1
1 481 . 2 1 1 A 39 39 ILE N N 173 121.527 117.501 4.026 1
1 482 . 2 1 1 A 40 40 GLN H H 174 8.860 8.376 0.484 1
1 483 . 2 1 1 A 40 40 GLN HA H 174 3.533 3.998 -0.465 1
1 490 . 2 1 1 A 40 40 GLN C C 174 179.022 178.511 0.511 1
1 491 . 2 1 1 A 40 40 GLN CA C 174 61.316 59.305 2.011 1
1 492 . 2 1 1 A 40 40 GLN CB C 174 26.604 28.469 -1.865 1
1 494 . 2 1 1 A 40 40 GLN N N 174 121.956 121.065 0.891 1
1 496 . 2 1 1 A 41 41 LYS H H 175 7.879 8.065 -0.186 1
1 497 . 2 1 1 A 41 41 LYS HA H 175 3.777 4.146 -0.369 1
1 506 . 2 1 1 A 41 41 LYS C C 175 178.779 178.430 0.349 1
1 507 . 2 1 1 A 41 41 LYS CA C 175 59.701 58.892 0.809 1
1 508 . 2 1 1 A 41 41 LYS CB C 175 32.581 31.779 0.802 1
1 512 . 2 1 1 A 41 41 LYS N N 175 119.012 118.239 0.773 1
1 513 . 2 1 1 A 42 42 GLU H H 176 7.447 8.150 -0.703 1
1 514 . 2 1 1 A 42 42 GLU HA H 176 4.059 4.166 -0.107 1
1 519 . 2 1 1 A 42 42 GLU C C 176 180.058 178.737 1.321 1
1 520 . 2 1 1 A 42 42 GLU CA C 176 59.456 59.187 0.269 1
1 521 . 2 1 1 A 42 42 GLU CB C 176 29.923 29.432 0.491 1
1 523 . 2 1 1 A 42 42 GLU N N 176 120.054 118.994 1.060 1
1 524 . 2 1 1 A 43 43 VAL H H 177 8.618 8.046 0.572 1
1 525 . 2 1 1 A 43 43 VAL HA H 177 3.986 3.924 0.062 1
1 533 . 2 1 1 A 43 43 VAL C C 177 176.459 177.524 -1.065 1
1 534 . 2 1 1 A 43 43 VAL CA C 177 63.923 64.837 -0.914 1
1 535 . 2 1 1 A 43 43 VAL CB C 177 31.899 31.347 0.552 1
1 538 . 2 1 1 A 43 43 VAL N N 177 114.191 117.267 -3.076 1
1 539 . 2 1 1 A 44 44 SER H H 178 8.052 8.360 -0.308 1
1 540 . 2 1 1 A 44 44 SER HA H 178 4.098 4.276 -0.178 1
1 543 . 2 1 1 A 44 44 SER C C 178 176.548 176.175 0.373 1
1 544 . 2 1 1 A 44 44 SER CA C 178 61.160 61.111 0.049 1
1 545 . 2 1 1 A 44 44 SER CB C 178 62.959 62.663 0.296 1
1 546 . 2 1 1 A 44 44 SER N N 178 114.202 115.994 -1.792 1
1 547 . 2 1 1 A 45 45 LYS H H 179 7.083 8.163 -1.080 1
1 548 . 2 1 1 A 45 45 LYS HA H 179 4.140 4.185 -0.045 1
1 557 . 2 1 1 A 45 45 LYS C C 179 177.288 176.158 1.130 1
1 558 . 2 1 1 A 45 45 LYS CA C 179 58.469 57.976 0.493 1
1 559 . 2 1 1 A 45 45 LYS CB C 179 32.671 31.451 1.220 1
1 563 . 2 1 1 A 45 45 LYS N N 179 120.935 117.750 3.185 1
1 564 . 2 1 1 A 46 46 ASP H H 180 7.098 7.936 -0.838 1
1 565 . 2 1 1 A 46 46 ASP HA H 180 4.917 4.993 -0.076 1
1 568 . 2 1 1 A 46 46 ASP CA C 180 51.492 51.554 -0.062 1
1 569 . 2 1 1 A 46 46 ASP CB C 180 40.595 41.422 -0.827 1
1 570 . 2 1 1 A 46 46 ASP N N 180 112.836 120.375 -7.539 1
1 571 . 2 1 1 A 47 47 PRO HA H 181 4.681 4.573 0.108 1
1 578 . 2 1 1 A 47 47 PRO C C 181 179.248 177.526 1.722 1
1 579 . 2 1 1 A 47 47 PRO CA C 181 64.718 64.231 0.487 1
1 580 . 2 1 1 A 47 47 PRO CB C 181 32.159 32.003 0.156 1
1 583 . 2 1 1 A 48 48 SER H H 182 8.248 8.002 0.246 1
1 584 . 2 1 1 A 48 48 SER HA H 182 4.378 4.292 0.086 1
1 587 . 2 1 1 A 48 48 SER C C 182 176.071 175.553 0.518 1
1 588 . 2 1 1 A 48 48 SER CA C 182 61.377 60.998 0.379 1
1 589 . 2 1 1 A 48 48 SER CB C 182 62.455 63.240 -0.785 1
1 590 . 2 1 1 A 48 48 SER N N 182 116.986 113.936 3.050 1
1 591 . 2 1 1 A 49 49 LYS H H 183 7.842 7.327 0.515 1
1 592 . 2 1 1 A 49 49 LYS HA H 183 4.482 4.294 0.188 1
1 601 . 2 1 1 A 49 49 LYS C C 183 175.605 177.618 -2.013 1
1 602 . 2 1 1 A 49 49 LYS CA C 183 55.824 56.968 -1.144 1
1 603 . 2 1 1 A 49 49 LYS CB C 183 32.834 32.740 0.094 1
1 607 . 2 1 1 A 49 49 LYS N N 183 121.698 120.022 1.676 1
1 608 . 2 1 1 A 50 50 PHE H H 184 7.634 7.994 -0.360 1
1 609 . 2 1 1 A 50 50 PHE HA H 184 3.510 4.178 -0.668 1
1 617 . 2 1 1 A 50 50 PHE C C 184 176.214 177.601 -1.387 1
1 618 . 2 1 1 A 50 50 PHE CA C 184 63.276 61.018 2.258 1
1 619 . 2 1 1 A 50 50 PHE CB C 184 40.948 39.097 1.851 1
1 623 . 2 1 1 A 50 50 PHE N N 184 120.120 121.477 -1.357 1
1 624 . 2 1 1 A 51 51 GLY H H 185 8.855 8.612 0.243 1
1 625 . 2 1 1 A 51 51 GLY HA2 H 185 3.993 3.885 0.108 1
1 626 . 2 1 1 A 51 51 GLY HA3 H 185 3.958 3.924 0.034 1
1 627 . 2 1 1 A 51 51 GLY C C 185 175.169 176.166 -0.997 1
1 628 . 2 1 1 A 51 51 GLY CA C 185 47.475 47.550 -0.075 1
1 629 . 2 1 1 A 51 51 GLY N N 185 105.550 106.355 -0.805 1
1 630 . 2 1 1 A 52 52 GLU H H 186 7.917 7.960 -0.043 1
1 631 . 2 1 1 A 52 52 GLU HA H 186 4.006 4.048 -0.042 1
1 636 . 2 1 1 A 52 52 GLU C C 186 179.499 179.540 -0.041 1
1 637 . 2 1 1 A 52 52 GLU CA C 186 58.904 59.212 -0.308 1
1 638 . 2 1 1 A 52 52 GLU CB C 186 29.700 29.745 -0.045 1
1 640 . 2 1 1 A 52 52 GLU N N 186 121.929 121.783 0.146 1
1 641 . 2 1 1 A 53 53 ILE H H 187 7.936 8.074 -0.138 1
1 642 . 2 1 1 A 53 53 ILE HA H 187 3.648 3.752 -0.104 1
1 652 . 2 1 1 A 53 53 ILE C C 187 177.886 177.817 0.069 1
1 653 . 2 1 1 A 53 53 ILE CA C 187 64.366 64.715 -0.349 1
1 654 . 2 1 1 A 53 53 ILE CB C 187 36.478 37.413 -0.935 1
1 658 . 2 1 1 A 53 53 ILE N N 187 120.991 121.613 -0.622 1
1 659 . 2 1 1 A 54 54 ALA H H 188 8.895 8.496 0.399 1
1 660 . 2 1 1 A 54 54 ALA HA H 188 3.629 3.801 -0.172 1
1 664 . 2 1 1 A 54 54 ALA C C 188 179.437 178.902 0.535 1
1 665 . 2 1 1 A 54 54 ALA CA C 188 55.974 55.662 0.312 1
1 666 . 2 1 1 A 54 54 ALA CB C 188 17.591 18.811 -1.220 1
1 667 . 2 1 1 A 54 54 ALA N N 188 125.308 122.108 3.200 1
1 668 . 2 1 1 A 55 55 LYS H H 189 8.049 7.798 0.251 1
1 669 . 2 1 1 A 55 55 LYS HA H 189 4.106 3.854 0.252 1
1 678 . 2 1 1 A 55 55 LYS C C 189 178.995 178.508 0.487 1
1 679 . 2 1 1 A 55 55 LYS CA C 189 59.312 59.380 -0.068 1
1 680 . 2 1 1 A 55 55 LYS CB C 189 32.647 32.101 0.546 1
1 684 . 2 1 1 A 55 55 LYS N N 189 116.835 118.494 -1.659 1
1 685 . 2 1 1 A 56 56 LYS H H 190 7.215 7.635 -0.420 1
1 686 . 2 1 1 A 56 56 LYS HA H 190 4.172 4.216 -0.044 1
1 695 . 2 1 1 A 56 56 LYS C C 190 177.897 177.885 0.012 1
1 696 . 2 1 1 A 56 56 LYS CA C 190 58.418 58.720 -0.302 1
1 697 . 2 1 1 A 56 56 LYS CB C 190 34.652 33.276 1.376 1
1 701 . 2 1 1 A 56 56 LYS N N 190 117.170 118.080 -0.910 1
1 702 . 2 1 1 A 57 57 GLU H H 191 8.572 7.839 0.733 1
1 703 . 2 1 1 A 57 57 GLU HA H 191 4.643 4.398 0.245 1
1 708 . 2 1 1 A 57 57 GLU C C 191 177.903 176.012 1.891 1
1 709 . 2 1 1 A 57 57 GLU CA C 191 55.708 55.762 -0.054 1
1 710 . 2 1 1 A 57 57 GLU CB C 191 32.460 30.898 1.562 1
1 712 . 2 1 1 A 57 57 GLU N N 191 113.316 116.628 -3.312 1
1 713 . 2 1 1 A 58 58 SER H H 192 8.550 7.628 0.922 1
1 714 . 2 1 1 A 58 58 SER HA H 192 4.149 4.375 -0.226 1
1 717 . 2 1 1 A 58 58 SER C C 192 176.161 175.426 0.735 1
1 718 . 2 1 1 A 58 58 SER CA C 192 58.403 58.017 0.386 1
1 719 . 2 1 1 A 58 58 SER CB C 192 64.392 64.303 0.089 1
1 720 . 2 1 1 A 58 58 SER N N 192 109.861 116.094 -6.233 1
1 721 . 2 1 1 A 59 59 MET H H 193 9.533 8.837 0.696 1
1 722 . 2 1 1 A 59 59 MET HA H 193 4.457 4.447 0.010 1
1 730 . 2 1 1 A 59 59 MET C C 193 175.204 175.697 -0.493 1
1 731 . 2 1 1 A 59 59 MET CA C 193 55.781 56.587 -0.806 1
1 732 . 2 1 1 A 59 59 MET CB C 193 32.855 33.005 -0.150 1
1 735 . 2 1 1 A 59 59 MET N N 193 124.493 123.871 0.622 1
1 736 . 2 1 1 A 60 60 ASP H H 194 7.514 7.507 0.007 1
1 737 . 2 1 1 A 60 60 ASP HA H 194 4.886 4.580 0.306 1
1 740 . 2 1 1 A 60 60 ASP C C 194 175.517 176.740 -1.223 1
1 741 . 2 1 1 A 60 60 ASP CA C 194 52.286 53.426 -1.140 1
1 742 . 2 1 1 A 60 60 ASP CB C 194 40.222 40.393 -0.171 1
1 743 . 2 1 1 A 60 60 ASP N N 194 117.785 120.459 -2.674 1
1 744 . 2 1 1 A 61 61 THR H H 195 8.118 7.886 0.232 1
1 745 . 2 1 1 A 61 61 THR HA H 195 3.918 3.961 -0.043 1
1 750 . 2 1 1 A 61 61 THR C C 195 176.269 176.651 -0.382 1
1 751 . 2 1 1 A 61 61 THR CA C 195 65.469 65.309 0.160 1
1 752 . 2 1 1 A 61 61 THR CB C 195 68.741 68.461 0.280 1
1 754 . 2 1 1 A 61 61 THR N N 195 120.765 118.631 2.134 1
1 755 . 2 1 1 A 62 62 GLY H H 196 8.399 8.127 0.272 1
1 756 . 2 1 1 A 62 62 GLY HA2 H 196 3.932 3.868 0.064 1
1 757 . 2 1 1 A 62 62 GLY HA3 H 196 3.900 3.868 0.032 1
1 758 . 2 1 1 A 62 62 GLY C C 196 174.948 175.696 -0.748 1
1 759 . 2 1 1 A 62 62 GLY CA C 196 46.768 46.672 0.096 1
1 760 . 2 1 1 A 62 62 GLY N N 196 108.183 111.382 -3.199 1
1 761 . 2 1 1 A 63 63 SER H H 197 7.265 7.868 -0.603 1
1 762 . 2 1 1 A 63 63 SER HA H 197 4.554 4.383 0.171 1
1 765 . 2 1 1 A 63 63 SER C C 197 177.630 177.025 0.605 1
1 766 . 2 1 1 A 63 63 SER CA C 197 59.550 60.988 -1.438 1
1 767 . 2 1 1 A 63 63 SER CB C 197 65.504 63.190 2.314 1
1 768 . 2 1 1 A 63 63 SER N N 197 111.815 116.566 -4.751 1
1 769 . 2 1 1 A 64 64 ALA H H 198 8.675 8.461 0.214 1
1 770 . 2 1 1 A 64 64 ALA HA H 198 3.801 3.995 -0.194 1
1 774 . 2 1 1 A 64 64 ALA C C 198 178.492 179.567 -1.075 1
1 775 . 2 1 1 A 64 64 ALA CA C 198 56.794 55.329 1.465 1
1 776 . 2 1 1 A 64 64 ALA CB C 198 18.951 18.459 0.492 1
1 777 . 2 1 1 A 64 64 ALA N N 198 131.710 122.873 8.837 1
1 778 . 2 1 1 A 65 65 LYS H H 199 7.666 7.923 -0.257 1
1 779 . 2 1 1 A 65 65 LYS HA H 199 4.175 4.119 0.056 1
1 788 . 2 1 1 A 65 65 LYS C C 199 177.159 177.380 -0.221 1
1 789 . 2 1 1 A 65 65 LYS CA C 199 57.735 58.852 -1.117 1
1 790 . 2 1 1 A 65 65 LYS CB C 199 31.948 31.529 0.419 1
1 794 . 2 1 1 A 65 65 LYS N N 199 111.375 115.601 -4.226 1
1 795 . 2 1 1 A 66 66 LYS H H 200 7.545 7.587 -0.042 1
1 796 . 2 1 1 A 66 66 LYS HA H 200 4.612 4.413 0.199 1
1 805 . 2 1 1 A 66 66 LYS C C 200 175.609 175.211 0.398 1
1 806 . 2 1 1 A 66 66 LYS CA C 200 54.468 55.890 -1.422 1
1 807 . 2 1 1 A 66 66 LYS CB C 200 31.525 32.438 -0.913 1
1 811 . 2 1 1 A 66 66 LYS N N 200 121.421 117.888 3.533 1
1 812 . 2 1 1 A 67 67 ASP H H 201 7.630 8.287 -0.657 1
1 813 . 2 1 1 A 67 67 ASP HA H 201 4.306 4.369 -0.063 1
1 816 . 2 1 1 A 67 67 ASP C C 201 175.025 176.310 -1.285 1
1 817 . 2 1 1 A 67 67 ASP CA C 201 56.400 55.383 1.017 1
1 818 . 2 1 1 A 67 67 ASP CB C 201 38.315 39.086 -0.771 1
1 819 . 2 1 1 A 67 67 ASP N N 201 116.216 116.952 -0.736 1
1 820 . 2 1 1 A 68 68 GLY H H 202 8.368 8.483 -0.115 1
1 821 . 2 1 1 A 68 68 GLY HA2 H 202 4.316 3.907 0.409 1
1 822 . 2 1 1 A 68 68 GLY HA3 H 202 3.731 3.957 -0.226 1
1 823 . 2 1 1 A 68 68 GLY C C 202 174.139 174.578 -0.439 1
1 824 . 2 1 1 A 68 68 GLY CA C 202 45.514 45.367 0.147 1
1 825 . 2 1 1 A 68 68 GLY N N 202 105.095 104.745 0.350 1
1 826 . 2 1 1 A 69 69 GLU H H 203 7.534 8.039 -0.505 1
1 827 . 2 1 1 A 69 69 GLU HA H 203 4.479 4.495 -0.016 1
1 832 . 2 1 1 A 69 69 GLU C C 203 176.961 176.249 0.712 1
1 833 . 2 1 1 A 69 69 GLU CA C 203 58.549 56.140 2.409 1
1 834 . 2 1 1 A 69 69 GLU CB C 203 30.998 30.697 0.301 1
1 836 . 2 1 1 A 69 69 GLU N N 203 120.426 119.893 0.533 1
1 837 . 2 1 1 A 70 70 LEU H H 204 8.962 9.153 -0.191 1
1 838 . 2 1 1 A 70 70 LEU HA H 204 4.438 4.618 -0.180 1
1 848 . 2 1 1 A 70 70 LEU C C 204 178.648 177.243 1.405 1
1 849 . 2 1 1 A 70 70 LEU CA C 204 53.977 55.106 -1.129 1
1 850 . 2 1 1 A 70 70 LEU CB C 204 43.612 43.663 -0.051 1
1 854 . 2 1 1 A 70 70 LEU N N 204 122.066 123.757 -1.691 1
1 855 . 2 1 1 A 71 71 GLY H H 205 8.104 7.597 0.507 1
1 856 . 2 1 1 A 71 71 GLY HA2 H 205 4.165 4.043 0.122 1
1 857 . 2 1 1 A 71 71 GLY HA3 H 205 3.552 4.137 -0.585 1
1 858 . 2 1 1 A 71 71 GLY C C 205 173.098 173.350 -0.252 1
1 859 . 2 1 1 A 71 71 GLY CA C 205 44.723 45.028 -0.305 1
1 860 . 2 1 1 A 71 71 GLY N N 205 110.168 106.712 3.456 1
1 861 . 2 1 1 A 72 72 TYR H H 206 8.457 8.667 -0.210 1
1 862 . 2 1 1 A 72 72 TYR HA H 206 4.184 4.830 -0.646 1
1 869 . 2 1 1 A 72 72 TYR C C 206 175.975 175.449 0.526 1
1 870 . 2 1 1 A 72 72 TYR CA C 206 59.722 58.941 0.781 1
1 871 . 2 1 1 A 72 72 TYR CB C 206 38.378 38.276 0.102 1
1 874 . 2 1 1 A 72 72 TYR N N 206 120.171 122.091 -1.920 1
1 875 . 2 1 1 A 73 73 VAL H H 207 8.782 9.124 -0.342 1
1 876 . 2 1 1 A 73 73 VAL HA H 207 4.056 4.467 -0.411 1
1 884 . 2 1 1 A 73 73 VAL C C 207 174.901 175.847 -0.946 1
1 885 . 2 1 1 A 73 73 VAL CA C 207 62.202 62.808 -0.606 1
1 886 . 2 1 1 A 73 73 VAL CB C 207 33.071 32.131 0.940 1
1 889 . 2 1 1 A 73 73 VAL N N 207 128.847 125.123 3.724 1
1 890 . 2 1 1 A 74 74 LEU H H 208 8.146 8.827 -0.681 1
1 891 . 2 1 1 A 74 74 LEU HA H 208 4.944 4.476 0.468 1
1 901 . 2 1 1 A 74 74 LEU C C 208 178.400 177.397 1.003 1
1 902 . 2 1 1 A 74 74 LEU CA C 208 53.520 54.344 -0.824 1
1 903 . 2 1 1 A 74 74 LEU CB C 208 43.499 42.267 1.232 1
1 907 . 2 1 1 A 74 74 LEU N N 208 127.599 129.257 -1.658 1
1 908 . 2 1 1 A 75 75 LYS H H 209 8.403 8.792 -0.389 1
1 909 . 2 1 1 A 75 75 LYS HA H 209 3.771 3.938 -0.167 1
1 918 . 2 1 1 A 75 75 LYS C C 209 177.536 177.492 0.044 1
1 919 . 2 1 1 A 75 75 LYS CA C 209 58.385 58.911 -0.526 1
1 920 . 2 1 1 A 75 75 LYS CB C 209 32.459 32.074 0.385 1
1 924 . 2 1 1 A 75 75 LYS N N 209 123.798 122.825 0.973 1
1 925 . 2 1 1 A 76 76 GLY H H 210 9.997 9.299 0.698 1
1 926 . 2 1 1 A 76 76 GLY HA2 H 210 4.255 4.008 0.247 1
1 927 . 2 1 1 A 76 76 GLY HA3 H 210 3.791 4.009 -0.218 1
1 928 . 2 1 1 A 76 76 GLY C C 210 175.091 175.539 -0.448 1
1 929 . 2 1 1 A 76 76 GLY CA C 210 45.465 45.610 -0.145 1
1 930 . 2 1 1 A 76 76 GLY N N 210 114.705 113.198 1.507 1
1 931 . 2 1 1 A 77 77 GLN H H 211 7.726 8.057 -0.331 1
1 932 . 2 1 1 A 77 77 GLN HA H 211 4.373 4.190 0.183 1
1 939 . 2 1 1 A 77 77 GLN C C 211 176.301 175.952 0.349 1
1 940 . 2 1 1 A 77 77 GLN CA C 211 57.074 57.644 -0.570 1
1 941 . 2 1 1 A 77 77 GLN CB C 211 30.798 29.280 1.518 1
1 943 . 2 1 1 A 77 77 GLN N N 211 118.702 118.009 0.693 1
1 945 . 2 1 1 A 78 78 THR H H 212 8.225 7.512 0.713 1
1 946 . 2 1 1 A 78 78 THR HA H 212 4.620 4.644 -0.024 1
1 951 . 2 1 1 A 78 78 THR C C 212 173.920 174.259 -0.339 1
1 952 . 2 1 1 A 78 78 THR CA C 212 60.087 59.686 0.401 1
1 953 . 2 1 1 A 78 78 THR CB C 212 71.412 70.816 0.596 1
1 955 . 2 1 1 A 78 78 THR N N 212 111.935 110.877 1.058 1
1 956 . 2 1 1 A 79 79 ASP H H 213 8.372 8.511 -0.139 1
1 957 . 2 1 1 A 79 79 ASP HA H 213 4.470 4.549 -0.079 1
1 960 . 2 1 1 A 79 79 ASP C C 213 176.759 177.622 -0.863 1
1 961 . 2 1 1 A 79 79 ASP CA C 213 54.927 54.309 0.618 1
1 962 . 2 1 1 A 79 79 ASP CB C 213 43.859 41.533 2.326 1
1 963 . 2 1 1 A 79 79 ASP N N 213 122.093 121.359 0.734 1
1 964 . 2 1 1 A 80 80 LYS H H 214 8.740 8.942 -0.202 1
1 965 . 2 1 1 A 80 80 LYS HA H 214 4.027 3.920 0.107 1
1 974 . 2 1 1 A 80 80 LYS C C 214 178.493 178.304 0.189 1
1 975 . 2 1 1 A 80 80 LYS CA C 214 59.802 59.752 0.050 1
1 976 . 2 1 1 A 80 80 LYS CB C 214 32.374 32.163 0.211 1
1 980 . 2 1 1 A 80 80 LYS N N 214 124.685 122.889 1.796 1
1 981 . 2 1 1 A 81 81 ASP H H 215 8.556 8.187 0.369 1
1 982 . 2 1 1 A 81 81 ASP HA H 215 4.566 4.360 0.206 1
1 985 . 2 1 1 A 81 81 ASP C C 215 178.889 178.838 0.051 1
1 986 . 2 1 1 A 81 81 ASP CA C 215 58.046 57.449 0.597 1
1 987 . 2 1 1 A 81 81 ASP CB C 215 40.872 40.632 0.240 1
1 988 . 2 1 1 A 81 81 ASP N N 215 121.413 119.521 1.892 1
1 989 . 2 1 1 A 82 82 PHE H H 216 8.205 8.347 -0.142 1
1 990 . 2 1 1 A 82 82 PHE HA H 216 3.686 4.047 -0.361 1
1 998 . 2 1 1 A 82 82 PHE C C 216 175.919 177.335 -1.416 1
1 999 . 2 1 1 A 82 82 PHE CA C 216 61.648 60.974 0.674 1
1 1000 . 2 1 1 A 82 82 PHE CB C 216 39.743 39.237 0.506 1
1 1004 . 2 1 1 A 82 82 PHE N N 216 124.401 122.173 2.228 1
1 1005 . 2 1 1 A 83 83 GLU H H 217 8.887 8.832 0.055 1
1 1006 . 2 1 1 A 83 83 GLU HA H 217 3.704 4.153 -0.449 1
1 1011 . 2 1 1 A 83 83 GLU C C 217 177.788 178.871 -1.083 1
1 1012 . 2 1 1 A 83 83 GLU CA C 217 60.545 60.215 0.330 1
1 1013 . 2 1 1 A 83 83 GLU CB C 217 30.639 29.444 1.195 1
1 1015 . 2 1 1 A 83 83 GLU N N 217 119.421 119.045 0.376 1
1 1016 . 2 1 1 A 84 84 LYS H H 218 8.055 7.965 0.090 1
1 1017 . 2 1 1 A 84 84 LYS HA H 218 3.947 4.109 -0.162 1
1 1026 . 2 1 1 A 84 84 LYS C C 218 178.783 178.711 0.072 1
1 1027 . 2 1 1 A 84 84 LYS CA C 218 59.327 58.896 0.431 1
1 1028 . 2 1 1 A 84 84 LYS CB C 218 32.539 32.217 0.322 1
1 1032 . 2 1 1 A 84 84 LYS N N 218 117.821 119.529 -1.708 1
1 1033 . 2 1 1 A 85 85 ALA H H 219 7.059 7.749 -0.690 1
1 1034 . 2 1 1 A 85 85 ALA HA H 219 4.040 4.039 0.001 1
1 1038 . 2 1 1 A 85 85 ALA C C 219 179.794 180.245 -0.451 1
1 1039 . 2 1 1 A 85 85 ALA CA C 219 54.407 54.822 -0.415 1
1 1040 . 2 1 1 A 85 85 ALA CB C 219 20.130 18.021 2.109 1
1 1041 . 2 1 1 A 85 85 ALA N N 219 118.905 121.383 -2.478 1
1 1042 . 2 1 1 A 86 86 LEU H H 220 8.157 8.303 -0.146 1
1 1043 . 2 1 1 A 86 86 LEU HA H 220 3.692 3.981 -0.289 1
1 1053 . 2 1 1 A 86 86 LEU C C 220 178.330 178.633 -0.303 1
1 1054 . 2 1 1 A 86 86 LEU CA C 220 57.752 58.110 -0.358 1
1 1055 . 2 1 1 A 86 86 LEU CB C 220 41.464 41.855 -0.391 1
1 1059 . 2 1 1 A 86 86 LEU N N 220 118.606 120.481 -1.875 1
1 1060 . 2 1 1 A 87 87 PHE H H 221 8.349 8.234 0.115 1
1 1061 . 2 1 1 A 87 87 PHE HA H 221 3.861 4.467 -0.606 1
1 1069 . 2 1 1 A 87 87 PHE C C 221 176.176 177.882 -1.706 1
1 1070 . 2 1 1 A 87 87 PHE CA C 221 61.780 61.491 0.289 1
1 1071 . 2 1 1 A 87 87 PHE CB C 221 37.549 37.911 -0.362 1
1 1075 . 2 1 1 A 87 87 PHE N N 221 112.449 116.811 -4.362 1
1 1076 . 2 1 1 A 88 88 LYS H H 222 7.061 8.107 -1.046 1
1 1077 . 2 1 1 A 88 88 LYS HA H 222 4.380 4.133 0.247 1
1 1086 . 2 1 1 A 88 88 LYS C C 222 177.089 177.174 -0.085 1
1 1087 . 2 1 1 A 88 88 LYS CA C 222 56.726 58.342 -1.616 1
1 1088 . 2 1 1 A 88 88 LYS CB C 222 33.738 32.469 1.269 1
1 1092 . 2 1 1 A 88 88 LYS N N 222 118.308 121.057 -2.749 1
1 1093 . 2 1 1 A 89 89 LEU H H 223 7.270 7.386 -0.116 1
1 1094 . 2 1 1 A 89 89 LEU HA H 223 4.168 4.217 -0.049 1
1 1104 . 2 1 1 A 89 89 LEU C C 223 177.528 176.888 0.640 1
1 1105 . 2 1 1 A 89 89 LEU CA C 223 55.279 54.566 0.713 1
1 1106 . 2 1 1 A 89 89 LEU CB C 223 43.240 42.473 0.767 1
1 1110 . 2 1 1 A 89 89 LEU N N 223 121.317 122.149 -0.832 1
1 1111 . 2 1 1 A 90 90 LYS H H 224 8.788 8.393 0.395 1
1 1112 . 2 1 1 A 90 90 LYS HA H 224 4.359 4.281 0.078 1
1 1121 . 2 1 1 A 90 90 LYS C C 224 175.839 176.474 -0.635 1
1 1122 . 2 1 1 A 90 90 LYS CA C 224 54.772 55.911 -1.139 1
1 1123 . 2 1 1 A 90 90 LYS CB C 224 33.232 33.209 0.023 1
1 1127 . 2 1 1 A 90 90 LYS N N 224 123.558 123.152 0.406 1
1 1128 . 2 1 1 A 91 91 ASP H H 225 8.125 8.750 -0.625 1
1 1129 . 2 1 1 A 91 91 ASP HA H 225 3.958 4.152 -0.194 1
1 1132 . 2 1 1 A 91 91 ASP C C 225 177.452 177.218 0.234 1
1 1133 . 2 1 1 A 91 91 ASP CA C 225 56.642 56.252 0.390 1
1 1134 . 2 1 1 A 91 91 ASP CB C 225 40.269 40.232 0.037 1
1 1135 . 2 1 1 A 91 91 ASP N N 225 119.419 121.838 -2.419 1
1 1136 . 2 1 1 A 92 92 GLY H H 226 8.681 8.603 0.078 1
1 1137 . 2 1 1 A 92 92 GLY HA2 H 226 4.131 3.816 0.315 1
1 1138 . 2 1 1 A 92 92 GLY HA3 H 226 3.579 3.844 -0.265 1
1 1139 . 2 1 1 A 92 92 GLY C C 226 173.614 173.771 -0.157 1
1 1140 . 2 1 1 A 92 92 GLY CA C 226 45.564 45.401 0.163 1
1 1141 . 2 1 1 A 92 92 GLY N N 226 113.802 111.671 2.131 1
1 1142 . 2 1 1 A 93 93 GLU H H 227 8.104 7.925 0.179 1
1 1143 . 2 1 1 A 93 93 GLU HA H 227 4.232 4.418 -0.186 1
1 1148 . 2 1 1 A 93 93 GLU C C 227 174.282 175.516 -1.234 1
1 1149 . 2 1 1 A 93 93 GLU CA C 227 56.651 56.028 0.623 1
1 1150 . 2 1 1 A 93 93 GLU CB C 227 32.190 31.048 1.142 1
1 1152 . 2 1 1 A 93 93 GLU N N 227 121.527 121.734 -0.207 1
1 1153 . 2 1 1 A 94 94 VAL H H 228 7.918 8.482 -0.564 1
1 1154 . 2 1 1 A 94 94 VAL HA H 228 4.857 4.759 0.098 1
1 1162 . 2 1 1 A 94 94 VAL C C 228 176.556 175.683 0.873 1
1 1163 . 2 1 1 A 94 94 VAL CA C 228 60.309 60.476 -0.167 1
1 1164 . 2 1 1 A 94 94 VAL CB C 228 33.847 35.173 -1.326 1
1 1167 . 2 1 1 A 94 94 VAL N N 228 119.768 126.232 -6.464 1
1 1168 . 2 1 1 A 95 95 SER H H 229 9.659 9.411 0.248 1
1 1169 . 2 1 1 A 95 95 SER HA H 229 4.313 4.719 -0.406 1
1 1172 . 2 1 1 A 95 95 SER C C 229 174.641 174.610 0.031 1
1 1173 . 2 1 1 A 95 95 SER CA C 229 59.208 57.768 1.440 1
1 1174 . 2 1 1 A 95 95 SER CB C 229 66.080 65.791 0.289 1
1 1175 . 2 1 1 A 95 95 SER N N 229 124.903 120.933 3.970 1
1 1176 . 2 1 1 A 96 96 GLU H H 230 8.014 8.402 -0.388 1
1 1177 . 2 1 1 A 96 96 GLU HA H 230 4.376 4.296 0.080 1
1 1182 . 2 1 1 A 96 96 GLU C C 230 176.641 175.913 0.728 1
1 1183 . 2 1 1 A 96 96 GLU CA C 230 56.236 56.130 0.106 1
1 1184 . 2 1 1 A 96 96 GLU CB C 230 30.324 30.311 0.013 1
1 1186 . 2 1 1 A 96 96 GLU N N 230 115.510 119.392 -3.882 1
1 1187 . 2 1 1 A 97 97 VAL H H 231 8.741 8.327 0.414 1
1 1188 . 2 1 1 A 97 97 VAL HA H 231 4.171 4.146 0.025 1
1 1196 . 2 1 1 A 97 97 VAL C C 231 176.684 175.789 0.895 1
1 1197 . 2 1 1 A 97 97 VAL CA C 231 65.418 63.208 2.210 1
1 1198 . 2 1 1 A 97 97 VAL CB C 231 31.218 31.474 -0.256 1
1 1201 . 2 1 1 A 97 97 VAL N N 231 121.289 120.574 0.715 1
1 1202 . 2 1 1 A 98 98 VAL H H 232 9.218 9.399 -0.181 1
1 1203 . 2 1 1 A 98 98 VAL HA H 232 4.405 4.659 -0.254 1
1 1211 . 2 1 1 A 98 98 VAL C C 232 174.258 174.391 -0.133 1
1 1212 . 2 1 1 A 98 98 VAL CA C 232 60.937 61.288 -0.351 1
1 1213 . 2 1 1 A 98 98 VAL CB C 232 35.825 33.751 2.074 1
1 1216 . 2 1 1 A 98 98 VAL N N 232 130.544 128.941 1.603 1
1 1217 . 2 1 1 A 99 99 LYS H H 233 8.800 8.839 -0.039 1
1 1218 . 2 1 1 A 99 99 LYS HA H 233 4.853 5.255 -0.402 1
1 1227 . 2 1 1 A 99 99 LYS C C 233 175.274 175.125 0.149 1
1 1228 . 2 1 1 A 99 99 LYS CA C 233 55.499 54.730 0.769 1
1 1229 . 2 1 1 A 99 99 LYS CB C 233 34.452 35.317 -0.865 1
1 1233 . 2 1 1 A 99 99 LYS N N 233 130.477 127.860 2.617 1
1 1234 . 2 1 1 A 100 100 SER H H 234 9.585 9.108 0.477 1
1 1235 . 2 1 1 A 100 100 SER HA H 234 5.150 4.888 0.262 1
1 1238 . 2 1 1 A 100 100 SER C C 234 175.493 174.019 1.474 1
1 1239 . 2 1 1 A 100 100 SER CA C 234 56.927 57.540 -0.613 1
1 1240 . 2 1 1 A 100 100 SER CB C 234 67.309 67.370 -0.061 1
1 1241 . 2 1 1 A 100 100 SER N N 234 125.814 122.502 3.312 1
1 1242 . 2 1 1 A 101 101 SER H H 235 8.631 8.375 0.256 1
1 1243 . 2 1 1 A 101 101 SER HA H 235 4.106 4.068 0.038 1
1 1246 . 2 1 1 A 101 101 SER C C 235 175.385 175.307 0.078 1
1 1247 . 2 1 1 A 101 101 SER CA C 235 61.123 61.345 -0.222 1
1 1248 . 2 1 1 A 101 101 SER CB C 235 62.818 62.604 0.214 1
1 1249 . 2 1 1 A 101 101 SER N N 235 115.089 117.101 -2.012 1
1 1250 . 2 1 1 A 102 102 PHE H H 236 8.957 7.583 1.374 1
1 1251 . 2 1 1 A 102 102 PHE HA H 236 4.610 4.614 -0.004 1
1 1259 . 2 1 1 A 102 102 PHE C C 236 176.453 175.804 0.649 1
1 1260 . 2 1 1 A 102 102 PHE CA C 236 58.382 58.099 0.283 1
1 1261 . 2 1 1 A 102 102 PHE CB C 236 40.275 39.497 0.778 1
1 1263 . 2 1 1 A 102 102 PHE N N 236 119.917 117.651 2.266 1
1 1264 . 2 1 1 A 103 103 GLY H H 237 7.377 7.350 0.027 1
1 1265 . 2 1 1 A 103 103 GLY HA2 H 237 4.453 3.953 0.500 1
1 1266 . 2 1 1 A 103 103 GLY HA3 H 237 3.472 4.134 -0.662 1
1 1267 . 2 1 1 A 103 103 GLY C C 237 169.627 172.434 -2.807 1
1 1268 . 2 1 1 A 103 103 GLY CA C 237 45.384 44.606 0.778 1
1 1269 . 2 1 1 A 103 103 GLY N N 237 108.809 106.598 2.211 1
1 1270 . 2 1 1 A 104 104 TYR H H 238 8.632 8.595 0.037 1
1 1271 . 2 1 1 A 104 104 TYR HA H 238 5.322 5.614 -0.292 1
1 1278 . 2 1 1 A 104 104 TYR C C 238 175.043 175.216 -0.173 1
1 1279 . 2 1 1 A 104 104 TYR CA C 238 57.627 56.943 0.684 1
1 1280 . 2 1 1 A 104 104 TYR CB C 238 41.711 41.817 -0.106 1
1 1283 . 2 1 1 A 104 104 TYR N N 238 120.030 121.785 -1.755 1
1 1284 . 2 1 1 A 105 105 HIS H H 239 10.070 9.453 0.617 1
1 1285 . 2 1 1 A 105 105 HIS HA H 239 6.046 5.662 0.384 1
1 1290 . 2 1 1 A 105 105 HIS C C 239 175.734 174.827 0.907 1
1 1291 . 2 1 1 A 105 105 HIS CA C 239 53.945 54.303 -0.358 1
1 1292 . 2 1 1 A 105 105 HIS CB C 239 32.450 34.519 -2.069 1
1 1295 . 2 1 1 A 105 105 HIS N N 239 119.504 118.932 0.572 1
1 1296 . 2 1 1 A 106 106 ILE H H 240 8.660 9.082 -0.422 1
1 1297 . 2 1 1 A 106 106 ILE HA H 240 4.120 4.913 -0.793 1
1 1307 . 2 1 1 A 106 106 ILE C C 240 174.758 175.317 -0.559 1
1 1308 . 2 1 1 A 106 106 ILE CA C 240 63.446 60.019 3.427 1
1 1309 . 2 1 1 A 106 106 ILE CB C 240 40.786 41.720 -0.934 1
1 1313 . 2 1 1 A 106 106 ILE N N 240 120.639 120.198 0.441 1
1 1314 . 2 1 1 A 107 107 ILE H H 241 9.033 9.230 -0.197 1
1 1315 . 2 1 1 A 107 107 ILE HA H 241 4.799 5.157 -0.358 1
1 1325 . 2 1 1 A 107 107 ILE C C 241 172.880 173.919 -1.039 1
1 1326 . 2 1 1 A 107 107 ILE CA C 241 60.563 59.627 0.936 1
1 1327 . 2 1 1 A 107 107 ILE CB C 241 41.652 40.806 0.846 1
1 1331 . 2 1 1 A 107 107 ILE N N 241 129.098 127.004 2.094 1
1 1332 . 2 1 1 A 108 108 LYS H H 242 8.692 9.004 -0.312 1
1 1333 . 2 1 1 A 108 108 LYS HA H 242 5.012 4.913 0.099 1
1 1342 . 2 1 1 A 108 108 LYS C C 242 174.484 175.318 -0.834 1
1 1343 . 2 1 1 A 108 108 LYS CA C 242 54.317 54.014 0.303 1
1 1344 . 2 1 1 A 108 108 LYS CB C 242 35.619 35.109 0.510 1
1 1348 . 2 1 1 A 108 108 LYS N N 242 127.179 127.780 -0.601 1
1 1349 . 2 1 1 A 109 109 ALA H H 243 7.816 8.911 -1.095 1
1 1350 . 2 1 1 A 109 109 ALA HA H 243 4.604 4.690 -0.086 1
1 1354 . 2 1 1 A 109 109 ALA C C 243 176.231 176.497 -0.266 1
1 1355 . 2 1 1 A 109 109 ALA CA C 243 50.505 51.488 -0.983 1
1 1356 . 2 1 1 A 109 109 ALA CB C 243 19.584 19.499 0.085 1
1 1357 . 2 1 1 A 109 109 ALA N N 243 129.619 128.354 1.265 1
1 1358 . 2 1 1 A 110 110 ASP H H 244 7.578 8.873 -1.295 1
1 1359 . 2 1 1 A 110 110 ASP HA H 244 4.424 4.706 -0.282 1
1 1362 . 2 1 1 A 110 110 ASP C C 244 175.259 174.406 0.853 1
1 1363 . 2 1 1 A 110 110 ASP CA C 244 54.489 52.261 2.228 1
1 1364 . 2 1 1 A 110 110 ASP CB C 244 42.693 43.186 -0.493 1
1 1365 . 2 1 1 A 110 110 ASP N N 244 125.434 122.422 3.012 1
1 4 . 3 1 1 A 2 2 PRO HA H -4 4.403 4.476 -0.073 1
1 11 . 3 1 1 A 2 2 PRO C C -4 176.990 176.314 0.676 1
1 12 . 3 1 1 A 2 2 PRO CA C -4 63.131 62.442 0.689 1
1 13 . 3 1 1 A 2 2 PRO CB C -4 32.342 32.675 -0.333 1
1 16 . 3 1 1 A 3 3 LEU H H -3 8.483 8.389 0.094 1
1 17 . 3 1 1 A 3 3 LEU HA H -3 4.333 4.245 0.088 1
1 27 . 3 1 1 A 3 3 LEU C C -3 177.991 179.033 -1.042 1
1 28 . 3 1 1 A 3 3 LEU CA C -3 55.314 54.874 0.440 1
1 29 . 3 1 1 A 3 3 LEU CB C -3 42.244 42.241 0.003 1
1 33 . 3 1 1 A 3 3 LEU N N -3 122.986 121.191 1.795 1
1 34 . 3 1 1 A 4 4 GLY H H -2 8.397 8.576 -0.179 1
1 35 . 3 1 1 A 4 4 GLY HA2 H -2 4.024 3.833 0.191 1
1 36 . 3 1 1 A 4 4 GLY HA3 H -2 3.976 3.838 0.138 1
1 37 . 3 1 1 A 4 4 GLY C C -2 174.360 173.993 0.367 1
1 38 . 3 1 1 A 4 4 GLY CA C -2 45.434 46.020 -0.586 1
1 39 . 3 1 1 A 4 4 GLY N N -2 110.666 111.876 -1.210 1
1 56 . 3 1 1 A 7 7 SER H H 141 7.913 7.947 -0.034 1
1 57 . 3 1 1 A 7 7 SER HA H 141 5.657 4.833 0.824 1
1 60 . 3 1 1 A 7 7 SER C C 141 173.753 173.870 -0.117 1
1 61 . 3 1 1 A 7 7 SER CA C 141 56.758 57.891 -1.133 1
1 62 . 3 1 1 A 7 7 SER CB C 141 66.774 65.189 1.585 1
1 63 . 3 1 1 A 7 7 SER N N 141 113.824 111.417 2.407 1
1 64 . 3 1 1 A 8 8 LYS H H 142 8.656 8.309 0.347 1
1 65 . 3 1 1 A 8 8 LYS HA H 142 4.543 4.949 -0.406 1
1 74 . 3 1 1 A 8 8 LYS C C 142 174.403 174.680 -0.277 1
1 75 . 3 1 1 A 8 8 LYS CA C 142 55.578 54.280 1.298 1
1 76 . 3 1 1 A 8 8 LYS CB C 142 36.561 35.439 1.122 1
1 80 . 3 1 1 A 8 8 LYS N N 142 123.076 120.004 3.072 1
1 81 . 3 1 1 A 9 9 LYS H H 143 8.623 8.539 0.084 1
1 82 . 3 1 1 A 9 9 LYS HA H 143 4.119 4.494 -0.375 1
1 91 . 3 1 1 A 9 9 LYS C C 143 176.144 175.526 0.618 1
1 92 . 3 1 1 A 9 9 LYS CA C 143 56.683 55.864 0.819 1
1 93 . 3 1 1 A 9 9 LYS CB C 143 32.580 32.658 -0.078 1
1 97 . 3 1 1 A 9 9 LYS N N 143 129.542 123.144 6.398 1
1 98 . 3 1 1 A 10 10 ALA H H 144 8.151 8.785 -0.634 1
1 99 . 3 1 1 A 10 10 ALA HA H 144 5.208 4.781 0.427 1
1 103 . 3 1 1 A 10 10 ALA C C 144 175.577 175.135 0.442 1
1 104 . 3 1 1 A 10 10 ALA CA C 144 51.226 51.382 -0.156 1
1 105 . 3 1 1 A 10 10 ALA CB C 144 25.299 23.636 1.663 1
1 106 . 3 1 1 A 10 10 ALA N N 144 127.933 127.136 0.797 1
1 107 . 3 1 1 A 11 11 SER H H 145 8.679 8.792 -0.113 1
1 108 . 3 1 1 A 11 11 SER HA H 145 5.431 5.789 -0.358 1
1 111 . 3 1 1 A 11 11 SER C C 145 173.072 173.282 -0.210 1
1 112 . 3 1 1 A 11 11 SER CA C 145 57.772 57.021 0.751 1
1 113 . 3 1 1 A 11 11 SER CB C 145 67.301 66.237 1.064 1
1 114 . 3 1 1 A 11 11 SER N N 145 116.245 115.101 1.144 1
1 115 . 3 1 1 A 12 12 HIS H H 146 9.962 9.512 0.450 1
1 116 . 3 1 1 A 12 12 HIS HA H 146 6.332 6.008 0.324 1
1 121 . 3 1 1 A 12 12 HIS C C 146 173.006 172.483 0.523 1
1 122 . 3 1 1 A 12 12 HIS CA C 146 55.020 54.206 0.814 1
1 123 . 3 1 1 A 12 12 HIS CB C 146 37.071 34.075 2.996 1
1 126 . 3 1 1 A 12 12 HIS N N 146 119.181 118.240 0.941 1
1 127 . 3 1 1 A 13 13 ILE H H 147 8.976 9.055 -0.079 1
1 128 . 3 1 1 A 13 13 ILE HA H 147 3.528 4.534 -1.006 1
1 138 . 3 1 1 A 13 13 ILE C C 147 173.010 173.788 -0.778 1
1 139 . 3 1 1 A 13 13 ILE CA C 147 61.273 59.624 1.649 1
1 140 . 3 1 1 A 13 13 ILE CB C 147 41.773 41.318 0.455 1
1 144 . 3 1 1 A 13 13 ILE N N 147 121.873 119.369 2.504 1
1 145 . 3 1 1 A 14 14 LEU H H 148 7.627 8.828 -1.201 1
1 146 . 3 1 1 A 14 14 LEU HA H 148 4.814 4.780 0.034 1
1 156 . 3 1 1 A 14 14 LEU C C 148 174.112 174.357 -0.245 1
1 157 . 3 1 1 A 14 14 LEU CA C 148 52.574 52.817 -0.243 1
1 158 . 3 1 1 A 14 14 LEU CB C 148 45.643 44.599 1.044 1
1 162 . 3 1 1 A 14 14 LEU N N 148 127.112 129.662 -2.550 1
1 163 . 3 1 1 A 15 15 ILE H H 149 9.524 9.187 0.337 1
1 164 . 3 1 1 A 15 15 ILE HA H 149 4.362 4.520 -0.158 1
1 174 . 3 1 1 A 15 15 ILE C C 149 175.452 175.683 -0.231 1
1 175 . 3 1 1 A 15 15 ILE CA C 149 58.516 60.505 -1.989 1
1 176 . 3 1 1 A 15 15 ILE CB C 149 36.560 37.955 -1.395 1
1 180 . 3 1 1 A 15 15 ILE N N 149 128.652 128.211 0.441 1
1 181 . 3 1 1 A 16 16 LYS H H 150 8.035 8.603 -0.568 1
1 182 . 3 1 1 A 16 16 LYS HA H 150 4.319 4.291 0.028 1
1 191 . 3 1 1 A 16 16 LYS C C 150 175.038 176.481 -1.443 1
1 192 . 3 1 1 A 16 16 LYS CA C 150 57.817 56.689 1.128 1
1 193 . 3 1 1 A 16 16 LYS CB C 150 34.853 32.617 2.236 1
1 197 . 3 1 1 A 16 16 LYS N N 150 129.153 127.960 1.193 1
1 198 . 3 1 1 A 17 17 VAL H H 151 8.016 9.068 -1.052 1
1 199 . 3 1 1 A 17 17 VAL HA H 151 4.873 4.902 -0.029 1
1 207 . 3 1 1 A 17 17 VAL C C 151 176.647 175.385 1.262 1
1 208 . 3 1 1 A 17 17 VAL CA C 151 60.088 61.633 -1.545 1
1 209 . 3 1 1 A 17 17 VAL CB C 151 34.082 33.154 0.928 1
1 212 . 3 1 1 A 17 17 VAL N N 151 121.288 125.110 -3.822 1
1 213 . 3 1 1 A 18 18 LYS H H 152 8.443 9.019 -0.576 1
1 214 . 3 1 1 A 18 18 LYS HA H 152 4.334 4.699 -0.365 1
1 223 . 3 1 1 A 18 18 LYS C C 152 176.345 177.824 -1.479 1
1 224 . 3 1 1 A 18 18 LYS CA C 152 57.016 54.527 2.489 1
1 225 . 3 1 1 A 18 18 LYS CB C 152 33.222 34.678 -1.456 1
1 229 . 3 1 1 A 18 18 LYS N N 152 128.408 127.396 1.012 1
1 230 . 3 1 1 A 19 19 SER H H 153 9.067 8.675 0.392 1
1 231 . 3 1 1 A 19 19 SER HA H 153 4.457 4.269 0.188 1
1 234 . 3 1 1 A 19 19 SER C C 153 174.236 174.198 0.038 1
1 235 . 3 1 1 A 19 19 SER CA C 153 59.642 60.569 -0.927 1
1 236 . 3 1 1 A 19 19 SER CB C 153 64.347 63.373 0.974 1
1 237 . 3 1 1 A 19 19 SER N N 153 121.522 115.724 5.798 1
1 238 . 3 1 1 A 20 20 LYS H H 154 7.961 7.672 0.289 1
1 239 . 3 1 1 A 20 20 LYS HA H 154 4.558 4.591 -0.033 1
1 244 . 3 1 1 A 20 20 LYS C C 154 177.256 176.133 1.123 1
1 245 . 3 1 1 A 20 20 LYS CA C 154 55.249 55.694 -0.445 1
1 246 . 3 1 1 A 20 20 LYS CB C 154 34.531 36.178 -1.647 1
1 248 . 3 1 1 A 20 20 LYS N N 154 120.270 120.247 0.023 1
1 249 . 3 1 1 A 21 21 LYS HA H 155 4.003 3.971 0.032 1
1 258 . 3 1 1 A 21 21 LYS C C 155 177.015 178.092 -1.077 1
1 259 . 3 1 1 A 21 21 LYS CA C 155 59.091 58.999 0.092 1
1 260 . 3 1 1 A 21 21 LYS CB C 155 32.394 32.171 0.223 1
1 264 . 3 1 1 A 22 22 SER H H 156 7.625 8.068 -0.443 1
1 265 . 3 1 1 A 22 22 SER HA H 156 4.293 4.322 -0.029 1
1 268 . 3 1 1 A 22 22 SER C C 156 174.843 175.421 -0.578 1
1 269 . 3 1 1 A 22 22 SER CA C 156 57.966 61.481 -3.515 1
1 270 . 3 1 1 A 22 22 SER CB C 156 63.369 63.175 0.194 1
1 271 . 3 1 1 A 22 22 SER N N 156 109.549 117.430 -7.881 1
1 272 . 3 1 1 A 23 23 ASP H H 157 7.701 7.778 -0.077 1
1 273 . 3 1 1 A 23 23 ASP HA H 157 4.548 4.627 -0.079 1
1 276 . 3 1 1 A 23 23 ASP C C 157 176.544 175.888 0.656 1
1 277 . 3 1 1 A 23 23 ASP CA C 157 55.242 55.964 -0.722 1
1 278 . 3 1 1 A 23 23 ASP CB C 157 41.103 41.422 -0.319 1
1 279 . 3 1 1 A 23 23 ASP N N 157 124.536 120.143 4.393 1
1 280 . 3 1 1 A 24 24 LYS H H 158 8.583 7.757 0.826 1
1 281 . 3 1 1 A 24 24 LYS HA H 158 4.252 3.944 0.308 1
1 290 . 3 1 1 A 24 24 LYS C C 158 176.813 176.357 0.456 1
1 291 . 3 1 1 A 24 24 LYS CA C 158 57.148 58.053 -0.905 1
1 292 . 3 1 1 A 24 24 LYS CB C 158 33.200 30.201 2.999 1
1 296 . 3 1 1 A 24 24 LYS N N 158 122.372 117.124 5.248 1
1 297 . 3 1 1 A 25 25 GLU H H 159 8.001 8.170 -0.169 1
1 298 . 3 1 1 A 25 25 GLU HA H 159 4.521 4.082 0.439 1
1 303 . 3 1 1 A 25 25 GLU C C 159 175.995 176.268 -0.273 1
1 304 . 3 1 1 A 25 25 GLU CA C 159 55.727 58.982 -3.255 1
1 305 . 3 1 1 A 25 25 GLU CB C 159 31.918 30.753 1.165 1
1 307 . 3 1 1 A 25 25 GLU N N 159 118.705 119.308 -0.603 1
1 308 . 3 1 1 A 26 26 GLY H H 160 8.458 7.636 0.822 1
1 309 . 3 1 1 A 26 26 GLY HA2 H 160 3.946 4.043 -0.097 1
1 310 . 3 1 1 A 26 26 GLY HA3 H 160 3.511 4.054 -0.543 1
1 311 . 3 1 1 A 26 26 GLY C C 160 172.201 172.383 -0.182 1
1 312 . 3 1 1 A 26 26 GLY CA C 160 44.038 45.235 -1.197 1
1 313 . 3 1 1 A 26 26 GLY N N 160 107.642 106.880 0.762 1
1 314 . 3 1 1 A 27 27 LEU H H 161 8.259 8.768 -0.509 1
1 315 . 3 1 1 A 27 27 LEU HA H 161 4.775 4.852 -0.077 1
1 325 . 3 1 1 A 27 27 LEU C C 161 177.422 175.420 2.002 1
1 326 . 3 1 1 A 27 27 LEU CA C 161 53.322 53.364 -0.042 1
1 327 . 3 1 1 A 27 27 LEU CB C 161 45.576 43.014 2.562 1
1 331 . 3 1 1 A 27 27 LEU N N 161 119.856 122.086 -2.230 1
1 332 . 3 1 1 A 28 28 ASP H H 162 8.848 8.478 0.370 1
1 333 . 3 1 1 A 28 28 ASP HA H 162 4.644 4.751 -0.107 1
1 336 . 3 1 1 A 28 28 ASP C C 162 176.630 176.914 -0.284 1
1 337 . 3 1 1 A 28 28 ASP CA C 162 55.195 54.224 0.971 1
1 338 . 3 1 1 A 28 28 ASP CB C 162 41.673 42.563 -0.890 1
1 339 . 3 1 1 A 28 28 ASP N N 162 122.434 121.233 1.201 1
1 340 . 3 1 1 A 29 29 ASP H H 163 8.720 9.132 -0.412 1
1 341 . 3 1 1 A 29 29 ASP HA H 163 4.386 4.348 0.038 1
1 344 . 3 1 1 A 29 29 ASP C C 163 176.604 177.924 -1.320 1
1 345 . 3 1 1 A 29 29 ASP CA C 163 59.690 58.580 1.110 1
1 346 . 3 1 1 A 29 29 ASP CB C 163 42.964 41.583 1.381 1
1 347 . 3 1 1 A 29 29 ASP N N 163 121.460 126.367 -4.907 1
1 348 . 3 1 1 A 30 30 LYS H H 164 8.434 7.621 0.813 1
1 349 . 3 1 1 A 30 30 LYS HA H 164 3.901 3.975 -0.074 1
1 358 . 3 1 1 A 30 30 LYS C C 164 179.479 179.260 0.219 1
1 359 . 3 1 1 A 30 30 LYS CA C 164 60.047 59.303 0.744 1
1 360 . 3 1 1 A 30 30 LYS CB C 164 32.038 32.182 -0.144 1
1 364 . 3 1 1 A 30 30 LYS N N 164 116.627 119.542 -2.915 1
1 365 . 3 1 1 A 31 31 GLU H H 165 7.755 8.235 -0.480 1
1 366 . 3 1 1 A 31 31 GLU HA H 165 3.998 4.007 -0.009 1
1 371 . 3 1 1 A 31 31 GLU C C 165 179.031 179.155 -0.124 1
1 372 . 3 1 1 A 31 31 GLU CA C 165 59.335 59.175 0.160 1
1 373 . 3 1 1 A 31 31 GLU CB C 165 29.972 29.393 0.579 1
1 375 . 3 1 1 A 31 31 GLU N N 165 120.456 119.844 0.612 1
1 376 . 3 1 1 A 32 32 ALA H H 166 9.060 8.377 0.683 1
1 377 . 3 1 1 A 32 32 ALA HA H 166 3.871 3.984 -0.113 1
1 381 . 3 1 1 A 32 32 ALA C C 166 178.029 179.031 -1.002 1
1 382 . 3 1 1 A 32 32 ALA CA C 166 54.997 55.492 -0.495 1
1 383 . 3 1 1 A 32 32 ALA CB C 166 19.727 18.382 1.345 1
1 384 . 3 1 1 A 32 32 ALA N N 166 124.406 122.205 2.201 1
1 385 . 3 1 1 A 33 33 LYS H H 167 8.228 7.824 0.404 1
1 386 . 3 1 1 A 33 33 LYS HA H 167 2.595 3.021 -0.426 1
1 395 . 3 1 1 A 33 33 LYS C C 167 177.938 178.391 -0.453 1
1 396 . 3 1 1 A 33 33 LYS CA C 167 59.573 59.357 0.216 1
1 397 . 3 1 1 A 33 33 LYS CB C 167 32.098 32.004 0.094 1
1 401 . 3 1 1 A 33 33 LYS N N 167 119.833 118.046 1.787 1
1 402 . 3 1 1 A 34 34 GLN H H 168 7.392 7.536 -0.144 1
1 403 . 3 1 1 A 34 34 GLN HA H 168 3.943 3.901 0.042 1
1 410 . 3 1 1 A 34 34 GLN C C 168 178.323 178.430 -0.107 1
1 411 . 3 1 1 A 34 34 GLN CA C 168 58.883 59.357 -0.474 1
1 412 . 3 1 1 A 34 34 GLN CB C 168 28.485 28.115 0.370 1
1 414 . 3 1 1 A 34 34 GLN N N 168 117.208 118.203 -0.995 1
1 416 . 3 1 1 A 35 35 LYS H H 169 7.994 7.871 0.123 1
1 417 . 3 1 1 A 35 35 LYS HA H 169 4.067 4.009 0.058 1
1 426 . 3 1 1 A 35 35 LYS C C 169 178.161 178.524 -0.363 1
1 427 . 3 1 1 A 35 35 LYS CA C 169 58.437 59.159 -0.722 1
1 428 . 3 1 1 A 35 35 LYS CB C 169 31.611 32.172 -0.561 1
1 432 . 3 1 1 A 35 35 LYS N N 169 120.898 119.945 0.953 1
1 433 . 3 1 1 A 36 36 ALA H H 170 8.431 8.350 0.081 1
1 434 . 3 1 1 A 36 36 ALA HA H 170 3.738 4.057 -0.319 1
1 438 . 3 1 1 A 36 36 ALA C C 170 178.862 180.070 -1.208 1
1 439 . 3 1 1 A 36 36 ALA CA C 170 55.351 54.959 0.392 1
1 440 . 3 1 1 A 36 36 ALA CB C 170 18.295 18.505 -0.210 1
1 441 . 3 1 1 A 36 36 ALA N N 170 120.641 120.227 0.414 1
1 442 . 3 1 1 A 37 37 GLU H H 171 8.412 7.893 0.519 1
1 443 . 3 1 1 A 37 37 GLU HA H 171 3.867 3.994 -0.127 1
1 448 . 3 1 1 A 37 37 GLU C C 171 179.255 179.291 -0.036 1
1 449 . 3 1 1 A 37 37 GLU CA C 171 59.543 59.533 0.010 1
1 450 . 3 1 1 A 37 37 GLU CB C 171 29.569 29.059 0.510 1
1 452 . 3 1 1 A 37 37 GLU N N 171 118.224 117.889 0.335 1
1 453 . 3 1 1 A 38 38 GLU H H 172 8.019 7.543 0.476 1
1 454 . 3 1 1 A 38 38 GLU HA H 172 3.952 4.066 -0.114 1
1 459 . 3 1 1 A 38 38 GLU C C 172 180.250 179.392 0.858 1
1 460 . 3 1 1 A 38 38 GLU CA C 172 59.627 58.981 0.646 1
1 461 . 3 1 1 A 38 38 GLU CB C 172 29.368 29.567 -0.199 1
1 463 . 3 1 1 A 38 38 GLU N N 172 121.250 119.896 1.354 1
1 464 . 3 1 1 A 39 39 ILE H H 173 8.174 7.464 0.710 1
1 465 . 3 1 1 A 39 39 ILE HA H 173 3.643 3.802 -0.159 1
1 475 . 3 1 1 A 39 39 ILE C C 173 177.568 177.880 -0.312 1
1 476 . 3 1 1 A 39 39 ILE CA C 173 64.869 63.584 1.285 1
1 477 . 3 1 1 A 39 39 ILE CB C 173 38.160 37.255 0.905 1
1 481 . 3 1 1 A 39 39 ILE N N 173 121.527 118.243 3.284 1
1 482 . 3 1 1 A 40 40 GLN H H 174 8.860 8.341 0.519 1
1 483 . 3 1 1 A 40 40 GLN HA H 174 3.533 3.974 -0.441 1
1 490 . 3 1 1 A 40 40 GLN C C 174 179.022 178.475 0.547 1
1 491 . 3 1 1 A 40 40 GLN CA C 174 61.316 59.223 2.093 1
1 492 . 3 1 1 A 40 40 GLN CB C 174 26.604 28.179 -1.575 1
1 494 . 3 1 1 A 40 40 GLN N N 174 121.956 121.136 0.820 1
1 496 . 3 1 1 A 41 41 LYS H H 175 7.879 7.513 0.366 1
1 497 . 3 1 1 A 41 41 LYS HA H 175 3.777 4.132 -0.355 1
1 506 . 3 1 1 A 41 41 LYS C C 175 178.779 179.625 -0.846 1
1 507 . 3 1 1 A 41 41 LYS CA C 175 59.701 59.566 0.135 1
1 508 . 3 1 1 A 41 41 LYS CB C 175 32.581 31.952 0.629 1
1 512 . 3 1 1 A 41 41 LYS N N 175 119.012 118.953 0.059 1
1 513 . 3 1 1 A 42 42 GLU H H 176 7.447 7.589 -0.142 1
1 514 . 3 1 1 A 42 42 GLU HA H 176 4.059 4.130 -0.071 1
1 519 . 3 1 1 A 42 42 GLU C C 176 180.058 178.611 1.447 1
1 520 . 3 1 1 A 42 42 GLU CA C 176 59.456 59.100 0.356 1
1 521 . 3 1 1 A 42 42 GLU CB C 176 29.923 29.299 0.624 1
1 523 . 3 1 1 A 42 42 GLU N N 176 120.054 120.227 -0.173 1
1 524 . 3 1 1 A 43 43 VAL H H 177 8.618 8.093 0.525 1
1 525 . 3 1 1 A 43 43 VAL HA H 177 3.986 3.872 0.114 1
1 533 . 3 1 1 A 43 43 VAL C C 177 176.459 178.221 -1.762 1
1 534 . 3 1 1 A 43 43 VAL CA C 177 63.923 64.778 -0.855 1
1 535 . 3 1 1 A 43 43 VAL CB C 177 31.899 31.573 0.326 1
1 538 . 3 1 1 A 43 43 VAL N N 177 114.191 117.172 -2.981 1
1 539 . 3 1 1 A 44 44 SER H H 178 8.052 8.031 0.021 1
1 540 . 3 1 1 A 44 44 SER HA H 178 4.098 4.197 -0.099 1
1 543 . 3 1 1 A 44 44 SER C C 178 176.548 176.478 0.070 1
1 544 . 3 1 1 A 44 44 SER CA C 178 61.160 61.223 -0.063 1
1 545 . 3 1 1 A 44 44 SER CB C 178 62.959 63.106 -0.147 1
1 546 . 3 1 1 A 44 44 SER N N 178 114.202 117.328 -3.126 1
1 547 . 3 1 1 A 45 45 LYS H H 179 7.083 7.883 -0.800 1
1 548 . 3 1 1 A 45 45 LYS HA H 179 4.140 4.183 -0.043 1
1 557 . 3 1 1 A 45 45 LYS C C 179 177.288 176.169 1.119 1
1 558 . 3 1 1 A 45 45 LYS CA C 179 58.469 57.976 0.493 1
1 559 . 3 1 1 A 45 45 LYS CB C 179 32.671 31.454 1.217 1
1 563 . 3 1 1 A 45 45 LYS N N 179 120.935 117.204 3.731 1
1 564 . 3 1 1 A 46 46 ASP H H 180 7.098 7.872 -0.774 1
1 565 . 3 1 1 A 46 46 ASP HA H 180 4.917 4.960 -0.043 1
1 568 . 3 1 1 A 46 46 ASP CA C 180 51.492 51.790 -0.298 1
1 569 . 3 1 1 A 46 46 ASP CB C 180 40.595 41.375 -0.780 1
1 570 . 3 1 1 A 46 46 ASP N N 180 112.836 119.931 -7.095 1
1 571 . 3 1 1 A 47 47 PRO HA H 181 4.681 4.559 0.122 1
1 578 . 3 1 1 A 47 47 PRO C C 181 179.248 177.636 1.612 1
1 579 . 3 1 1 A 47 47 PRO CA C 181 64.718 64.305 0.413 1
1 580 . 3 1 1 A 47 47 PRO CB C 181 32.159 31.930 0.229 1
1 583 . 3 1 1 A 48 48 SER H H 182 8.248 7.939 0.309 1
1 584 . 3 1 1 A 48 48 SER HA H 182 4.378 4.319 0.059 1
1 587 . 3 1 1 A 48 48 SER C C 182 176.071 175.496 0.575 1
1 588 . 3 1 1 A 48 48 SER CA C 182 61.377 60.822 0.555 1
1 589 . 3 1 1 A 48 48 SER CB C 182 62.455 63.148 -0.693 1
1 590 . 3 1 1 A 48 48 SER N N 182 116.986 113.285 3.701 1
1 591 . 3 1 1 A 49 49 LYS H H 183 7.842 7.328 0.514 1
1 592 . 3 1 1 A 49 49 LYS HA H 183 4.482 4.290 0.192 1
1 601 . 3 1 1 A 49 49 LYS C C 183 175.605 177.501 -1.896 1
1 602 . 3 1 1 A 49 49 LYS CA C 183 55.824 57.045 -1.221 1
1 603 . 3 1 1 A 49 49 LYS CB C 183 32.834 32.594 0.240 1
1 607 . 3 1 1 A 49 49 LYS N N 183 121.698 119.732 1.966 1
1 608 . 3 1 1 A 50 50 PHE H H 184 7.634 7.742 -0.108 1
1 609 . 3 1 1 A 50 50 PHE HA H 184 3.510 4.223 -0.713 1
1 617 . 3 1 1 A 50 50 PHE C C 184 176.214 177.527 -1.313 1
1 618 . 3 1 1 A 50 50 PHE CA C 184 63.276 60.996 2.280 1
1 619 . 3 1 1 A 50 50 PHE CB C 184 40.948 39.043 1.905 1
1 623 . 3 1 1 A 50 50 PHE N N 184 120.120 121.590 -1.470 1
1 624 . 3 1 1 A 51 51 GLY H H 185 8.855 8.549 0.306 1
1 625 . 3 1 1 A 51 51 GLY HA2 H 185 3.993 3.859 0.134 1
1 626 . 3 1 1 A 51 51 GLY HA3 H 185 3.958 3.873 0.085 1
1 627 . 3 1 1 A 51 51 GLY C C 185 175.169 176.205 -1.036 1
1 628 . 3 1 1 A 51 51 GLY CA C 185 47.475 47.514 -0.039 1
1 629 . 3 1 1 A 51 51 GLY N N 185 105.550 106.237 -0.687 1
1 630 . 3 1 1 A 52 52 GLU H H 186 7.917 7.952 -0.035 1
1 631 . 3 1 1 A 52 52 GLU HA H 186 4.006 4.042 -0.036 1
1 636 . 3 1 1 A 52 52 GLU C C 186 179.499 179.166 0.333 1
1 637 . 3 1 1 A 52 52 GLU CA C 186 58.904 59.040 -0.136 1
1 638 . 3 1 1 A 52 52 GLU CB C 186 29.700 29.306 0.394 1
1 640 . 3 1 1 A 52 52 GLU N N 186 121.929 121.620 0.309 1
1 641 . 3 1 1 A 53 53 ILE H H 187 7.936 7.645 0.291 1
1 642 . 3 1 1 A 53 53 ILE HA H 187 3.648 3.696 -0.048 1
1 652 . 3 1 1 A 53 53 ILE C C 187 177.886 177.965 -0.079 1
1 653 . 3 1 1 A 53 53 ILE CA C 187 64.366 64.668 -0.302 1
1 654 . 3 1 1 A 53 53 ILE CB C 187 36.478 37.493 -1.015 1
1 658 . 3 1 1 A 53 53 ILE N N 187 120.991 122.237 -1.246 1
1 659 . 3 1 1 A 54 54 ALA H H 188 8.895 8.565 0.330 1
1 660 . 3 1 1 A 54 54 ALA HA H 188 3.629 3.732 -0.103 1
1 664 . 3 1 1 A 54 54 ALA C C 188 179.437 179.265 0.172 1
1 665 . 3 1 1 A 54 54 ALA CA C 188 55.974 55.473 0.501 1
1 666 . 3 1 1 A 54 54 ALA CB C 188 17.591 18.282 -0.691 1
1 667 . 3 1 1 A 54 54 ALA N N 188 125.308 122.230 3.078 1
1 668 . 3 1 1 A 55 55 LYS H H 189 8.049 7.671 0.378 1
1 669 . 3 1 1 A 55 55 LYS HA H 189 4.106 3.892 0.214 1
1 678 . 3 1 1 A 55 55 LYS C C 189 178.995 178.111 0.884 1
1 679 . 3 1 1 A 55 55 LYS CA C 189 59.312 59.140 0.172 1
1 680 . 3 1 1 A 55 55 LYS CB C 189 32.647 31.894 0.753 1
1 684 . 3 1 1 A 55 55 LYS N N 189 116.835 118.198 -1.363 1
1 685 . 3 1 1 A 56 56 LYS H H 190 7.215 7.813 -0.598 1
1 686 . 3 1 1 A 56 56 LYS HA H 190 4.172 4.307 -0.135 1
1 695 . 3 1 1 A 56 56 LYS C C 190 177.897 178.100 -0.203 1
1 696 . 3 1 1 A 56 56 LYS CA C 190 58.418 57.796 0.622 1
1 697 . 3 1 1 A 56 56 LYS CB C 190 34.652 33.342 1.310 1
1 701 . 3 1 1 A 56 56 LYS N N 190 117.170 118.007 -0.837 1
1 702 . 3 1 1 A 57 57 GLU H H 191 8.572 7.840 0.732 1
1 703 . 3 1 1 A 57 57 GLU HA H 191 4.643 4.357 0.286 1
1 708 . 3 1 1 A 57 57 GLU C C 191 177.903 176.070 1.833 1
1 709 . 3 1 1 A 57 57 GLU CA C 191 55.708 56.108 -0.400 1
1 710 . 3 1 1 A 57 57 GLU CB C 191 32.460 30.598 1.862 1
1 712 . 3 1 1 A 57 57 GLU N N 191 113.316 116.880 -3.564 1
1 713 . 3 1 1 A 58 58 SER H H 192 8.550 7.673 0.877 1
1 714 . 3 1 1 A 58 58 SER HA H 192 4.149 4.432 -0.283 1
1 717 . 3 1 1 A 58 58 SER C C 192 176.161 175.370 0.791 1
1 718 . 3 1 1 A 58 58 SER CA C 192 58.403 57.779 0.624 1
1 719 . 3 1 1 A 58 58 SER CB C 192 64.392 64.295 0.097 1
1 720 . 3 1 1 A 58 58 SER N N 192 109.861 116.115 -6.254 1
1 721 . 3 1 1 A 59 59 MET H H 193 9.533 8.811 0.722 1
1 722 . 3 1 1 A 59 59 MET HA H 193 4.457 4.681 -0.224 1
1 730 . 3 1 1 A 59 59 MET C C 193 175.204 175.583 -0.379 1
1 731 . 3 1 1 A 59 59 MET CA C 193 55.781 54.432 1.349 1
1 732 . 3 1 1 A 59 59 MET CB C 193 32.855 31.731 1.124 1
1 735 . 3 1 1 A 59 59 MET N N 193 124.493 124.357 0.136 1
1 736 . 3 1 1 A 60 60 ASP H H 194 7.514 7.409 0.105 1
1 737 . 3 1 1 A 60 60 ASP HA H 194 4.886 4.565 0.321 1
1 740 . 3 1 1 A 60 60 ASP C C 194 175.517 176.717 -1.200 1
1 741 . 3 1 1 A 60 60 ASP CA C 194 52.286 53.540 -1.254 1
1 742 . 3 1 1 A 60 60 ASP CB C 194 40.222 40.684 -0.462 1
1 743 . 3 1 1 A 60 60 ASP N N 194 117.785 122.395 -4.610 1
1 744 . 3 1 1 A 61 61 THR H H 195 8.118 8.283 -0.165 1
1 745 . 3 1 1 A 61 61 THR HA H 195 3.918 3.945 -0.027 1
1 750 . 3 1 1 A 61 61 THR C C 195 176.269 176.874 -0.605 1
1 751 . 3 1 1 A 61 61 THR CA C 195 65.469 65.215 0.254 1
1 752 . 3 1 1 A 61 61 THR CB C 195 68.741 68.431 0.310 1
1 754 . 3 1 1 A 61 61 THR N N 195 120.765 118.724 2.041 1
1 755 . 3 1 1 A 62 62 GLY H H 196 8.399 8.443 -0.044 1
1 756 . 3 1 1 A 62 62 GLY HA2 H 196 3.932 3.846 0.086 1
1 757 . 3 1 1 A 62 62 GLY HA3 H 196 3.900 3.846 0.054 1
1 758 . 3 1 1 A 62 62 GLY C C 196 174.948 175.758 -0.810 1
1 759 . 3 1 1 A 62 62 GLY CA C 196 46.768 46.823 -0.055 1
1 760 . 3 1 1 A 62 62 GLY N N 196 108.183 111.340 -3.157 1
1 761 . 3 1 1 A 63 63 SER H H 197 7.265 8.139 -0.874 1
1 762 . 3 1 1 A 63 63 SER HA H 197 4.554 4.309 0.245 1
1 765 . 3 1 1 A 63 63 SER C C 197 177.630 177.107 0.523 1
1 766 . 3 1 1 A 63 63 SER CA C 197 59.550 61.021 -1.471 1
1 767 . 3 1 1 A 63 63 SER CB C 197 65.504 63.029 2.475 1
1 768 . 3 1 1 A 63 63 SER N N 197 111.815 116.820 -5.005 1
1 769 . 3 1 1 A 64 64 ALA H H 198 8.675 8.545 0.130 1
1 770 . 3 1 1 A 64 64 ALA HA H 198 3.801 3.959 -0.158 1
1 774 . 3 1 1 A 64 64 ALA C C 198 178.492 179.537 -1.045 1
1 775 . 3 1 1 A 64 64 ALA CA C 198 56.794 55.378 1.416 1
1 776 . 3 1 1 A 64 64 ALA CB C 198 18.951 18.563 0.388 1
1 777 . 3 1 1 A 64 64 ALA N N 198 131.710 123.793 7.917 1
1 778 . 3 1 1 A 65 65 LYS H H 199 7.666 7.710 -0.044 1
1 779 . 3 1 1 A 65 65 LYS HA H 199 4.175 4.137 0.038 1
1 788 . 3 1 1 A 65 65 LYS C C 199 177.159 176.879 0.280 1
1 789 . 3 1 1 A 65 65 LYS CA C 199 57.735 58.604 -0.869 1
1 790 . 3 1 1 A 65 65 LYS CB C 199 31.948 31.419 0.529 1
1 794 . 3 1 1 A 65 65 LYS N N 199 111.375 115.706 -4.331 1
1 795 . 3 1 1 A 66 66 LYS H H 200 7.545 7.611 -0.066 1
1 796 . 3 1 1 A 66 66 LYS HA H 200 4.612 4.502 0.110 1
1 805 . 3 1 1 A 66 66 LYS C C 200 175.609 175.927 -0.318 1
1 806 . 3 1 1 A 66 66 LYS CA C 200 54.468 55.383 -0.915 1
1 807 . 3 1 1 A 66 66 LYS CB C 200 31.525 32.655 -1.130 1
1 811 . 3 1 1 A 66 66 LYS N N 200 121.421 119.434 1.987 1
1 812 . 3 1 1 A 67 67 ASP H H 201 7.630 8.188 -0.558 1
1 813 . 3 1 1 A 67 67 ASP HA H 201 4.306 4.354 -0.048 1
1 816 . 3 1 1 A 67 67 ASP C C 201 175.025 176.281 -1.256 1
1 817 . 3 1 1 A 67 67 ASP CA C 201 56.400 55.358 1.042 1
1 818 . 3 1 1 A 67 67 ASP CB C 201 38.315 39.056 -0.741 1
1 819 . 3 1 1 A 67 67 ASP N N 201 116.216 116.405 -0.189 1
1 820 . 3 1 1 A 68 68 GLY H H 202 8.368 8.632 -0.264 1
1 821 . 3 1 1 A 68 68 GLY HA2 H 202 4.316 3.922 0.394 1
1 822 . 3 1 1 A 68 68 GLY HA3 H 202 3.731 4.016 -0.285 1
1 823 . 3 1 1 A 68 68 GLY C C 202 174.139 174.387 -0.248 1
1 824 . 3 1 1 A 68 68 GLY CA C 202 45.514 45.376 0.138 1
1 825 . 3 1 1 A 68 68 GLY N N 202 105.095 105.037 0.058 1
1 826 . 3 1 1 A 69 69 GLU H H 203 7.534 7.641 -0.107 1
1 827 . 3 1 1 A 69 69 GLU HA H 203 4.479 4.498 -0.019 1
1 832 . 3 1 1 A 69 69 GLU C C 203 176.961 176.522 0.439 1
1 833 . 3 1 1 A 69 69 GLU CA C 203 58.549 56.960 1.589 1
1 834 . 3 1 1 A 69 69 GLU CB C 203 30.998 30.398 0.600 1
1 836 . 3 1 1 A 69 69 GLU N N 203 120.426 120.809 -0.383 1
1 837 . 3 1 1 A 70 70 LEU H H 204 8.962 8.805 0.157 1
1 838 . 3 1 1 A 70 70 LEU HA H 204 4.438 4.648 -0.210 1
1 848 . 3 1 1 A 70 70 LEU C C 204 178.648 177.377 1.271 1
1 849 . 3 1 1 A 70 70 LEU CA C 204 53.977 55.223 -1.246 1
1 850 . 3 1 1 A 70 70 LEU CB C 204 43.612 43.667 -0.055 1
1 854 . 3 1 1 A 70 70 LEU N N 204 122.066 125.801 -3.735 1
1 855 . 3 1 1 A 71 71 GLY H H 205 8.104 7.769 0.335 1
1 856 . 3 1 1 A 71 71 GLY HA2 H 205 4.165 4.056 0.109 1
1 857 . 3 1 1 A 71 71 GLY HA3 H 205 3.552 4.145 -0.593 1
1 858 . 3 1 1 A 71 71 GLY C C 205 173.098 173.408 -0.310 1
1 859 . 3 1 1 A 71 71 GLY CA C 205 44.723 45.167 -0.444 1
1 860 . 3 1 1 A 71 71 GLY N N 205 110.168 106.801 3.367 1
1 861 . 3 1 1 A 72 72 TYR H H 206 8.457 8.665 -0.208 1
1 862 . 3 1 1 A 72 72 TYR HA H 206 4.184 4.808 -0.624 1
1 869 . 3 1 1 A 72 72 TYR C C 206 175.975 175.558 0.417 1
1 870 . 3 1 1 A 72 72 TYR CA C 206 59.722 59.308 0.414 1
1 871 . 3 1 1 A 72 72 TYR CB C 206 38.378 38.413 -0.035 1
1 874 . 3 1 1 A 72 72 TYR N N 206 120.171 122.500 -2.329 1
1 875 . 3 1 1 A 73 73 VAL H H 207 8.782 9.217 -0.435 1
1 876 . 3 1 1 A 73 73 VAL HA H 207 4.056 4.513 -0.457 1
1 884 . 3 1 1 A 73 73 VAL C C 207 174.901 175.867 -0.966 1
1 885 . 3 1 1 A 73 73 VAL CA C 207 62.202 62.690 -0.488 1
1 886 . 3 1 1 A 73 73 VAL CB C 207 33.071 32.120 0.951 1
1 889 . 3 1 1 A 73 73 VAL N N 207 128.847 125.200 3.647 1
1 890 . 3 1 1 A 74 74 LEU H H 208 8.146 8.753 -0.607 1
1 891 . 3 1 1 A 74 74 LEU HA H 208 4.944 4.435 0.509 1
1 901 . 3 1 1 A 74 74 LEU C C 208 178.400 177.544 0.856 1
1 902 . 3 1 1 A 74 74 LEU CA C 208 53.520 54.759 -1.239 1
1 903 . 3 1 1 A 74 74 LEU CB C 208 43.499 42.397 1.102 1
1 907 . 3 1 1 A 74 74 LEU N N 208 127.599 129.397 -1.798 1
1 908 . 3 1 1 A 75 75 LYS H H 209 8.403 8.806 -0.403 1
1 909 . 3 1 1 A 75 75 LYS HA H 209 3.771 3.905 -0.134 1
1 918 . 3 1 1 A 75 75 LYS C C 209 177.536 177.504 0.032 1
1 919 . 3 1 1 A 75 75 LYS CA C 209 58.385 58.956 -0.571 1
1 920 . 3 1 1 A 75 75 LYS CB C 209 32.459 32.124 0.335 1
1 924 . 3 1 1 A 75 75 LYS N N 209 123.798 122.861 0.937 1
1 925 . 3 1 1 A 76 76 GLY H H 210 9.997 9.383 0.614 1
1 926 . 3 1 1 A 76 76 GLY HA2 H 210 4.255 4.003 0.252 1
1 927 . 3 1 1 A 76 76 GLY HA3 H 210 3.791 4.007 -0.216 1
1 928 . 3 1 1 A 76 76 GLY C C 210 175.091 175.453 -0.362 1
1 929 . 3 1 1 A 76 76 GLY CA C 210 45.465 45.602 -0.137 1
1 930 . 3 1 1 A 76 76 GLY N N 210 114.705 113.300 1.405 1
1 931 . 3 1 1 A 77 77 GLN H H 211 7.726 7.868 -0.142 1
1 932 . 3 1 1 A 77 77 GLN HA H 211 4.373 4.212 0.161 1
1 939 . 3 1 1 A 77 77 GLN C C 211 176.301 175.935 0.366 1
1 940 . 3 1 1 A 77 77 GLN CA C 211 57.074 57.115 -0.041 1
1 941 . 3 1 1 A 77 77 GLN CB C 211 30.798 29.405 1.393 1
1 943 . 3 1 1 A 77 77 GLN N N 211 118.702 118.235 0.467 1
1 945 . 3 1 1 A 78 78 THR H H 212 8.225 7.445 0.780 1
1 946 . 3 1 1 A 78 78 THR HA H 212 4.620 4.698 -0.078 1
1 951 . 3 1 1 A 78 78 THR C C 212 173.920 174.051 -0.131 1
1 952 . 3 1 1 A 78 78 THR CA C 212 60.087 59.157 0.930 1
1 953 . 3 1 1 A 78 78 THR CB C 212 71.412 71.104 0.308 1
1 955 . 3 1 1 A 78 78 THR N N 212 111.935 110.382 1.553 1
1 956 . 3 1 1 A 79 79 ASP H H 213 8.372 8.498 -0.126 1
1 957 . 3 1 1 A 79 79 ASP HA H 213 4.470 4.527 -0.057 1
1 960 . 3 1 1 A 79 79 ASP C C 213 176.759 177.919 -1.160 1
1 961 . 3 1 1 A 79 79 ASP CA C 213 54.927 54.353 0.574 1
1 962 . 3 1 1 A 79 79 ASP CB C 213 43.859 41.446 2.413 1
1 963 . 3 1 1 A 79 79 ASP N N 213 122.093 121.423 0.670 1
1 964 . 3 1 1 A 80 80 LYS H H 214 8.740 8.797 -0.057 1
1 965 . 3 1 1 A 80 80 LYS HA H 214 4.027 4.063 -0.036 1
1 974 . 3 1 1 A 80 80 LYS C C 214 178.493 177.976 0.517 1
1 975 . 3 1 1 A 80 80 LYS CA C 214 59.802 59.115 0.687 1
1 976 . 3 1 1 A 80 80 LYS CB C 214 32.374 31.992 0.382 1
1 980 . 3 1 1 A 80 80 LYS N N 214 124.685 122.349 2.336 1
1 981 . 3 1 1 A 81 81 ASP H H 215 8.556 7.893 0.663 1
1 982 . 3 1 1 A 81 81 ASP HA H 215 4.566 4.466 0.100 1
1 985 . 3 1 1 A 81 81 ASP C C 215 178.889 178.361 0.528 1
1 986 . 3 1 1 A 81 81 ASP CA C 215 58.046 56.923 1.123 1
1 987 . 3 1 1 A 81 81 ASP CB C 215 40.872 40.943 -0.071 1
1 988 . 3 1 1 A 81 81 ASP N N 215 121.413 119.870 1.543 1
1 989 . 3 1 1 A 82 82 PHE H H 216 8.205 8.234 -0.029 1
1 990 . 3 1 1 A 82 82 PHE HA H 216 3.686 4.093 -0.407 1
1 998 . 3 1 1 A 82 82 PHE C C 216 175.919 177.372 -1.453 1
1 999 . 3 1 1 A 82 82 PHE CA C 216 61.648 60.597 1.051 1
1 1000 . 3 1 1 A 82 82 PHE CB C 216 39.743 39.129 0.614 1
1 1004 . 3 1 1 A 82 82 PHE N N 216 124.401 123.066 1.335 1
1 1005 . 3 1 1 A 83 83 GLU H H 217 8.887 8.811 0.076 1
1 1006 . 3 1 1 A 83 83 GLU HA H 217 3.704 4.083 -0.379 1
1 1011 . 3 1 1 A 83 83 GLU C C 217 177.788 178.692 -0.904 1
1 1012 . 3 1 1 A 83 83 GLU CA C 217 60.545 60.303 0.242 1
1 1013 . 3 1 1 A 83 83 GLU CB C 217 30.639 29.850 0.789 1
1 1015 . 3 1 1 A 83 83 GLU N N 217 119.421 119.444 -0.023 1
1 1016 . 3 1 1 A 84 84 LYS H H 218 8.055 7.949 0.106 1
1 1017 . 3 1 1 A 84 84 LYS HA H 218 3.947 4.090 -0.143 1
1 1026 . 3 1 1 A 84 84 LYS C C 218 178.783 178.831 -0.048 1
1 1027 . 3 1 1 A 84 84 LYS CA C 218 59.327 58.993 0.334 1
1 1028 . 3 1 1 A 84 84 LYS CB C 218 32.539 32.217 0.322 1
1 1032 . 3 1 1 A 84 84 LYS N N 218 117.821 119.577 -1.756 1
1 1033 . 3 1 1 A 85 85 ALA H H 219 7.059 7.718 -0.659 1
1 1034 . 3 1 1 A 85 85 ALA HA H 219 4.040 4.040 0.000 1
1 1038 . 3 1 1 A 85 85 ALA C C 219 179.794 180.001 -0.207 1
1 1039 . 3 1 1 A 85 85 ALA CA C 219 54.407 54.834 -0.427 1
1 1040 . 3 1 1 A 85 85 ALA CB C 219 20.130 18.266 1.864 1
1 1041 . 3 1 1 A 85 85 ALA N N 219 118.905 121.472 -2.567 1
1 1042 . 3 1 1 A 86 86 LEU H H 220 8.157 8.236 -0.079 1
1 1043 . 3 1 1 A 86 86 LEU HA H 220 3.692 3.942 -0.250 1
1 1053 . 3 1 1 A 86 86 LEU C C 220 178.330 178.562 -0.232 1
1 1054 . 3 1 1 A 86 86 LEU CA C 220 57.752 58.180 -0.428 1
1 1055 . 3 1 1 A 86 86 LEU CB C 220 41.464 41.757 -0.293 1
1 1059 . 3 1 1 A 86 86 LEU N N 220 118.606 120.355 -1.749 1
1 1060 . 3 1 1 A 87 87 PHE H H 221 8.349 8.162 0.187 1
1 1061 . 3 1 1 A 87 87 PHE HA H 221 3.861 4.443 -0.582 1
1 1069 . 3 1 1 A 87 87 PHE C C 221 176.176 177.809 -1.633 1
1 1070 . 3 1 1 A 87 87 PHE CA C 221 61.780 61.822 -0.042 1
1 1071 . 3 1 1 A 87 87 PHE CB C 221 37.549 37.880 -0.331 1
1 1075 . 3 1 1 A 87 87 PHE N N 221 112.449 116.592 -4.143 1
1 1076 . 3 1 1 A 88 88 LYS H H 222 7.061 7.718 -0.657 1
1 1077 . 3 1 1 A 88 88 LYS HA H 222 4.380 4.149 0.231 1
1 1086 . 3 1 1 A 88 88 LYS C C 222 177.089 177.168 -0.079 1
1 1087 . 3 1 1 A 88 88 LYS CA C 222 56.726 58.268 -1.542 1
1 1088 . 3 1 1 A 88 88 LYS CB C 222 33.738 32.459 1.279 1
1 1092 . 3 1 1 A 88 88 LYS N N 222 118.308 120.734 -2.426 1
1 1093 . 3 1 1 A 89 89 LEU H H 223 7.270 7.123 0.147 1
1 1094 . 3 1 1 A 89 89 LEU HA H 223 4.168 4.227 -0.059 1
1 1104 . 3 1 1 A 89 89 LEU C C 223 177.528 176.796 0.732 1
1 1105 . 3 1 1 A 89 89 LEU CA C 223 55.279 54.520 0.759 1
1 1106 . 3 1 1 A 89 89 LEU CB C 223 43.240 42.486 0.754 1
1 1110 . 3 1 1 A 89 89 LEU N N 223 121.317 122.306 -0.989 1
1 1111 . 3 1 1 A 90 90 LYS H H 224 8.788 8.434 0.354 1
1 1112 . 3 1 1 A 90 90 LYS HA H 224 4.359 4.290 0.069 1
1 1121 . 3 1 1 A 90 90 LYS C C 224 175.839 176.570 -0.731 1
1 1122 . 3 1 1 A 90 90 LYS CA C 224 54.772 55.977 -1.205 1
1 1123 . 3 1 1 A 90 90 LYS CB C 224 33.232 33.207 0.025 1
1 1127 . 3 1 1 A 90 90 LYS N N 224 123.558 123.082 0.476 1
1 1128 . 3 1 1 A 91 91 ASP H H 225 8.125 8.754 -0.629 1
1 1129 . 3 1 1 A 91 91 ASP HA H 225 3.958 4.142 -0.184 1
1 1132 . 3 1 1 A 91 91 ASP C C 225 177.452 177.059 0.393 1
1 1133 . 3 1 1 A 91 91 ASP CA C 225 56.642 56.224 0.418 1
1 1134 . 3 1 1 A 91 91 ASP CB C 225 40.269 40.115 0.154 1
1 1135 . 3 1 1 A 91 91 ASP N N 225 119.419 121.999 -2.580 1
1 1136 . 3 1 1 A 92 92 GLY H H 226 8.681 8.908 -0.227 1
1 1137 . 3 1 1 A 92 92 GLY HA2 H 226 4.131 3.810 0.321 1
1 1138 . 3 1 1 A 92 92 GLY HA3 H 226 3.579 3.837 -0.258 1
1 1139 . 3 1 1 A 92 92 GLY C C 226 173.614 174.215 -0.601 1
1 1140 . 3 1 1 A 92 92 GLY CA C 226 45.564 44.926 0.638 1
1 1141 . 3 1 1 A 92 92 GLY N N 226 113.802 111.839 1.963 1
1 1142 . 3 1 1 A 93 93 GLU H H 227 8.104 8.126 -0.022 1
1 1143 . 3 1 1 A 93 93 GLU HA H 227 4.232 4.399 -0.167 1
1 1148 . 3 1 1 A 93 93 GLU C C 227 174.282 175.619 -1.337 1
1 1149 . 3 1 1 A 93 93 GLU CA C 227 56.651 56.232 0.419 1
1 1150 . 3 1 1 A 93 93 GLU CB C 227 32.190 31.087 1.103 1
1 1152 . 3 1 1 A 93 93 GLU N N 227 121.527 122.031 -0.504 1
1 1153 . 3 1 1 A 94 94 VAL H H 228 7.918 8.466 -0.548 1
1 1154 . 3 1 1 A 94 94 VAL HA H 228 4.857 4.750 0.107 1
1 1162 . 3 1 1 A 94 94 VAL C C 228 176.556 175.766 0.790 1
1 1163 . 3 1 1 A 94 94 VAL CA C 228 60.309 60.461 -0.152 1
1 1164 . 3 1 1 A 94 94 VAL CB C 228 33.847 35.117 -1.270 1
1 1167 . 3 1 1 A 94 94 VAL N N 228 119.768 126.317 -6.549 1
1 1168 . 3 1 1 A 95 95 SER H H 229 9.659 9.375 0.284 1
1 1169 . 3 1 1 A 95 95 SER HA H 229 4.313 4.659 -0.346 1
1 1172 . 3 1 1 A 95 95 SER C C 229 174.641 174.608 0.033 1
1 1173 . 3 1 1 A 95 95 SER CA C 229 59.208 57.878 1.330 1
1 1174 . 3 1 1 A 95 95 SER CB C 229 66.080 65.716 0.364 1
1 1175 . 3 1 1 A 95 95 SER N N 229 124.903 121.222 3.681 1
1 1176 . 3 1 1 A 96 96 GLU H H 230 8.014 8.390 -0.376 1
1 1177 . 3 1 1 A 96 96 GLU HA H 230 4.376 4.437 -0.061 1
1 1182 . 3 1 1 A 96 96 GLU C C 230 176.641 175.853 0.788 1
1 1183 . 3 1 1 A 96 96 GLU CA C 230 56.236 56.119 0.117 1
1 1184 . 3 1 1 A 96 96 GLU CB C 230 30.324 30.319 0.005 1
1 1186 . 3 1 1 A 96 96 GLU N N 230 115.510 119.397 -3.887 1
1 1187 . 3 1 1 A 97 97 VAL H H 231 8.741 8.318 0.423 1
1 1188 . 3 1 1 A 97 97 VAL HA H 231 4.171 4.119 0.052 1
1 1196 . 3 1 1 A 97 97 VAL C C 231 176.684 175.745 0.939 1
1 1197 . 3 1 1 A 97 97 VAL CA C 231 65.418 63.248 2.170 1
1 1198 . 3 1 1 A 97 97 VAL CB C 231 31.218 31.355 -0.137 1
1 1201 . 3 1 1 A 97 97 VAL N N 231 121.289 120.479 0.810 1
1 1202 . 3 1 1 A 98 98 VAL H H 232 9.218 9.567 -0.349 1
1 1203 . 3 1 1 A 98 98 VAL HA H 232 4.405 4.635 -0.230 1
1 1211 . 3 1 1 A 98 98 VAL C C 232 174.258 174.686 -0.428 1
1 1212 . 3 1 1 A 98 98 VAL CA C 232 60.937 61.291 -0.354 1
1 1213 . 3 1 1 A 98 98 VAL CB C 232 35.825 33.815 2.010 1
1 1216 . 3 1 1 A 98 98 VAL N N 232 130.544 129.178 1.366 1
1 1217 . 3 1 1 A 99 99 LYS H H 233 8.800 8.893 -0.093 1
1 1218 . 3 1 1 A 99 99 LYS HA H 233 4.853 4.943 -0.090 1
1 1227 . 3 1 1 A 99 99 LYS C C 233 175.274 175.183 0.091 1
1 1228 . 3 1 1 A 99 99 LYS CA C 233 55.499 55.030 0.469 1
1 1229 . 3 1 1 A 99 99 LYS CB C 233 34.452 34.247 0.205 1
1 1233 . 3 1 1 A 99 99 LYS N N 233 130.477 128.316 2.161 1
1 1234 . 3 1 1 A 100 100 SER H H 234 9.585 8.974 0.611 1
1 1235 . 3 1 1 A 100 100 SER HA H 234 5.150 4.901 0.249 1
1 1238 . 3 1 1 A 100 100 SER C C 234 175.493 174.055 1.438 1
1 1239 . 3 1 1 A 100 100 SER CA C 234 56.927 57.540 -0.613 1
1 1240 . 3 1 1 A 100 100 SER CB C 234 67.309 67.363 -0.054 1
1 1241 . 3 1 1 A 100 100 SER N N 234 125.814 123.213 2.601 1
1 1242 . 3 1 1 A 101 101 SER H H 235 8.631 9.107 -0.476 1
1 1243 . 3 1 1 A 101 101 SER HA H 235 4.106 4.072 0.034 1
1 1246 . 3 1 1 A 101 101 SER C C 235 175.385 175.034 0.351 1
1 1247 . 3 1 1 A 101 101 SER CA C 235 61.123 61.337 -0.214 1
1 1248 . 3 1 1 A 101 101 SER CB C 235 62.818 62.561 0.257 1
1 1249 . 3 1 1 A 101 101 SER N N 235 115.089 117.202 -2.113 1
1 1250 . 3 1 1 A 102 102 PHE H H 236 8.957 7.641 1.316 1
1 1251 . 3 1 1 A 102 102 PHE HA H 236 4.610 4.648 -0.038 1
1 1259 . 3 1 1 A 102 102 PHE C C 236 176.453 175.676 0.777 1
1 1260 . 3 1 1 A 102 102 PHE CA C 236 58.382 57.988 0.394 1
1 1261 . 3 1 1 A 102 102 PHE CB C 236 40.275 39.669 0.606 1
1 1263 . 3 1 1 A 102 102 PHE N N 236 119.917 117.174 2.743 1
1 1264 . 3 1 1 A 103 103 GLY H H 237 7.377 7.281 0.096 1
1 1265 . 3 1 1 A 103 103 GLY HA2 H 237 4.453 4.060 0.393 1
1 1266 . 3 1 1 A 103 103 GLY HA3 H 237 3.472 4.183 -0.711 1
1 1267 . 3 1 1 A 103 103 GLY C C 237 169.627 172.489 -2.862 1
1 1268 . 3 1 1 A 103 103 GLY CA C 237 45.384 44.690 0.694 1
1 1269 . 3 1 1 A 103 103 GLY N N 237 108.809 106.531 2.278 1
1 1270 . 3 1 1 A 104 104 TYR H H 238 8.632 8.567 0.065 1
1 1271 . 3 1 1 A 104 104 TYR HA H 238 5.322 5.628 -0.306 1
1 1278 . 3 1 1 A 104 104 TYR C C 238 175.043 175.065 -0.022 1
1 1279 . 3 1 1 A 104 104 TYR CA C 238 57.627 57.017 0.610 1
1 1280 . 3 1 1 A 104 104 TYR CB C 238 41.711 41.987 -0.276 1
1 1283 . 3 1 1 A 104 104 TYR N N 238 120.030 121.792 -1.762 1
1 1284 . 3 1 1 A 105 105 HIS H H 239 10.070 9.466 0.604 1
1 1285 . 3 1 1 A 105 105 HIS HA H 239 6.046 5.612 0.434 1
1 1290 . 3 1 1 A 105 105 HIS C C 239 175.734 174.725 1.009 1
1 1291 . 3 1 1 A 105 105 HIS CA C 239 53.945 54.557 -0.612 1
1 1292 . 3 1 1 A 105 105 HIS CB C 239 32.450 34.172 -1.722 1
1 1295 . 3 1 1 A 105 105 HIS N N 239 119.504 118.489 1.015 1
1 1296 . 3 1 1 A 106 106 ILE H H 240 8.660 8.908 -0.248 1
1 1297 . 3 1 1 A 106 106 ILE HA H 240 4.120 4.917 -0.797 1
1 1307 . 3 1 1 A 106 106 ILE C C 240 174.758 175.288 -0.530 1
1 1308 . 3 1 1 A 106 106 ILE CA C 240 63.446 60.004 3.442 1
1 1309 . 3 1 1 A 106 106 ILE CB C 240 40.786 41.479 -0.693 1
1 1313 . 3 1 1 A 106 106 ILE N N 240 120.639 120.254 0.385 1
1 1314 . 3 1 1 A 107 107 ILE H H 241 9.033 9.253 -0.220 1
1 1315 . 3 1 1 A 107 107 ILE HA H 241 4.799 5.076 -0.277 1
1 1325 . 3 1 1 A 107 107 ILE C C 241 172.880 174.510 -1.630 1
1 1326 . 3 1 1 A 107 107 ILE CA C 241 60.563 59.551 1.012 1
1 1327 . 3 1 1 A 107 107 ILE CB C 241 41.652 40.479 1.173 1
1 1331 . 3 1 1 A 107 107 ILE N N 241 129.098 126.886 2.212 1
1 1332 . 3 1 1 A 108 108 LYS H H 242 8.692 8.842 -0.150 1
1 1333 . 3 1 1 A 108 108 LYS HA H 242 5.012 4.899 0.113 1
1 1342 . 3 1 1 A 108 108 LYS C C 242 174.484 175.670 -1.186 1
1 1343 . 3 1 1 A 108 108 LYS CA C 242 54.317 54.369 -0.052 1
1 1344 . 3 1 1 A 108 108 LYS CB C 242 35.619 35.263 0.356 1
1 1348 . 3 1 1 A 108 108 LYS N N 242 127.179 126.836 0.343 1
1 1349 . 3 1 1 A 109 109 ALA H H 243 7.816 8.818 -1.002 1
1 1350 . 3 1 1 A 109 109 ALA HA H 243 4.604 4.273 0.331 1
1 1354 . 3 1 1 A 109 109 ALA C C 243 176.231 176.483 -0.252 1
1 1355 . 3 1 1 A 109 109 ALA CA C 243 50.505 52.074 -1.569 1
1 1356 . 3 1 1 A 109 109 ALA CB C 243 19.584 19.705 -0.121 1
1 1357 . 3 1 1 A 109 109 ALA N N 243 129.619 128.954 0.665 1
1 1358 . 3 1 1 A 110 110 ASP H H 244 7.578 8.354 -0.776 1
1 1359 . 3 1 1 A 110 110 ASP HA H 244 4.424 5.054 -0.630 1
1 1362 . 3 1 1 A 110 110 ASP C C 244 175.259 174.981 0.278 1
1 1363 . 3 1 1 A 110 110 ASP CA C 244 54.489 52.640 1.849 1
1 1364 . 3 1 1 A 110 110 ASP CB C 244 42.693 44.102 -1.409 1
1 1365 . 3 1 1 A 110 110 ASP N N 244 125.434 120.466 4.968 1
1 4 . 4 1 1 A 2 2 PRO HA H -4 4.403 4.354 0.049 1
1 11 . 4 1 1 A 2 2 PRO C C -4 176.990 178.437 -1.447 1
1 12 . 4 1 1 A 2 2 PRO CA C -4 63.131 65.030 -1.899 1
1 13 . 4 1 1 A 2 2 PRO CB C -4 32.342 31.730 0.612 1
1 16 . 4 1 1 A 3 3 LEU H H -3 8.483 8.305 0.178 1
1 17 . 4 1 1 A 3 3 LEU HA H -3 4.333 4.189 0.144 1
1 27 . 4 1 1 A 3 3 LEU C C -3 177.991 177.561 0.430 1
1 28 . 4 1 1 A 3 3 LEU CA C -3 55.314 57.096 -1.782 1
1 29 . 4 1 1 A 3 3 LEU CB C -3 42.244 41.999 0.245 1
1 33 . 4 1 1 A 3 3 LEU N N -3 122.986 117.146 5.840 1
1 34 . 4 1 1 A 4 4 GLY H H -2 8.397 7.828 0.569 1
1 35 . 4 1 1 A 4 4 GLY HA2 H -2 4.024 4.060 -0.036 1
1 36 . 4 1 1 A 4 4 GLY HA3 H -2 3.976 4.136 -0.160 1
1 37 . 4 1 1 A 4 4 GLY C C -2 174.360 172.987 1.373 1
1 38 . 4 1 1 A 4 4 GLY CA C -2 45.434 45.511 -0.077 1
1 39 . 4 1 1 A 4 4 GLY N N -2 110.666 108.180 2.486 1
1 56 . 4 1 1 A 7 7 SER H H 141 7.913 7.547 0.366 1
1 57 . 4 1 1 A 7 7 SER HA H 141 5.657 5.344 0.313 1
1 60 . 4 1 1 A 7 7 SER C C 141 173.753 172.214 1.539 1
1 61 . 4 1 1 A 7 7 SER CA C 141 56.758 57.771 -1.013 1
1 62 . 4 1 1 A 7 7 SER CB C 141 66.774 65.642 1.132 1
1 63 . 4 1 1 A 7 7 SER N N 141 113.824 111.982 1.842 1
1 64 . 4 1 1 A 8 8 LYS H H 142 8.656 8.291 0.365 1
1 65 . 4 1 1 A 8 8 LYS HA H 142 4.543 4.949 -0.406 1
1 74 . 4 1 1 A 8 8 LYS C C 142 174.403 174.574 -0.171 1
1 75 . 4 1 1 A 8 8 LYS CA C 142 55.578 54.326 1.252 1
1 76 . 4 1 1 A 8 8 LYS CB C 142 36.561 35.998 0.563 1
1 80 . 4 1 1 A 8 8 LYS N N 142 123.076 120.280 2.796 1
1 81 . 4 1 1 A 9 9 LYS H H 143 8.623 8.362 0.261 1
1 82 . 4 1 1 A 9 9 LYS HA H 143 4.119 4.357 -0.238 1
1 91 . 4 1 1 A 9 9 LYS C C 143 176.144 175.493 0.651 1
1 92 . 4 1 1 A 9 9 LYS CA C 143 56.683 56.117 0.566 1
1 93 . 4 1 1 A 9 9 LYS CB C 143 32.580 32.495 0.085 1
1 97 . 4 1 1 A 9 9 LYS N N 143 129.542 123.041 6.501 1
1 98 . 4 1 1 A 10 10 ALA H H 144 8.151 8.650 -0.499 1
1 99 . 4 1 1 A 10 10 ALA HA H 144 5.208 5.015 0.193 1
1 103 . 4 1 1 A 10 10 ALA C C 144 175.577 175.030 0.547 1
1 104 . 4 1 1 A 10 10 ALA CA C 144 51.226 51.110 0.116 1
1 105 . 4 1 1 A 10 10 ALA CB C 144 25.299 24.232 1.067 1
1 106 . 4 1 1 A 10 10 ALA N N 144 127.933 127.892 0.041 1
1 107 . 4 1 1 A 11 11 SER H H 145 8.679 8.864 -0.185 1
1 108 . 4 1 1 A 11 11 SER HA H 145 5.431 5.917 -0.486 1
1 111 . 4 1 1 A 11 11 SER C C 145 173.072 173.210 -0.138 1
1 112 . 4 1 1 A 11 11 SER CA C 145 57.772 56.718 1.054 1
1 113 . 4 1 1 A 11 11 SER CB C 145 67.301 66.050 1.251 1
1 114 . 4 1 1 A 11 11 SER N N 145 116.245 115.189 1.056 1
1 115 . 4 1 1 A 12 12 HIS H H 146 9.962 9.684 0.278 1
1 116 . 4 1 1 A 12 12 HIS HA H 146 6.332 6.151 0.181 1
1 121 . 4 1 1 A 12 12 HIS C C 146 173.006 172.576 0.430 1
1 122 . 4 1 1 A 12 12 HIS CA C 146 55.020 54.214 0.806 1
1 123 . 4 1 1 A 12 12 HIS CB C 146 37.071 33.968 3.103 1
1 126 . 4 1 1 A 12 12 HIS N N 146 119.181 118.807 0.374 1
1 127 . 4 1 1 A 13 13 ILE H H 147 8.976 8.869 0.107 1
1 128 . 4 1 1 A 13 13 ILE HA H 147 3.528 4.518 -0.990 1
1 138 . 4 1 1 A 13 13 ILE C C 147 173.010 173.769 -0.759 1
1 139 . 4 1 1 A 13 13 ILE CA C 147 61.273 59.562 1.711 1
1 140 . 4 1 1 A 13 13 ILE CB C 147 41.773 41.848 -0.075 1
1 144 . 4 1 1 A 13 13 ILE N N 147 121.873 119.481 2.392 1
1 145 . 4 1 1 A 14 14 LEU H H 148 7.627 8.921 -1.294 1
1 146 . 4 1 1 A 14 14 LEU HA H 148 4.814 4.904 -0.090 1
1 156 . 4 1 1 A 14 14 LEU C C 148 174.112 174.326 -0.214 1
1 157 . 4 1 1 A 14 14 LEU CA C 148 52.574 52.982 -0.408 1
1 158 . 4 1 1 A 14 14 LEU CB C 148 45.643 44.935 0.708 1
1 162 . 4 1 1 A 14 14 LEU N N 148 127.112 129.603 -2.491 1
1 163 . 4 1 1 A 15 15 ILE H H 149 9.524 9.191 0.333 1
1 164 . 4 1 1 A 15 15 ILE HA H 149 4.362 4.690 -0.328 1
1 174 . 4 1 1 A 15 15 ILE C C 149 175.452 175.425 0.027 1
1 175 . 4 1 1 A 15 15 ILE CA C 149 58.516 60.356 -1.840 1
1 176 . 4 1 1 A 15 15 ILE CB C 149 36.560 40.257 -3.697 1
1 180 . 4 1 1 A 15 15 ILE N N 149 128.652 126.849 1.803 1
1 181 . 4 1 1 A 16 16 LYS H H 150 8.035 8.382 -0.347 1
1 182 . 4 1 1 A 16 16 LYS HA H 150 4.319 4.449 -0.130 1
1 191 . 4 1 1 A 16 16 LYS C C 150 175.038 176.267 -1.229 1
1 192 . 4 1 1 A 16 16 LYS CA C 150 57.817 56.493 1.324 1
1 193 . 4 1 1 A 16 16 LYS CB C 150 34.853 33.151 1.702 1
1 197 . 4 1 1 A 16 16 LYS N N 150 129.153 127.866 1.287 1
1 198 . 4 1 1 A 17 17 VAL H H 151 8.016 8.619 -0.603 1
1 199 . 4 1 1 A 17 17 VAL HA H 151 4.873 4.703 0.170 1
1 207 . 4 1 1 A 17 17 VAL C C 151 176.647 175.450 1.197 1
1 208 . 4 1 1 A 17 17 VAL CA C 151 60.088 61.534 -1.446 1
1 209 . 4 1 1 A 17 17 VAL CB C 151 34.082 33.157 0.925 1
1 212 . 4 1 1 A 17 17 VAL N N 151 121.288 124.174 -2.886 1
1 213 . 4 1 1 A 18 18 LYS H H 152 8.443 9.108 -0.665 1
1 214 . 4 1 1 A 18 18 LYS HA H 152 4.334 4.658 -0.324 1
1 223 . 4 1 1 A 18 18 LYS C C 152 176.345 177.704 -1.359 1
1 224 . 4 1 1 A 18 18 LYS CA C 152 57.016 54.620 2.396 1
1 225 . 4 1 1 A 18 18 LYS CB C 152 33.222 34.693 -1.471 1
1 229 . 4 1 1 A 18 18 LYS N N 152 128.408 127.309 1.099 1
1 230 . 4 1 1 A 19 19 SER H H 153 9.067 8.800 0.267 1
1 231 . 4 1 1 A 19 19 SER HA H 153 4.457 4.403 0.054 1
1 234 . 4 1 1 A 19 19 SER C C 153 174.236 174.397 -0.161 1
1 235 . 4 1 1 A 19 19 SER CA C 153 59.642 59.261 0.381 1
1 236 . 4 1 1 A 19 19 SER CB C 153 64.347 63.844 0.503 1
1 237 . 4 1 1 A 19 19 SER N N 153 121.522 115.323 6.199 1
1 238 . 4 1 1 A 20 20 LYS H H 154 7.961 7.610 0.351 1
1 239 . 4 1 1 A 20 20 LYS HA H 154 4.558 4.641 -0.083 1
1 244 . 4 1 1 A 20 20 LYS C C 154 177.256 175.934 1.322 1
1 245 . 4 1 1 A 20 20 LYS CA C 154 55.249 55.482 -0.233 1
1 246 . 4 1 1 A 20 20 LYS CB C 154 34.531 35.964 -1.433 1
1 248 . 4 1 1 A 20 20 LYS N N 154 120.270 119.931 0.339 1
1 249 . 4 1 1 A 21 21 LYS HA H 155 4.003 3.970 0.033 1
1 258 . 4 1 1 A 21 21 LYS C C 155 177.015 178.194 -1.179 1
1 259 . 4 1 1 A 21 21 LYS CA C 155 59.091 58.942 0.149 1
1 260 . 4 1 1 A 21 21 LYS CB C 155 32.394 32.176 0.218 1
1 264 . 4 1 1 A 22 22 SER H H 156 7.625 7.948 -0.323 1
1 265 . 4 1 1 A 22 22 SER HA H 156 4.293 4.365 -0.072 1
1 268 . 4 1 1 A 22 22 SER C C 156 174.843 174.405 0.438 1
1 269 . 4 1 1 A 22 22 SER CA C 156 57.966 61.359 -3.393 1
1 270 . 4 1 1 A 22 22 SER CB C 156 63.369 63.248 0.121 1
1 271 . 4 1 1 A 22 22 SER N N 156 109.549 113.905 -4.356 1
1 272 . 4 1 1 A 23 23 ASP H H 157 7.701 7.636 0.065 1
1 273 . 4 1 1 A 23 23 ASP HA H 157 4.548 4.834 -0.286 1
1 276 . 4 1 1 A 23 23 ASP C C 157 176.544 175.695 0.849 1
1 277 . 4 1 1 A 23 23 ASP CA C 157 55.242 53.662 1.580 1
1 278 . 4 1 1 A 23 23 ASP CB C 157 41.103 41.906 -0.803 1
1 279 . 4 1 1 A 23 23 ASP N N 157 124.536 120.135 4.401 1
1 280 . 4 1 1 A 24 24 LYS H H 158 8.583 8.888 -0.305 1
1 281 . 4 1 1 A 24 24 LYS HA H 158 4.252 4.344 -0.092 1
1 290 . 4 1 1 A 24 24 LYS C C 158 176.813 177.761 -0.948 1
1 291 . 4 1 1 A 24 24 LYS CA C 158 57.148 56.999 0.149 1
1 292 . 4 1 1 A 24 24 LYS CB C 158 33.200 32.332 0.868 1
1 296 . 4 1 1 A 24 24 LYS N N 158 122.372 123.969 -1.597 1
1 297 . 4 1 1 A 25 25 GLU H H 159 8.001 8.006 -0.005 1
1 298 . 4 1 1 A 25 25 GLU HA H 159 4.521 4.193 0.328 1
1 303 . 4 1 1 A 25 25 GLU C C 159 175.995 176.793 -0.798 1
1 304 . 4 1 1 A 25 25 GLU CA C 159 55.727 58.203 -2.476 1
1 305 . 4 1 1 A 25 25 GLU CB C 159 31.918 30.249 1.669 1
1 307 . 4 1 1 A 25 25 GLU N N 159 118.705 117.002 1.703 1
1 308 . 4 1 1 A 26 26 GLY H H 160 8.458 7.661 0.797 1
1 309 . 4 1 1 A 26 26 GLY HA2 H 160 3.946 4.031 -0.085 1
1 310 . 4 1 1 A 26 26 GLY HA3 H 160 3.511 4.041 -0.530 1
1 311 . 4 1 1 A 26 26 GLY C C 160 172.201 172.233 -0.032 1
1 312 . 4 1 1 A 26 26 GLY CA C 160 44.038 45.345 -1.307 1
1 313 . 4 1 1 A 26 26 GLY N N 160 107.642 104.719 2.923 1
1 314 . 4 1 1 A 27 27 LEU H H 161 8.259 8.440 -0.181 1
1 315 . 4 1 1 A 27 27 LEU HA H 161 4.775 4.952 -0.177 1
1 325 . 4 1 1 A 27 27 LEU C C 161 177.422 176.630 0.792 1
1 326 . 4 1 1 A 27 27 LEU CA C 161 53.322 53.295 0.027 1
1 327 . 4 1 1 A 27 27 LEU CB C 161 45.576 43.549 2.027 1
1 331 . 4 1 1 A 27 27 LEU N N 161 119.856 122.268 -2.412 1
1 332 . 4 1 1 A 28 28 ASP H H 162 8.848 8.719 0.129 1
1 333 . 4 1 1 A 28 28 ASP HA H 162 4.644 4.697 -0.053 1
1 336 . 4 1 1 A 28 28 ASP C C 162 176.630 177.275 -0.645 1
1 337 . 4 1 1 A 28 28 ASP CA C 162 55.195 54.434 0.761 1
1 338 . 4 1 1 A 28 28 ASP CB C 162 41.673 41.974 -0.301 1
1 339 . 4 1 1 A 28 28 ASP N N 162 122.434 120.768 1.666 1
1 340 . 4 1 1 A 29 29 ASP H H 163 8.720 9.214 -0.494 1
1 341 . 4 1 1 A 29 29 ASP HA H 163 4.386 4.431 -0.045 1
1 344 . 4 1 1 A 29 29 ASP C C 163 176.604 178.506 -1.902 1
1 345 . 4 1 1 A 29 29 ASP CA C 163 59.690 57.111 2.579 1
1 346 . 4 1 1 A 29 29 ASP CB C 163 42.964 39.867 3.097 1
1 347 . 4 1 1 A 29 29 ASP N N 163 121.460 122.518 -1.058 1
1 348 . 4 1 1 A 30 30 LYS H H 164 8.434 8.008 0.426 1
1 349 . 4 1 1 A 30 30 LYS HA H 164 3.901 3.982 -0.081 1
1 358 . 4 1 1 A 30 30 LYS C C 164 179.479 179.063 0.416 1
1 359 . 4 1 1 A 30 30 LYS CA C 164 60.047 59.453 0.594 1
1 360 . 4 1 1 A 30 30 LYS CB C 164 32.038 32.272 -0.234 1
1 364 . 4 1 1 A 30 30 LYS N N 164 116.627 119.761 -3.134 1
1 365 . 4 1 1 A 31 31 GLU H H 165 7.755 8.399 -0.644 1
1 366 . 4 1 1 A 31 31 GLU HA H 165 3.998 4.051 -0.053 1
1 371 . 4 1 1 A 31 31 GLU C C 165 179.031 179.209 -0.178 1
1 372 . 4 1 1 A 31 31 GLU CA C 165 59.335 59.065 0.270 1
1 373 . 4 1 1 A 31 31 GLU CB C 165 29.972 29.802 0.170 1
1 375 . 4 1 1 A 31 31 GLU N N 165 120.456 119.776 0.680 1
1 376 . 4 1 1 A 32 32 ALA H H 166 9.060 8.550 0.510 1
1 377 . 4 1 1 A 32 32 ALA HA H 166 3.871 4.030 -0.159 1
1 381 . 4 1 1 A 32 32 ALA C C 166 178.029 179.012 -0.983 1
1 382 . 4 1 1 A 32 32 ALA CA C 166 54.997 55.381 -0.384 1
1 383 . 4 1 1 A 32 32 ALA CB C 166 19.727 18.425 1.302 1
1 384 . 4 1 1 A 32 32 ALA N N 166 124.406 122.412 1.994 1
1 385 . 4 1 1 A 33 33 LYS H H 167 8.228 7.783 0.445 1
1 386 . 4 1 1 A 33 33 LYS HA H 167 2.595 3.145 -0.550 1
1 395 . 4 1 1 A 33 33 LYS C C 167 177.938 178.063 -0.125 1
1 396 . 4 1 1 A 33 33 LYS CA C 167 59.573 59.362 0.211 1
1 397 . 4 1 1 A 33 33 LYS CB C 167 32.098 32.291 -0.193 1
1 401 . 4 1 1 A 33 33 LYS N N 167 119.833 118.363 1.470 1
1 402 . 4 1 1 A 34 34 GLN H H 168 7.392 7.740 -0.348 1
1 403 . 4 1 1 A 34 34 GLN HA H 168 3.943 3.928 0.015 1
1 410 . 4 1 1 A 34 34 GLN C C 168 178.323 178.411 -0.088 1
1 411 . 4 1 1 A 34 34 GLN CA C 168 58.883 59.266 -0.383 1
1 412 . 4 1 1 A 34 34 GLN CB C 168 28.485 28.123 0.362 1
1 414 . 4 1 1 A 34 34 GLN N N 168 117.208 117.771 -0.563 1
1 416 . 4 1 1 A 35 35 LYS H H 169 7.994 7.979 0.015 1
1 417 . 4 1 1 A 35 35 LYS HA H 169 4.067 4.006 0.061 1
1 426 . 4 1 1 A 35 35 LYS C C 169 178.161 178.643 -0.482 1
1 427 . 4 1 1 A 35 35 LYS CA C 169 58.437 59.170 -0.733 1
1 428 . 4 1 1 A 35 35 LYS CB C 169 31.611 32.236 -0.625 1
1 432 . 4 1 1 A 35 35 LYS N N 169 120.898 119.838 1.060 1
1 433 . 4 1 1 A 36 36 ALA H H 170 8.431 8.363 0.068 1
1 434 . 4 1 1 A 36 36 ALA HA H 170 3.738 4.020 -0.282 1
1 438 . 4 1 1 A 36 36 ALA C C 170 178.862 179.541 -0.679 1
1 439 . 4 1 1 A 36 36 ALA CA C 170 55.351 55.126 0.225 1
1 440 . 4 1 1 A 36 36 ALA CB C 170 18.295 18.317 -0.022 1
1 441 . 4 1 1 A 36 36 ALA N N 170 120.641 120.531 0.110 1
1 442 . 4 1 1 A 37 37 GLU H H 171 8.412 8.159 0.253 1
1 443 . 4 1 1 A 37 37 GLU HA H 171 3.867 3.930 -0.063 1
1 448 . 4 1 1 A 37 37 GLU C C 171 179.255 179.092 0.163 1
1 449 . 4 1 1 A 37 37 GLU CA C 171 59.543 59.581 -0.038 1
1 450 . 4 1 1 A 37 37 GLU CB C 171 29.569 29.533 0.036 1
1 452 . 4 1 1 A 37 37 GLU N N 171 118.224 117.737 0.487 1
1 453 . 4 1 1 A 38 38 GLU H H 172 8.019 8.418 -0.399 1
1 454 . 4 1 1 A 38 38 GLU HA H 172 3.952 4.062 -0.110 1
1 459 . 4 1 1 A 38 38 GLU C C 172 180.250 178.461 1.789 1
1 460 . 4 1 1 A 38 38 GLU CA C 172 59.627 59.136 0.491 1
1 461 . 4 1 1 A 38 38 GLU CB C 172 29.368 28.775 0.593 1
1 463 . 4 1 1 A 38 38 GLU N N 172 121.250 118.306 2.944 1
1 464 . 4 1 1 A 39 39 ILE H H 173 8.174 7.383 0.791 1
1 465 . 4 1 1 A 39 39 ILE HA H 173 3.643 3.796 -0.153 1
1 475 . 4 1 1 A 39 39 ILE C C 173 177.568 177.974 -0.406 1
1 476 . 4 1 1 A 39 39 ILE CA C 173 64.869 63.843 1.026 1
1 477 . 4 1 1 A 39 39 ILE CB C 173 38.160 37.455 0.705 1
1 481 . 4 1 1 A 39 39 ILE N N 173 121.527 117.330 4.197 1
1 482 . 4 1 1 A 40 40 GLN H H 174 8.860 8.302 0.558 1
1 483 . 4 1 1 A 40 40 GLN HA H 174 3.533 3.970 -0.437 1
1 490 . 4 1 1 A 40 40 GLN C C 174 179.022 178.964 0.058 1
1 491 . 4 1 1 A 40 40 GLN CA C 174 61.316 59.303 2.013 1
1 492 . 4 1 1 A 40 40 GLN CB C 174 26.604 28.290 -1.686 1
1 494 . 4 1 1 A 40 40 GLN N N 174 121.956 121.139 0.817 1
1 496 . 4 1 1 A 41 41 LYS H H 175 7.879 8.032 -0.153 1
1 497 . 4 1 1 A 41 41 LYS HA H 175 3.777 4.165 -0.388 1
1 506 . 4 1 1 A 41 41 LYS C C 175 178.779 178.097 0.682 1
1 507 . 4 1 1 A 41 41 LYS CA C 175 59.701 58.885 0.816 1
1 508 . 4 1 1 A 41 41 LYS CB C 175 32.581 32.281 0.300 1
1 512 . 4 1 1 A 41 41 LYS N N 175 119.012 118.293 0.719 1
1 513 . 4 1 1 A 42 42 GLU H H 176 7.447 7.894 -0.447 1
1 514 . 4 1 1 A 42 42 GLU HA H 176 4.059 4.205 -0.146 1
1 519 . 4 1 1 A 42 42 GLU C C 176 180.058 178.972 1.086 1
1 520 . 4 1 1 A 42 42 GLU CA C 176 59.456 58.879 0.577 1
1 521 . 4 1 1 A 42 42 GLU CB C 176 29.923 30.085 -0.162 1
1 523 . 4 1 1 A 42 42 GLU N N 176 120.054 118.545 1.509 1
1 524 . 4 1 1 A 43 43 VAL H H 177 8.618 8.036 0.582 1
1 525 . 4 1 1 A 43 43 VAL HA H 177 3.986 3.918 0.068 1
1 533 . 4 1 1 A 43 43 VAL C C 177 176.459 177.644 -1.185 1
1 534 . 4 1 1 A 43 43 VAL CA C 177 63.923 64.764 -0.841 1
1 535 . 4 1 1 A 43 43 VAL CB C 177 31.899 31.423 0.476 1
1 538 . 4 1 1 A 43 43 VAL N N 177 114.191 116.966 -2.775 1
1 539 . 4 1 1 A 44 44 SER H H 178 8.052 8.316 -0.264 1
1 540 . 4 1 1 A 44 44 SER HA H 178 4.098 4.237 -0.139 1
1 543 . 4 1 1 A 44 44 SER C C 178 176.548 176.037 0.511 1
1 544 . 4 1 1 A 44 44 SER CA C 178 61.160 61.469 -0.309 1
1 545 . 4 1 1 A 44 44 SER CB C 178 62.959 62.528 0.431 1
1 546 . 4 1 1 A 44 44 SER N N 178 114.202 115.896 -1.694 1
1 547 . 4 1 1 A 45 45 LYS H H 179 7.083 8.132 -1.049 1
1 548 . 4 1 1 A 45 45 LYS HA H 179 4.140 4.222 -0.082 1
1 557 . 4 1 1 A 45 45 LYS C C 179 177.288 176.134 1.154 1
1 558 . 4 1 1 A 45 45 LYS CA C 179 58.469 57.785 0.684 1
1 559 . 4 1 1 A 45 45 LYS CB C 179 32.671 31.739 0.932 1
1 563 . 4 1 1 A 45 45 LYS N N 179 120.935 117.485 3.450 1
1 564 . 4 1 1 A 46 46 ASP H H 180 7.098 7.926 -0.828 1
1 565 . 4 1 1 A 46 46 ASP HA H 180 4.917 4.984 -0.067 1
1 568 . 4 1 1 A 46 46 ASP CA C 180 51.492 51.407 0.085 1
1 569 . 4 1 1 A 46 46 ASP CB C 180 40.595 41.571 -0.976 1
1 570 . 4 1 1 A 46 46 ASP N N 180 112.836 120.284 -7.448 1
1 571 . 4 1 1 A 47 47 PRO HA H 181 4.681 4.554 0.127 1
1 578 . 4 1 1 A 47 47 PRO C C 181 179.248 177.415 1.833 1
1 579 . 4 1 1 A 47 47 PRO CA C 181 64.718 64.139 0.579 1
1 580 . 4 1 1 A 47 47 PRO CB C 181 32.159 32.038 0.121 1
1 583 . 4 1 1 A 48 48 SER H H 182 8.248 8.076 0.172 1
1 584 . 4 1 1 A 48 48 SER HA H 182 4.378 4.343 0.035 1
1 587 . 4 1 1 A 48 48 SER C C 182 176.071 176.429 -0.358 1
1 588 . 4 1 1 A 48 48 SER CA C 182 61.377 60.681 0.696 1
1 589 . 4 1 1 A 48 48 SER CB C 182 62.455 63.161 -0.706 1
1 590 . 4 1 1 A 48 48 SER N N 182 116.986 113.867 3.119 1
1 591 . 4 1 1 A 49 49 LYS H H 183 7.842 7.309 0.533 1
1 592 . 4 1 1 A 49 49 LYS HA H 183 4.482 4.246 0.236 1
1 601 . 4 1 1 A 49 49 LYS C C 183 175.605 177.926 -2.321 1
1 602 . 4 1 1 A 49 49 LYS CA C 183 55.824 57.401 -1.577 1
1 603 . 4 1 1 A 49 49 LYS CB C 183 32.834 32.090 0.744 1
1 607 . 4 1 1 A 49 49 LYS N N 183 121.698 120.846 0.852 1
1 608 . 4 1 1 A 50 50 PHE H H 184 7.634 8.135 -0.501 1
1 609 . 4 1 1 A 50 50 PHE HA H 184 3.510 4.284 -0.774 1
1 617 . 4 1 1 A 50 50 PHE C C 184 176.214 177.833 -1.619 1
1 618 . 4 1 1 A 50 50 PHE CA C 184 63.276 61.244 2.032 1
1 619 . 4 1 1 A 50 50 PHE CB C 184 40.948 39.005 1.943 1
1 623 . 4 1 1 A 50 50 PHE N N 184 120.120 121.597 -1.477 1
1 624 . 4 1 1 A 51 51 GLY H H 185 8.855 8.616 0.239 1
1 625 . 4 1 1 A 51 51 GLY HA2 H 185 3.993 3.927 0.066 1
1 626 . 4 1 1 A 51 51 GLY HA3 H 185 3.958 3.976 -0.018 1
1 627 . 4 1 1 A 51 51 GLY C C 185 175.169 176.146 -0.977 1
1 628 . 4 1 1 A 51 51 GLY CA C 185 47.475 47.005 0.470 1
1 629 . 4 1 1 A 51 51 GLY N N 185 105.550 105.683 -0.133 1
1 630 . 4 1 1 A 52 52 GLU H H 186 7.917 7.706 0.211 1
1 631 . 4 1 1 A 52 52 GLU HA H 186 4.006 4.120 -0.114 1
1 636 . 4 1 1 A 52 52 GLU C C 186 179.499 179.448 0.051 1
1 637 . 4 1 1 A 52 52 GLU CA C 186 58.904 59.251 -0.347 1
1 638 . 4 1 1 A 52 52 GLU CB C 186 29.700 29.675 0.025 1
1 640 . 4 1 1 A 52 52 GLU N N 186 121.929 120.789 1.140 1
1 641 . 4 1 1 A 53 53 ILE H H 187 7.936 8.202 -0.266 1
1 642 . 4 1 1 A 53 53 ILE HA H 187 3.648 3.633 0.015 1
1 652 . 4 1 1 A 53 53 ILE C C 187 177.886 177.586 0.300 1
1 653 . 4 1 1 A 53 53 ILE CA C 187 64.366 65.287 -0.921 1
1 654 . 4 1 1 A 53 53 ILE CB C 187 36.478 37.818 -1.340 1
1 658 . 4 1 1 A 53 53 ILE N N 187 120.991 120.696 0.295 1
1 659 . 4 1 1 A 54 54 ALA H H 188 8.895 8.455 0.440 1
1 660 . 4 1 1 A 54 54 ALA HA H 188 3.629 3.806 -0.177 1
1 664 . 4 1 1 A 54 54 ALA C C 188 179.437 179.121 0.316 1
1 665 . 4 1 1 A 54 54 ALA CA C 188 55.974 55.464 0.510 1
1 666 . 4 1 1 A 54 54 ALA CB C 188 17.591 18.493 -0.902 1
1 667 . 4 1 1 A 54 54 ALA N N 188 125.308 122.235 3.073 1
1 668 . 4 1 1 A 55 55 LYS H H 189 8.049 7.855 0.194 1
1 669 . 4 1 1 A 55 55 LYS HA H 189 4.106 3.895 0.211 1
1 678 . 4 1 1 A 55 55 LYS C C 189 178.995 178.447 0.548 1
1 679 . 4 1 1 A 55 55 LYS CA C 189 59.312 59.229 0.083 1
1 680 . 4 1 1 A 55 55 LYS CB C 189 32.647 31.901 0.746 1
1 684 . 4 1 1 A 55 55 LYS N N 189 116.835 118.339 -1.504 1
1 685 . 4 1 1 A 56 56 LYS H H 190 7.215 7.653 -0.438 1
1 686 . 4 1 1 A 56 56 LYS HA H 190 4.172 4.235 -0.063 1
1 695 . 4 1 1 A 56 56 LYS C C 190 177.897 178.016 -0.119 1
1 696 . 4 1 1 A 56 56 LYS CA C 190 58.418 58.282 0.136 1
1 697 . 4 1 1 A 56 56 LYS CB C 190 34.652 33.246 1.406 1
1 701 . 4 1 1 A 56 56 LYS N N 190 117.170 118.030 -0.860 1
1 702 . 4 1 1 A 57 57 GLU H H 191 8.572 7.852 0.720 1
1 703 . 4 1 1 A 57 57 GLU HA H 191 4.643 4.360 0.283 1
1 708 . 4 1 1 A 57 57 GLU C C 191 177.903 176.047 1.856 1
1 709 . 4 1 1 A 57 57 GLU CA C 191 55.708 56.007 -0.299 1
1 710 . 4 1 1 A 57 57 GLU CB C 191 32.460 30.974 1.486 1
1 712 . 4 1 1 A 57 57 GLU N N 191 113.316 116.680 -3.364 1
1 713 . 4 1 1 A 58 58 SER H H 192 8.550 7.611 0.939 1
1 714 . 4 1 1 A 58 58 SER HA H 192 4.149 4.362 -0.213 1
1 717 . 4 1 1 A 58 58 SER C C 192 176.161 175.106 1.055 1
1 718 . 4 1 1 A 58 58 SER CA C 192 58.403 58.053 0.350 1
1 719 . 4 1 1 A 58 58 SER CB C 192 64.392 64.378 0.014 1
1 720 . 4 1 1 A 58 58 SER N N 192 109.861 115.670 -5.809 1
1 721 . 4 1 1 A 59 59 MET H H 193 9.533 8.917 0.616 1
1 722 . 4 1 1 A 59 59 MET HA H 193 4.457 4.595 -0.138 1
1 730 . 4 1 1 A 59 59 MET C C 193 175.204 175.587 -0.383 1
1 731 . 4 1 1 A 59 59 MET CA C 193 55.781 55.262 0.519 1
1 732 . 4 1 1 A 59 59 MET CB C 193 32.855 32.531 0.324 1
1 735 . 4 1 1 A 59 59 MET N N 193 124.493 123.558 0.935 1
1 736 . 4 1 1 A 60 60 ASP H H 194 7.514 7.384 0.130 1
1 737 . 4 1 1 A 60 60 ASP HA H 194 4.886 4.583 0.303 1
1 740 . 4 1 1 A 60 60 ASP C C 194 175.517 176.615 -1.098 1
1 741 . 4 1 1 A 60 60 ASP CA C 194 52.286 53.379 -1.093 1
1 742 . 4 1 1 A 60 60 ASP CB C 194 40.222 40.350 -0.128 1
1 743 . 4 1 1 A 60 60 ASP N N 194 117.785 122.039 -4.254 1
1 744 . 4 1 1 A 61 61 THR H H 195 8.118 7.726 0.392 1
1 745 . 4 1 1 A 61 61 THR HA H 195 3.918 3.820 0.098 1
1 750 . 4 1 1 A 61 61 THR C C 195 176.269 176.976 -0.707 1
1 751 . 4 1 1 A 61 61 THR CA C 195 65.469 66.550 -1.081 1
1 752 . 4 1 1 A 61 61 THR CB C 195 68.741 68.204 0.537 1
1 754 . 4 1 1 A 61 61 THR N N 195 120.765 118.219 2.546 1
1 755 . 4 1 1 A 62 62 GLY H H 196 8.399 8.461 -0.062 1
1 756 . 4 1 1 A 62 62 GLY HA2 H 196 3.932 3.837 0.095 1
1 757 . 4 1 1 A 62 62 GLY HA3 H 196 3.900 3.838 0.062 1
1 758 . 4 1 1 A 62 62 GLY C C 196 174.948 175.927 -0.979 1
1 759 . 4 1 1 A 62 62 GLY CA C 196 46.768 47.669 -0.901 1
1 760 . 4 1 1 A 62 62 GLY N N 196 108.183 108.613 -0.430 1
1 761 . 4 1 1 A 63 63 SER H H 197 7.265 8.432 -1.167 1
1 762 . 4 1 1 A 63 63 SER HA H 197 4.554 4.206 0.348 1
1 765 . 4 1 1 A 63 63 SER C C 197 177.630 177.051 0.579 1
1 766 . 4 1 1 A 63 63 SER CA C 197 59.550 61.222 -1.672 1
1 767 . 4 1 1 A 63 63 SER CB C 197 65.504 63.016 2.488 1
1 768 . 4 1 1 A 63 63 SER N N 197 111.815 116.902 -5.087 1
1 769 . 4 1 1 A 64 64 ALA H H 198 8.675 8.471 0.204 1
1 770 . 4 1 1 A 64 64 ALA HA H 198 3.801 3.956 -0.155 1
1 774 . 4 1 1 A 64 64 ALA C C 198 178.492 179.351 -0.859 1
1 775 . 4 1 1 A 64 64 ALA CA C 198 56.794 55.390 1.404 1
1 776 . 4 1 1 A 64 64 ALA CB C 198 18.951 18.313 0.638 1
1 777 . 4 1 1 A 64 64 ALA N N 198 131.710 123.604 8.106 1
1 778 . 4 1 1 A 65 65 LYS H H 199 7.666 7.989 -0.323 1
1 779 . 4 1 1 A 65 65 LYS HA H 199 4.175 4.020 0.155 1
1 788 . 4 1 1 A 65 65 LYS C C 199 177.159 177.765 -0.606 1
1 789 . 4 1 1 A 65 65 LYS CA C 199 57.735 59.111 -1.376 1
1 790 . 4 1 1 A 65 65 LYS CB C 199 31.948 31.860 0.088 1
1 794 . 4 1 1 A 65 65 LYS N N 199 111.375 118.414 -7.039 1
1 795 . 4 1 1 A 66 66 LYS H H 200 7.545 7.506 0.039 1
1 796 . 4 1 1 A 66 66 LYS HA H 200 4.612 4.444 0.168 1
1 805 . 4 1 1 A 66 66 LYS C C 200 175.609 175.010 0.599 1
1 806 . 4 1 1 A 66 66 LYS CA C 200 54.468 55.813 -1.345 1
1 807 . 4 1 1 A 66 66 LYS CB C 200 31.525 32.178 -0.653 1
1 811 . 4 1 1 A 66 66 LYS N N 200 121.421 116.195 5.226 1
1 812 . 4 1 1 A 67 67 ASP H H 201 7.630 8.088 -0.458 1
1 813 . 4 1 1 A 67 67 ASP HA H 201 4.306 4.373 -0.067 1
1 816 . 4 1 1 A 67 67 ASP C C 201 175.025 176.301 -1.276 1
1 817 . 4 1 1 A 67 67 ASP CA C 201 56.400 55.373 1.027 1
1 818 . 4 1 1 A 67 67 ASP CB C 201 38.315 39.064 -0.749 1
1 819 . 4 1 1 A 67 67 ASP N N 201 116.216 116.905 -0.689 1
1 820 . 4 1 1 A 68 68 GLY H H 202 8.368 8.585 -0.217 1
1 821 . 4 1 1 A 68 68 GLY HA2 H 202 4.316 3.959 0.357 1
1 822 . 4 1 1 A 68 68 GLY HA3 H 202 3.731 4.066 -0.335 1
1 823 . 4 1 1 A 68 68 GLY C C 202 174.139 174.406 -0.267 1
1 824 . 4 1 1 A 68 68 GLY CA C 202 45.514 45.399 0.115 1
1 825 . 4 1 1 A 68 68 GLY N N 202 105.095 105.093 0.002 1
1 826 . 4 1 1 A 69 69 GLU H H 203 7.534 7.682 -0.148 1
1 827 . 4 1 1 A 69 69 GLU HA H 203 4.479 4.379 0.100 1
1 832 . 4 1 1 A 69 69 GLU C C 203 176.961 176.619 0.342 1
1 833 . 4 1 1 A 69 69 GLU CA C 203 58.549 57.060 1.489 1
1 834 . 4 1 1 A 69 69 GLU CB C 203 30.998 30.455 0.543 1
1 836 . 4 1 1 A 69 69 GLU N N 203 120.426 120.851 -0.425 1
1 837 . 4 1 1 A 70 70 LEU H H 204 8.962 8.955 0.007 1
1 838 . 4 1 1 A 70 70 LEU HA H 204 4.438 4.592 -0.154 1
1 848 . 4 1 1 A 70 70 LEU C C 204 178.648 177.208 1.440 1
1 849 . 4 1 1 A 70 70 LEU CA C 204 53.977 55.100 -1.123 1
1 850 . 4 1 1 A 70 70 LEU CB C 204 43.612 43.591 0.021 1
1 854 . 4 1 1 A 70 70 LEU N N 204 122.066 125.656 -3.590 1
1 855 . 4 1 1 A 71 71 GLY H H 205 8.104 7.471 0.633 1
1 856 . 4 1 1 A 71 71 GLY HA2 H 205 4.165 4.066 0.099 1
1 857 . 4 1 1 A 71 71 GLY HA3 H 205 3.552 4.141 -0.589 1
1 858 . 4 1 1 A 71 71 GLY C C 205 173.098 173.367 -0.269 1
1 859 . 4 1 1 A 71 71 GLY CA C 205 44.723 45.185 -0.462 1
1 860 . 4 1 1 A 71 71 GLY N N 205 110.168 106.662 3.506 1
1 861 . 4 1 1 A 72 72 TYR H H 206 8.457 8.668 -0.211 1
1 862 . 4 1 1 A 72 72 TYR HA H 206 4.184 4.767 -0.583 1
1 869 . 4 1 1 A 72 72 TYR C C 206 175.975 175.654 0.321 1
1 870 . 4 1 1 A 72 72 TYR CA C 206 59.722 59.068 0.654 1
1 871 . 4 1 1 A 72 72 TYR CB C 206 38.378 38.642 -0.264 1
1 874 . 4 1 1 A 72 72 TYR N N 206 120.171 122.118 -1.947 1
1 875 . 4 1 1 A 73 73 VAL H H 207 8.782 9.232 -0.450 1
1 876 . 4 1 1 A 73 73 VAL HA H 207 4.056 4.502 -0.446 1
1 884 . 4 1 1 A 73 73 VAL C C 207 174.901 175.591 -0.690 1
1 885 . 4 1 1 A 73 73 VAL CA C 207 62.202 62.347 -0.145 1
1 886 . 4 1 1 A 73 73 VAL CB C 207 33.071 32.176 0.895 1
1 889 . 4 1 1 A 73 73 VAL N N 207 128.847 124.634 4.213 1
1 890 . 4 1 1 A 74 74 LEU H H 208 8.146 8.868 -0.722 1
1 891 . 4 1 1 A 74 74 LEU HA H 208 4.944 4.564 0.380 1
1 901 . 4 1 1 A 74 74 LEU C C 208 178.400 177.353 1.047 1
1 902 . 4 1 1 A 74 74 LEU CA C 208 53.520 54.234 -0.714 1
1 903 . 4 1 1 A 74 74 LEU CB C 208 43.499 42.306 1.193 1
1 907 . 4 1 1 A 74 74 LEU N N 208 127.599 129.392 -1.793 1
1 908 . 4 1 1 A 75 75 LYS H H 209 8.403 8.717 -0.314 1
1 909 . 4 1 1 A 75 75 LYS HA H 209 3.771 3.851 -0.080 1
1 918 . 4 1 1 A 75 75 LYS C C 209 177.536 177.485 0.051 1
1 919 . 4 1 1 A 75 75 LYS CA C 209 58.385 59.034 -0.649 1
1 920 . 4 1 1 A 75 75 LYS CB C 209 32.459 32.198 0.261 1
1 924 . 4 1 1 A 75 75 LYS N N 209 123.798 122.831 0.967 1
1 925 . 4 1 1 A 76 76 GLY H H 210 9.997 9.239 0.758 1
1 926 . 4 1 1 A 76 76 GLY HA2 H 210 4.255 4.013 0.242 1
1 927 . 4 1 1 A 76 76 GLY HA3 H 210 3.791 4.013 -0.222 1
1 928 . 4 1 1 A 76 76 GLY C C 210 175.091 175.750 -0.659 1
1 929 . 4 1 1 A 76 76 GLY CA C 210 45.465 45.427 0.038 1
1 930 . 4 1 1 A 76 76 GLY N N 210 114.705 113.461 1.244 1
1 931 . 4 1 1 A 77 77 GLN H H 211 7.726 8.153 -0.427 1
1 932 . 4 1 1 A 77 77 GLN HA H 211 4.373 4.171 0.202 1
1 939 . 4 1 1 A 77 77 GLN C C 211 176.301 175.947 0.354 1
1 940 . 4 1 1 A 77 77 GLN CA C 211 57.074 58.217 -1.143 1
1 941 . 4 1 1 A 77 77 GLN CB C 211 30.798 28.845 1.953 1
1 943 . 4 1 1 A 77 77 GLN N N 211 118.702 118.000 0.702 1
1 945 . 4 1 1 A 78 78 THR H H 212 8.225 7.517 0.708 1
1 946 . 4 1 1 A 78 78 THR HA H 212 4.620 4.499 0.121 1
1 951 . 4 1 1 A 78 78 THR C C 212 173.920 174.207 -0.287 1
1 952 . 4 1 1 A 78 78 THR CA C 212 60.087 59.917 0.170 1
1 953 . 4 1 1 A 78 78 THR CB C 212 71.412 70.862 0.550 1
1 955 . 4 1 1 A 78 78 THR N N 212 111.935 111.355 0.580 1
1 956 . 4 1 1 A 79 79 ASP H H 213 8.372 8.473 -0.101 1
1 957 . 4 1 1 A 79 79 ASP HA H 213 4.470 4.533 -0.063 1
1 960 . 4 1 1 A 79 79 ASP C C 213 176.759 177.260 -0.501 1
1 961 . 4 1 1 A 79 79 ASP CA C 213 54.927 54.351 0.576 1
1 962 . 4 1 1 A 79 79 ASP CB C 213 43.859 41.461 2.398 1
1 963 . 4 1 1 A 79 79 ASP N N 213 122.093 121.430 0.663 1
1 964 . 4 1 1 A 80 80 LYS H H 214 8.740 8.843 -0.103 1
1 965 . 4 1 1 A 80 80 LYS HA H 214 4.027 4.002 0.025 1
1 974 . 4 1 1 A 80 80 LYS C C 214 178.493 177.982 0.511 1
1 975 . 4 1 1 A 80 80 LYS CA C 214 59.802 59.407 0.395 1
1 976 . 4 1 1 A 80 80 LYS CB C 214 32.374 32.183 0.191 1
1 980 . 4 1 1 A 80 80 LYS N N 214 124.685 123.474 1.211 1
1 981 . 4 1 1 A 81 81 ASP H H 215 8.556 8.158 0.398 1
1 982 . 4 1 1 A 81 81 ASP HA H 215 4.566 4.365 0.201 1
1 985 . 4 1 1 A 81 81 ASP C C 215 178.889 178.786 0.103 1
1 986 . 4 1 1 A 81 81 ASP CA C 215 58.046 57.547 0.499 1
1 987 . 4 1 1 A 81 81 ASP CB C 215 40.872 40.866 0.006 1
1 988 . 4 1 1 A 81 81 ASP N N 215 121.413 119.495 1.918 1
1 989 . 4 1 1 A 82 82 PHE H H 216 8.205 8.368 -0.163 1
1 990 . 4 1 1 A 82 82 PHE HA H 216 3.686 4.069 -0.383 1
1 998 . 4 1 1 A 82 82 PHE C C 216 175.919 177.398 -1.479 1
1 999 . 4 1 1 A 82 82 PHE CA C 216 61.648 60.953 0.695 1
1 1000 . 4 1 1 A 82 82 PHE CB C 216 39.743 39.299 0.444 1
1 1004 . 4 1 1 A 82 82 PHE N N 216 124.401 122.009 2.392 1
1 1005 . 4 1 1 A 83 83 GLU H H 217 8.887 8.843 0.044 1
1 1006 . 4 1 1 A 83 83 GLU HA H 217 3.704 4.171 -0.467 1
1 1011 . 4 1 1 A 83 83 GLU C C 217 177.788 178.910 -1.122 1
1 1012 . 4 1 1 A 83 83 GLU CA C 217 60.545 60.281 0.264 1
1 1013 . 4 1 1 A 83 83 GLU CB C 217 30.639 29.504 1.135 1
1 1015 . 4 1 1 A 83 83 GLU N N 217 119.421 119.095 0.326 1
1 1016 . 4 1 1 A 84 84 LYS H H 218 8.055 8.076 -0.021 1
1 1017 . 4 1 1 A 84 84 LYS HA H 218 3.947 4.135 -0.188 1
1 1026 . 4 1 1 A 84 84 LYS C C 218 178.783 178.352 0.431 1
1 1027 . 4 1 1 A 84 84 LYS CA C 218 59.327 58.968 0.359 1
1 1028 . 4 1 1 A 84 84 LYS CB C 218 32.539 32.243 0.296 1
1 1032 . 4 1 1 A 84 84 LYS N N 218 117.821 119.583 -1.762 1
1 1033 . 4 1 1 A 85 85 ALA H H 219 7.059 7.713 -0.654 1
1 1034 . 4 1 1 A 85 85 ALA HA H 219 4.040 4.091 -0.051 1
1 1038 . 4 1 1 A 85 85 ALA C C 219 179.794 179.733 0.061 1
1 1039 . 4 1 1 A 85 85 ALA CA C 219 54.407 54.460 -0.053 1
1 1040 . 4 1 1 A 85 85 ALA CB C 219 20.130 18.302 1.828 1
1 1041 . 4 1 1 A 85 85 ALA N N 219 118.905 121.158 -2.253 1
1 1042 . 4 1 1 A 86 86 LEU H H 220 8.157 8.184 -0.027 1
1 1043 . 4 1 1 A 86 86 LEU HA H 220 3.692 3.981 -0.289 1
1 1053 . 4 1 1 A 86 86 LEU C C 220 178.330 178.497 -0.167 1
1 1054 . 4 1 1 A 86 86 LEU CA C 220 57.752 57.731 0.021 1
1 1055 . 4 1 1 A 86 86 LEU CB C 220 41.464 41.904 -0.440 1
1 1059 . 4 1 1 A 86 86 LEU N N 220 118.606 120.621 -2.015 1
1 1060 . 4 1 1 A 87 87 PHE H H 221 8.349 8.211 0.138 1
1 1061 . 4 1 1 A 87 87 PHE HA H 221 3.861 4.458 -0.597 1
1 1069 . 4 1 1 A 87 87 PHE C C 221 176.176 177.989 -1.813 1
1 1070 . 4 1 1 A 87 87 PHE CA C 221 61.780 61.679 0.101 1
1 1071 . 4 1 1 A 87 87 PHE CB C 221 37.549 37.669 -0.120 1
1 1075 . 4 1 1 A 87 87 PHE N N 221 112.449 117.035 -4.586 1
1 1076 . 4 1 1 A 88 88 LYS H H 222 7.061 8.251 -1.190 1
1 1077 . 4 1 1 A 88 88 LYS HA H 222 4.380 4.058 0.322 1
1 1086 . 4 1 1 A 88 88 LYS C C 222 177.089 177.038 0.051 1
1 1087 . 4 1 1 A 88 88 LYS CA C 222 56.726 59.045 -2.319 1
1 1088 . 4 1 1 A 88 88 LYS CB C 222 33.738 32.300 1.438 1
1 1092 . 4 1 1 A 88 88 LYS N N 222 118.308 121.657 -3.349 1
1 1093 . 4 1 1 A 89 89 LEU H H 223 7.270 7.496 -0.226 1
1 1094 . 4 1 1 A 89 89 LEU HA H 223 4.168 4.223 -0.055 1
1 1104 . 4 1 1 A 89 89 LEU C C 223 177.528 176.732 0.796 1
1 1105 . 4 1 1 A 89 89 LEU CA C 223 55.279 54.517 0.762 1
1 1106 . 4 1 1 A 89 89 LEU CB C 223 43.240 42.540 0.700 1
1 1110 . 4 1 1 A 89 89 LEU N N 223 121.317 121.428 -0.111 1
1 1111 . 4 1 1 A 90 90 LYS H H 224 8.788 8.420 0.368 1
1 1112 . 4 1 1 A 90 90 LYS HA H 224 4.359 4.490 -0.131 1
1 1121 . 4 1 1 A 90 90 LYS C C 224 175.839 176.442 -0.603 1
1 1122 . 4 1 1 A 90 90 LYS CA C 224 54.772 55.147 -0.375 1
1 1123 . 4 1 1 A 90 90 LYS CB C 224 33.232 33.567 -0.335 1
1 1127 . 4 1 1 A 90 90 LYS N N 224 123.558 122.159 1.399 1
1 1128 . 4 1 1 A 91 91 ASP H H 225 8.125 8.769 -0.644 1
1 1129 . 4 1 1 A 91 91 ASP HA H 225 3.958 4.152 -0.194 1
1 1132 . 4 1 1 A 91 91 ASP C C 225 177.452 177.133 0.319 1
1 1133 . 4 1 1 A 91 91 ASP CA C 225 56.642 56.263 0.379 1
1 1134 . 4 1 1 A 91 91 ASP CB C 225 40.269 40.173 0.096 1
1 1135 . 4 1 1 A 91 91 ASP N N 225 119.419 121.840 -2.421 1
1 1136 . 4 1 1 A 92 92 GLY H H 226 8.681 8.752 -0.071 1
1 1137 . 4 1 1 A 92 92 GLY HA2 H 226 4.131 3.837 0.294 1
1 1138 . 4 1 1 A 92 92 GLY HA3 H 226 3.579 3.864 -0.285 1
1 1139 . 4 1 1 A 92 92 GLY C C 226 173.614 174.084 -0.470 1
1 1140 . 4 1 1 A 92 92 GLY CA C 226 45.564 45.189 0.375 1
1 1141 . 4 1 1 A 92 92 GLY N N 226 113.802 111.866 1.936 1
1 1142 . 4 1 1 A 93 93 GLU H H 227 8.104 8.078 0.026 1
1 1143 . 4 1 1 A 93 93 GLU HA H 227 4.232 4.411 -0.179 1
1 1148 . 4 1 1 A 93 93 GLU C C 227 174.282 175.681 -1.399 1
1 1149 . 4 1 1 A 93 93 GLU CA C 227 56.651 56.227 0.424 1
1 1150 . 4 1 1 A 93 93 GLU CB C 227 32.190 31.187 1.003 1
1 1152 . 4 1 1 A 93 93 GLU N N 227 121.527 121.933 -0.406 1
1 1153 . 4 1 1 A 94 94 VAL H H 228 7.918 8.565 -0.647 1
1 1154 . 4 1 1 A 94 94 VAL HA H 228 4.857 4.747 0.110 1
1 1162 . 4 1 1 A 94 94 VAL C C 228 176.556 175.641 0.915 1
1 1163 . 4 1 1 A 94 94 VAL CA C 228 60.309 60.479 -0.170 1
1 1164 . 4 1 1 A 94 94 VAL CB C 228 33.847 35.386 -1.539 1
1 1167 . 4 1 1 A 94 94 VAL N N 228 119.768 125.885 -6.117 1
1 1168 . 4 1 1 A 95 95 SER H H 229 9.659 9.424 0.235 1
1 1169 . 4 1 1 A 95 95 SER HA H 229 4.313 4.670 -0.357 1
1 1172 . 4 1 1 A 95 95 SER C C 229 174.641 174.502 0.139 1
1 1173 . 4 1 1 A 95 95 SER CA C 229 59.208 57.871 1.337 1
1 1174 . 4 1 1 A 95 95 SER CB C 229 66.080 65.736 0.344 1
1 1175 . 4 1 1 A 95 95 SER N N 229 124.903 121.460 3.443 1
1 1176 . 4 1 1 A 96 96 GLU H H 230 8.014 8.649 -0.635 1
1 1177 . 4 1 1 A 96 96 GLU HA H 230 4.376 4.395 -0.019 1
1 1182 . 4 1 1 A 96 96 GLU C C 230 176.641 177.146 -0.505 1
1 1183 . 4 1 1 A 96 96 GLU CA C 230 56.236 56.584 -0.348 1
1 1184 . 4 1 1 A 96 96 GLU CB C 230 30.324 30.722 -0.398 1
1 1186 . 4 1 1 A 96 96 GLU N N 230 115.510 121.044 -5.534 1
1 1187 . 4 1 1 A 97 97 VAL H H 231 8.741 7.856 0.885 1
1 1188 . 4 1 1 A 97 97 VAL HA H 231 4.171 4.127 0.044 1
1 1196 . 4 1 1 A 97 97 VAL C C 231 176.684 175.690 0.994 1
1 1197 . 4 1 1 A 97 97 VAL CA C 231 65.418 63.217 2.201 1
1 1198 . 4 1 1 A 97 97 VAL CB C 231 31.218 31.462 -0.244 1
1 1201 . 4 1 1 A 97 97 VAL N N 231 121.289 121.570 -0.281 1
1 1202 . 4 1 1 A 98 98 VAL H H 232 9.218 9.478 -0.260 1
1 1203 . 4 1 1 A 98 98 VAL HA H 232 4.405 4.666 -0.261 1
1 1211 . 4 1 1 A 98 98 VAL C C 232 174.258 174.277 -0.019 1
1 1212 . 4 1 1 A 98 98 VAL CA C 232 60.937 61.151 -0.214 1
1 1213 . 4 1 1 A 98 98 VAL CB C 232 35.825 33.820 2.005 1
1 1216 . 4 1 1 A 98 98 VAL N N 232 130.544 128.870 1.674 1
1 1217 . 4 1 1 A 99 99 LYS H H 233 8.800 8.844 -0.044 1
1 1218 . 4 1 1 A 99 99 LYS HA H 233 4.853 5.295 -0.442 1
1 1227 . 4 1 1 A 99 99 LYS C C 233 175.274 174.929 0.345 1
1 1228 . 4 1 1 A 99 99 LYS CA C 233 55.499 54.805 0.694 1
1 1229 . 4 1 1 A 99 99 LYS CB C 233 34.452 35.456 -1.004 1
1 1233 . 4 1 1 A 99 99 LYS N N 233 130.477 128.055 2.422 1
1 1234 . 4 1 1 A 100 100 SER H H 234 9.585 9.027 0.558 1
1 1235 . 4 1 1 A 100 100 SER HA H 234 5.150 4.912 0.238 1
1 1238 . 4 1 1 A 100 100 SER C C 234 175.493 174.266 1.227 1
1 1239 . 4 1 1 A 100 100 SER CA C 234 56.927 57.252 -0.325 1
1 1240 . 4 1 1 A 100 100 SER CB C 234 67.309 66.950 0.359 1
1 1241 . 4 1 1 A 100 100 SER N N 234 125.814 123.855 1.959 1
1 1242 . 4 1 1 A 101 101 SER H H 235 8.631 8.640 -0.009 1
1 1243 . 4 1 1 A 101 101 SER HA H 235 4.106 4.060 0.046 1
1 1246 . 4 1 1 A 101 101 SER C C 235 175.385 175.008 0.377 1
1 1247 . 4 1 1 A 101 101 SER CA C 235 61.123 61.694 -0.571 1
1 1248 . 4 1 1 A 101 101 SER CB C 235 62.818 62.475 0.343 1
1 1249 . 4 1 1 A 101 101 SER N N 235 115.089 116.800 -1.711 1
1 1250 . 4 1 1 A 102 102 PHE H H 236 8.957 7.704 1.253 1
1 1251 . 4 1 1 A 102 102 PHE HA H 236 4.610 4.653 -0.043 1
1 1259 . 4 1 1 A 102 102 PHE C C 236 176.453 175.570 0.883 1
1 1260 . 4 1 1 A 102 102 PHE CA C 236 58.382 58.019 0.363 1
1 1261 . 4 1 1 A 102 102 PHE CB C 236 40.275 39.924 0.351 1
1 1263 . 4 1 1 A 102 102 PHE N N 236 119.917 116.974 2.943 1
1 1264 . 4 1 1 A 103 103 GLY H H 237 7.377 7.138 0.239 1
1 1265 . 4 1 1 A 103 103 GLY HA2 H 237 4.453 3.938 0.515 1
1 1266 . 4 1 1 A 103 103 GLY HA3 H 237 3.472 4.104 -0.632 1
1 1267 . 4 1 1 A 103 103 GLY C C 237 169.627 172.351 -2.724 1
1 1268 . 4 1 1 A 103 103 GLY CA C 237 45.384 44.520 0.864 1
1 1269 . 4 1 1 A 103 103 GLY N N 237 108.809 106.169 2.640 1
1 1270 . 4 1 1 A 104 104 TYR H H 238 8.632 8.405 0.227 1
1 1271 . 4 1 1 A 104 104 TYR HA H 238 5.322 5.437 -0.115 1
1 1278 . 4 1 1 A 104 104 TYR C C 238 175.043 175.029 0.014 1
1 1279 . 4 1 1 A 104 104 TYR CA C 238 57.627 57.738 -0.111 1
1 1280 . 4 1 1 A 104 104 TYR CB C 238 41.711 41.520 0.191 1
1 1283 . 4 1 1 A 104 104 TYR N N 238 120.030 121.819 -1.789 1
1 1284 . 4 1 1 A 105 105 HIS H H 239 10.070 9.453 0.617 1
1 1285 . 4 1 1 A 105 105 HIS HA H 239 6.046 5.575 0.471 1
1 1290 . 4 1 1 A 105 105 HIS C C 239 175.734 174.738 0.996 1
1 1291 . 4 1 1 A 105 105 HIS CA C 239 53.945 54.574 -0.629 1
1 1292 . 4 1 1 A 105 105 HIS CB C 239 32.450 34.364 -1.914 1
1 1295 . 4 1 1 A 105 105 HIS N N 239 119.504 118.459 1.045 1
1 1296 . 4 1 1 A 106 106 ILE H H 240 8.660 8.888 -0.228 1
1 1297 . 4 1 1 A 106 106 ILE HA H 240 4.120 4.866 -0.746 1
1 1307 . 4 1 1 A 106 106 ILE C C 240 174.758 175.314 -0.556 1
1 1308 . 4 1 1 A 106 106 ILE CA C 240 63.446 60.040 3.406 1
1 1309 . 4 1 1 A 106 106 ILE CB C 240 40.786 41.719 -0.933 1
1 1313 . 4 1 1 A 106 106 ILE N N 240 120.639 120.334 0.305 1
1 1314 . 4 1 1 A 107 107 ILE H H 241 9.033 9.046 -0.013 1
1 1315 . 4 1 1 A 107 107 ILE HA H 241 4.799 5.113 -0.314 1
1 1325 . 4 1 1 A 107 107 ILE C C 241 172.880 173.934 -1.054 1
1 1326 . 4 1 1 A 107 107 ILE CA C 241 60.563 59.718 0.845 1
1 1327 . 4 1 1 A 107 107 ILE CB C 241 41.652 40.892 0.760 1
1 1331 . 4 1 1 A 107 107 ILE N N 241 129.098 127.131 1.967 1
1 1332 . 4 1 1 A 108 108 LYS H H 242 8.692 9.050 -0.358 1
1 1333 . 4 1 1 A 108 108 LYS HA H 242 5.012 4.930 0.082 1
1 1342 . 4 1 1 A 108 108 LYS C C 242 174.484 175.751 -1.267 1
1 1343 . 4 1 1 A 108 108 LYS CA C 242 54.317 53.928 0.389 1
1 1344 . 4 1 1 A 108 108 LYS CB C 242 35.619 35.506 0.113 1
1 1348 . 4 1 1 A 108 108 LYS N N 242 127.179 127.960 -0.781 1
1 1349 . 4 1 1 A 109 109 ALA H H 243 7.816 8.975 -1.159 1
1 1350 . 4 1 1 A 109 109 ALA HA H 243 4.604 4.470 0.134 1
1 1354 . 4 1 1 A 109 109 ALA C C 243 176.231 176.340 -0.109 1
1 1355 . 4 1 1 A 109 109 ALA CA C 243 50.505 51.298 -0.793 1
1 1356 . 4 1 1 A 109 109 ALA CB C 243 19.584 19.598 -0.014 1
1 1357 . 4 1 1 A 109 109 ALA N N 243 129.619 127.975 1.644 1
1 1358 . 4 1 1 A 110 110 ASP H H 244 7.578 8.684 -1.106 1
1 1359 . 4 1 1 A 110 110 ASP HA H 244 4.424 5.137 -0.713 1
1 1362 . 4 1 1 A 110 110 ASP C C 244 175.259 174.874 0.385 1
1 1363 . 4 1 1 A 110 110 ASP CA C 244 54.489 52.338 2.151 1
1 1364 . 4 1 1 A 110 110 ASP CB C 244 42.693 44.781 -2.088 1
1 1365 . 4 1 1 A 110 110 ASP N N 244 125.434 122.050 3.384 1
1 4 . 5 1 1 A 2 2 PRO HA H -4 4.403 4.843 -0.440 1
1 11 . 5 1 1 A 2 2 PRO C C -4 176.990 175.389 1.601 1
1 12 . 5 1 1 A 2 2 PRO CA C -4 63.131 62.919 0.212 1
1 13 . 5 1 1 A 2 2 PRO CB C -4 32.342 32.925 -0.583 1
1 16 . 5 1 1 A 3 3 LEU H H -3 8.483 8.604 -0.121 1
1 17 . 5 1 1 A 3 3 LEU HA H -3 4.333 4.795 -0.462 1
1 27 . 5 1 1 A 3 3 LEU C C -3 177.991 174.566 3.425 1
1 28 . 5 1 1 A 3 3 LEU CA C -3 55.314 54.023 1.291 1
1 29 . 5 1 1 A 3 3 LEU CB C -3 42.244 45.892 -3.648 1
1 33 . 5 1 1 A 3 3 LEU N N -3 122.986 122.109 0.877 1
1 34 . 5 1 1 A 4 4 GLY H H -2 8.397 8.209 0.188 1
1 35 . 5 1 1 A 4 4 GLY HA2 H -2 4.024 3.814 0.210 1
1 36 . 5 1 1 A 4 4 GLY HA3 H -2 3.976 3.959 0.017 1
1 37 . 5 1 1 A 4 4 GLY C C -2 174.360 171.714 2.646 1
1 38 . 5 1 1 A 4 4 GLY CA C -2 45.434 45.456 -0.022 1
1 39 . 5 1 1 A 4 4 GLY N N -2 110.666 111.318 -0.652 1
1 56 . 5 1 1 A 7 7 SER H H 141 7.913 7.694 0.219 1
1 57 . 5 1 1 A 7 7 SER HA H 141 5.657 5.237 0.420 1
1 60 . 5 1 1 A 7 7 SER C C 141 173.753 172.287 1.466 1
1 61 . 5 1 1 A 7 7 SER CA C 141 56.758 57.769 -1.011 1
1 62 . 5 1 1 A 7 7 SER CB C 141 66.774 65.758 1.016 1
1 63 . 5 1 1 A 7 7 SER N N 141 113.824 111.951 1.873 1
1 64 . 5 1 1 A 8 8 LYS H H 142 8.656 8.029 0.627 1
1 65 . 5 1 1 A 8 8 LYS HA H 142 4.543 4.879 -0.336 1
1 74 . 5 1 1 A 8 8 LYS C C 142 174.403 175.127 -0.724 1
1 75 . 5 1 1 A 8 8 LYS CA C 142 55.578 54.162 1.416 1
1 76 . 5 1 1 A 8 8 LYS CB C 142 36.561 35.193 1.368 1
1 80 . 5 1 1 A 8 8 LYS N N 142 123.076 120.045 3.031 1
1 81 . 5 1 1 A 9 9 LYS H H 143 8.623 8.694 -0.071 1
1 82 . 5 1 1 A 9 9 LYS HA H 143 4.119 4.532 -0.413 1
1 91 . 5 1 1 A 9 9 LYS C C 143 176.144 175.632 0.512 1
1 92 . 5 1 1 A 9 9 LYS CA C 143 56.683 56.176 0.507 1
1 93 . 5 1 1 A 9 9 LYS CB C 143 32.580 32.679 -0.099 1
1 97 . 5 1 1 A 9 9 LYS N N 143 129.542 123.736 5.806 1
1 98 . 5 1 1 A 10 10 ALA H H 144 8.151 8.724 -0.573 1
1 99 . 5 1 1 A 10 10 ALA HA H 144 5.208 4.876 0.332 1
1 103 . 5 1 1 A 10 10 ALA C C 144 175.577 175.041 0.536 1
1 104 . 5 1 1 A 10 10 ALA CA C 144 51.226 51.260 -0.034 1
1 105 . 5 1 1 A 10 10 ALA CB C 144 25.299 24.038 1.261 1
1 106 . 5 1 1 A 10 10 ALA N N 144 127.933 127.902 0.031 1
1 107 . 5 1 1 A 11 11 SER H H 145 8.679 8.813 -0.134 1
1 108 . 5 1 1 A 11 11 SER HA H 145 5.431 5.875 -0.444 1
1 111 . 5 1 1 A 11 11 SER C C 145 173.072 173.229 -0.157 1
1 112 . 5 1 1 A 11 11 SER CA C 145 57.772 57.167 0.605 1
1 113 . 5 1 1 A 11 11 SER CB C 145 67.301 66.277 1.024 1
1 114 . 5 1 1 A 11 11 SER N N 145 116.245 115.474 0.771 1
1 115 . 5 1 1 A 12 12 HIS H H 146 9.962 9.606 0.356 1
1 116 . 5 1 1 A 12 12 HIS HA H 146 6.332 6.052 0.280 1
1 121 . 5 1 1 A 12 12 HIS C C 146 173.006 172.180 0.826 1
1 122 . 5 1 1 A 12 12 HIS CA C 146 55.020 54.269 0.751 1
1 123 . 5 1 1 A 12 12 HIS CB C 146 37.071 33.164 3.907 1
1 126 . 5 1 1 A 12 12 HIS N N 146 119.181 118.426 0.755 1
1 127 . 5 1 1 A 13 13 ILE H H 147 8.976 9.017 -0.041 1
1 128 . 5 1 1 A 13 13 ILE HA H 147 3.528 4.647 -1.119 1
1 138 . 5 1 1 A 13 13 ILE C C 147 173.010 174.001 -0.991 1
1 139 . 5 1 1 A 13 13 ILE CA C 147 61.273 59.706 1.567 1
1 140 . 5 1 1 A 13 13 ILE CB C 147 41.773 40.855 0.918 1
1 144 . 5 1 1 A 13 13 ILE N N 147 121.873 119.314 2.559 1
1 145 . 5 1 1 A 14 14 LEU H H 148 7.627 8.909 -1.282 1
1 146 . 5 1 1 A 14 14 LEU HA H 148 4.814 5.006 -0.192 1
1 156 . 5 1 1 A 14 14 LEU C C 148 174.112 174.363 -0.251 1
1 157 . 5 1 1 A 14 14 LEU CA C 148 52.574 52.954 -0.380 1
1 158 . 5 1 1 A 14 14 LEU CB C 148 45.643 44.948 0.695 1
1 162 . 5 1 1 A 14 14 LEU N N 148 127.112 129.672 -2.560 1
1 163 . 5 1 1 A 15 15 ILE H H 149 9.524 9.222 0.302 1
1 164 . 5 1 1 A 15 15 ILE HA H 149 4.362 4.709 -0.347 1
1 174 . 5 1 1 A 15 15 ILE C C 149 175.452 175.358 0.094 1
1 175 . 5 1 1 A 15 15 ILE CA C 149 58.516 60.350 -1.834 1
1 176 . 5 1 1 A 15 15 ILE CB C 149 36.560 40.105 -3.545 1
1 180 . 5 1 1 A 15 15 ILE N N 149 128.652 127.142 1.510 1
1 181 . 5 1 1 A 16 16 LYS H H 150 8.035 8.640 -0.605 1
1 182 . 5 1 1 A 16 16 LYS HA H 150 4.319 4.440 -0.121 1
1 191 . 5 1 1 A 16 16 LYS C C 150 175.038 176.361 -1.323 1
1 192 . 5 1 1 A 16 16 LYS CA C 150 57.817 56.703 1.114 1
1 193 . 5 1 1 A 16 16 LYS CB C 150 34.853 32.975 1.878 1
1 197 . 5 1 1 A 16 16 LYS N N 150 129.153 127.998 1.155 1
1 198 . 5 1 1 A 17 17 VAL H H 151 8.016 8.846 -0.830 1
1 199 . 5 1 1 A 17 17 VAL HA H 151 4.873 4.960 -0.087 1
1 207 . 5 1 1 A 17 17 VAL C C 151 176.647 175.262 1.385 1
1 208 . 5 1 1 A 17 17 VAL CA C 151 60.088 61.075 -0.987 1
1 209 . 5 1 1 A 17 17 VAL CB C 151 34.082 34.184 -0.102 1
1 212 . 5 1 1 A 17 17 VAL N N 151 121.288 123.851 -2.563 1
1 213 . 5 1 1 A 18 18 LYS H H 152 8.443 8.595 -0.152 1
1 214 . 5 1 1 A 18 18 LYS HA H 152 4.334 4.765 -0.431 1
1 223 . 5 1 1 A 18 18 LYS C C 152 176.345 177.135 -0.790 1
1 224 . 5 1 1 A 18 18 LYS CA C 152 57.016 54.482 2.534 1
1 225 . 5 1 1 A 18 18 LYS CB C 152 33.222 34.906 -1.684 1
1 229 . 5 1 1 A 18 18 LYS N N 152 128.408 126.971 1.437 1
1 230 . 5 1 1 A 19 19 SER H H 153 9.067 8.666 0.401 1
1 231 . 5 1 1 A 19 19 SER HA H 153 4.457 4.496 -0.039 1
1 234 . 5 1 1 A 19 19 SER C C 153 174.236 174.245 -0.009 1
1 235 . 5 1 1 A 19 19 SER CA C 153 59.642 59.751 -0.109 1
1 236 . 5 1 1 A 19 19 SER CB C 153 64.347 64.129 0.218 1
1 237 . 5 1 1 A 19 19 SER N N 153 121.522 116.253 5.269 1
1 238 . 5 1 1 A 20 20 LYS H H 154 7.961 7.572 0.389 1
1 239 . 5 1 1 A 20 20 LYS HA H 154 4.558 4.705 -0.147 1
1 244 . 5 1 1 A 20 20 LYS C C 154 177.256 176.764 0.492 1
1 245 . 5 1 1 A 20 20 LYS CA C 154 55.249 54.909 0.340 1
1 246 . 5 1 1 A 20 20 LYS CB C 154 34.531 35.722 -1.191 1
1 248 . 5 1 1 A 20 20 LYS N N 154 120.270 119.101 1.169 1
1 249 . 5 1 1 A 21 21 LYS HA H 155 4.003 4.037 -0.034 1
1 258 . 5 1 1 A 21 21 LYS C C 155 177.015 177.473 -0.458 1
1 259 . 5 1 1 A 21 21 LYS CA C 155 59.091 59.039 0.052 1
1 260 . 5 1 1 A 21 21 LYS CB C 155 32.394 32.020 0.374 1
1 264 . 5 1 1 A 22 22 SER H H 156 7.625 7.874 -0.249 1
1 265 . 5 1 1 A 22 22 SER HA H 156 4.293 4.397 -0.104 1
1 268 . 5 1 1 A 22 22 SER C C 156 174.843 174.524 0.319 1
1 269 . 5 1 1 A 22 22 SER CA C 156 57.966 58.329 -0.363 1
1 270 . 5 1 1 A 22 22 SER CB C 156 63.369 63.806 -0.437 1
1 271 . 5 1 1 A 22 22 SER N N 156 109.549 111.421 -1.872 1
1 272 . 5 1 1 A 23 23 ASP H H 157 7.701 7.198 0.503 1
1 273 . 5 1 1 A 23 23 ASP HA H 157 4.548 4.406 0.142 1
1 276 . 5 1 1 A 23 23 ASP C C 157 176.544 177.416 -0.872 1
1 277 . 5 1 1 A 23 23 ASP CA C 157 55.242 54.754 0.488 1
1 278 . 5 1 1 A 23 23 ASP CB C 157 41.103 42.037 -0.934 1
1 279 . 5 1 1 A 23 23 ASP N N 157 124.536 123.421 1.115 1
1 280 . 5 1 1 A 24 24 LYS H H 158 8.583 8.670 -0.087 1
1 281 . 5 1 1 A 24 24 LYS HA H 158 4.252 4.106 0.146 1
1 290 . 5 1 1 A 24 24 LYS C C 158 176.813 178.211 -1.398 1
1 291 . 5 1 1 A 24 24 LYS CA C 158 57.148 58.444 -1.296 1
1 292 . 5 1 1 A 24 24 LYS CB C 158 33.200 32.259 0.941 1
1 296 . 5 1 1 A 24 24 LYS N N 158 122.372 123.137 -0.765 1
1 297 . 5 1 1 A 25 25 GLU H H 159 8.001 8.466 -0.465 1
1 298 . 5 1 1 A 25 25 GLU HA H 159 4.521 4.384 0.137 1
1 303 . 5 1 1 A 25 25 GLU C C 159 175.995 176.161 -0.166 1
1 304 . 5 1 1 A 25 25 GLU CA C 159 55.727 57.695 -1.968 1
1 305 . 5 1 1 A 25 25 GLU CB C 159 31.918 31.312 0.606 1
1 307 . 5 1 1 A 25 25 GLU N N 159 118.705 119.198 -0.493 1
1 308 . 5 1 1 A 26 26 GLY H H 160 8.458 7.988 0.470 1
1 309 . 5 1 1 A 26 26 GLY HA2 H 160 3.946 4.070 -0.124 1
1 310 . 5 1 1 A 26 26 GLY HA3 H 160 3.511 4.078 -0.567 1
1 311 . 5 1 1 A 26 26 GLY C C 160 172.201 173.157 -0.956 1
1 312 . 5 1 1 A 26 26 GLY CA C 160 44.038 44.363 -0.325 1
1 313 . 5 1 1 A 26 26 GLY N N 160 107.642 108.947 -1.305 1
1 314 . 5 1 1 A 27 27 LEU H H 161 8.259 8.264 -0.005 1
1 315 . 5 1 1 A 27 27 LEU HA H 161 4.775 5.029 -0.254 1
1 325 . 5 1 1 A 27 27 LEU C C 161 177.422 175.474 1.948 1
1 326 . 5 1 1 A 27 27 LEU CA C 161 53.322 53.290 0.032 1
1 327 . 5 1 1 A 27 27 LEU CB C 161 45.576 43.967 1.609 1
1 331 . 5 1 1 A 27 27 LEU N N 161 119.856 121.149 -1.293 1
1 332 . 5 1 1 A 28 28 ASP H H 162 8.848 8.707 0.141 1
1 333 . 5 1 1 A 28 28 ASP HA H 162 4.644 4.745 -0.101 1
1 336 . 5 1 1 A 28 28 ASP C C 162 176.630 176.783 -0.153 1
1 337 . 5 1 1 A 28 28 ASP CA C 162 55.195 54.173 1.022 1
1 338 . 5 1 1 A 28 28 ASP CB C 162 41.673 42.393 -0.720 1
1 339 . 5 1 1 A 28 28 ASP N N 162 122.434 121.749 0.685 1
1 340 . 5 1 1 A 29 29 ASP H H 163 8.720 9.216 -0.496 1
1 341 . 5 1 1 A 29 29 ASP HA H 163 4.386 4.456 -0.070 1
1 344 . 5 1 1 A 29 29 ASP C C 163 176.604 178.611 -2.007 1
1 345 . 5 1 1 A 29 29 ASP CA C 163 59.690 56.974 2.716 1
1 346 . 5 1 1 A 29 29 ASP CB C 163 42.964 39.819 3.145 1
1 347 . 5 1 1 A 29 29 ASP N N 163 121.460 124.439 -2.979 1
1 348 . 5 1 1 A 30 30 LYS H H 164 8.434 8.108 0.326 1
1 349 . 5 1 1 A 30 30 LYS HA H 164 3.901 4.147 -0.246 1
1 358 . 5 1 1 A 30 30 LYS C C 164 179.479 179.157 0.322 1
1 359 . 5 1 1 A 30 30 LYS CA C 164 60.047 59.329 0.718 1
1 360 . 5 1 1 A 30 30 LYS CB C 164 32.038 32.335 -0.297 1
1 364 . 5 1 1 A 30 30 LYS N N 164 116.627 119.452 -2.825 1
1 365 . 5 1 1 A 31 31 GLU H H 165 7.755 8.449 -0.694 1
1 366 . 5 1 1 A 31 31 GLU HA H 165 3.998 4.067 -0.069 1
1 371 . 5 1 1 A 31 31 GLU C C 165 179.031 179.255 -0.224 1
1 372 . 5 1 1 A 31 31 GLU CA C 165 59.335 59.199 0.136 1
1 373 . 5 1 1 A 31 31 GLU CB C 165 29.972 29.788 0.184 1
1 375 . 5 1 1 A 31 31 GLU N N 165 120.456 120.306 0.150 1
1 376 . 5 1 1 A 32 32 ALA H H 166 9.060 8.546 0.514 1
1 377 . 5 1 1 A 32 32 ALA HA H 166 3.871 4.063 -0.192 1
1 381 . 5 1 1 A 32 32 ALA C C 166 178.029 179.080 -1.051 1
1 382 . 5 1 1 A 32 32 ALA CA C 166 54.997 55.342 -0.345 1
1 383 . 5 1 1 A 32 32 ALA CB C 166 19.727 18.544 1.183 1
1 384 . 5 1 1 A 32 32 ALA N N 166 124.406 122.479 1.927 1
1 385 . 5 1 1 A 33 33 LYS H H 167 8.228 7.672 0.556 1
1 386 . 5 1 1 A 33 33 LYS HA H 167 2.595 3.116 -0.521 1
1 395 . 5 1 1 A 33 33 LYS C C 167 177.938 178.011 -0.073 1
1 396 . 5 1 1 A 33 33 LYS CA C 167 59.573 59.292 0.281 1
1 397 . 5 1 1 A 33 33 LYS CB C 167 32.098 32.179 -0.081 1
1 401 . 5 1 1 A 33 33 LYS N N 167 119.833 118.295 1.538 1
1 402 . 5 1 1 A 34 34 GLN H H 168 7.392 7.846 -0.454 1
1 403 . 5 1 1 A 34 34 GLN HA H 168 3.943 3.912 0.031 1
1 410 . 5 1 1 A 34 34 GLN C C 168 178.323 178.388 -0.065 1
1 411 . 5 1 1 A 34 34 GLN CA C 168 58.883 59.301 -0.418 1
1 412 . 5 1 1 A 34 34 GLN CB C 168 28.485 28.136 0.349 1
1 414 . 5 1 1 A 34 34 GLN N N 168 117.208 117.901 -0.693 1
1 416 . 5 1 1 A 35 35 LYS H H 169 7.994 7.958 0.036 1
1 417 . 5 1 1 A 35 35 LYS HA H 169 4.067 3.999 0.068 1
1 426 . 5 1 1 A 35 35 LYS C C 169 178.161 178.465 -0.304 1
1 427 . 5 1 1 A 35 35 LYS CA C 169 58.437 59.393 -0.956 1
1 428 . 5 1 1 A 35 35 LYS CB C 169 31.611 32.294 -0.683 1
1 432 . 5 1 1 A 35 35 LYS N N 169 120.898 119.796 1.102 1
1 433 . 5 1 1 A 36 36 ALA H H 170 8.431 8.199 0.232 1
1 434 . 5 1 1 A 36 36 ALA HA H 170 3.738 4.045 -0.307 1
1 438 . 5 1 1 A 36 36 ALA C C 170 178.862 179.855 -0.993 1
1 439 . 5 1 1 A 36 36 ALA CA C 170 55.351 54.996 0.355 1
1 440 . 5 1 1 A 36 36 ALA CB C 170 18.295 18.368 -0.073 1
1 441 . 5 1 1 A 36 36 ALA N N 170 120.641 119.960 0.681 1
1 442 . 5 1 1 A 37 37 GLU H H 171 8.412 8.212 0.200 1
1 443 . 5 1 1 A 37 37 GLU HA H 171 3.867 3.944 -0.077 1
1 448 . 5 1 1 A 37 37 GLU C C 171 179.255 178.859 0.396 1
1 449 . 5 1 1 A 37 37 GLU CA C 171 59.543 59.563 -0.020 1
1 450 . 5 1 1 A 37 37 GLU CB C 171 29.569 29.565 0.004 1
1 452 . 5 1 1 A 37 37 GLU N N 171 118.224 117.753 0.471 1
1 453 . 5 1 1 A 38 38 GLU H H 172 8.019 8.134 -0.115 1
1 454 . 5 1 1 A 38 38 GLU HA H 172 3.952 4.062 -0.110 1
1 459 . 5 1 1 A 38 38 GLU C C 172 180.250 178.503 1.747 1
1 460 . 5 1 1 A 38 38 GLU CA C 172 59.627 59.220 0.407 1
1 461 . 5 1 1 A 38 38 GLU CB C 172 29.368 29.114 0.254 1
1 463 . 5 1 1 A 38 38 GLU N N 172 121.250 118.603 2.647 1
1 464 . 5 1 1 A 39 39 ILE H H 173 8.174 7.710 0.464 1
1 465 . 5 1 1 A 39 39 ILE HA H 173 3.643 3.805 -0.162 1
1 475 . 5 1 1 A 39 39 ILE C C 173 177.568 177.905 -0.337 1
1 476 . 5 1 1 A 39 39 ILE CA C 173 64.869 63.588 1.281 1
1 477 . 5 1 1 A 39 39 ILE CB C 173 38.160 37.256 0.904 1
1 481 . 5 1 1 A 39 39 ILE N N 173 121.527 117.041 4.486 1
1 482 . 5 1 1 A 40 40 GLN H H 174 8.860 8.316 0.544 1
1 483 . 5 1 1 A 40 40 GLN HA H 174 3.533 3.985 -0.452 1
1 490 . 5 1 1 A 40 40 GLN C C 174 179.022 178.043 0.979 1
1 491 . 5 1 1 A 40 40 GLN CA C 174 61.316 59.411 1.905 1
1 492 . 5 1 1 A 40 40 GLN CB C 174 26.604 28.724 -2.120 1
1 494 . 5 1 1 A 40 40 GLN N N 174 121.956 121.111 0.845 1
1 496 . 5 1 1 A 41 41 LYS H H 175 7.879 7.612 0.267 1
1 497 . 5 1 1 A 41 41 LYS HA H 175 3.777 4.061 -0.284 1
1 506 . 5 1 1 A 41 41 LYS C C 175 178.779 179.524 -0.745 1
1 507 . 5 1 1 A 41 41 LYS CA C 175 59.701 59.493 0.208 1
1 508 . 5 1 1 A 41 41 LYS CB C 175 32.581 32.178 0.403 1
1 512 . 5 1 1 A 41 41 LYS N N 175 119.012 117.734 1.278 1
1 513 . 5 1 1 A 42 42 GLU H H 176 7.447 7.522 -0.075 1
1 514 . 5 1 1 A 42 42 GLU HA H 176 4.059 4.133 -0.074 1
1 519 . 5 1 1 A 42 42 GLU C C 176 180.058 178.398 1.660 1
1 520 . 5 1 1 A 42 42 GLU CA C 176 59.456 59.206 0.250 1
1 521 . 5 1 1 A 42 42 GLU CB C 176 29.923 29.384 0.539 1
1 523 . 5 1 1 A 42 42 GLU N N 176 120.054 119.796 0.258 1
1 524 . 5 1 1 A 43 43 VAL H H 177 8.618 8.064 0.554 1
1 525 . 5 1 1 A 43 43 VAL HA H 177 3.986 3.949 0.037 1
1 533 . 5 1 1 A 43 43 VAL C C 177 176.459 178.235 -1.776 1
1 534 . 5 1 1 A 43 43 VAL CA C 177 63.923 64.800 -0.877 1
1 535 . 5 1 1 A 43 43 VAL CB C 177 31.899 31.408 0.491 1
1 538 . 5 1 1 A 43 43 VAL N N 177 114.191 117.150 -2.959 1
1 539 . 5 1 1 A 44 44 SER H H 178 8.052 8.537 -0.485 1
1 540 . 5 1 1 A 44 44 SER HA H 178 4.098 4.387 -0.289 1
1 543 . 5 1 1 A 44 44 SER C C 178 176.548 176.256 0.292 1
1 544 . 5 1 1 A 44 44 SER CA C 178 61.160 61.437 -0.277 1
1 545 . 5 1 1 A 44 44 SER CB C 178 62.959 63.244 -0.285 1
1 546 . 5 1 1 A 44 44 SER N N 178 114.202 117.455 -3.253 1
1 547 . 5 1 1 A 45 45 LYS H H 179 7.083 8.024 -0.941 1
1 548 . 5 1 1 A 45 45 LYS HA H 179 4.140 4.180 -0.040 1
1 557 . 5 1 1 A 45 45 LYS C C 179 177.288 176.211 1.077 1
1 558 . 5 1 1 A 45 45 LYS CA C 179 58.469 58.059 0.410 1
1 559 . 5 1 1 A 45 45 LYS CB C 179 32.671 31.458 1.213 1
1 563 . 5 1 1 A 45 45 LYS N N 179 120.935 119.048 1.887 1
1 564 . 5 1 1 A 46 46 ASP H H 180 7.098 7.938 -0.840 1
1 565 . 5 1 1 A 46 46 ASP HA H 180 4.917 4.995 -0.078 1
1 568 . 5 1 1 A 46 46 ASP CA C 180 51.492 51.585 -0.093 1
1 569 . 5 1 1 A 46 46 ASP CB C 180 40.595 41.382 -0.787 1
1 570 . 5 1 1 A 46 46 ASP N N 180 112.836 120.296 -7.460 1
1 571 . 5 1 1 A 47 47 PRO HA H 181 4.681 4.453 0.228 1
1 578 . 5 1 1 A 47 47 PRO C C 181 179.248 177.804 1.444 1
1 579 . 5 1 1 A 47 47 PRO CA C 181 64.718 64.524 0.194 1
1 580 . 5 1 1 A 47 47 PRO CB C 181 32.159 32.002 0.157 1
1 583 . 5 1 1 A 48 48 SER H H 182 8.248 7.815 0.433 1
1 584 . 5 1 1 A 48 48 SER HA H 182 4.378 4.310 0.068 1
1 587 . 5 1 1 A 48 48 SER C C 182 176.071 175.280 0.791 1
1 588 . 5 1 1 A 48 48 SER CA C 182 61.377 60.789 0.588 1
1 589 . 5 1 1 A 48 48 SER CB C 182 62.455 63.084 -0.629 1
1 590 . 5 1 1 A 48 48 SER N N 182 116.986 112.990 3.996 1
1 591 . 5 1 1 A 49 49 LYS H H 183 7.842 7.538 0.304 1
1 592 . 5 1 1 A 49 49 LYS HA H 183 4.482 4.342 0.140 1
1 601 . 5 1 1 A 49 49 LYS C C 183 175.605 177.525 -1.920 1
1 602 . 5 1 1 A 49 49 LYS CA C 183 55.824 56.492 -0.668 1
1 603 . 5 1 1 A 49 49 LYS CB C 183 32.834 32.863 -0.029 1
1 607 . 5 1 1 A 49 49 LYS N N 183 121.698 118.505 3.193 1
1 608 . 5 1 1 A 50 50 PHE H H 184 7.634 7.720 -0.086 1
1 609 . 5 1 1 A 50 50 PHE HA H 184 3.510 4.191 -0.681 1
1 617 . 5 1 1 A 50 50 PHE C C 184 176.214 177.656 -1.442 1
1 618 . 5 1 1 A 50 50 PHE CA C 184 63.276 60.995 2.281 1
1 619 . 5 1 1 A 50 50 PHE CB C 184 40.948 39.020 1.928 1
1 623 . 5 1 1 A 50 50 PHE N N 184 120.120 121.521 -1.401 1
1 624 . 5 1 1 A 51 51 GLY H H 185 8.855 8.601 0.254 1
1 625 . 5 1 1 A 51 51 GLY HA2 H 185 3.993 3.872 0.121 1
1 626 . 5 1 1 A 51 51 GLY HA3 H 185 3.958 3.892 0.066 1
1 627 . 5 1 1 A 51 51 GLY C C 185 175.169 176.311 -1.142 1
1 628 . 5 1 1 A 51 51 GLY CA C 185 47.475 47.630 -0.155 1
1 629 . 5 1 1 A 51 51 GLY N N 185 105.550 106.336 -0.786 1
1 630 . 5 1 1 A 52 52 GLU H H 186 7.917 7.988 -0.071 1
1 631 . 5 1 1 A 52 52 GLU HA H 186 4.006 4.025 -0.019 1
1 636 . 5 1 1 A 52 52 GLU C C 186 179.499 179.120 0.379 1
1 637 . 5 1 1 A 52 52 GLU CA C 186 58.904 59.111 -0.207 1
1 638 . 5 1 1 A 52 52 GLU CB C 186 29.700 29.677 0.023 1
1 640 . 5 1 1 A 52 52 GLU N N 186 121.929 121.811 0.118 1
1 641 . 5 1 1 A 53 53 ILE H H 187 7.936 7.649 0.287 1
1 642 . 5 1 1 A 53 53 ILE HA H 187 3.648 3.765 -0.117 1
1 652 . 5 1 1 A 53 53 ILE C C 187 177.886 177.879 0.007 1
1 653 . 5 1 1 A 53 53 ILE CA C 187 64.366 64.270 0.096 1
1 654 . 5 1 1 A 53 53 ILE CB C 187 36.478 37.168 -0.690 1
1 658 . 5 1 1 A 53 53 ILE N N 187 120.991 121.806 -0.815 1
1 659 . 5 1 1 A 54 54 ALA H H 188 8.895 8.581 0.314 1
1 660 . 5 1 1 A 54 54 ALA HA H 188 3.629 3.745 -0.116 1
1 664 . 5 1 1 A 54 54 ALA C C 188 179.437 179.421 0.016 1
1 665 . 5 1 1 A 54 54 ALA CA C 188 55.974 55.509 0.465 1
1 666 . 5 1 1 A 54 54 ALA CB C 188 17.591 18.275 -0.684 1
1 667 . 5 1 1 A 54 54 ALA N N 188 125.308 122.495 2.813 1
1 668 . 5 1 1 A 55 55 LYS H H 189 8.049 7.726 0.323 1
1 669 . 5 1 1 A 55 55 LYS HA H 189 4.106 3.885 0.221 1
1 678 . 5 1 1 A 55 55 LYS C C 189 178.995 177.810 1.185 1
1 679 . 5 1 1 A 55 55 LYS CA C 189 59.312 59.161 0.151 1
1 680 . 5 1 1 A 55 55 LYS CB C 189 32.647 31.869 0.778 1
1 684 . 5 1 1 A 55 55 LYS N N 189 116.835 118.276 -1.441 1
1 685 . 5 1 1 A 56 56 LYS H H 190 7.215 7.841 -0.626 1
1 686 . 5 1 1 A 56 56 LYS HA H 190 4.172 4.362 -0.190 1
1 695 . 5 1 1 A 56 56 LYS C C 190 177.897 178.101 -0.204 1
1 696 . 5 1 1 A 56 56 LYS CA C 190 58.418 57.425 0.993 1
1 697 . 5 1 1 A 56 56 LYS CB C 190 34.652 33.569 1.083 1
1 701 . 5 1 1 A 56 56 LYS N N 190 117.170 117.947 -0.777 1
1 702 . 5 1 1 A 57 57 GLU H H 191 8.572 7.892 0.680 1
1 703 . 5 1 1 A 57 57 GLU HA H 191 4.643 4.310 0.333 1
1 708 . 5 1 1 A 57 57 GLU C C 191 177.903 176.238 1.665 1
1 709 . 5 1 1 A 57 57 GLU CA C 191 55.708 56.801 -1.093 1
1 710 . 5 1 1 A 57 57 GLU CB C 191 32.460 30.775 1.685 1
1 712 . 5 1 1 A 57 57 GLU N N 191 113.316 117.269 -3.953 1
1 713 . 5 1 1 A 58 58 SER H H 192 8.550 7.724 0.826 1
1 714 . 5 1 1 A 58 58 SER HA H 192 4.149 4.316 -0.167 1
1 717 . 5 1 1 A 58 58 SER C C 192 176.161 175.592 0.569 1
1 718 . 5 1 1 A 58 58 SER CA C 192 58.403 58.133 0.270 1
1 719 . 5 1 1 A 58 58 SER CB C 192 64.392 64.183 0.209 1
1 720 . 5 1 1 A 58 58 SER N N 192 109.861 115.498 -5.637 1
1 721 . 5 1 1 A 59 59 MET H H 193 9.533 8.825 0.708 1
1 722 . 5 1 1 A 59 59 MET HA H 193 4.457 4.642 -0.185 1
1 730 . 5 1 1 A 59 59 MET C C 193 175.204 175.334 -0.130 1
1 731 . 5 1 1 A 59 59 MET CA C 193 55.781 54.648 1.133 1
1 732 . 5 1 1 A 59 59 MET CB C 193 32.855 32.315 0.540 1
1 735 . 5 1 1 A 59 59 MET N N 193 124.493 124.116 0.377 1
1 736 . 5 1 1 A 60 60 ASP H H 194 7.514 7.688 -0.174 1
1 737 . 5 1 1 A 60 60 ASP HA H 194 4.886 4.680 0.206 1
1 740 . 5 1 1 A 60 60 ASP C C 194 175.517 176.521 -1.004 1
1 741 . 5 1 1 A 60 60 ASP CA C 194 52.286 53.016 -0.730 1
1 742 . 5 1 1 A 60 60 ASP CB C 194 40.222 42.169 -1.947 1
1 743 . 5 1 1 A 60 60 ASP N N 194 117.785 122.265 -4.480 1
1 744 . 5 1 1 A 61 61 THR H H 195 8.118 8.493 -0.375 1
1 745 . 5 1 1 A 61 61 THR HA H 195 3.918 3.887 0.031 1
1 750 . 5 1 1 A 61 61 THR C C 195 176.269 176.870 -0.601 1
1 751 . 5 1 1 A 61 61 THR CA C 195 65.469 66.612 -1.143 1
1 752 . 5 1 1 A 61 61 THR CB C 195 68.741 68.486 0.255 1
1 754 . 5 1 1 A 61 61 THR N N 195 120.765 119.553 1.212 1
1 755 . 5 1 1 A 62 62 GLY H H 196 8.399 8.516 -0.117 1
1 756 . 5 1 1 A 62 62 GLY HA2 H 196 3.932 3.911 0.021 1
1 757 . 5 1 1 A 62 62 GLY HA3 H 196 3.900 3.914 -0.014 1
1 758 . 5 1 1 A 62 62 GLY C C 196 174.948 175.674 -0.726 1
1 759 . 5 1 1 A 62 62 GLY CA C 196 46.768 46.865 -0.097 1
1 760 . 5 1 1 A 62 62 GLY N N 196 108.183 108.106 0.077 1
1 761 . 5 1 1 A 63 63 SER H H 197 7.265 7.597 -0.332 1
1 762 . 5 1 1 A 63 63 SER HA H 197 4.554 4.569 -0.015 1
1 765 . 5 1 1 A 63 63 SER C C 197 177.630 176.012 1.618 1
1 766 . 5 1 1 A 63 63 SER CA C 197 59.550 60.312 -0.762 1
1 767 . 5 1 1 A 63 63 SER CB C 197 65.504 63.857 1.647 1
1 768 . 5 1 1 A 63 63 SER N N 197 111.815 114.567 -2.752 1
1 769 . 5 1 1 A 64 64 ALA H H 198 8.675 8.367 0.308 1
1 770 . 5 1 1 A 64 64 ALA HA H 198 3.801 3.936 -0.135 1
1 774 . 5 1 1 A 64 64 ALA C C 198 178.492 179.335 -0.843 1
1 775 . 5 1 1 A 64 64 ALA CA C 198 56.794 55.396 1.398 1
1 776 . 5 1 1 A 64 64 ALA CB C 198 18.951 18.659 0.292 1
1 777 . 5 1 1 A 64 64 ALA N N 198 131.710 124.156 7.554 1
1 778 . 5 1 1 A 65 65 LYS H H 199 7.666 7.849 -0.183 1
1 779 . 5 1 1 A 65 65 LYS HA H 199 4.175 4.000 0.175 1
1 788 . 5 1 1 A 65 65 LYS C C 199 177.159 177.865 -0.706 1
1 789 . 5 1 1 A 65 65 LYS CA C 199 57.735 59.107 -1.372 1
1 790 . 5 1 1 A 65 65 LYS CB C 199 31.948 31.830 0.118 1
1 794 . 5 1 1 A 65 65 LYS N N 199 111.375 118.285 -6.910 1
1 795 . 5 1 1 A 66 66 LYS H H 200 7.545 7.315 0.230 1
1 796 . 5 1 1 A 66 66 LYS HA H 200 4.612 4.438 0.174 1
1 805 . 5 1 1 A 66 66 LYS C C 200 175.609 175.034 0.575 1
1 806 . 5 1 1 A 66 66 LYS CA C 200 54.468 55.927 -1.459 1
1 807 . 5 1 1 A 66 66 LYS CB C 200 31.525 32.120 -0.595 1
1 811 . 5 1 1 A 66 66 LYS N N 200 121.421 116.180 5.241 1
1 812 . 5 1 1 A 67 67 ASP H H 201 7.630 8.112 -0.482 1
1 813 . 5 1 1 A 67 67 ASP HA H 201 4.306 4.348 -0.042 1
1 816 . 5 1 1 A 67 67 ASP C C 201 175.025 176.356 -1.331 1
1 817 . 5 1 1 A 67 67 ASP CA C 201 56.400 55.389 1.011 1
1 818 . 5 1 1 A 67 67 ASP CB C 201 38.315 39.117 -0.802 1
1 819 . 5 1 1 A 67 67 ASP N N 201 116.216 117.331 -1.115 1
1 820 . 5 1 1 A 68 68 GLY H H 202 8.368 8.608 -0.240 1
1 821 . 5 1 1 A 68 68 GLY HA2 H 202 4.316 3.942 0.374 1
1 822 . 5 1 1 A 68 68 GLY HA3 H 202 3.731 4.049 -0.318 1
1 823 . 5 1 1 A 68 68 GLY C C 202 174.139 174.517 -0.378 1
1 824 . 5 1 1 A 68 68 GLY CA C 202 45.514 45.297 0.217 1
1 825 . 5 1 1 A 68 68 GLY N N 202 105.095 104.705 0.390 1
1 826 . 5 1 1 A 69 69 GLU H H 203 7.534 7.720 -0.186 1
1 827 . 5 1 1 A 69 69 GLU HA H 203 4.479 4.482 -0.003 1
1 832 . 5 1 1 A 69 69 GLU C C 203 176.961 176.517 0.444 1
1 833 . 5 1 1 A 69 69 GLU CA C 203 58.549 57.112 1.437 1
1 834 . 5 1 1 A 69 69 GLU CB C 203 30.998 30.559 0.439 1
1 836 . 5 1 1 A 69 69 GLU N N 203 120.426 120.647 -0.221 1
1 837 . 5 1 1 A 70 70 LEU H H 204 8.962 9.003 -0.041 1
1 838 . 5 1 1 A 70 70 LEU HA H 204 4.438 4.616 -0.178 1
1 848 . 5 1 1 A 70 70 LEU C C 204 178.648 177.373 1.275 1
1 849 . 5 1 1 A 70 70 LEU CA C 204 53.977 55.276 -1.299 1
1 850 . 5 1 1 A 70 70 LEU CB C 204 43.612 43.675 -0.063 1
1 854 . 5 1 1 A 70 70 LEU N N 204 122.066 125.801 -3.735 1
1 855 . 5 1 1 A 71 71 GLY H H 205 8.104 7.643 0.461 1
1 856 . 5 1 1 A 71 71 GLY HA2 H 205 4.165 3.980 0.185 1
1 857 . 5 1 1 A 71 71 GLY HA3 H 205 3.552 4.097 -0.545 1
1 858 . 5 1 1 A 71 71 GLY C C 205 173.098 173.352 -0.254 1
1 859 . 5 1 1 A 71 71 GLY CA C 205 44.723 44.851 -0.128 1
1 860 . 5 1 1 A 71 71 GLY N N 205 110.168 106.496 3.672 1
1 861 . 5 1 1 A 72 72 TYR H H 206 8.457 8.605 -0.148 1
1 862 . 5 1 1 A 72 72 TYR HA H 206 4.184 4.625 -0.441 1
1 869 . 5 1 1 A 72 72 TYR C C 206 175.975 175.548 0.427 1
1 870 . 5 1 1 A 72 72 TYR CA C 206 59.722 59.037 0.685 1
1 871 . 5 1 1 A 72 72 TYR CB C 206 38.378 38.282 0.096 1
1 874 . 5 1 1 A 72 72 TYR N N 206 120.171 122.118 -1.947 1
1 875 . 5 1 1 A 73 73 VAL H H 207 8.782 9.242 -0.460 1
1 876 . 5 1 1 A 73 73 VAL HA H 207 4.056 4.534 -0.478 1
1 884 . 5 1 1 A 73 73 VAL C C 207 174.901 175.787 -0.886 1
1 885 . 5 1 1 A 73 73 VAL CA C 207 62.202 62.806 -0.604 1
1 886 . 5 1 1 A 73 73 VAL CB C 207 33.071 31.720 1.351 1
1 889 . 5 1 1 A 73 73 VAL N N 207 128.847 125.384 3.463 1
1 890 . 5 1 1 A 74 74 LEU H H 208 8.146 8.743 -0.597 1
1 891 . 5 1 1 A 74 74 LEU HA H 208 4.944 4.491 0.453 1
1 901 . 5 1 1 A 74 74 LEU C C 208 178.400 177.759 0.641 1
1 902 . 5 1 1 A 74 74 LEU CA C 208 53.520 54.702 -1.182 1
1 903 . 5 1 1 A 74 74 LEU CB C 208 43.499 42.353 1.146 1
1 907 . 5 1 1 A 74 74 LEU N N 208 127.599 129.542 -1.943 1
1 908 . 5 1 1 A 75 75 LYS H H 209 8.403 9.019 -0.616 1
1 909 . 5 1 1 A 75 75 LYS HA H 209 3.771 4.317 -0.546 1
1 918 . 5 1 1 A 75 75 LYS C C 209 177.536 177.496 0.040 1
1 919 . 5 1 1 A 75 75 LYS CA C 209 58.385 57.474 0.911 1
1 920 . 5 1 1 A 75 75 LYS CB C 209 32.459 32.076 0.383 1
1 924 . 5 1 1 A 75 75 LYS N N 209 123.798 122.207 1.591 1
1 925 . 5 1 1 A 76 76 GLY H H 210 9.997 7.946 2.051 1
1 926 . 5 1 1 A 76 76 GLY HA2 H 210 4.255 4.032 0.223 1
1 927 . 5 1 1 A 76 76 GLY HA3 H 210 3.791 4.039 -0.248 1
1 928 . 5 1 1 A 76 76 GLY C C 210 175.091 174.759 0.332 1
1 929 . 5 1 1 A 76 76 GLY CA C 210 45.465 45.223 0.242 1
1 930 . 5 1 1 A 76 76 GLY N N 210 114.705 108.107 6.598 1
1 931 . 5 1 1 A 77 77 GLN H H 211 7.726 7.803 -0.077 1
1 932 . 5 1 1 A 77 77 GLN HA H 211 4.373 4.382 -0.009 1
1 939 . 5 1 1 A 77 77 GLN C C 211 176.301 175.627 0.674 1
1 940 . 5 1 1 A 77 77 GLN CA C 211 57.074 56.321 0.753 1
1 941 . 5 1 1 A 77 77 GLN CB C 211 30.798 30.078 0.720 1
1 943 . 5 1 1 A 77 77 GLN N N 211 118.702 117.953 0.749 1
1 945 . 5 1 1 A 78 78 THR H H 212 8.225 7.296 0.929 1
1 946 . 5 1 1 A 78 78 THR HA H 212 4.620 4.781 -0.161 1
1 951 . 5 1 1 A 78 78 THR C C 212 173.920 173.329 0.591 1
1 952 . 5 1 1 A 78 78 THR CA C 212 60.087 58.947 1.140 1
1 953 . 5 1 1 A 78 78 THR CB C 212 71.412 71.778 -0.366 1
1 955 . 5 1 1 A 78 78 THR N N 212 111.935 110.381 1.554 1
1 956 . 5 1 1 A 79 79 ASP H H 213 8.372 8.314 0.058 1
1 957 . 5 1 1 A 79 79 ASP HA H 213 4.470 4.517 -0.047 1
1 960 . 5 1 1 A 79 79 ASP C C 213 176.759 177.323 -0.564 1
1 961 . 5 1 1 A 79 79 ASP CA C 213 54.927 54.283 0.644 1
1 962 . 5 1 1 A 79 79 ASP CB C 213 43.859 41.453 2.406 1
1 963 . 5 1 1 A 79 79 ASP N N 213 122.093 121.889 0.204 1
1 964 . 5 1 1 A 80 80 LYS H H 214 8.740 8.855 -0.115 1
1 965 . 5 1 1 A 80 80 LYS HA H 214 4.027 3.962 0.065 1
1 974 . 5 1 1 A 80 80 LYS C C 214 178.493 178.058 0.435 1
1 975 . 5 1 1 A 80 80 LYS CA C 214 59.802 59.707 0.095 1
1 976 . 5 1 1 A 80 80 LYS CB C 214 32.374 32.244 0.130 1
1 980 . 5 1 1 A 80 80 LYS N N 214 124.685 123.499 1.186 1
1 981 . 5 1 1 A 81 81 ASP H H 215 8.556 8.235 0.321 1
1 982 . 5 1 1 A 81 81 ASP HA H 215 4.566 4.369 0.197 1
1 985 . 5 1 1 A 81 81 ASP C C 215 178.889 178.811 0.078 1
1 986 . 5 1 1 A 81 81 ASP CA C 215 58.046 57.419 0.627 1
1 987 . 5 1 1 A 81 81 ASP CB C 215 40.872 40.357 0.515 1
1 988 . 5 1 1 A 81 81 ASP N N 215 121.413 119.188 2.225 1
1 989 . 5 1 1 A 82 82 PHE H H 216 8.205 8.361 -0.156 1
1 990 . 5 1 1 A 82 82 PHE HA H 216 3.686 4.062 -0.376 1
1 998 . 5 1 1 A 82 82 PHE C C 216 175.919 177.350 -1.431 1
1 999 . 5 1 1 A 82 82 PHE CA C 216 61.648 60.985 0.663 1
1 1000 . 5 1 1 A 82 82 PHE CB C 216 39.743 39.252 0.491 1
1 1004 . 5 1 1 A 82 82 PHE N N 216 124.401 122.777 1.624 1
1 1005 . 5 1 1 A 83 83 GLU H H 217 8.887 8.772 0.115 1
1 1006 . 5 1 1 A 83 83 GLU HA H 217 3.704 4.185 -0.481 1
1 1011 . 5 1 1 A 83 83 GLU C C 217 177.788 178.958 -1.170 1
1 1012 . 5 1 1 A 83 83 GLU CA C 217 60.545 60.187 0.358 1
1 1013 . 5 1 1 A 83 83 GLU CB C 217 30.639 29.237 1.402 1
1 1015 . 5 1 1 A 83 83 GLU N N 217 119.421 118.827 0.594 1
1 1016 . 5 1 1 A 84 84 LYS H H 218 8.055 7.947 0.108 1
1 1017 . 5 1 1 A 84 84 LYS HA H 218 3.947 4.107 -0.160 1
1 1026 . 5 1 1 A 84 84 LYS C C 218 178.783 178.421 0.362 1
1 1027 . 5 1 1 A 84 84 LYS CA C 218 59.327 58.806 0.521 1
1 1028 . 5 1 1 A 84 84 LYS CB C 218 32.539 32.189 0.350 1
1 1032 . 5 1 1 A 84 84 LYS N N 218 117.821 119.734 -1.913 1
1 1033 . 5 1 1 A 85 85 ALA H H 219 7.059 7.789 -0.730 1
1 1034 . 5 1 1 A 85 85 ALA HA H 219 4.040 4.099 -0.059 1
1 1038 . 5 1 1 A 85 85 ALA C C 219 179.794 179.427 0.367 1
1 1039 . 5 1 1 A 85 85 ALA CA C 219 54.407 54.228 0.179 1
1 1040 . 5 1 1 A 85 85 ALA CB C 219 20.130 18.159 1.971 1
1 1041 . 5 1 1 A 85 85 ALA N N 219 118.905 121.004 -2.099 1
1 1042 . 5 1 1 A 86 86 LEU H H 220 8.157 7.955 0.202 1
1 1043 . 5 1 1 A 86 86 LEU HA H 220 3.692 4.021 -0.329 1
1 1053 . 5 1 1 A 86 86 LEU C C 220 178.330 178.524 -0.194 1
1 1054 . 5 1 1 A 86 86 LEU CA C 220 57.752 57.530 0.222 1
1 1055 . 5 1 1 A 86 86 LEU CB C 220 41.464 41.874 -0.410 1
1 1059 . 5 1 1 A 86 86 LEU N N 220 118.606 120.475 -1.869 1
1 1060 . 5 1 1 A 87 87 PHE H H 221 8.349 8.489 -0.140 1
1 1061 . 5 1 1 A 87 87 PHE HA H 221 3.861 4.478 -0.617 1
1 1069 . 5 1 1 A 87 87 PHE C C 221 176.176 176.933 -0.757 1
1 1070 . 5 1 1 A 87 87 PHE CA C 221 61.780 61.754 0.026 1
1 1071 . 5 1 1 A 87 87 PHE CB C 221 37.549 37.987 -0.438 1
1 1075 . 5 1 1 A 87 87 PHE N N 221 112.449 116.958 -4.509 1
1 1076 . 5 1 1 A 88 88 LYS H H 222 7.061 8.140 -1.079 1
1 1077 . 5 1 1 A 88 88 LYS HA H 222 4.380 4.376 0.004 1
1 1086 . 5 1 1 A 88 88 LYS C C 222 177.089 176.767 0.322 1
1 1087 . 5 1 1 A 88 88 LYS CA C 222 56.726 58.080 -1.354 1
1 1088 . 5 1 1 A 88 88 LYS CB C 222 33.738 32.161 1.577 1
1 1092 . 5 1 1 A 88 88 LYS N N 222 118.308 114.338 3.970 1
1 1093 . 5 1 1 A 89 89 LEU H H 223 7.270 7.292 -0.022 1
1 1094 . 5 1 1 A 89 89 LEU HA H 223 4.168 4.197 -0.029 1
1 1104 . 5 1 1 A 89 89 LEU C C 223 177.528 176.814 0.714 1
1 1105 . 5 1 1 A 89 89 LEU CA C 223 55.279 54.611 0.668 1
1 1106 . 5 1 1 A 89 89 LEU CB C 223 43.240 42.311 0.929 1
1 1110 . 5 1 1 A 89 89 LEU N N 223 121.317 122.167 -0.850 1
1 1111 . 5 1 1 A 90 90 LYS H H 224 8.788 8.411 0.377 1
1 1112 . 5 1 1 A 90 90 LYS HA H 224 4.359 4.282 0.077 1
1 1121 . 5 1 1 A 90 90 LYS C C 224 175.839 176.497 -0.658 1
1 1122 . 5 1 1 A 90 90 LYS CA C 224 54.772 55.973 -1.201 1
1 1123 . 5 1 1 A 90 90 LYS CB C 224 33.232 33.267 -0.035 1
1 1127 . 5 1 1 A 90 90 LYS N N 224 123.558 123.496 0.062 1
1 1128 . 5 1 1 A 91 91 ASP H H 225 8.125 8.758 -0.633 1
1 1129 . 5 1 1 A 91 91 ASP HA H 225 3.958 4.154 -0.196 1
1 1132 . 5 1 1 A 91 91 ASP C C 225 177.452 177.142 0.310 1
1 1133 . 5 1 1 A 91 91 ASP CA C 225 56.642 56.257 0.385 1
1 1134 . 5 1 1 A 91 91 ASP CB C 225 40.269 40.221 0.048 1
1 1135 . 5 1 1 A 91 91 ASP N N 225 119.419 121.908 -2.489 1
1 1136 . 5 1 1 A 92 92 GLY H H 226 8.681 8.710 -0.029 1
1 1137 . 5 1 1 A 92 92 GLY HA2 H 226 4.131 3.849 0.282 1
1 1138 . 5 1 1 A 92 92 GLY HA3 H 226 3.579 3.876 -0.297 1
1 1139 . 5 1 1 A 92 92 GLY C C 226 173.614 173.984 -0.370 1
1 1140 . 5 1 1 A 92 92 GLY CA C 226 45.564 45.161 0.403 1
1 1141 . 5 1 1 A 92 92 GLY N N 226 113.802 111.815 1.987 1
1 1142 . 5 1 1 A 93 93 GLU H H 227 8.104 8.039 0.065 1
1 1143 . 5 1 1 A 93 93 GLU HA H 227 4.232 4.393 -0.161 1
1 1148 . 5 1 1 A 93 93 GLU C C 227 174.282 175.661 -1.379 1
1 1149 . 5 1 1 A 93 93 GLU CA C 227 56.651 56.228 0.423 1
1 1150 . 5 1 1 A 93 93 GLU CB C 227 32.190 31.006 1.184 1
1 1152 . 5 1 1 A 93 93 GLU N N 227 121.527 121.961 -0.434 1
1 1153 . 5 1 1 A 94 94 VAL H H 228 7.918 8.489 -0.571 1
1 1154 . 5 1 1 A 94 94 VAL HA H 228 4.857 4.755 0.102 1
1 1162 . 5 1 1 A 94 94 VAL C C 228 176.556 175.692 0.864 1
1 1163 . 5 1 1 A 94 94 VAL CA C 228 60.309 60.457 -0.148 1
1 1164 . 5 1 1 A 94 94 VAL CB C 228 33.847 35.160 -1.313 1
1 1167 . 5 1 1 A 94 94 VAL N N 228 119.768 125.966 -6.198 1
1 1168 . 5 1 1 A 95 95 SER H H 229 9.659 9.445 0.214 1
1 1169 . 5 1 1 A 95 95 SER HA H 229 4.313 4.689 -0.376 1
1 1172 . 5 1 1 A 95 95 SER C C 229 174.641 174.467 0.174 1
1 1173 . 5 1 1 A 95 95 SER CA C 229 59.208 57.812 1.396 1
1 1174 . 5 1 1 A 95 95 SER CB C 229 66.080 65.724 0.356 1
1 1175 . 5 1 1 A 95 95 SER N N 229 124.903 120.921 3.982 1
1 1176 . 5 1 1 A 96 96 GLU H H 230 8.014 8.636 -0.622 1
1 1177 . 5 1 1 A 96 96 GLU HA H 230 4.376 4.407 -0.031 1
1 1182 . 5 1 1 A 96 96 GLU C C 230 176.641 177.189 -0.548 1
1 1183 . 5 1 1 A 96 96 GLU CA C 230 56.236 56.511 -0.275 1
1 1184 . 5 1 1 A 96 96 GLU CB C 230 30.324 30.900 -0.576 1
1 1186 . 5 1 1 A 96 96 GLU N N 230 115.510 120.897 -5.387 1
1 1187 . 5 1 1 A 97 97 VAL H H 231 8.741 8.333 0.408 1
1 1188 . 5 1 1 A 97 97 VAL HA H 231 4.171 4.171 0.000 1
1 1196 . 5 1 1 A 97 97 VAL C C 231 176.684 175.635 1.049 1
1 1197 . 5 1 1 A 97 97 VAL CA C 231 65.418 63.166 2.252 1
1 1198 . 5 1 1 A 97 97 VAL CB C 231 31.218 31.643 -0.425 1
1 1201 . 5 1 1 A 97 97 VAL N N 231 121.289 121.581 -0.292 1
1 1202 . 5 1 1 A 98 98 VAL H H 232 9.218 9.682 -0.464 1
1 1203 . 5 1 1 A 98 98 VAL HA H 232 4.405 4.669 -0.264 1
1 1211 . 5 1 1 A 98 98 VAL C C 232 174.258 174.599 -0.341 1
1 1212 . 5 1 1 A 98 98 VAL CA C 232 60.937 61.209 -0.272 1
1 1213 . 5 1 1 A 98 98 VAL CB C 232 35.825 33.743 2.082 1
1 1216 . 5 1 1 A 98 98 VAL N N 232 130.544 128.839 1.705 1
1 1217 . 5 1 1 A 99 99 LYS H H 233 8.800 8.935 -0.135 1
1 1218 . 5 1 1 A 99 99 LYS HA H 233 4.853 5.125 -0.272 1
1 1227 . 5 1 1 A 99 99 LYS C C 233 175.274 175.174 0.100 1
1 1228 . 5 1 1 A 99 99 LYS CA C 233 55.499 55.077 0.422 1
1 1229 . 5 1 1 A 99 99 LYS CB C 233 34.452 34.428 0.024 1
1 1233 . 5 1 1 A 99 99 LYS N N 233 130.477 128.418 2.059 1
1 1234 . 5 1 1 A 100 100 SER H H 234 9.585 8.976 0.609 1
1 1235 . 5 1 1 A 100 100 SER HA H 234 5.150 4.846 0.304 1
1 1238 . 5 1 1 A 100 100 SER C C 234 175.493 174.365 1.128 1
1 1239 . 5 1 1 A 100 100 SER CA C 234 56.927 57.536 -0.609 1
1 1240 . 5 1 1 A 100 100 SER CB C 234 67.309 67.399 -0.090 1
1 1241 . 5 1 1 A 100 100 SER N N 234 125.814 122.655 3.159 1
1 1242 . 5 1 1 A 101 101 SER H H 235 8.631 9.041 -0.410 1
1 1243 . 5 1 1 A 101 101 SER HA H 235 4.106 4.022 0.084 1
1 1246 . 5 1 1 A 101 101 SER C C 235 175.385 175.522 -0.137 1
1 1247 . 5 1 1 A 101 101 SER CA C 235 61.123 60.930 0.193 1
1 1248 . 5 1 1 A 101 101 SER CB C 235 62.818 62.507 0.311 1
1 1249 . 5 1 1 A 101 101 SER N N 235 115.089 118.169 -3.080 1
1 1250 . 5 1 1 A 102 102 PHE H H 236 8.957 7.608 1.349 1
1 1251 . 5 1 1 A 102 102 PHE HA H 236 4.610 4.598 0.012 1
1 1259 . 5 1 1 A 102 102 PHE C C 236 176.453 175.774 0.679 1
1 1260 . 5 1 1 A 102 102 PHE CA C 236 58.382 58.135 0.247 1
1 1261 . 5 1 1 A 102 102 PHE CB C 236 40.275 39.408 0.867 1
1 1263 . 5 1 1 A 102 102 PHE N N 236 119.917 117.962 1.955 1
1 1264 . 5 1 1 A 103 103 GLY H H 237 7.377 7.281 0.096 1
1 1265 . 5 1 1 A 103 103 GLY HA2 H 237 4.453 3.951 0.502 1
1 1266 . 5 1 1 A 103 103 GLY HA3 H 237 3.472 4.118 -0.646 1
1 1267 . 5 1 1 A 103 103 GLY C C 237 169.627 172.328 -2.701 1
1 1268 . 5 1 1 A 103 103 GLY CA C 237 45.384 44.670 0.714 1
1 1269 . 5 1 1 A 103 103 GLY N N 237 108.809 106.283 2.526 1
1 1270 . 5 1 1 A 104 104 TYR H H 238 8.632 8.573 0.059 1
1 1271 . 5 1 1 A 104 104 TYR HA H 238 5.322 5.586 -0.264 1
1 1278 . 5 1 1 A 104 104 TYR C C 238 175.043 175.199 -0.156 1
1 1279 . 5 1 1 A 104 104 TYR CA C 238 57.627 57.056 0.571 1
1 1280 . 5 1 1 A 104 104 TYR CB C 238 41.711 41.737 -0.026 1
1 1283 . 5 1 1 A 104 104 TYR N N 238 120.030 121.886 -1.856 1
1 1284 . 5 1 1 A 105 105 HIS H H 239 10.070 9.442 0.628 1
1 1285 . 5 1 1 A 105 105 HIS HA H 239 6.046 5.622 0.424 1
1 1290 . 5 1 1 A 105 105 HIS C C 239 175.734 174.645 1.089 1
1 1291 . 5 1 1 A 105 105 HIS CA C 239 53.945 54.589 -0.644 1
1 1292 . 5 1 1 A 105 105 HIS CB C 239 32.450 34.393 -1.943 1
1 1295 . 5 1 1 A 105 105 HIS N N 239 119.504 118.479 1.025 1
1 1296 . 5 1 1 A 106 106 ILE H H 240 8.660 8.672 -0.012 1
1 1297 . 5 1 1 A 106 106 ILE HA H 240 4.120 4.896 -0.776 1
1 1307 . 5 1 1 A 106 106 ILE C C 240 174.758 175.370 -0.612 1
1 1308 . 5 1 1 A 106 106 ILE CA C 240 63.446 59.953 3.493 1
1 1309 . 5 1 1 A 106 106 ILE CB C 240 40.786 41.670 -0.884 1
1 1313 . 5 1 1 A 106 106 ILE N N 240 120.639 119.440 1.199 1
1 1314 . 5 1 1 A 107 107 ILE H H 241 9.033 9.213 -0.180 1
1 1315 . 5 1 1 A 107 107 ILE HA H 241 4.799 5.169 -0.370 1
1 1325 . 5 1 1 A 107 107 ILE C C 241 172.880 173.957 -1.077 1
1 1326 . 5 1 1 A 107 107 ILE CA C 241 60.563 59.605 0.958 1
1 1327 . 5 1 1 A 107 107 ILE CB C 241 41.652 40.531 1.121 1
1 1331 . 5 1 1 A 107 107 ILE N N 241 129.098 127.423 1.675 1
1 1332 . 5 1 1 A 108 108 LYS H H 242 8.692 9.010 -0.318 1
1 1333 . 5 1 1 A 108 108 LYS HA H 242 5.012 4.996 0.016 1
1 1342 . 5 1 1 A 108 108 LYS C C 242 174.484 175.626 -1.142 1
1 1343 . 5 1 1 A 108 108 LYS CA C 242 54.317 53.886 0.431 1
1 1344 . 5 1 1 A 108 108 LYS CB C 242 35.619 35.394 0.225 1
1 1348 . 5 1 1 A 108 108 LYS N N 242 127.179 126.740 0.439 1
1 1349 . 5 1 1 A 109 109 ALA H H 243 7.816 8.934 -1.118 1
1 1350 . 5 1 1 A 109 109 ALA HA H 243 4.604 4.405 0.199 1
1 1354 . 5 1 1 A 109 109 ALA C C 243 176.231 176.211 0.020 1
1 1355 . 5 1 1 A 109 109 ALA CA C 243 50.505 51.455 -0.950 1
1 1356 . 5 1 1 A 109 109 ALA CB C 243 19.584 19.652 -0.068 1
1 1357 . 5 1 1 A 109 109 ALA N N 243 129.619 127.802 1.817 1
1 1358 . 5 1 1 A 110 110 ASP H H 244 7.578 8.620 -1.042 1
1 1359 . 5 1 1 A 110 110 ASP HA H 244 4.424 5.230 -0.806 1
1 1362 . 5 1 1 A 110 110 ASP C C 244 175.259 174.782 0.477 1
1 1363 . 5 1 1 A 110 110 ASP CA C 244 54.489 52.557 1.932 1
1 1364 . 5 1 1 A 110 110 ASP CB C 244 42.693 44.019 -1.326 1
1 1365 . 5 1 1 A 110 110 ASP N N 244 125.434 121.918 3.516 1
1 4 . 6 1 1 A 2 2 PRO HA H -4 4.403 4.633 -0.230 1
1 11 . 6 1 1 A 2 2 PRO C C -4 176.990 177.083 -0.093 1
1 12 . 6 1 1 A 2 2 PRO CA C -4 63.131 62.824 0.307 1
1 13 . 6 1 1 A 2 2 PRO CB C -4 32.342 32.473 -0.131 1
1 16 . 6 1 1 A 3 3 LEU H H -3 8.483 8.837 -0.354 1
1 17 . 6 1 1 A 3 3 LEU HA H -3 4.333 4.362 -0.029 1
1 27 . 6 1 1 A 3 3 LEU C C -3 177.991 176.897 1.094 1
1 28 . 6 1 1 A 3 3 LEU CA C -3 55.314 55.291 0.023 1
1 29 . 6 1 1 A 3 3 LEU CB C -3 42.244 43.409 -1.165 1
1 33 . 6 1 1 A 3 3 LEU N N -3 122.986 121.730 1.256 1
1 34 . 6 1 1 A 4 4 GLY H H -2 8.397 7.954 0.443 1
1 35 . 6 1 1 A 4 4 GLY HA2 H -2 4.024 4.112 -0.088 1
1 36 . 6 1 1 A 4 4 GLY HA3 H -2 3.976 4.116 -0.140 1
1 37 . 6 1 1 A 4 4 GLY C C -2 174.360 173.696 0.664 1
1 38 . 6 1 1 A 4 4 GLY CA C -2 45.434 44.480 0.954 1
1 39 . 6 1 1 A 4 4 GLY N N -2 110.666 108.345 2.321 1
1 56 . 6 1 1 A 7 7 SER H H 141 7.913 7.681 0.232 1
1 57 . 6 1 1 A 7 7 SER HA H 141 5.657 5.467 0.190 1
1 60 . 6 1 1 A 7 7 SER C C 141 173.753 172.320 1.433 1
1 61 . 6 1 1 A 7 7 SER CA C 141 56.758 57.643 -0.885 1
1 62 . 6 1 1 A 7 7 SER CB C 141 66.774 66.061 0.713 1
1 63 . 6 1 1 A 7 7 SER N N 141 113.824 111.135 2.689 1
1 64 . 6 1 1 A 8 8 LYS H H 142 8.656 8.284 0.372 1
1 65 . 6 1 1 A 8 8 LYS HA H 142 4.543 4.916 -0.373 1
1 74 . 6 1 1 A 8 8 LYS C C 142 174.403 174.701 -0.298 1
1 75 . 6 1 1 A 8 8 LYS CA C 142 55.578 54.376 1.202 1
1 76 . 6 1 1 A 8 8 LYS CB C 142 36.561 35.760 0.801 1
1 80 . 6 1 1 A 8 8 LYS N N 142 123.076 120.127 2.949 1
1 81 . 6 1 1 A 9 9 LYS H H 143 8.623 8.463 0.160 1
1 82 . 6 1 1 A 9 9 LYS HA H 143 4.119 4.338 -0.219 1
1 91 . 6 1 1 A 9 9 LYS C C 143 176.144 175.537 0.607 1
1 92 . 6 1 1 A 9 9 LYS CA C 143 56.683 56.157 0.526 1
1 93 . 6 1 1 A 9 9 LYS CB C 143 32.580 32.524 0.056 1
1 97 . 6 1 1 A 9 9 LYS N N 143 129.542 123.701 5.841 1
1 98 . 6 1 1 A 10 10 ALA H H 144 8.151 8.757 -0.606 1
1 99 . 6 1 1 A 10 10 ALA HA H 144 5.208 4.941 0.267 1
1 103 . 6 1 1 A 10 10 ALA C C 144 175.577 175.000 0.577 1
1 104 . 6 1 1 A 10 10 ALA CA C 144 51.226 51.227 -0.001 1
1 105 . 6 1 1 A 10 10 ALA CB C 144 25.299 24.131 1.168 1
1 106 . 6 1 1 A 10 10 ALA N N 144 127.933 127.855 0.078 1
1 107 . 6 1 1 A 11 11 SER H H 145 8.679 8.750 -0.071 1
1 108 . 6 1 1 A 11 11 SER HA H 145 5.431 5.720 -0.289 1
1 111 . 6 1 1 A 11 11 SER C C 145 173.072 173.303 -0.231 1
1 112 . 6 1 1 A 11 11 SER CA C 145 57.772 56.937 0.835 1
1 113 . 6 1 1 A 11 11 SER CB C 145 67.301 66.086 1.215 1
1 114 . 6 1 1 A 11 11 SER N N 145 116.245 115.467 0.778 1
1 115 . 6 1 1 A 12 12 HIS H H 146 9.962 9.522 0.440 1
1 116 . 6 1 1 A 12 12 HIS HA H 146 6.332 6.103 0.229 1
1 121 . 6 1 1 A 12 12 HIS C C 146 173.006 172.467 0.539 1
1 122 . 6 1 1 A 12 12 HIS CA C 146 55.020 54.190 0.830 1
1 123 . 6 1 1 A 12 12 HIS CB C 146 37.071 34.375 2.696 1
1 126 . 6 1 1 A 12 12 HIS N N 146 119.181 118.470 0.711 1
1 127 . 6 1 1 A 13 13 ILE H H 147 8.976 8.997 -0.021 1
1 128 . 6 1 1 A 13 13 ILE HA H 147 3.528 4.583 -1.055 1
1 138 . 6 1 1 A 13 13 ILE C C 147 173.010 173.861 -0.851 1
1 139 . 6 1 1 A 13 13 ILE CA C 147 61.273 59.497 1.776 1
1 140 . 6 1 1 A 13 13 ILE CB C 147 41.773 41.758 0.015 1
1 144 . 6 1 1 A 13 13 ILE N N 147 121.873 119.509 2.364 1
1 145 . 6 1 1 A 14 14 LEU H H 148 7.627 8.915 -1.288 1
1 146 . 6 1 1 A 14 14 LEU HA H 148 4.814 5.203 -0.389 1
1 156 . 6 1 1 A 14 14 LEU C C 148 174.112 174.320 -0.208 1
1 157 . 6 1 1 A 14 14 LEU CA C 148 52.574 52.917 -0.343 1
1 158 . 6 1 1 A 14 14 LEU CB C 148 45.643 45.143 0.500 1
1 162 . 6 1 1 A 14 14 LEU N N 148 127.112 129.179 -2.067 1
1 163 . 6 1 1 A 15 15 ILE H H 149 9.524 9.312 0.212 1
1 164 . 6 1 1 A 15 15 ILE HA H 149 4.362 4.710 -0.348 1
1 174 . 6 1 1 A 15 15 ILE C C 149 175.452 175.258 0.194 1
1 175 . 6 1 1 A 15 15 ILE CA C 149 58.516 60.416 -1.900 1
1 176 . 6 1 1 A 15 15 ILE CB C 149 36.560 39.900 -3.340 1
1 180 . 6 1 1 A 15 15 ILE N N 149 128.652 126.833 1.819 1
1 181 . 6 1 1 A 16 16 LYS H H 150 8.035 8.460 -0.425 1
1 182 . 6 1 1 A 16 16 LYS HA H 150 4.319 4.537 -0.218 1
1 191 . 6 1 1 A 16 16 LYS C C 150 175.038 176.263 -1.225 1
1 192 . 6 1 1 A 16 16 LYS CA C 150 57.817 56.380 1.437 1
1 193 . 6 1 1 A 16 16 LYS CB C 150 34.853 33.021 1.832 1
1 197 . 6 1 1 A 16 16 LYS N N 150 129.153 127.776 1.377 1
1 198 . 6 1 1 A 17 17 VAL H H 151 8.016 8.330 -0.314 1
1 199 . 6 1 1 A 17 17 VAL HA H 151 4.873 4.694 0.179 1
1 207 . 6 1 1 A 17 17 VAL C C 151 176.647 175.500 1.147 1
1 208 . 6 1 1 A 17 17 VAL CA C 151 60.088 61.529 -1.441 1
1 209 . 6 1 1 A 17 17 VAL CB C 151 34.082 32.756 1.326 1
1 212 . 6 1 1 A 17 17 VAL N N 151 121.288 124.645 -3.357 1
1 213 . 6 1 1 A 18 18 LYS H H 152 8.443 8.735 -0.292 1
1 214 . 6 1 1 A 18 18 LYS HA H 152 4.334 4.754 -0.420 1
1 223 . 6 1 1 A 18 18 LYS C C 152 176.345 176.747 -0.402 1
1 224 . 6 1 1 A 18 18 LYS CA C 152 57.016 54.377 2.639 1
1 225 . 6 1 1 A 18 18 LYS CB C 152 33.222 35.304 -2.082 1
1 229 . 6 1 1 A 18 18 LYS N N 152 128.408 127.446 0.962 1
1 230 . 6 1 1 A 19 19 SER H H 153 9.067 8.853 0.214 1
1 231 . 6 1 1 A 19 19 SER HA H 153 4.457 4.315 0.142 1
1 234 . 6 1 1 A 19 19 SER C C 153 174.236 173.672 0.564 1
1 235 . 6 1 1 A 19 19 SER CA C 153 59.642 59.993 -0.351 1
1 236 . 6 1 1 A 19 19 SER CB C 153 64.347 63.859 0.488 1
1 237 . 6 1 1 A 19 19 SER N N 153 121.522 117.948 3.574 1
1 238 . 6 1 1 A 20 20 LYS H H 154 7.961 7.793 0.168 1
1 239 . 6 1 1 A 20 20 LYS HA H 154 4.558 4.693 -0.135 1
1 244 . 6 1 1 A 20 20 LYS C C 154 177.256 176.194 1.062 1
1 245 . 6 1 1 A 20 20 LYS CA C 154 55.249 55.404 -0.155 1
1 246 . 6 1 1 A 20 20 LYS CB C 154 34.531 35.750 -1.219 1
1 248 . 6 1 1 A 20 20 LYS N N 154 120.270 120.036 0.234 1
1 249 . 6 1 1 A 21 21 LYS HA H 155 4.003 3.956 0.047 1
1 258 . 6 1 1 A 21 21 LYS C C 155 177.015 178.132 -1.117 1
1 259 . 6 1 1 A 21 21 LYS CA C 155 59.091 59.007 0.084 1
1 260 . 6 1 1 A 21 21 LYS CB C 155 32.394 32.224 0.170 1
1 264 . 6 1 1 A 22 22 SER H H 156 7.625 7.966 -0.341 1
1 265 . 6 1 1 A 22 22 SER HA H 156 4.293 4.381 -0.088 1
1 268 . 6 1 1 A 22 22 SER C C 156 174.843 174.678 0.165 1
1 269 . 6 1 1 A 22 22 SER CA C 156 57.966 61.344 -3.378 1
1 270 . 6 1 1 A 22 22 SER CB C 156 63.369 63.117 0.252 1
1 271 . 6 1 1 A 22 22 SER N N 156 109.549 114.658 -5.109 1
1 272 . 6 1 1 A 23 23 ASP H H 157 7.701 7.426 0.275 1
1 273 . 6 1 1 A 23 23 ASP HA H 157 4.548 4.847 -0.299 1
1 276 . 6 1 1 A 23 23 ASP C C 157 176.544 176.113 0.431 1
1 277 . 6 1 1 A 23 23 ASP CA C 157 55.242 53.534 1.708 1
1 278 . 6 1 1 A 23 23 ASP CB C 157 41.103 39.690 1.413 1
1 279 . 6 1 1 A 23 23 ASP N N 157 124.536 120.911 3.625 1
1 280 . 6 1 1 A 24 24 LYS H H 158 8.583 8.509 0.074 1
1 281 . 6 1 1 A 24 24 LYS HA H 158 4.252 3.982 0.270 1
1 290 . 6 1 1 A 24 24 LYS C C 158 176.813 178.190 -1.377 1
1 291 . 6 1 1 A 24 24 LYS CA C 158 57.148 58.525 -1.377 1
1 292 . 6 1 1 A 24 24 LYS CB C 158 33.200 32.532 0.668 1
1 296 . 6 1 1 A 24 24 LYS N N 158 122.372 126.295 -3.923 1
1 297 . 6 1 1 A 25 25 GLU H H 159 8.001 8.014 -0.013 1
1 298 . 6 1 1 A 25 25 GLU HA H 159 4.521 4.082 0.439 1
1 303 . 6 1 1 A 25 25 GLU C C 159 175.995 176.864 -0.869 1
1 304 . 6 1 1 A 25 25 GLU CA C 159 55.727 58.488 -2.761 1
1 305 . 6 1 1 A 25 25 GLU CB C 159 31.918 29.937 1.981 1
1 307 . 6 1 1 A 25 25 GLU N N 159 118.705 118.113 0.592 1
1 308 . 6 1 1 A 26 26 GLY H H 160 8.458 7.327 1.131 1
1 309 . 6 1 1 A 26 26 GLY HA2 H 160 3.946 4.043 -0.097 1
1 310 . 6 1 1 A 26 26 GLY HA3 H 160 3.511 4.050 -0.539 1
1 311 . 6 1 1 A 26 26 GLY C C 160 172.201 171.782 0.419 1
1 312 . 6 1 1 A 26 26 GLY CA C 160 44.038 45.870 -1.832 1
1 313 . 6 1 1 A 26 26 GLY N N 160 107.642 105.119 2.523 1
1 314 . 6 1 1 A 27 27 LEU H H 161 8.259 8.290 -0.031 1
1 315 . 6 1 1 A 27 27 LEU HA H 161 4.775 5.128 -0.353 1
1 325 . 6 1 1 A 27 27 LEU C C 161 177.422 175.200 2.222 1
1 326 . 6 1 1 A 27 27 LEU CA C 161 53.322 53.177 0.145 1
1 327 . 6 1 1 A 27 27 LEU CB C 161 45.576 45.508 0.068 1
1 331 . 6 1 1 A 27 27 LEU N N 161 119.856 122.338 -2.482 1
1 332 . 6 1 1 A 28 28 ASP H H 162 8.848 8.159 0.689 1
1 333 . 6 1 1 A 28 28 ASP HA H 162 4.644 4.462 0.182 1
1 336 . 6 1 1 A 28 28 ASP C C 162 176.630 177.125 -0.495 1
1 337 . 6 1 1 A 28 28 ASP CA C 162 55.195 54.807 0.388 1
1 338 . 6 1 1 A 28 28 ASP CB C 162 41.673 42.664 -0.991 1
1 339 . 6 1 1 A 28 28 ASP N N 162 122.434 122.608 -0.174 1
1 340 . 6 1 1 A 29 29 ASP H H 163 8.720 9.069 -0.349 1
1 341 . 6 1 1 A 29 29 ASP HA H 163 4.386 4.430 -0.044 1
1 344 . 6 1 1 A 29 29 ASP C C 163 176.604 178.545 -1.941 1
1 345 . 6 1 1 A 29 29 ASP CA C 163 59.690 56.756 2.934 1
1 346 . 6 1 1 A 29 29 ASP CB C 163 42.964 39.949 3.015 1
1 347 . 6 1 1 A 29 29 ASP N N 163 121.460 125.254 -3.794 1
1 348 . 6 1 1 A 30 30 LYS H H 164 8.434 7.970 0.464 1
1 349 . 6 1 1 A 30 30 LYS HA H 164 3.901 4.183 -0.282 1
1 358 . 6 1 1 A 30 30 LYS C C 164 179.479 179.009 0.470 1
1 359 . 6 1 1 A 30 30 LYS CA C 164 60.047 59.020 1.027 1
1 360 . 6 1 1 A 30 30 LYS CB C 164 32.038 32.577 -0.539 1
1 364 . 6 1 1 A 30 30 LYS N N 164 116.627 119.324 -2.697 1
1 365 . 6 1 1 A 31 31 GLU H H 165 7.755 8.313 -0.558 1
1 366 . 6 1 1 A 31 31 GLU HA H 165 3.998 4.032 -0.034 1
1 371 . 6 1 1 A 31 31 GLU C C 165 179.031 179.291 -0.260 1
1 372 . 6 1 1 A 31 31 GLU CA C 165 59.335 59.029 0.306 1
1 373 . 6 1 1 A 31 31 GLU CB C 165 29.972 29.649 0.323 1
1 375 . 6 1 1 A 31 31 GLU N N 165 120.456 120.264 0.192 1
1 376 . 6 1 1 A 32 32 ALA H H 166 9.060 8.631 0.429 1
1 377 . 6 1 1 A 32 32 ALA HA H 166 3.871 4.088 -0.217 1
1 381 . 6 1 1 A 32 32 ALA C C 166 178.029 179.207 -1.178 1
1 382 . 6 1 1 A 32 32 ALA CA C 166 54.997 55.232 -0.235 1
1 383 . 6 1 1 A 32 32 ALA CB C 166 19.727 18.674 1.053 1
1 384 . 6 1 1 A 32 32 ALA N N 166 124.406 122.617 1.789 1
1 385 . 6 1 1 A 33 33 LYS H H 167 8.228 7.720 0.508 1
1 386 . 6 1 1 A 33 33 LYS HA H 167 2.595 3.156 -0.561 1
1 395 . 6 1 1 A 33 33 LYS C C 167 177.938 178.134 -0.196 1
1 396 . 6 1 1 A 33 33 LYS CA C 167 59.573 59.331 0.242 1
1 397 . 6 1 1 A 33 33 LYS CB C 167 32.098 32.036 0.062 1
1 401 . 6 1 1 A 33 33 LYS N N 167 119.833 118.375 1.458 1
1 402 . 6 1 1 A 34 34 GLN H H 168 7.392 7.984 -0.592 1
1 403 . 6 1 1 A 34 34 GLN HA H 168 3.943 3.936 0.007 1
1 410 . 6 1 1 A 34 34 GLN C C 168 178.323 178.503 -0.180 1
1 411 . 6 1 1 A 34 34 GLN CA C 168 58.883 59.330 -0.447 1
1 412 . 6 1 1 A 34 34 GLN CB C 168 28.485 28.229 0.256 1
1 414 . 6 1 1 A 34 34 GLN N N 168 117.208 118.214 -1.006 1
1 416 . 6 1 1 A 35 35 LYS H H 169 7.994 8.010 -0.016 1
1 417 . 6 1 1 A 35 35 LYS HA H 169 4.067 3.998 0.069 1
1 426 . 6 1 1 A 35 35 LYS C C 169 178.161 178.451 -0.290 1
1 427 . 6 1 1 A 35 35 LYS CA C 169 58.437 59.397 -0.960 1
1 428 . 6 1 1 A 35 35 LYS CB C 169 31.611 32.286 -0.675 1
1 432 . 6 1 1 A 35 35 LYS N N 169 120.898 119.791 1.107 1
1 433 . 6 1 1 A 36 36 ALA H H 170 8.431 8.115 0.316 1
1 434 . 6 1 1 A 36 36 ALA HA H 170 3.738 4.038 -0.300 1
1 438 . 6 1 1 A 36 36 ALA C C 170 178.862 179.672 -0.810 1
1 439 . 6 1 1 A 36 36 ALA CA C 170 55.351 55.024 0.327 1
1 440 . 6 1 1 A 36 36 ALA CB C 170 18.295 18.535 -0.240 1
1 441 . 6 1 1 A 36 36 ALA N N 170 120.641 120.199 0.442 1
1 442 . 6 1 1 A 37 37 GLU H H 171 8.412 8.343 0.069 1
1 443 . 6 1 1 A 37 37 GLU HA H 171 3.867 3.926 -0.059 1
1 448 . 6 1 1 A 37 37 GLU C C 171 179.255 178.813 0.442 1
1 449 . 6 1 1 A 37 37 GLU CA C 171 59.543 59.569 -0.026 1
1 450 . 6 1 1 A 37 37 GLU CB C 171 29.569 29.628 -0.059 1
1 452 . 6 1 1 A 37 37 GLU N N 171 118.224 117.748 0.476 1
1 453 . 6 1 1 A 38 38 GLU H H 172 8.019 8.222 -0.203 1
1 454 . 6 1 1 A 38 38 GLU HA H 172 3.952 4.058 -0.106 1
1 459 . 6 1 1 A 38 38 GLU C C 172 180.250 178.524 1.726 1
1 460 . 6 1 1 A 38 38 GLU CA C 172 59.627 59.227 0.400 1
1 461 . 6 1 1 A 38 38 GLU CB C 172 29.368 29.095 0.273 1
1 463 . 6 1 1 A 38 38 GLU N N 172 121.250 118.541 2.709 1
1 464 . 6 1 1 A 39 39 ILE H H 173 8.174 7.587 0.587 1
1 465 . 6 1 1 A 39 39 ILE HA H 173 3.643 3.787 -0.144 1
1 475 . 6 1 1 A 39 39 ILE C C 173 177.568 177.842 -0.274 1
1 476 . 6 1 1 A 39 39 ILE CA C 173 64.869 63.658 1.211 1
1 477 . 6 1 1 A 39 39 ILE CB C 173 38.160 37.292 0.868 1
1 481 . 6 1 1 A 39 39 ILE N N 173 121.527 117.048 4.479 1
1 482 . 6 1 1 A 40 40 GLN H H 174 8.860 8.176 0.684 1
1 483 . 6 1 1 A 40 40 GLN HA H 174 3.533 3.997 -0.464 1
1 490 . 6 1 1 A 40 40 GLN C C 174 179.022 178.349 0.673 1
1 491 . 6 1 1 A 40 40 GLN CA C 174 61.316 59.116 2.200 1
1 492 . 6 1 1 A 40 40 GLN CB C 174 26.604 28.282 -1.678 1
1 494 . 6 1 1 A 40 40 GLN N N 174 121.956 121.030 0.926 1
1 496 . 6 1 1 A 41 41 LYS H H 175 7.879 7.771 0.108 1
1 497 . 6 1 1 A 41 41 LYS HA H 175 3.777 4.057 -0.280 1
1 506 . 6 1 1 A 41 41 LYS C C 175 178.779 179.366 -0.587 1
1 507 . 6 1 1 A 41 41 LYS CA C 175 59.701 59.125 0.576 1
1 508 . 6 1 1 A 41 41 LYS CB C 175 32.581 31.941 0.640 1
1 512 . 6 1 1 A 41 41 LYS N N 175 119.012 118.175 0.837 1
1 513 . 6 1 1 A 42 42 GLU H H 176 7.447 7.713 -0.266 1
1 514 . 6 1 1 A 42 42 GLU HA H 176 4.059 4.124 -0.065 1
1 519 . 6 1 1 A 42 42 GLU C C 176 180.058 179.172 0.886 1
1 520 . 6 1 1 A 42 42 GLU CA C 176 59.456 58.978 0.478 1
1 521 . 6 1 1 A 42 42 GLU CB C 176 29.923 30.066 -0.143 1
1 523 . 6 1 1 A 42 42 GLU N N 176 120.054 119.710 0.344 1
1 524 . 6 1 1 A 43 43 VAL H H 177 8.618 8.125 0.493 1
1 525 . 6 1 1 A 43 43 VAL HA H 177 3.986 3.908 0.078 1
1 533 . 6 1 1 A 43 43 VAL C C 177 176.459 178.050 -1.591 1
1 534 . 6 1 1 A 43 43 VAL CA C 177 63.923 64.847 -0.924 1
1 535 . 6 1 1 A 43 43 VAL CB C 177 31.899 31.351 0.548 1
1 538 . 6 1 1 A 43 43 VAL N N 177 114.191 117.173 -2.982 1
1 539 . 6 1 1 A 44 44 SER H H 178 8.052 8.468 -0.416 1
1 540 . 6 1 1 A 44 44 SER HA H 178 4.098 4.417 -0.319 1
1 543 . 6 1 1 A 44 44 SER C C 178 176.548 176.152 0.396 1
1 544 . 6 1 1 A 44 44 SER CA C 178 61.160 61.475 -0.315 1
1 545 . 6 1 1 A 44 44 SER CB C 178 62.959 63.302 -0.343 1
1 546 . 6 1 1 A 44 44 SER N N 178 114.202 117.358 -3.156 1
1 547 . 6 1 1 A 45 45 LYS H H 179 7.083 8.140 -1.057 1
1 548 . 6 1 1 A 45 45 LYS HA H 179 4.140 4.226 -0.086 1
1 557 . 6 1 1 A 45 45 LYS C C 179 177.288 176.131 1.157 1
1 558 . 6 1 1 A 45 45 LYS CA C 179 58.469 57.801 0.668 1
1 559 . 6 1 1 A 45 45 LYS CB C 179 32.671 31.768 0.903 1
1 563 . 6 1 1 A 45 45 LYS N N 179 120.935 117.635 3.300 1
1 564 . 6 1 1 A 46 46 ASP H H 180 7.098 7.876 -0.778 1
1 565 . 6 1 1 A 46 46 ASP HA H 180 4.917 4.982 -0.065 1
1 568 . 6 1 1 A 46 46 ASP CA C 180 51.492 51.664 -0.172 1
1 569 . 6 1 1 A 46 46 ASP CB C 180 40.595 41.374 -0.779 1
1 570 . 6 1 1 A 46 46 ASP N N 180 112.836 120.096 -7.260 1
1 571 . 6 1 1 A 47 47 PRO HA H 181 4.681 4.486 0.195 1
1 578 . 6 1 1 A 47 47 PRO C C 181 179.248 177.718 1.530 1
1 579 . 6 1 1 A 47 47 PRO CA C 181 64.718 64.424 0.294 1
1 580 . 6 1 1 A 47 47 PRO CB C 181 32.159 31.997 0.162 1
1 583 . 6 1 1 A 48 48 SER H H 182 8.248 8.018 0.230 1
1 584 . 6 1 1 A 48 48 SER HA H 182 4.378 4.348 0.030 1
1 587 . 6 1 1 A 48 48 SER C C 182 176.071 175.899 0.172 1
1 588 . 6 1 1 A 48 48 SER CA C 182 61.377 60.706 0.671 1
1 589 . 6 1 1 A 48 48 SER CB C 182 62.455 63.128 -0.673 1
1 590 . 6 1 1 A 48 48 SER N N 182 116.986 113.193 3.793 1
1 591 . 6 1 1 A 49 49 LYS H H 183 7.842 7.550 0.292 1
1 592 . 6 1 1 A 49 49 LYS HA H 183 4.482 4.274 0.208 1
1 601 . 6 1 1 A 49 49 LYS C C 183 175.605 177.931 -2.326 1
1 602 . 6 1 1 A 49 49 LYS CA C 183 55.824 57.386 -1.562 1
1 603 . 6 1 1 A 49 49 LYS CB C 183 32.834 32.846 -0.012 1
1 607 . 6 1 1 A 49 49 LYS N N 183 121.698 120.207 1.491 1
1 608 . 6 1 1 A 50 50 PHE H H 184 7.634 7.922 -0.288 1
1 609 . 6 1 1 A 50 50 PHE HA H 184 3.510 4.277 -0.767 1
1 617 . 6 1 1 A 50 50 PHE C C 184 176.214 177.636 -1.422 1
1 618 . 6 1 1 A 50 50 PHE CA C 184 63.276 61.161 2.115 1
1 619 . 6 1 1 A 50 50 PHE CB C 184 40.948 38.983 1.965 1
1 623 . 6 1 1 A 50 50 PHE N N 184 120.120 121.849 -1.729 1
1 624 . 6 1 1 A 51 51 GLY H H 185 8.855 8.556 0.299 1
1 625 . 6 1 1 A 51 51 GLY HA2 H 185 3.993 3.871 0.122 1
1 626 . 6 1 1 A 51 51 GLY HA3 H 185 3.958 3.922 0.036 1
1 627 . 6 1 1 A 51 51 GLY C C 185 175.169 176.353 -1.184 1
1 628 . 6 1 1 A 51 51 GLY CA C 185 47.475 47.428 0.047 1
1 629 . 6 1 1 A 51 51 GLY N N 185 105.550 105.709 -0.159 1
1 630 . 6 1 1 A 52 52 GLU H H 186 7.917 7.640 0.277 1
1 631 . 6 1 1 A 52 52 GLU HA H 186 4.006 4.072 -0.066 1
1 636 . 6 1 1 A 52 52 GLU C C 186 179.499 179.497 0.002 1
1 637 . 6 1 1 A 52 52 GLU CA C 186 58.904 59.211 -0.307 1
1 638 . 6 1 1 A 52 52 GLU CB C 186 29.700 29.720 -0.020 1
1 640 . 6 1 1 A 52 52 GLU N N 186 121.929 121.518 0.411 1
1 641 . 6 1 1 A 53 53 ILE H H 187 7.936 8.140 -0.204 1
1 642 . 6 1 1 A 53 53 ILE HA H 187 3.648 3.655 -0.007 1
1 652 . 6 1 1 A 53 53 ILE C C 187 177.886 177.681 0.205 1
1 653 . 6 1 1 A 53 53 ILE CA C 187 64.366 65.203 -0.837 1
1 654 . 6 1 1 A 53 53 ILE CB C 187 36.478 37.660 -1.182 1
1 658 . 6 1 1 A 53 53 ILE N N 187 120.991 121.331 -0.340 1
1 659 . 6 1 1 A 54 54 ALA H H 188 8.895 8.539 0.356 1
1 660 . 6 1 1 A 54 54 ALA HA H 188 3.629 3.757 -0.128 1
1 664 . 6 1 1 A 54 54 ALA C C 188 179.437 179.267 0.170 1
1 665 . 6 1 1 A 54 54 ALA CA C 188 55.974 55.552 0.422 1
1 666 . 6 1 1 A 54 54 ALA CB C 188 17.591 18.419 -0.828 1
1 667 . 6 1 1 A 54 54 ALA N N 188 125.308 122.092 3.216 1
1 668 . 6 1 1 A 55 55 LYS H H 189 8.049 7.436 0.613 1
1 669 . 6 1 1 A 55 55 LYS HA H 189 4.106 3.901 0.205 1
1 678 . 6 1 1 A 55 55 LYS C C 189 178.995 178.243 0.752 1
1 679 . 6 1 1 A 55 55 LYS CA C 189 59.312 59.175 0.137 1
1 680 . 6 1 1 A 55 55 LYS CB C 189 32.647 31.892 0.755 1
1 684 . 6 1 1 A 55 55 LYS N N 189 116.835 118.317 -1.482 1
1 685 . 6 1 1 A 56 56 LYS H H 190 7.215 7.677 -0.462 1
1 686 . 6 1 1 A 56 56 LYS HA H 190 4.172 4.242 -0.070 1
1 695 . 6 1 1 A 56 56 LYS C C 190 177.897 178.038 -0.141 1
1 696 . 6 1 1 A 56 56 LYS CA C 190 58.418 58.043 0.375 1
1 697 . 6 1 1 A 56 56 LYS CB C 190 34.652 33.243 1.409 1
1 701 . 6 1 1 A 56 56 LYS N N 190 117.170 118.033 -0.863 1
1 702 . 6 1 1 A 57 57 GLU H H 191 8.572 7.854 0.718 1
1 703 . 6 1 1 A 57 57 GLU HA H 191 4.643 4.353 0.290 1
1 708 . 6 1 1 A 57 57 GLU C C 191 177.903 176.059 1.844 1
1 709 . 6 1 1 A 57 57 GLU CA C 191 55.708 56.698 -0.990 1
1 710 . 6 1 1 A 57 57 GLU CB C 191 32.460 30.980 1.480 1
1 712 . 6 1 1 A 57 57 GLU N N 191 113.316 116.902 -3.586 1
1 713 . 6 1 1 A 58 58 SER H H 192 8.550 7.711 0.839 1
1 714 . 6 1 1 A 58 58 SER HA H 192 4.149 4.386 -0.237 1
1 717 . 6 1 1 A 58 58 SER C C 192 176.161 175.053 1.108 1
1 718 . 6 1 1 A 58 58 SER CA C 192 58.403 57.999 0.404 1
1 719 . 6 1 1 A 58 58 SER CB C 192 64.392 64.380 0.012 1
1 720 . 6 1 1 A 58 58 SER N N 192 109.861 115.643 -5.782 1
1 721 . 6 1 1 A 59 59 MET H H 193 9.533 8.988 0.545 1
1 722 . 6 1 1 A 59 59 MET HA H 193 4.457 4.582 -0.125 1
1 730 . 6 1 1 A 59 59 MET C C 193 175.204 175.778 -0.574 1
1 731 . 6 1 1 A 59 59 MET CA C 193 55.781 55.281 0.500 1
1 732 . 6 1 1 A 59 59 MET CB C 193 32.855 32.600 0.255 1
1 735 . 6 1 1 A 59 59 MET N N 193 124.493 123.565 0.928 1
1 736 . 6 1 1 A 60 60 ASP H H 194 7.514 7.361 0.153 1
1 737 . 6 1 1 A 60 60 ASP HA H 194 4.886 4.574 0.312 1
1 740 . 6 1 1 A 60 60 ASP C C 194 175.517 176.796 -1.279 1
1 741 . 6 1 1 A 60 60 ASP CA C 194 52.286 53.341 -1.055 1
1 742 . 6 1 1 A 60 60 ASP CB C 194 40.222 40.241 -0.019 1
1 743 . 6 1 1 A 60 60 ASP N N 194 117.785 121.744 -3.959 1
1 744 . 6 1 1 A 61 61 THR H H 195 8.118 7.834 0.284 1
1 745 . 6 1 1 A 61 61 THR HA H 195 3.918 4.003 -0.085 1
1 750 . 6 1 1 A 61 61 THR C C 195 176.269 176.495 -0.226 1
1 751 . 6 1 1 A 61 61 THR CA C 195 65.469 64.773 0.696 1
1 752 . 6 1 1 A 61 61 THR CB C 195 68.741 68.695 0.046 1
1 754 . 6 1 1 A 61 61 THR N N 195 120.765 118.677 2.088 1
1 755 . 6 1 1 A 62 62 GLY H H 196 8.399 8.550 -0.151 1
1 756 . 6 1 1 A 62 62 GLY HA2 H 196 3.932 3.950 -0.018 1
1 757 . 6 1 1 A 62 62 GLY HA3 H 196 3.900 3.951 -0.051 1
1 758 . 6 1 1 A 62 62 GLY C C 196 174.948 174.953 -0.005 1
1 759 . 6 1 1 A 62 62 GLY CA C 196 46.768 46.605 0.163 1
1 760 . 6 1 1 A 62 62 GLY N N 196 108.183 111.893 -3.710 1
1 761 . 6 1 1 A 63 63 SER H H 197 7.265 7.944 -0.679 1
1 762 . 6 1 1 A 63 63 SER HA H 197 4.554 4.668 -0.114 1
1 765 . 6 1 1 A 63 63 SER C C 197 177.630 175.419 2.211 1
1 766 . 6 1 1 A 63 63 SER CA C 197 59.550 60.635 -1.085 1
1 767 . 6 1 1 A 63 63 SER CB C 197 65.504 64.647 0.857 1
1 768 . 6 1 1 A 63 63 SER N N 197 111.815 115.815 -4.000 1
1 769 . 6 1 1 A 64 64 ALA H H 198 8.675 8.630 0.045 1
1 770 . 6 1 1 A 64 64 ALA HA H 198 3.801 3.982 -0.181 1
1 774 . 6 1 1 A 64 64 ALA C C 198 178.492 179.802 -1.310 1
1 775 . 6 1 1 A 64 64 ALA CA C 198 56.794 55.405 1.389 1
1 776 . 6 1 1 A 64 64 ALA CB C 198 18.951 18.887 0.064 1
1 777 . 6 1 1 A 64 64 ALA N N 198 131.710 123.556 8.154 1
1 778 . 6 1 1 A 65 65 LYS H H 199 7.666 7.657 0.009 1
1 779 . 6 1 1 A 65 65 LYS HA H 199 4.175 4.113 0.062 1
1 788 . 6 1 1 A 65 65 LYS C C 199 177.159 177.332 -0.173 1
1 789 . 6 1 1 A 65 65 LYS CA C 199 57.735 58.472 -0.737 1
1 790 . 6 1 1 A 65 65 LYS CB C 199 31.948 32.224 -0.276 1
1 794 . 6 1 1 A 65 65 LYS N N 199 111.375 117.766 -6.391 1
1 795 . 6 1 1 A 66 66 LYS H H 200 7.545 7.492 0.053 1
1 796 . 6 1 1 A 66 66 LYS HA H 200 4.612 4.482 0.130 1
1 805 . 6 1 1 A 66 66 LYS C C 200 175.609 175.852 -0.243 1
1 806 . 6 1 1 A 66 66 LYS CA C 200 54.468 55.739 -1.271 1
1 807 . 6 1 1 A 66 66 LYS CB C 200 31.525 32.904 -1.379 1
1 811 . 6 1 1 A 66 66 LYS N N 200 121.421 118.723 2.698 1
1 812 . 6 1 1 A 67 67 ASP H H 201 7.630 8.186 -0.556 1
1 813 . 6 1 1 A 67 67 ASP HA H 201 4.306 4.380 -0.074 1
1 816 . 6 1 1 A 67 67 ASP C C 201 175.025 176.298 -1.273 1
1 817 . 6 1 1 A 67 67 ASP CA C 201 56.400 55.362 1.038 1
1 818 . 6 1 1 A 67 67 ASP CB C 201 38.315 39.025 -0.710 1
1 819 . 6 1 1 A 67 67 ASP N N 201 116.216 117.156 -0.940 1
1 820 . 6 1 1 A 68 68 GLY H H 202 8.368 8.703 -0.335 1
1 821 . 6 1 1 A 68 68 GLY HA2 H 202 4.316 3.950 0.366 1
1 822 . 6 1 1 A 68 68 GLY HA3 H 202 3.731 4.049 -0.318 1
1 823 . 6 1 1 A 68 68 GLY C C 202 174.139 174.565 -0.426 1
1 824 . 6 1 1 A 68 68 GLY CA C 202 45.514 45.398 0.116 1
1 825 . 6 1 1 A 68 68 GLY N N 202 105.095 104.982 0.113 1
1 826 . 6 1 1 A 69 69 GLU H H 203 7.534 8.126 -0.592 1
1 827 . 6 1 1 A 69 69 GLU HA H 203 4.479 4.452 0.027 1
1 832 . 6 1 1 A 69 69 GLU C C 203 176.961 176.054 0.907 1
1 833 . 6 1 1 A 69 69 GLU CA C 203 58.549 56.427 2.122 1
1 834 . 6 1 1 A 69 69 GLU CB C 203 30.998 30.409 0.589 1
1 836 . 6 1 1 A 69 69 GLU N N 203 120.426 120.165 0.261 1
1 837 . 6 1 1 A 70 70 LEU H H 204 8.962 9.069 -0.107 1
1 838 . 6 1 1 A 70 70 LEU HA H 204 4.438 4.634 -0.196 1
1 848 . 6 1 1 A 70 70 LEU C C 204 178.648 177.223 1.425 1
1 849 . 6 1 1 A 70 70 LEU CA C 204 53.977 55.096 -1.119 1
1 850 . 6 1 1 A 70 70 LEU CB C 204 43.612 43.633 -0.021 1
1 854 . 6 1 1 A 70 70 LEU N N 204 122.066 123.876 -1.810 1
1 855 . 6 1 1 A 71 71 GLY H H 205 8.104 7.604 0.500 1
1 856 . 6 1 1 A 71 71 GLY HA2 H 205 4.165 4.015 0.150 1
1 857 . 6 1 1 A 71 71 GLY HA3 H 205 3.552 4.122 -0.570 1
1 858 . 6 1 1 A 71 71 GLY C C 205 173.098 173.468 -0.370 1
1 859 . 6 1 1 A 71 71 GLY CA C 205 44.723 44.992 -0.269 1
1 860 . 6 1 1 A 71 71 GLY N N 205 110.168 106.768 3.400 1
1 861 . 6 1 1 A 72 72 TYR H H 206 8.457 8.670 -0.213 1
1 862 . 6 1 1 A 72 72 TYR HA H 206 4.184 4.685 -0.501 1
1 869 . 6 1 1 A 72 72 TYR C C 206 175.975 175.533 0.442 1
1 870 . 6 1 1 A 72 72 TYR CA C 206 59.722 58.831 0.891 1
1 871 . 6 1 1 A 72 72 TYR CB C 206 38.378 38.215 0.163 1
1 874 . 6 1 1 A 72 72 TYR N N 206 120.171 122.086 -1.915 1
1 875 . 6 1 1 A 73 73 VAL H H 207 8.782 9.129 -0.347 1
1 876 . 6 1 1 A 73 73 VAL HA H 207 4.056 4.497 -0.441 1
1 884 . 6 1 1 A 73 73 VAL C C 207 174.901 175.944 -1.043 1
1 885 . 6 1 1 A 73 73 VAL CA C 207 62.202 62.627 -0.425 1
1 886 . 6 1 1 A 73 73 VAL CB C 207 33.071 32.063 1.008 1
1 889 . 6 1 1 A 73 73 VAL N N 207 128.847 125.337 3.510 1
1 890 . 6 1 1 A 74 74 LEU H H 208 8.146 8.809 -0.663 1
1 891 . 6 1 1 A 74 74 LEU HA H 208 4.944 4.496 0.448 1
1 901 . 6 1 1 A 74 74 LEU C C 208 178.400 177.439 0.961 1
1 902 . 6 1 1 A 74 74 LEU CA C 208 53.520 54.847 -1.327 1
1 903 . 6 1 1 A 74 74 LEU CB C 208 43.499 42.327 1.172 1
1 907 . 6 1 1 A 74 74 LEU N N 208 127.599 129.373 -1.774 1
1 908 . 6 1 1 A 75 75 LYS H H 209 8.403 8.543 -0.140 1
1 909 . 6 1 1 A 75 75 LYS HA H 209 3.771 3.912 -0.141 1
1 918 . 6 1 1 A 75 75 LYS C C 209 177.536 177.560 -0.024 1
1 919 . 6 1 1 A 75 75 LYS CA C 209 58.385 59.007 -0.622 1
1 920 . 6 1 1 A 75 75 LYS CB C 209 32.459 32.106 0.353 1
1 924 . 6 1 1 A 75 75 LYS N N 209 123.798 122.777 1.021 1
1 925 . 6 1 1 A 76 76 GLY H H 210 9.997 9.323 0.674 1
1 926 . 6 1 1 A 76 76 GLY HA2 H 210 4.255 4.005 0.250 1
1 927 . 6 1 1 A 76 76 GLY HA3 H 210 3.791 4.007 -0.216 1
1 928 . 6 1 1 A 76 76 GLY C C 210 175.091 175.648 -0.557 1
1 929 . 6 1 1 A 76 76 GLY CA C 210 45.465 45.587 -0.122 1
1 930 . 6 1 1 A 76 76 GLY N N 210 114.705 113.197 1.508 1
1 931 . 6 1 1 A 77 77 GLN H H 211 7.726 7.945 -0.219 1
1 932 . 6 1 1 A 77 77 GLN HA H 211 4.373 4.199 0.174 1
1 939 . 6 1 1 A 77 77 GLN C C 211 176.301 176.015 0.286 1
1 940 . 6 1 1 A 77 77 GLN CA C 211 57.074 57.582 -0.508 1
1 941 . 6 1 1 A 77 77 GLN CB C 211 30.798 29.296 1.502 1
1 943 . 6 1 1 A 77 77 GLN N N 211 118.702 117.976 0.726 1
1 945 . 6 1 1 A 78 78 THR H H 212 8.225 7.458 0.767 1
1 946 . 6 1 1 A 78 78 THR HA H 212 4.620 4.627 -0.007 1
1 951 . 6 1 1 A 78 78 THR C C 212 173.920 174.234 -0.314 1
1 952 . 6 1 1 A 78 78 THR CA C 212 60.087 59.514 0.573 1
1 953 . 6 1 1 A 78 78 THR CB C 212 71.412 70.804 0.608 1
1 955 . 6 1 1 A 78 78 THR N N 212 111.935 110.827 1.108 1
1 956 . 6 1 1 A 79 79 ASP H H 213 8.372 8.493 -0.121 1
1 957 . 6 1 1 A 79 79 ASP HA H 213 4.470 4.553 -0.083 1
1 960 . 6 1 1 A 79 79 ASP C C 213 176.759 177.883 -1.124 1
1 961 . 6 1 1 A 79 79 ASP CA C 213 54.927 54.345 0.582 1
1 962 . 6 1 1 A 79 79 ASP CB C 213 43.859 41.516 2.343 1
1 963 . 6 1 1 A 79 79 ASP N N 213 122.093 121.350 0.743 1
1 964 . 6 1 1 A 80 80 LYS H H 214 8.740 8.794 -0.054 1
1 965 . 6 1 1 A 80 80 LYS HA H 214 4.027 4.060 -0.033 1
1 974 . 6 1 1 A 80 80 LYS C C 214 178.493 178.245 0.248 1
1 975 . 6 1 1 A 80 80 LYS CA C 214 59.802 59.118 0.684 1
1 976 . 6 1 1 A 80 80 LYS CB C 214 32.374 32.021 0.353 1
1 980 . 6 1 1 A 80 80 LYS N N 214 124.685 122.210 2.475 1
1 981 . 6 1 1 A 81 81 ASP H H 215 8.556 8.015 0.541 1
1 982 . 6 1 1 A 81 81 ASP HA H 215 4.566 4.373 0.193 1
1 985 . 6 1 1 A 81 81 ASP C C 215 178.889 178.553 0.336 1
1 986 . 6 1 1 A 81 81 ASP CA C 215 58.046 57.278 0.768 1
1 987 . 6 1 1 A 81 81 ASP CB C 215 40.872 40.701 0.171 1
1 988 . 6 1 1 A 81 81 ASP N N 215 121.413 120.029 1.384 1
1 989 . 6 1 1 A 82 82 PHE H H 216 8.205 8.289 -0.084 1
1 990 . 6 1 1 A 82 82 PHE HA H 216 3.686 4.076 -0.390 1
1 998 . 6 1 1 A 82 82 PHE C C 216 175.919 177.322 -1.403 1
1 999 . 6 1 1 A 82 82 PHE CA C 216 61.648 60.847 0.801 1
1 1000 . 6 1 1 A 82 82 PHE CB C 216 39.743 39.254 0.489 1
1 1004 . 6 1 1 A 82 82 PHE N N 216 124.401 122.112 2.289 1
1 1005 . 6 1 1 A 83 83 GLU H H 217 8.887 8.910 -0.023 1
1 1006 . 6 1 1 A 83 83 GLU HA H 217 3.704 4.177 -0.473 1
1 1011 . 6 1 1 A 83 83 GLU C C 217 177.788 178.949 -1.161 1
1 1012 . 6 1 1 A 83 83 GLU CA C 217 60.545 60.248 0.297 1
1 1013 . 6 1 1 A 83 83 GLU CB C 217 30.639 29.488 1.151 1
1 1015 . 6 1 1 A 83 83 GLU N N 217 119.421 119.067 0.354 1
1 1016 . 6 1 1 A 84 84 LYS H H 218 8.055 7.926 0.129 1
1 1017 . 6 1 1 A 84 84 LYS HA H 218 3.947 4.117 -0.170 1
1 1026 . 6 1 1 A 84 84 LYS C C 218 178.783 178.691 0.092 1
1 1027 . 6 1 1 A 84 84 LYS CA C 218 59.327 58.928 0.399 1
1 1028 . 6 1 1 A 84 84 LYS CB C 218 32.539 32.200 0.339 1
1 1032 . 6 1 1 A 84 84 LYS N N 218 117.821 119.565 -1.744 1
1 1033 . 6 1 1 A 85 85 ALA H H 219 7.059 7.700 -0.641 1
1 1034 . 6 1 1 A 85 85 ALA HA H 219 4.040 4.046 -0.006 1
1 1038 . 6 1 1 A 85 85 ALA C C 219 179.794 180.261 -0.467 1
1 1039 . 6 1 1 A 85 85 ALA CA C 219 54.407 54.866 -0.459 1
1 1040 . 6 1 1 A 85 85 ALA CB C 219 20.130 18.123 2.007 1
1 1041 . 6 1 1 A 85 85 ALA N N 219 118.905 121.310 -2.405 1
1 1042 . 6 1 1 A 86 86 LEU H H 220 8.157 8.384 -0.227 1
1 1043 . 6 1 1 A 86 86 LEU HA H 220 3.692 4.008 -0.316 1
1 1053 . 6 1 1 A 86 86 LEU C C 220 178.330 178.652 -0.322 1
1 1054 . 6 1 1 A 86 86 LEU CA C 220 57.752 58.145 -0.393 1
1 1055 . 6 1 1 A 86 86 LEU CB C 220 41.464 41.871 -0.407 1
1 1059 . 6 1 1 A 86 86 LEU N N 220 118.606 120.465 -1.859 1
1 1060 . 6 1 1 A 87 87 PHE H H 221 8.349 8.295 0.054 1
1 1061 . 6 1 1 A 87 87 PHE HA H 221 3.861 4.511 -0.650 1
1 1069 . 6 1 1 A 87 87 PHE C C 221 176.176 177.874 -1.698 1
1 1070 . 6 1 1 A 87 87 PHE CA C 221 61.780 61.254 0.526 1
1 1071 . 6 1 1 A 87 87 PHE CB C 221 37.549 37.853 -0.304 1
1 1075 . 6 1 1 A 87 87 PHE N N 221 112.449 116.818 -4.369 1
1 1076 . 6 1 1 A 88 88 LYS H H 222 7.061 8.091 -1.030 1
1 1077 . 6 1 1 A 88 88 LYS HA H 222 4.380 4.138 0.242 1
1 1086 . 6 1 1 A 88 88 LYS C C 222 177.089 177.112 -0.023 1
1 1087 . 6 1 1 A 88 88 LYS CA C 222 56.726 58.357 -1.631 1
1 1088 . 6 1 1 A 88 88 LYS CB C 222 33.738 32.529 1.209 1
1 1092 . 6 1 1 A 88 88 LYS N N 222 118.308 121.082 -2.774 1
1 1093 . 6 1 1 A 89 89 LEU H H 223 7.270 7.349 -0.079 1
1 1094 . 6 1 1 A 89 89 LEU HA H 223 4.168 4.224 -0.056 1
1 1104 . 6 1 1 A 89 89 LEU C C 223 177.528 176.801 0.727 1
1 1105 . 6 1 1 A 89 89 LEU CA C 223 55.279 54.411 0.868 1
1 1106 . 6 1 1 A 89 89 LEU CB C 223 43.240 42.512 0.728 1
1 1110 . 6 1 1 A 89 89 LEU N N 223 121.317 122.499 -1.182 1
1 1111 . 6 1 1 A 90 90 LYS H H 224 8.788 8.635 0.153 1
1 1112 . 6 1 1 A 90 90 LYS HA H 224 4.359 4.376 -0.017 1
1 1121 . 6 1 1 A 90 90 LYS C C 224 175.839 176.502 -0.663 1
1 1122 . 6 1 1 A 90 90 LYS CA C 224 54.772 55.805 -1.033 1
1 1123 . 6 1 1 A 90 90 LYS CB C 224 33.232 33.222 0.010 1
1 1127 . 6 1 1 A 90 90 LYS N N 224 123.558 123.044 0.514 1
1 1128 . 6 1 1 A 91 91 ASP H H 225 8.125 8.710 -0.585 1
1 1129 . 6 1 1 A 91 91 ASP HA H 225 3.958 4.154 -0.196 1
1 1132 . 6 1 1 A 91 91 ASP C C 225 177.452 177.208 0.244 1
1 1133 . 6 1 1 A 91 91 ASP CA C 225 56.642 56.258 0.384 1
1 1134 . 6 1 1 A 91 91 ASP CB C 225 40.269 40.248 0.021 1
1 1135 . 6 1 1 A 91 91 ASP N N 225 119.419 121.814 -2.395 1
1 1136 . 6 1 1 A 92 92 GLY H H 226 8.681 8.629 0.052 1
1 1137 . 6 1 1 A 92 92 GLY HA2 H 226 4.131 3.858 0.273 1
1 1138 . 6 1 1 A 92 92 GLY HA3 H 226 3.579 3.884 -0.305 1
1 1139 . 6 1 1 A 92 92 GLY C C 226 173.614 174.026 -0.412 1
1 1140 . 6 1 1 A 92 92 GLY CA C 226 45.564 45.345 0.219 1
1 1141 . 6 1 1 A 92 92 GLY N N 226 113.802 111.662 2.140 1
1 1142 . 6 1 1 A 93 93 GLU H H 227 8.104 8.048 0.056 1
1 1143 . 6 1 1 A 93 93 GLU HA H 227 4.232 4.407 -0.175 1
1 1148 . 6 1 1 A 93 93 GLU C C 227 174.282 175.677 -1.395 1
1 1149 . 6 1 1 A 93 93 GLU CA C 227 56.651 56.237 0.414 1
1 1150 . 6 1 1 A 93 93 GLU CB C 227 32.190 31.201 0.989 1
1 1152 . 6 1 1 A 93 93 GLU N N 227 121.527 121.925 -0.398 1
1 1153 . 6 1 1 A 94 94 VAL H H 228 7.918 8.565 -0.647 1
1 1154 . 6 1 1 A 94 94 VAL HA H 228 4.857 4.762 0.095 1
1 1162 . 6 1 1 A 94 94 VAL C C 228 176.556 175.656 0.900 1
1 1163 . 6 1 1 A 94 94 VAL CA C 228 60.309 60.430 -0.121 1
1 1164 . 6 1 1 A 94 94 VAL CB C 228 33.847 35.560 -1.713 1
1 1167 . 6 1 1 A 94 94 VAL N N 228 119.768 125.891 -6.123 1
1 1168 . 6 1 1 A 95 95 SER H H 229 9.659 9.429 0.230 1
1 1169 . 6 1 1 A 95 95 SER HA H 229 4.313 4.679 -0.366 1
1 1172 . 6 1 1 A 95 95 SER C C 229 174.641 174.484 0.157 1
1 1173 . 6 1 1 A 95 95 SER CA C 229 59.208 57.824 1.384 1
1 1174 . 6 1 1 A 95 95 SER CB C 229 66.080 65.773 0.307 1
1 1175 . 6 1 1 A 95 95 SER N N 229 124.903 121.098 3.805 1
1 1176 . 6 1 1 A 96 96 GLU H H 230 8.014 8.655 -0.641 1
1 1177 . 6 1 1 A 96 96 GLU HA H 230 4.376 4.398 -0.022 1
1 1182 . 6 1 1 A 96 96 GLU C C 230 176.641 177.239 -0.598 1
1 1183 . 6 1 1 A 96 96 GLU CA C 230 56.236 56.609 -0.373 1
1 1184 . 6 1 1 A 96 96 GLU CB C 230 30.324 30.650 -0.326 1
1 1186 . 6 1 1 A 96 96 GLU N N 230 115.510 120.871 -5.361 1
1 1187 . 6 1 1 A 97 97 VAL H H 231 8.741 8.282 0.459 1
1 1188 . 6 1 1 A 97 97 VAL HA H 231 4.171 4.163 0.008 1
1 1196 . 6 1 1 A 97 97 VAL C C 231 176.684 175.616 1.068 1
1 1197 . 6 1 1 A 97 97 VAL CA C 231 65.418 63.167 2.251 1
1 1198 . 6 1 1 A 97 97 VAL CB C 231 31.218 31.578 -0.360 1
1 1201 . 6 1 1 A 97 97 VAL N N 231 121.289 121.593 -0.304 1
1 1202 . 6 1 1 A 98 98 VAL H H 232 9.218 9.614 -0.396 1
1 1203 . 6 1 1 A 98 98 VAL HA H 232 4.405 4.656 -0.251 1
1 1211 . 6 1 1 A 98 98 VAL C C 232 174.258 174.523 -0.265 1
1 1212 . 6 1 1 A 98 98 VAL CA C 232 60.937 61.237 -0.300 1
1 1213 . 6 1 1 A 98 98 VAL CB C 232 35.825 33.635 2.190 1
1 1216 . 6 1 1 A 98 98 VAL N N 232 130.544 129.270 1.274 1
1 1217 . 6 1 1 A 99 99 LYS H H 233 8.800 9.035 -0.235 1
1 1218 . 6 1 1 A 99 99 LYS HA H 233 4.853 5.053 -0.200 1
1 1227 . 6 1 1 A 99 99 LYS C C 233 175.274 175.158 0.116 1
1 1228 . 6 1 1 A 99 99 LYS CA C 233 55.499 55.373 0.126 1
1 1229 . 6 1 1 A 99 99 LYS CB C 233 34.452 33.778 0.674 1
1 1233 . 6 1 1 A 99 99 LYS N N 233 130.477 129.133 1.344 1
1 1234 . 6 1 1 A 100 100 SER H H 234 9.585 9.004 0.581 1
1 1235 . 6 1 1 A 100 100 SER HA H 234 5.150 4.963 0.187 1
1 1238 . 6 1 1 A 100 100 SER C C 234 175.493 174.249 1.244 1
1 1239 . 6 1 1 A 100 100 SER CA C 234 56.927 57.341 -0.414 1
1 1240 . 6 1 1 A 100 100 SER CB C 234 67.309 67.246 0.063 1
1 1241 . 6 1 1 A 100 100 SER N N 234 125.814 123.774 2.040 1
1 1242 . 6 1 1 A 101 101 SER H H 235 8.631 8.759 -0.128 1
1 1243 . 6 1 1 A 101 101 SER HA H 235 4.106 4.074 0.032 1
1 1246 . 6 1 1 A 101 101 SER C C 235 175.385 175.484 -0.099 1
1 1247 . 6 1 1 A 101 101 SER CA C 235 61.123 61.528 -0.405 1
1 1248 . 6 1 1 A 101 101 SER CB C 235 62.818 62.520 0.298 1
1 1249 . 6 1 1 A 101 101 SER N N 235 115.089 117.138 -2.049 1
1 1250 . 6 1 1 A 102 102 PHE H H 236 8.957 7.686 1.271 1
1 1251 . 6 1 1 A 102 102 PHE HA H 236 4.610 4.624 -0.014 1
1 1259 . 6 1 1 A 102 102 PHE C C 236 176.453 175.818 0.635 1
1 1260 . 6 1 1 A 102 102 PHE CA C 236 58.382 58.134 0.248 1
1 1261 . 6 1 1 A 102 102 PHE CB C 236 40.275 39.674 0.601 1
1 1263 . 6 1 1 A 102 102 PHE N N 236 119.917 117.686 2.231 1
1 1264 . 6 1 1 A 103 103 GLY H H 237 7.377 7.390 -0.013 1
1 1265 . 6 1 1 A 103 103 GLY HA2 H 237 4.453 3.919 0.534 1
1 1266 . 6 1 1 A 103 103 GLY HA3 H 237 3.472 4.079 -0.607 1
1 1267 . 6 1 1 A 103 103 GLY C C 237 169.627 172.505 -2.878 1
1 1268 . 6 1 1 A 103 103 GLY CA C 237 45.384 44.277 1.107 1
1 1269 . 6 1 1 A 103 103 GLY N N 237 108.809 106.552 2.257 1
1 1270 . 6 1 1 A 104 104 TYR H H 238 8.632 8.374 0.258 1
1 1271 . 6 1 1 A 104 104 TYR HA H 238 5.322 5.266 0.056 1
1 1278 . 6 1 1 A 104 104 TYR C C 238 175.043 174.947 0.096 1
1 1279 . 6 1 1 A 104 104 TYR CA C 238 57.627 57.194 0.433 1
1 1280 . 6 1 1 A 104 104 TYR CB C 238 41.711 41.103 0.608 1
1 1283 . 6 1 1 A 104 104 TYR N N 238 120.030 121.824 -1.794 1
1 1284 . 6 1 1 A 105 105 HIS H H 239 10.070 9.589 0.481 1
1 1285 . 6 1 1 A 105 105 HIS HA H 239 6.046 5.588 0.458 1
1 1290 . 6 1 1 A 105 105 HIS C C 239 175.734 174.792 0.942 1
1 1291 . 6 1 1 A 105 105 HIS CA C 239 53.945 54.228 -0.283 1
1 1292 . 6 1 1 A 105 105 HIS CB C 239 32.450 34.033 -1.583 1
1 1295 . 6 1 1 A 105 105 HIS N N 239 119.504 119.823 -0.319 1
1 1296 . 6 1 1 A 106 106 ILE H H 240 8.660 8.892 -0.232 1
1 1297 . 6 1 1 A 106 106 ILE HA H 240 4.120 4.878 -0.758 1
1 1307 . 6 1 1 A 106 106 ILE C C 240 174.758 175.385 -0.627 1
1 1308 . 6 1 1 A 106 106 ILE CA C 240 63.446 59.954 3.492 1
1 1309 . 6 1 1 A 106 106 ILE CB C 240 40.786 41.480 -0.694 1
1 1313 . 6 1 1 A 106 106 ILE N N 240 120.639 120.260 0.379 1
1 1314 . 6 1 1 A 107 107 ILE H H 241 9.033 9.043 -0.010 1
1 1315 . 6 1 1 A 107 107 ILE HA H 241 4.799 5.110 -0.311 1
1 1325 . 6 1 1 A 107 107 ILE C C 241 172.880 173.888 -1.008 1
1 1326 . 6 1 1 A 107 107 ILE CA C 241 60.563 59.794 0.769 1
1 1327 . 6 1 1 A 107 107 ILE CB C 241 41.652 40.943 0.709 1
1 1331 . 6 1 1 A 107 107 ILE N N 241 129.098 127.249 1.849 1
1 1332 . 6 1 1 A 108 108 LYS H H 242 8.692 9.001 -0.309 1
1 1333 . 6 1 1 A 108 108 LYS HA H 242 5.012 4.957 0.055 1
1 1342 . 6 1 1 A 108 108 LYS C C 242 174.484 175.899 -1.415 1
1 1343 . 6 1 1 A 108 108 LYS CA C 242 54.317 53.896 0.421 1
1 1344 . 6 1 1 A 108 108 LYS CB C 242 35.619 35.397 0.222 1
1 1348 . 6 1 1 A 108 108 LYS N N 242 127.179 128.116 -0.937 1
1 1349 . 6 1 1 A 109 109 ALA H H 243 7.816 9.013 -1.197 1
1 1350 . 6 1 1 A 109 109 ALA HA H 243 4.604 4.518 0.086 1
1 1354 . 6 1 1 A 109 109 ALA C C 243 176.231 176.388 -0.157 1
1 1355 . 6 1 1 A 109 109 ALA CA C 243 50.505 51.272 -0.767 1
1 1356 . 6 1 1 A 109 109 ALA CB C 243 19.584 19.719 -0.135 1
1 1357 . 6 1 1 A 109 109 ALA N N 243 129.619 128.059 1.560 1
1 1358 . 6 1 1 A 110 110 ASP H H 244 7.578 8.818 -1.240 1
1 1359 . 6 1 1 A 110 110 ASP HA H 244 4.424 5.419 -0.995 1
1 1362 . 6 1 1 A 110 110 ASP C C 244 175.259 174.139 1.120 1
1 1363 . 6 1 1 A 110 110 ASP CA C 244 54.489 52.513 1.976 1
1 1364 . 6 1 1 A 110 110 ASP CB C 244 42.693 45.118 -2.425 1
1 1365 . 6 1 1 A 110 110 ASP N N 244 125.434 122.077 3.357 1
1 4 . 7 1 1 A 2 2 PRO HA H -4 4.403 4.696 -0.293 1
1 11 . 7 1 1 A 2 2 PRO C C -4 176.990 175.514 1.476 1
1 12 . 7 1 1 A 2 2 PRO CA C -4 63.131 62.778 0.353 1
1 13 . 7 1 1 A 2 2 PRO CB C -4 32.342 33.026 -0.684 1
1 16 . 7 1 1 A 3 3 LEU H H -3 8.483 8.654 -0.171 1
1 17 . 7 1 1 A 3 3 LEU HA H -3 4.333 4.814 -0.481 1
1 27 . 7 1 1 A 3 3 LEU C C -3 177.991 176.414 1.577 1
1 28 . 7 1 1 A 3 3 LEU CA C -3 55.314 53.831 1.483 1
1 29 . 7 1 1 A 3 3 LEU CB C -3 42.244 45.871 -3.627 1
1 33 . 7 1 1 A 3 3 LEU N N -3 122.986 121.885 1.101 1
1 34 . 7 1 1 A 4 4 GLY H H -2 8.397 9.033 -0.636 1
1 35 . 7 1 1 A 4 4 GLY HA2 H -2 4.024 3.930 0.094 1
1 36 . 7 1 1 A 4 4 GLY HA3 H -2 3.976 3.951 0.025 1
1 37 . 7 1 1 A 4 4 GLY C C -2 174.360 174.793 -0.433 1
1 38 . 7 1 1 A 4 4 GLY CA C -2 45.434 45.928 -0.494 1
1 39 . 7 1 1 A 4 4 GLY N N -2 110.666 114.667 -4.001 1
1 56 . 7 1 1 A 7 7 SER H H 141 7.913 7.956 -0.043 1
1 57 . 7 1 1 A 7 7 SER HA H 141 5.657 5.242 0.415 1
1 60 . 7 1 1 A 7 7 SER C C 141 173.753 172.245 1.508 1
1 61 . 7 1 1 A 7 7 SER CA C 141 56.758 57.817 -1.059 1
1 62 . 7 1 1 A 7 7 SER CB C 141 66.774 65.450 1.324 1
1 63 . 7 1 1 A 7 7 SER N N 141 113.824 110.725 3.099 1
1 64 . 7 1 1 A 8 8 LYS H H 142 8.656 8.529 0.127 1
1 65 . 7 1 1 A 8 8 LYS HA H 142 4.543 4.841 -0.298 1
1 74 . 7 1 1 A 8 8 LYS C C 142 174.403 174.900 -0.497 1
1 75 . 7 1 1 A 8 8 LYS CA C 142 55.578 54.339 1.239 1
1 76 . 7 1 1 A 8 8 LYS CB C 142 36.561 35.685 0.876 1
1 80 . 7 1 1 A 8 8 LYS N N 142 123.076 120.474 2.602 1
1 81 . 7 1 1 A 9 9 LYS H H 143 8.623 8.420 0.203 1
1 82 . 7 1 1 A 9 9 LYS HA H 143 4.119 4.286 -0.167 1
1 91 . 7 1 1 A 9 9 LYS C C 143 176.144 175.497 0.647 1
1 92 . 7 1 1 A 9 9 LYS CA C 143 56.683 56.109 0.574 1
1 93 . 7 1 1 A 9 9 LYS CB C 143 32.580 32.343 0.237 1
1 97 . 7 1 1 A 9 9 LYS N N 143 129.542 123.982 5.560 1
1 98 . 7 1 1 A 10 10 ALA H H 144 8.151 8.712 -0.561 1
1 99 . 7 1 1 A 10 10 ALA HA H 144 5.208 4.966 0.242 1
1 103 . 7 1 1 A 10 10 ALA C C 144 175.577 175.002 0.575 1
1 104 . 7 1 1 A 10 10 ALA CA C 144 51.226 51.221 0.005 1
1 105 . 7 1 1 A 10 10 ALA CB C 144 25.299 24.152 1.147 1
1 106 . 7 1 1 A 10 10 ALA N N 144 127.933 127.856 0.077 1
1 107 . 7 1 1 A 11 11 SER H H 145 8.679 8.830 -0.151 1
1 108 . 7 1 1 A 11 11 SER HA H 145 5.431 5.834 -0.403 1
1 111 . 7 1 1 A 11 11 SER C C 145 173.072 173.302 -0.230 1
1 112 . 7 1 1 A 11 11 SER CA C 145 57.772 56.974 0.798 1
1 113 . 7 1 1 A 11 11 SER CB C 145 67.301 66.149 1.152 1
1 114 . 7 1 1 A 11 11 SER N N 145 116.245 115.482 0.763 1
1 115 . 7 1 1 A 12 12 HIS H H 146 9.962 9.536 0.426 1
1 116 . 7 1 1 A 12 12 HIS HA H 146 6.332 6.053 0.279 1
1 121 . 7 1 1 A 12 12 HIS C C 146 173.006 172.378 0.628 1
1 122 . 7 1 1 A 12 12 HIS CA C 146 55.020 54.198 0.822 1
1 123 . 7 1 1 A 12 12 HIS CB C 146 37.071 34.143 2.928 1
1 126 . 7 1 1 A 12 12 HIS N N 146 119.181 118.540 0.641 1
1 127 . 7 1 1 A 13 13 ILE H H 147 8.976 9.015 -0.039 1
1 128 . 7 1 1 A 13 13 ILE HA H 147 3.528 4.597 -1.069 1
1 138 . 7 1 1 A 13 13 ILE C C 147 173.010 173.891 -0.881 1
1 139 . 7 1 1 A 13 13 ILE CA C 147 61.273 59.565 1.708 1
1 140 . 7 1 1 A 13 13 ILE CB C 147 41.773 40.987 0.786 1
1 144 . 7 1 1 A 13 13 ILE N N 147 121.873 119.416 2.457 1
1 145 . 7 1 1 A 14 14 LEU H H 148 7.627 8.903 -1.276 1
1 146 . 7 1 1 A 14 14 LEU HA H 148 4.814 5.174 -0.360 1
1 156 . 7 1 1 A 14 14 LEU C C 148 174.112 174.363 -0.251 1
1 157 . 7 1 1 A 14 14 LEU CA C 148 52.574 52.971 -0.397 1
1 158 . 7 1 1 A 14 14 LEU CB C 148 45.643 45.056 0.587 1
1 162 . 7 1 1 A 14 14 LEU N N 148 127.112 129.292 -2.180 1
1 163 . 7 1 1 A 15 15 ILE H H 149 9.524 9.235 0.289 1
1 164 . 7 1 1 A 15 15 ILE HA H 149 4.362 4.650 -0.288 1
1 174 . 7 1 1 A 15 15 ILE C C 149 175.452 175.441 0.011 1
1 175 . 7 1 1 A 15 15 ILE CA C 149 58.516 60.756 -2.240 1
1 176 . 7 1 1 A 15 15 ILE CB C 149 36.560 39.471 -2.911 1
1 180 . 7 1 1 A 15 15 ILE N N 149 128.652 127.064 1.588 1
1 181 . 7 1 1 A 16 16 LYS H H 150 8.035 8.433 -0.398 1
1 182 . 7 1 1 A 16 16 LYS HA H 150 4.319 4.494 -0.175 1
1 191 . 7 1 1 A 16 16 LYS C C 150 175.038 176.346 -1.308 1
1 192 . 7 1 1 A 16 16 LYS CA C 150 57.817 56.517 1.300 1
1 193 . 7 1 1 A 16 16 LYS CB C 150 34.853 33.001 1.852 1
1 197 . 7 1 1 A 16 16 LYS N N 150 129.153 127.792 1.361 1
1 198 . 7 1 1 A 17 17 VAL H H 151 8.016 8.977 -0.961 1
1 199 . 7 1 1 A 17 17 VAL HA H 151 4.873 4.710 0.163 1
1 207 . 7 1 1 A 17 17 VAL C C 151 176.647 175.311 1.336 1
1 208 . 7 1 1 A 17 17 VAL CA C 151 60.088 61.406 -1.318 1
1 209 . 7 1 1 A 17 17 VAL CB C 151 34.082 33.270 0.812 1
1 212 . 7 1 1 A 17 17 VAL N N 151 121.288 124.111 -2.823 1
1 213 . 7 1 1 A 18 18 LYS H H 152 8.443 9.024 -0.581 1
1 214 . 7 1 1 A 18 18 LYS HA H 152 4.334 4.503 -0.169 1
1 223 . 7 1 1 A 18 18 LYS C C 152 176.345 176.226 0.119 1
1 224 . 7 1 1 A 18 18 LYS CA C 152 57.016 55.252 1.764 1
1 225 . 7 1 1 A 18 18 LYS CB C 152 33.222 34.178 -0.956 1
1 229 . 7 1 1 A 18 18 LYS N N 152 128.408 126.940 1.468 1
1 230 . 7 1 1 A 19 19 SER H H 153 9.067 9.127 -0.060 1
1 231 . 7 1 1 A 19 19 SER HA H 153 4.457 4.745 -0.288 1
1 234 . 7 1 1 A 19 19 SER C C 153 174.236 174.231 0.005 1
1 235 . 7 1 1 A 19 19 SER CA C 153 59.642 59.139 0.503 1
1 236 . 7 1 1 A 19 19 SER CB C 153 64.347 64.898 -0.551 1
1 237 . 7 1 1 A 19 19 SER N N 153 121.522 116.220 5.302 1
1 238 . 7 1 1 A 20 20 LYS H H 154 7.961 7.455 0.506 1
1 239 . 7 1 1 A 20 20 LYS HA H 154 4.558 4.805 -0.247 1
1 244 . 7 1 1 A 20 20 LYS C C 154 177.256 176.593 0.663 1
1 245 . 7 1 1 A 20 20 LYS CA C 154 55.249 54.537 0.712 1
1 246 . 7 1 1 A 20 20 LYS CB C 154 34.531 36.646 -2.115 1
1 248 . 7 1 1 A 20 20 LYS N N 154 120.270 117.485 2.785 1
1 249 . 7 1 1 A 21 21 LYS HA H 155 4.003 3.956 0.047 1
1 258 . 7 1 1 A 21 21 LYS C C 155 177.015 178.157 -1.142 1
1 259 . 7 1 1 A 21 21 LYS CA C 155 59.091 58.850 0.241 1
1 260 . 7 1 1 A 21 21 LYS CB C 155 32.394 32.227 0.167 1
1 264 . 7 1 1 A 22 22 SER H H 156 7.625 7.834 -0.209 1
1 265 . 7 1 1 A 22 22 SER HA H 156 4.293 4.404 -0.111 1
1 268 . 7 1 1 A 22 22 SER C C 156 174.843 174.603 0.240 1
1 269 . 7 1 1 A 22 22 SER CA C 156 57.966 60.252 -2.286 1
1 270 . 7 1 1 A 22 22 SER CB C 156 63.369 63.413 -0.044 1
1 271 . 7 1 1 A 22 22 SER N N 156 109.549 113.139 -3.590 1
1 272 . 7 1 1 A 23 23 ASP H H 157 7.701 7.428 0.273 1
1 273 . 7 1 1 A 23 23 ASP HA H 157 4.548 4.607 -0.059 1
1 276 . 7 1 1 A 23 23 ASP C C 157 176.544 175.766 0.778 1
1 277 . 7 1 1 A 23 23 ASP CA C 157 55.242 54.154 1.088 1
1 278 . 7 1 1 A 23 23 ASP CB C 157 41.103 41.194 -0.091 1
1 279 . 7 1 1 A 23 23 ASP N N 157 124.536 120.888 3.648 1
1 280 . 7 1 1 A 24 24 LYS H H 158 8.583 8.930 -0.347 1
1 281 . 7 1 1 A 24 24 LYS HA H 158 4.252 4.347 -0.095 1
1 290 . 7 1 1 A 24 24 LYS C C 158 176.813 176.188 0.625 1
1 291 . 7 1 1 A 24 24 LYS CA C 158 57.148 57.322 -0.174 1
1 292 . 7 1 1 A 24 24 LYS CB C 158 33.200 33.298 -0.098 1
1 296 . 7 1 1 A 24 24 LYS N N 158 122.372 123.930 -1.558 1
1 297 . 7 1 1 A 25 25 GLU H H 159 8.001 7.796 0.205 1
1 298 . 7 1 1 A 25 25 GLU HA H 159 4.521 4.721 -0.200 1
1 303 . 7 1 1 A 25 25 GLU C C 159 175.995 175.033 0.962 1
1 304 . 7 1 1 A 25 25 GLU CA C 159 55.727 56.153 -0.426 1
1 305 . 7 1 1 A 25 25 GLU CB C 159 31.918 32.909 -0.991 1
1 307 . 7 1 1 A 25 25 GLU N N 159 118.705 116.513 2.192 1
1 308 . 7 1 1 A 26 26 GLY H H 160 8.458 8.592 -0.134 1
1 309 . 7 1 1 A 26 26 GLY HA2 H 160 3.946 4.112 -0.166 1
1 310 . 7 1 1 A 26 26 GLY HA3 H 160 3.511 4.120 -0.609 1
1 311 . 7 1 1 A 26 26 GLY C C 160 172.201 172.307 -0.106 1
1 312 . 7 1 1 A 26 26 GLY CA C 160 44.038 44.017 0.021 1
1 313 . 7 1 1 A 26 26 GLY N N 160 107.642 112.629 -4.987 1
1 314 . 7 1 1 A 27 27 LEU H H 161 8.259 8.223 0.036 1
1 315 . 7 1 1 A 27 27 LEU HA H 161 4.775 5.132 -0.357 1
1 325 . 7 1 1 A 27 27 LEU C C 161 177.422 175.109 2.313 1
1 326 . 7 1 1 A 27 27 LEU CA C 161 53.322 53.290 0.032 1
1 327 . 7 1 1 A 27 27 LEU CB C 161 45.576 45.499 0.077 1
1 331 . 7 1 1 A 27 27 LEU N N 161 119.856 120.614 -0.758 1
1 332 . 7 1 1 A 28 28 ASP H H 162 8.848 8.653 0.195 1
1 333 . 7 1 1 A 28 28 ASP HA H 162 4.644 4.612 0.032 1
1 336 . 7 1 1 A 28 28 ASP C C 162 176.630 177.020 -0.390 1
1 337 . 7 1 1 A 28 28 ASP CA C 162 55.195 54.269 0.926 1
1 338 . 7 1 1 A 28 28 ASP CB C 162 41.673 42.402 -0.729 1
1 339 . 7 1 1 A 28 28 ASP N N 162 122.434 121.839 0.595 1
1 340 . 7 1 1 A 29 29 ASP H H 163 8.720 8.904 -0.184 1
1 341 . 7 1 1 A 29 29 ASP HA H 163 4.386 4.451 -0.065 1
1 344 . 7 1 1 A 29 29 ASP C C 163 176.604 178.173 -1.569 1
1 345 . 7 1 1 A 29 29 ASP CA C 163 59.690 58.099 1.591 1
1 346 . 7 1 1 A 29 29 ASP CB C 163 42.964 40.470 2.494 1
1 347 . 7 1 1 A 29 29 ASP N N 163 121.460 124.539 -3.079 1
1 348 . 7 1 1 A 30 30 LYS H H 164 8.434 7.856 0.578 1
1 349 . 7 1 1 A 30 30 LYS HA H 164 3.901 4.129 -0.228 1
1 358 . 7 1 1 A 30 30 LYS C C 164 179.479 179.264 0.215 1
1 359 . 7 1 1 A 30 30 LYS CA C 164 60.047 59.404 0.643 1
1 360 . 7 1 1 A 30 30 LYS CB C 164 32.038 32.248 -0.210 1
1 364 . 7 1 1 A 30 30 LYS N N 164 116.627 119.199 -2.572 1
1 365 . 7 1 1 A 31 31 GLU H H 165 7.755 8.445 -0.690 1
1 366 . 7 1 1 A 31 31 GLU HA H 165 3.998 4.051 -0.053 1
1 371 . 7 1 1 A 31 31 GLU C C 165 179.031 179.156 -0.125 1
1 372 . 7 1 1 A 31 31 GLU CA C 165 59.335 59.154 0.181 1
1 373 . 7 1 1 A 31 31 GLU CB C 165 29.972 29.787 0.185 1
1 375 . 7 1 1 A 31 31 GLU N N 165 120.456 120.352 0.104 1
1 376 . 7 1 1 A 32 32 ALA H H 166 9.060 8.604 0.456 1
1 377 . 7 1 1 A 32 32 ALA HA H 166 3.871 4.045 -0.174 1
1 381 . 7 1 1 A 32 32 ALA C C 166 178.029 179.089 -1.060 1
1 382 . 7 1 1 A 32 32 ALA CA C 166 54.997 55.426 -0.429 1
1 383 . 7 1 1 A 32 32 ALA CB C 166 19.727 18.373 1.354 1
1 384 . 7 1 1 A 32 32 ALA N N 166 124.406 122.282 2.124 1
1 385 . 7 1 1 A 33 33 LYS H H 167 8.228 7.810 0.418 1
1 386 . 7 1 1 A 33 33 LYS HA H 167 2.595 3.008 -0.413 1
1 395 . 7 1 1 A 33 33 LYS C C 167 177.938 178.017 -0.079 1
1 396 . 7 1 1 A 33 33 LYS CA C 167 59.573 59.299 0.274 1
1 397 . 7 1 1 A 33 33 LYS CB C 167 32.098 32.149 -0.051 1
1 401 . 7 1 1 A 33 33 LYS N N 167 119.833 118.151 1.682 1
1 402 . 7 1 1 A 34 34 GLN H H 168 7.392 7.699 -0.307 1
1 403 . 7 1 1 A 34 34 GLN HA H 168 3.943 3.881 0.062 1
1 410 . 7 1 1 A 34 34 GLN C C 168 178.323 178.463 -0.140 1
1 411 . 7 1 1 A 34 34 GLN CA C 168 58.883 59.434 -0.551 1
1 412 . 7 1 1 A 34 34 GLN CB C 168 28.485 28.096 0.389 1
1 414 . 7 1 1 A 34 34 GLN N N 168 117.208 118.079 -0.871 1
1 416 . 7 1 1 A 35 35 LYS H H 169 7.994 8.012 -0.018 1
1 417 . 7 1 1 A 35 35 LYS HA H 169 4.067 4.006 0.061 1
1 426 . 7 1 1 A 35 35 LYS C C 169 178.161 178.607 -0.446 1
1 427 . 7 1 1 A 35 35 LYS CA C 169 58.437 59.131 -0.694 1
1 428 . 7 1 1 A 35 35 LYS CB C 169 31.611 32.160 -0.549 1
1 432 . 7 1 1 A 35 35 LYS N N 169 120.898 119.886 1.012 1
1 433 . 7 1 1 A 36 36 ALA H H 170 8.431 8.345 0.086 1
1 434 . 7 1 1 A 36 36 ALA HA H 170 3.738 4.025 -0.287 1
1 438 . 7 1 1 A 36 36 ALA C C 170 178.862 179.734 -0.872 1
1 439 . 7 1 1 A 36 36 ALA CA C 170 55.351 55.104 0.247 1
1 440 . 7 1 1 A 36 36 ALA CB C 170 18.295 18.344 -0.049 1
1 441 . 7 1 1 A 36 36 ALA N N 170 120.641 120.477 0.164 1
1 442 . 7 1 1 A 37 37 GLU H H 171 8.412 8.147 0.265 1
1 443 . 7 1 1 A 37 37 GLU HA H 171 3.867 3.983 -0.116 1
1 448 . 7 1 1 A 37 37 GLU C C 171 179.255 179.050 0.205 1
1 449 . 7 1 1 A 37 37 GLU CA C 171 59.543 59.514 0.029 1
1 450 . 7 1 1 A 37 37 GLU CB C 171 29.569 29.352 0.217 1
1 452 . 7 1 1 A 37 37 GLU N N 171 118.224 117.846 0.378 1
1 453 . 7 1 1 A 38 38 GLU H H 172 8.019 8.289 -0.270 1
1 454 . 7 1 1 A 38 38 GLU HA H 172 3.952 4.077 -0.125 1
1 459 . 7 1 1 A 38 38 GLU C C 172 180.250 178.277 1.973 1
1 460 . 7 1 1 A 38 38 GLU CA C 172 59.627 59.141 0.486 1
1 461 . 7 1 1 A 38 38 GLU CB C 172 29.368 28.622 0.746 1
1 463 . 7 1 1 A 38 38 GLU N N 172 121.250 118.645 2.605 1
1 464 . 7 1 1 A 39 39 ILE H H 173 8.174 7.281 0.893 1
1 465 . 7 1 1 A 39 39 ILE HA H 173 3.643 3.781 -0.138 1
1 475 . 7 1 1 A 39 39 ILE C C 173 177.568 178.086 -0.518 1
1 476 . 7 1 1 A 39 39 ILE CA C 173 64.869 64.020 0.849 1
1 477 . 7 1 1 A 39 39 ILE CB C 173 38.160 37.463 0.697 1
1 481 . 7 1 1 A 39 39 ILE N N 173 121.527 117.945 3.582 1
1 482 . 7 1 1 A 40 40 GLN H H 174 8.860 8.335 0.525 1
1 483 . 7 1 1 A 40 40 GLN HA H 174 3.533 3.965 -0.432 1
1 490 . 7 1 1 A 40 40 GLN C C 174 179.022 178.534 0.488 1
1 491 . 7 1 1 A 40 40 GLN CA C 174 61.316 59.371 1.945 1
1 492 . 7 1 1 A 40 40 GLN CB C 174 26.604 28.680 -2.076 1
1 494 . 7 1 1 A 40 40 GLN N N 174 121.956 121.049 0.907 1
1 496 . 7 1 1 A 41 41 LYS H H 175 7.879 8.034 -0.155 1
1 497 . 7 1 1 A 41 41 LYS HA H 175 3.777 4.171 -0.394 1
1 506 . 7 1 1 A 41 41 LYS C C 175 178.779 178.570 0.209 1
1 507 . 7 1 1 A 41 41 LYS CA C 175 59.701 58.766 0.935 1
1 508 . 7 1 1 A 41 41 LYS CB C 175 32.581 31.584 0.997 1
1 512 . 7 1 1 A 41 41 LYS N N 175 119.012 118.355 0.657 1
1 513 . 7 1 1 A 42 42 GLU H H 176 7.447 7.950 -0.503 1
1 514 . 7 1 1 A 42 42 GLU HA H 176 4.059 4.208 -0.149 1
1 519 . 7 1 1 A 42 42 GLU C C 176 180.058 179.081 0.977 1
1 520 . 7 1 1 A 42 42 GLU CA C 176 59.456 58.910 0.546 1
1 521 . 7 1 1 A 42 42 GLU CB C 176 29.923 30.229 -0.306 1
1 523 . 7 1 1 A 42 42 GLU N N 176 120.054 118.927 1.127 1
1 524 . 7 1 1 A 43 43 VAL H H 177 8.618 8.020 0.598 1
1 525 . 7 1 1 A 43 43 VAL HA H 177 3.986 3.892 0.094 1
1 533 . 7 1 1 A 43 43 VAL C C 177 176.459 177.755 -1.296 1
1 534 . 7 1 1 A 43 43 VAL CA C 177 63.923 64.810 -0.887 1
1 535 . 7 1 1 A 43 43 VAL CB C 177 31.899 31.372 0.527 1
1 538 . 7 1 1 A 43 43 VAL N N 177 114.191 117.341 -3.150 1
1 539 . 7 1 1 A 44 44 SER H H 178 8.052 8.353 -0.301 1
1 540 . 7 1 1 A 44 44 SER HA H 178 4.098 4.240 -0.142 1
1 543 . 7 1 1 A 44 44 SER C C 178 176.548 176.003 0.545 1
1 544 . 7 1 1 A 44 44 SER CA C 178 61.160 61.477 -0.317 1
1 545 . 7 1 1 A 44 44 SER CB C 178 62.959 62.523 0.436 1
1 546 . 7 1 1 A 44 44 SER N N 178 114.202 115.288 -1.086 1
1 547 . 7 1 1 A 45 45 LYS H H 179 7.083 8.025 -0.942 1
1 548 . 7 1 1 A 45 45 LYS HA H 179 4.140 4.234 -0.094 1
1 557 . 7 1 1 A 45 45 LYS C C 179 177.288 176.085 1.203 1
1 558 . 7 1 1 A 45 45 LYS CA C 179 58.469 57.827 0.642 1
1 559 . 7 1 1 A 45 45 LYS CB C 179 32.671 32.406 0.265 1
1 563 . 7 1 1 A 45 45 LYS N N 179 120.935 117.516 3.419 1
1 564 . 7 1 1 A 46 46 ASP H H 180 7.098 7.902 -0.804 1
1 565 . 7 1 1 A 46 46 ASP HA H 180 4.917 4.991 -0.074 1
1 568 . 7 1 1 A 46 46 ASP CA C 180 51.492 51.599 -0.107 1
1 569 . 7 1 1 A 46 46 ASP CB C 180 40.595 41.238 -0.643 1
1 570 . 7 1 1 A 46 46 ASP N N 180 112.836 120.348 -7.512 1
1 571 . 7 1 1 A 47 47 PRO HA H 181 4.681 4.575 0.106 1
1 578 . 7 1 1 A 47 47 PRO C C 181 179.248 177.739 1.509 1
1 579 . 7 1 1 A 47 47 PRO CA C 181 64.718 64.276 0.442 1
1 580 . 7 1 1 A 47 47 PRO CB C 181 32.159 31.934 0.225 1
1 583 . 7 1 1 A 48 48 SER H H 182 8.248 7.785 0.463 1
1 584 . 7 1 1 A 48 48 SER HA H 182 4.378 4.309 0.069 1
1 587 . 7 1 1 A 48 48 SER C C 182 176.071 175.206 0.865 1
1 588 . 7 1 1 A 48 48 SER CA C 182 61.377 60.756 0.621 1
1 589 . 7 1 1 A 48 48 SER CB C 182 62.455 63.118 -0.663 1
1 590 . 7 1 1 A 48 48 SER N N 182 116.986 113.161 3.825 1
1 591 . 7 1 1 A 49 49 LYS H H 183 7.842 7.344 0.498 1
1 592 . 7 1 1 A 49 49 LYS HA H 183 4.482 4.373 0.109 1
1 601 . 7 1 1 A 49 49 LYS C C 183 175.605 177.352 -1.747 1
1 602 . 7 1 1 A 49 49 LYS CA C 183 55.824 56.406 -0.582 1
1 603 . 7 1 1 A 49 49 LYS CB C 183 32.834 32.496 0.338 1
1 607 . 7 1 1 A 49 49 LYS N N 183 121.698 118.461 3.237 1
1 608 . 7 1 1 A 50 50 PHE H H 184 7.634 7.800 -0.166 1
1 609 . 7 1 1 A 50 50 PHE HA H 184 3.510 4.263 -0.753 1
1 617 . 7 1 1 A 50 50 PHE C C 184 176.214 177.550 -1.336 1
1 618 . 7 1 1 A 50 50 PHE CA C 184 63.276 61.056 2.220 1
1 619 . 7 1 1 A 50 50 PHE CB C 184 40.948 38.975 1.973 1
1 623 . 7 1 1 A 50 50 PHE N N 184 120.120 121.586 -1.466 1
1 624 . 7 1 1 A 51 51 GLY H H 185 8.855 8.601 0.254 1
1 625 . 7 1 1 A 51 51 GLY HA2 H 185 3.993 3.890 0.103 1
1 626 . 7 1 1 A 51 51 GLY HA3 H 185 3.958 3.926 0.032 1
1 627 . 7 1 1 A 51 51 GLY C C 185 175.169 176.357 -1.188 1
1 628 . 7 1 1 A 51 51 GLY CA C 185 47.475 47.414 0.061 1
1 629 . 7 1 1 A 51 51 GLY N N 185 105.550 106.012 -0.462 1
1 630 . 7 1 1 A 52 52 GLU H H 186 7.917 7.628 0.289 1
1 631 . 7 1 1 A 52 52 GLU HA H 186 4.006 4.060 -0.054 1
1 636 . 7 1 1 A 52 52 GLU C C 186 179.499 179.629 -0.130 1
1 637 . 7 1 1 A 52 52 GLU CA C 186 58.904 59.241 -0.337 1
1 638 . 7 1 1 A 52 52 GLU CB C 186 29.700 29.909 -0.209 1
1 640 . 7 1 1 A 52 52 GLU N N 186 121.929 121.779 0.150 1
1 641 . 7 1 1 A 53 53 ILE H H 187 7.936 8.205 -0.269 1
1 642 . 7 1 1 A 53 53 ILE HA H 187 3.648 3.684 -0.036 1
1 652 . 7 1 1 A 53 53 ILE C C 187 177.886 177.706 0.180 1
1 653 . 7 1 1 A 53 53 ILE CA C 187 64.366 65.079 -0.713 1
1 654 . 7 1 1 A 53 53 ILE CB C 187 36.478 37.555 -1.077 1
1 658 . 7 1 1 A 53 53 ILE N N 187 120.991 120.903 0.088 1
1 659 . 7 1 1 A 54 54 ALA H H 188 8.895 8.545 0.350 1
1 660 . 7 1 1 A 54 54 ALA HA H 188 3.629 3.773 -0.144 1
1 664 . 7 1 1 A 54 54 ALA C C 188 179.437 179.137 0.300 1
1 665 . 7 1 1 A 54 54 ALA CA C 188 55.974 55.607 0.367 1
1 666 . 7 1 1 A 54 54 ALA CB C 188 17.591 18.713 -1.122 1
1 667 . 7 1 1 A 54 54 ALA N N 188 125.308 122.158 3.150 1
1 668 . 7 1 1 A 55 55 LYS H H 189 8.049 7.577 0.472 1
1 669 . 7 1 1 A 55 55 LYS HA H 189 4.106 3.881 0.225 1
1 678 . 7 1 1 A 55 55 LYS C C 189 178.995 178.231 0.764 1
1 679 . 7 1 1 A 55 55 LYS CA C 189 59.312 59.273 0.039 1
1 680 . 7 1 1 A 55 55 LYS CB C 189 32.647 31.989 0.658 1
1 684 . 7 1 1 A 55 55 LYS N N 189 116.835 118.469 -1.634 1
1 685 . 7 1 1 A 56 56 LYS H H 190 7.215 7.563 -0.348 1
1 686 . 7 1 1 A 56 56 LYS HA H 190 4.172 4.253 -0.081 1
1 695 . 7 1 1 A 56 56 LYS C C 190 177.897 177.945 -0.048 1
1 696 . 7 1 1 A 56 56 LYS CA C 190 58.418 58.037 0.381 1
1 697 . 7 1 1 A 56 56 LYS CB C 190 34.652 33.303 1.349 1
1 701 . 7 1 1 A 56 56 LYS N N 190 117.170 117.959 -0.789 1
1 702 . 7 1 1 A 57 57 GLU H H 191 8.572 7.898 0.674 1
1 703 . 7 1 1 A 57 57 GLU HA H 191 4.643 4.394 0.249 1
1 708 . 7 1 1 A 57 57 GLU C C 191 177.903 176.006 1.897 1
1 709 . 7 1 1 A 57 57 GLU CA C 191 55.708 55.860 -0.152 1
1 710 . 7 1 1 A 57 57 GLU CB C 191 32.460 30.993 1.467 1
1 712 . 7 1 1 A 57 57 GLU N N 191 113.316 116.697 -3.381 1
1 713 . 7 1 1 A 58 58 SER H H 192 8.550 7.762 0.788 1
1 714 . 7 1 1 A 58 58 SER HA H 192 4.149 4.417 -0.268 1
1 717 . 7 1 1 A 58 58 SER C C 192 176.161 175.051 1.110 1
1 718 . 7 1 1 A 58 58 SER CA C 192 58.403 57.971 0.432 1
1 719 . 7 1 1 A 58 58 SER CB C 192 64.392 64.280 0.112 1
1 720 . 7 1 1 A 58 58 SER N N 192 109.861 115.952 -6.091 1
1 721 . 7 1 1 A 59 59 MET H H 193 9.533 9.108 0.425 1
1 722 . 7 1 1 A 59 59 MET HA H 193 4.457 4.612 -0.155 1
1 730 . 7 1 1 A 59 59 MET C C 193 175.204 175.834 -0.630 1
1 731 . 7 1 1 A 59 59 MET CA C 193 55.781 54.899 0.882 1
1 732 . 7 1 1 A 59 59 MET CB C 193 32.855 32.275 0.580 1
1 735 . 7 1 1 A 59 59 MET N N 193 124.493 123.580 0.913 1
1 736 . 7 1 1 A 60 60 ASP H H 194 7.514 7.366 0.148 1
1 737 . 7 1 1 A 60 60 ASP HA H 194 4.886 4.587 0.299 1
1 740 . 7 1 1 A 60 60 ASP C C 194 175.517 176.756 -1.239 1
1 741 . 7 1 1 A 60 60 ASP CA C 194 52.286 53.249 -0.963 1
1 742 . 7 1 1 A 60 60 ASP CB C 194 40.222 40.105 0.117 1
1 743 . 7 1 1 A 60 60 ASP N N 194 117.785 121.899 -4.114 1
1 744 . 7 1 1 A 61 61 THR H H 195 8.118 7.804 0.314 1
1 745 . 7 1 1 A 61 61 THR HA H 195 3.918 3.924 -0.006 1
1 750 . 7 1 1 A 61 61 THR C C 195 176.269 176.636 -0.367 1
1 751 . 7 1 1 A 61 61 THR CA C 195 65.469 65.348 0.121 1
1 752 . 7 1 1 A 61 61 THR CB C 195 68.741 68.322 0.419 1
1 754 . 7 1 1 A 61 61 THR N N 195 120.765 118.457 2.308 1
1 755 . 7 1 1 A 62 62 GLY H H 196 8.399 8.640 -0.241 1
1 756 . 7 1 1 A 62 62 GLY HA2 H 196 3.932 3.913 0.019 1
1 757 . 7 1 1 A 62 62 GLY HA3 H 196 3.900 3.914 -0.014 1
1 758 . 7 1 1 A 62 62 GLY C C 196 174.948 175.588 -0.640 1
1 759 . 7 1 1 A 62 62 GLY CA C 196 46.768 46.637 0.131 1
1 760 . 7 1 1 A 62 62 GLY N N 196 108.183 111.370 -3.187 1
1 761 . 7 1 1 A 63 63 SER H H 197 7.265 8.096 -0.831 1
1 762 . 7 1 1 A 63 63 SER HA H 197 4.554 4.494 0.060 1
1 765 . 7 1 1 A 63 63 SER C C 197 177.630 175.814 1.816 1
1 766 . 7 1 1 A 63 63 SER CA C 197 59.550 61.333 -1.783 1
1 767 . 7 1 1 A 63 63 SER CB C 197 65.504 63.913 1.591 1
1 768 . 7 1 1 A 63 63 SER N N 197 111.815 117.094 -5.279 1
1 769 . 7 1 1 A 64 64 ALA H H 198 8.675 8.565 0.110 1
1 770 . 7 1 1 A 64 64 ALA HA H 198 3.801 3.978 -0.177 1
1 774 . 7 1 1 A 64 64 ALA C C 198 178.492 179.855 -1.363 1
1 775 . 7 1 1 A 64 64 ALA CA C 198 56.794 55.507 1.287 1
1 776 . 7 1 1 A 64 64 ALA CB C 198 18.951 18.300 0.651 1
1 777 . 7 1 1 A 64 64 ALA N N 198 131.710 123.441 8.269 1
1 778 . 7 1 1 A 65 65 LYS H H 199 7.666 7.767 -0.101 1
1 779 . 7 1 1 A 65 65 LYS HA H 199 4.175 4.166 0.009 1
1 788 . 7 1 1 A 65 65 LYS C C 199 177.159 177.460 -0.301 1
1 789 . 7 1 1 A 65 65 LYS CA C 199 57.735 58.287 -0.552 1
1 790 . 7 1 1 A 65 65 LYS CB C 199 31.948 31.974 -0.026 1
1 794 . 7 1 1 A 65 65 LYS N N 199 111.375 117.721 -6.346 1
1 795 . 7 1 1 A 66 66 LYS H H 200 7.545 7.392 0.153 1
1 796 . 7 1 1 A 66 66 LYS HA H 200 4.612 4.450 0.162 1
1 805 . 7 1 1 A 66 66 LYS C C 200 175.609 175.766 -0.157 1
1 806 . 7 1 1 A 66 66 LYS CA C 200 54.468 55.953 -1.485 1
1 807 . 7 1 1 A 66 66 LYS CB C 200 31.525 33.005 -1.480 1
1 811 . 7 1 1 A 66 66 LYS N N 200 121.421 118.469 2.952 1
1 812 . 7 1 1 A 67 67 ASP H H 201 7.630 8.284 -0.654 1
1 813 . 7 1 1 A 67 67 ASP HA H 201 4.306 4.422 -0.116 1
1 816 . 7 1 1 A 67 67 ASP C C 201 175.025 176.331 -1.306 1
1 817 . 7 1 1 A 67 67 ASP CA C 201 56.400 55.372 1.028 1
1 818 . 7 1 1 A 67 67 ASP CB C 201 38.315 39.095 -0.780 1
1 819 . 7 1 1 A 67 67 ASP N N 201 116.216 117.241 -1.025 1
1 820 . 7 1 1 A 68 68 GLY H H 202 8.368 8.760 -0.392 1
1 821 . 7 1 1 A 68 68 GLY HA2 H 202 4.316 3.946 0.370 1
1 822 . 7 1 1 A 68 68 GLY HA3 H 202 3.731 4.043 -0.312 1
1 823 . 7 1 1 A 68 68 GLY C C 202 174.139 174.691 -0.552 1
1 824 . 7 1 1 A 68 68 GLY CA C 202 45.514 45.336 0.178 1
1 825 . 7 1 1 A 68 68 GLY N N 202 105.095 104.953 0.142 1
1 826 . 7 1 1 A 69 69 GLU H H 203 7.534 8.085 -0.551 1
1 827 . 7 1 1 A 69 69 GLU HA H 203 4.479 4.373 0.106 1
1 832 . 7 1 1 A 69 69 GLU C C 203 176.961 176.012 0.949 1
1 833 . 7 1 1 A 69 69 GLU CA C 203 58.549 56.699 1.850 1
1 834 . 7 1 1 A 69 69 GLU CB C 203 30.998 30.180 0.818 1
1 836 . 7 1 1 A 69 69 GLU N N 203 120.426 119.782 0.644 1
1 837 . 7 1 1 A 70 70 LEU H H 204 8.962 9.094 -0.132 1
1 838 . 7 1 1 A 70 70 LEU HA H 204 4.438 4.613 -0.175 1
1 848 . 7 1 1 A 70 70 LEU C C 204 178.648 177.158 1.490 1
1 849 . 7 1 1 A 70 70 LEU CA C 204 53.977 55.121 -1.144 1
1 850 . 7 1 1 A 70 70 LEU CB C 204 43.612 43.574 0.038 1
1 854 . 7 1 1 A 70 70 LEU N N 204 122.066 124.073 -2.007 1
1 855 . 7 1 1 A 71 71 GLY H H 205 8.104 7.551 0.553 1
1 856 . 7 1 1 A 71 71 GLY HA2 H 205 4.165 4.030 0.135 1
1 857 . 7 1 1 A 71 71 GLY HA3 H 205 3.552 4.119 -0.567 1
1 858 . 7 1 1 A 71 71 GLY C C 205 173.098 173.463 -0.365 1
1 859 . 7 1 1 A 71 71 GLY CA C 205 44.723 44.975 -0.252 1
1 860 . 7 1 1 A 71 71 GLY N N 205 110.168 106.701 3.467 1
1 861 . 7 1 1 A 72 72 TYR H H 206 8.457 8.655 -0.198 1
1 862 . 7 1 1 A 72 72 TYR HA H 206 4.184 4.835 -0.651 1
1 869 . 7 1 1 A 72 72 TYR C C 206 175.975 175.381 0.594 1
1 870 . 7 1 1 A 72 72 TYR CA C 206 59.722 59.165 0.557 1
1 871 . 7 1 1 A 72 72 TYR CB C 206 38.378 38.284 0.094 1
1 874 . 7 1 1 A 72 72 TYR N N 206 120.171 122.038 -1.867 1
1 875 . 7 1 1 A 73 73 VAL H H 207 8.782 9.144 -0.362 1
1 876 . 7 1 1 A 73 73 VAL HA H 207 4.056 4.456 -0.400 1
1 884 . 7 1 1 A 73 73 VAL C C 207 174.901 175.572 -0.671 1
1 885 . 7 1 1 A 73 73 VAL CA C 207 62.202 62.506 -0.304 1
1 886 . 7 1 1 A 73 73 VAL CB C 207 33.071 32.068 1.003 1
1 889 . 7 1 1 A 73 73 VAL N N 207 128.847 124.949 3.898 1
1 890 . 7 1 1 A 74 74 LEU H H 208 8.146 8.790 -0.644 1
1 891 . 7 1 1 A 74 74 LEU HA H 208 4.944 4.984 -0.040 1
1 901 . 7 1 1 A 74 74 LEU C C 208 178.400 177.306 1.094 1
1 902 . 7 1 1 A 74 74 LEU CA C 208 53.520 53.470 0.050 1
1 903 . 7 1 1 A 74 74 LEU CB C 208 43.499 43.231 0.268 1
1 907 . 7 1 1 A 74 74 LEU N N 208 127.599 129.265 -1.666 1
1 908 . 7 1 1 A 75 75 LYS H H 209 8.403 8.545 -0.142 1
1 909 . 7 1 1 A 75 75 LYS HA H 209 3.771 3.891 -0.120 1
1 918 . 7 1 1 A 75 75 LYS C C 209 177.536 177.548 -0.012 1
1 919 . 7 1 1 A 75 75 LYS CA C 209 58.385 58.915 -0.530 1
1 920 . 7 1 1 A 75 75 LYS CB C 209 32.459 32.184 0.275 1
1 924 . 7 1 1 A 75 75 LYS N N 209 123.798 121.835 1.963 1
1 925 . 7 1 1 A 76 76 GLY H H 210 9.997 9.303 0.694 1
1 926 . 7 1 1 A 76 76 GLY HA2 H 210 4.255 4.013 0.242 1
1 927 . 7 1 1 A 76 76 GLY HA3 H 210 3.791 4.014 -0.223 1
1 928 . 7 1 1 A 76 76 GLY C C 210 175.091 175.450 -0.359 1
1 929 . 7 1 1 A 76 76 GLY CA C 210 45.465 45.626 -0.161 1
1 930 . 7 1 1 A 76 76 GLY N N 210 114.705 113.393 1.312 1
1 931 . 7 1 1 A 77 77 GLN H H 211 7.726 8.172 -0.446 1
1 932 . 7 1 1 A 77 77 GLN HA H 211 4.373 4.208 0.165 1
1 939 . 7 1 1 A 77 77 GLN C C 211 176.301 175.981 0.320 1
1 940 . 7 1 1 A 77 77 GLN CA C 211 57.074 56.947 0.127 1
1 941 . 7 1 1 A 77 77 GLN CB C 211 30.798 29.354 1.444 1
1 943 . 7 1 1 A 77 77 GLN N N 211 118.702 118.008 0.694 1
1 945 . 7 1 1 A 78 78 THR H H 212 8.225 7.361 0.864 1
1 946 . 7 1 1 A 78 78 THR HA H 212 4.620 4.684 -0.064 1
1 951 . 7 1 1 A 78 78 THR C C 212 173.920 173.629 0.291 1
1 952 . 7 1 1 A 78 78 THR CA C 212 60.087 59.094 0.993 1
1 953 . 7 1 1 A 78 78 THR CB C 212 71.412 71.013 0.399 1
1 955 . 7 1 1 A 78 78 THR N N 212 111.935 109.655 2.280 1
1 956 . 7 1 1 A 79 79 ASP H H 213 8.372 8.504 -0.132 1
1 957 . 7 1 1 A 79 79 ASP HA H 213 4.470 4.610 -0.140 1
1 960 . 7 1 1 A 79 79 ASP C C 213 176.759 177.524 -0.765 1
1 961 . 7 1 1 A 79 79 ASP CA C 213 54.927 54.337 0.590 1
1 962 . 7 1 1 A 79 79 ASP CB C 213 43.859 41.813 2.046 1
1 963 . 7 1 1 A 79 79 ASP N N 213 122.093 121.357 0.736 1
1 964 . 7 1 1 A 80 80 LYS H H 214 8.740 8.833 -0.093 1
1 965 . 7 1 1 A 80 80 LYS HA H 214 4.027 4.017 0.010 1
1 974 . 7 1 1 A 80 80 LYS C C 214 178.493 178.092 0.401 1
1 975 . 7 1 1 A 80 80 LYS CA C 214 59.802 59.771 0.031 1
1 976 . 7 1 1 A 80 80 LYS CB C 214 32.374 32.165 0.209 1
1 980 . 7 1 1 A 80 80 LYS N N 214 124.685 123.536 1.149 1
1 981 . 7 1 1 A 81 81 ASP H H 215 8.556 8.247 0.309 1
1 982 . 7 1 1 A 81 81 ASP HA H 215 4.566 4.381 0.185 1
1 985 . 7 1 1 A 81 81 ASP C C 215 178.889 178.666 0.223 1
1 986 . 7 1 1 A 81 81 ASP CA C 215 58.046 57.409 0.637 1
1 987 . 7 1 1 A 81 81 ASP CB C 215 40.872 40.378 0.494 1
1 988 . 7 1 1 A 81 81 ASP N N 215 121.413 119.178 2.235 1
1 989 . 7 1 1 A 82 82 PHE H H 216 8.205 8.334 -0.129 1
1 990 . 7 1 1 A 82 82 PHE HA H 216 3.686 4.079 -0.393 1
1 998 . 7 1 1 A 82 82 PHE C C 216 175.919 177.352 -1.433 1
1 999 . 7 1 1 A 82 82 PHE CA C 216 61.648 60.749 0.899 1
1 1000 . 7 1 1 A 82 82 PHE CB C 216 39.743 39.110 0.633 1
1 1004 . 7 1 1 A 82 82 PHE N N 216 124.401 122.846 1.555 1
1 1005 . 7 1 1 A 83 83 GLU H H 217 8.887 8.900 -0.013 1
1 1006 . 7 1 1 A 83 83 GLU HA H 217 3.704 4.153 -0.449 1
1 1011 . 7 1 1 A 83 83 GLU C C 217 177.788 178.896 -1.108 1
1 1012 . 7 1 1 A 83 83 GLU CA C 217 60.545 60.282 0.263 1
1 1013 . 7 1 1 A 83 83 GLU CB C 217 30.639 29.582 1.057 1
1 1015 . 7 1 1 A 83 83 GLU N N 217 119.421 119.277 0.144 1
1 1016 . 7 1 1 A 84 84 LYS H H 218 8.055 8.086 -0.031 1
1 1017 . 7 1 1 A 84 84 LYS HA H 218 3.947 4.119 -0.172 1
1 1026 . 7 1 1 A 84 84 LYS C C 218 178.783 178.798 -0.015 1
1 1027 . 7 1 1 A 84 84 LYS CA C 218 59.327 59.019 0.308 1
1 1028 . 7 1 1 A 84 84 LYS CB C 218 32.539 32.277 0.262 1
1 1032 . 7 1 1 A 84 84 LYS N N 218 117.821 119.547 -1.726 1
1 1033 . 7 1 1 A 85 85 ALA H H 219 7.059 7.648 -0.589 1
1 1034 . 7 1 1 A 85 85 ALA HA H 219 4.040 4.061 -0.021 1
1 1038 . 7 1 1 A 85 85 ALA C C 219 179.794 180.166 -0.372 1
1 1039 . 7 1 1 A 85 85 ALA CA C 219 54.407 54.824 -0.417 1
1 1040 . 7 1 1 A 85 85 ALA CB C 219 20.130 18.138 1.992 1
1 1041 . 7 1 1 A 85 85 ALA N N 219 118.905 121.221 -2.316 1
1 1042 . 7 1 1 A 86 86 LEU H H 220 8.157 8.329 -0.172 1
1 1043 . 7 1 1 A 86 86 LEU HA H 220 3.692 3.988 -0.296 1
1 1053 . 7 1 1 A 86 86 LEU C C 220 178.330 178.614 -0.284 1
1 1054 . 7 1 1 A 86 86 LEU CA C 220 57.752 58.041 -0.289 1
1 1055 . 7 1 1 A 86 86 LEU CB C 220 41.464 42.030 -0.566 1
1 1059 . 7 1 1 A 86 86 LEU N N 220 118.606 120.384 -1.778 1
1 1060 . 7 1 1 A 87 87 PHE H H 221 8.349 8.267 0.082 1
1 1061 . 7 1 1 A 87 87 PHE HA H 221 3.861 4.459 -0.598 1
1 1069 . 7 1 1 A 87 87 PHE C C 221 176.176 177.859 -1.683 1
1 1070 . 7 1 1 A 87 87 PHE CA C 221 61.780 61.752 0.028 1
1 1071 . 7 1 1 A 87 87 PHE CB C 221 37.549 37.770 -0.221 1
1 1075 . 7 1 1 A 87 87 PHE N N 221 112.449 116.789 -4.340 1
1 1076 . 7 1 1 A 88 88 LYS H H 222 7.061 8.208 -1.147 1
1 1077 . 7 1 1 A 88 88 LYS HA H 222 4.380 4.128 0.252 1
1 1086 . 7 1 1 A 88 88 LYS C C 222 177.089 177.238 -0.149 1
1 1087 . 7 1 1 A 88 88 LYS CA C 222 56.726 58.399 -1.673 1
1 1088 . 7 1 1 A 88 88 LYS CB C 222 33.738 32.425 1.313 1
1 1092 . 7 1 1 A 88 88 LYS N N 222 118.308 121.229 -2.921 1
1 1093 . 7 1 1 A 89 89 LEU H H 223 7.270 7.300 -0.030 1
1 1094 . 7 1 1 A 89 89 LEU HA H 223 4.168 4.203 -0.035 1
1 1104 . 7 1 1 A 89 89 LEU C C 223 177.528 176.900 0.628 1
1 1105 . 7 1 1 A 89 89 LEU CA C 223 55.279 54.462 0.817 1
1 1106 . 7 1 1 A 89 89 LEU CB C 223 43.240 42.642 0.598 1
1 1110 . 7 1 1 A 89 89 LEU N N 223 121.317 122.152 -0.835 1
1 1111 . 7 1 1 A 90 90 LYS H H 224 8.788 8.472 0.316 1
1 1112 . 7 1 1 A 90 90 LYS HA H 224 4.359 4.564 -0.205 1
1 1121 . 7 1 1 A 90 90 LYS C C 224 175.839 176.318 -0.479 1
1 1122 . 7 1 1 A 90 90 LYS CA C 224 54.772 54.677 0.095 1
1 1123 . 7 1 1 A 90 90 LYS CB C 224 33.232 33.950 -0.718 1
1 1127 . 7 1 1 A 90 90 LYS N N 224 123.558 122.166 1.392 1
1 1128 . 7 1 1 A 91 91 ASP H H 225 8.125 8.774 -0.649 1
1 1129 . 7 1 1 A 91 91 ASP HA H 225 3.958 4.155 -0.197 1
1 1132 . 7 1 1 A 91 91 ASP C C 225 177.452 177.113 0.339 1
1 1133 . 7 1 1 A 91 91 ASP CA C 225 56.642 56.258 0.384 1
1 1134 . 7 1 1 A 91 91 ASP CB C 225 40.269 40.265 0.004 1
1 1135 . 7 1 1 A 91 91 ASP N N 225 119.419 121.807 -2.388 1
1 1136 . 7 1 1 A 92 92 GLY H H 226 8.681 8.702 -0.021 1
1 1137 . 7 1 1 A 92 92 GLY HA2 H 226 4.131 3.872 0.259 1
1 1138 . 7 1 1 A 92 92 GLY HA3 H 226 3.579 3.898 -0.319 1
1 1139 . 7 1 1 A 92 92 GLY C C 226 173.614 173.988 -0.374 1
1 1140 . 7 1 1 A 92 92 GLY CA C 226 45.564 45.101 0.463 1
1 1141 . 7 1 1 A 92 92 GLY N N 226 113.802 111.589 2.213 1
1 1142 . 7 1 1 A 93 93 GLU H H 227 8.104 8.080 0.024 1
1 1143 . 7 1 1 A 93 93 GLU HA H 227 4.232 4.419 -0.187 1
1 1148 . 7 1 1 A 93 93 GLU C C 227 174.282 175.673 -1.391 1
1 1149 . 7 1 1 A 93 93 GLU CA C 227 56.651 56.181 0.470 1
1 1150 . 7 1 1 A 93 93 GLU CB C 227 32.190 30.977 1.213 1
1 1152 . 7 1 1 A 93 93 GLU N N 227 121.527 121.892 -0.365 1
1 1153 . 7 1 1 A 94 94 VAL H H 228 7.918 8.483 -0.565 1
1 1154 . 7 1 1 A 94 94 VAL HA H 228 4.857 4.730 0.127 1
1 1162 . 7 1 1 A 94 94 VAL C C 228 176.556 175.643 0.913 1
1 1163 . 7 1 1 A 94 94 VAL CA C 228 60.309 60.334 -0.025 1
1 1164 . 7 1 1 A 94 94 VAL CB C 228 33.847 35.321 -1.474 1
1 1167 . 7 1 1 A 94 94 VAL N N 228 119.768 125.964 -6.196 1
1 1168 . 7 1 1 A 95 95 SER H H 229 9.659 9.462 0.197 1
1 1169 . 7 1 1 A 95 95 SER HA H 229 4.313 4.659 -0.346 1
1 1172 . 7 1 1 A 95 95 SER C C 229 174.641 174.451 0.190 1
1 1173 . 7 1 1 A 95 95 SER CA C 229 59.208 57.863 1.345 1
1 1174 . 7 1 1 A 95 95 SER CB C 229 66.080 65.582 0.498 1
1 1175 . 7 1 1 A 95 95 SER N N 229 124.903 121.471 3.432 1
1 1176 . 7 1 1 A 96 96 GLU H H 230 8.014 8.695 -0.681 1
1 1177 . 7 1 1 A 96 96 GLU HA H 230 4.376 4.391 -0.015 1
1 1182 . 7 1 1 A 96 96 GLU C C 230 176.641 177.202 -0.561 1
1 1183 . 7 1 1 A 96 96 GLU CA C 230 56.236 56.709 -0.473 1
1 1184 . 7 1 1 A 96 96 GLU CB C 230 30.324 30.743 -0.419 1
1 1186 . 7 1 1 A 96 96 GLU N N 230 115.510 120.917 -5.407 1
1 1187 . 7 1 1 A 97 97 VAL H H 231 8.741 8.350 0.391 1
1 1188 . 7 1 1 A 97 97 VAL HA H 231 4.171 4.257 -0.086 1
1 1196 . 7 1 1 A 97 97 VAL C C 231 176.684 175.691 0.993 1
1 1197 . 7 1 1 A 97 97 VAL CA C 231 65.418 63.195 2.223 1
1 1198 . 7 1 1 A 97 97 VAL CB C 231 31.218 31.677 -0.459 1
1 1201 . 7 1 1 A 97 97 VAL N N 231 121.289 121.784 -0.495 1
1 1202 . 7 1 1 A 98 98 VAL H H 232 9.218 9.575 -0.357 1
1 1203 . 7 1 1 A 98 98 VAL HA H 232 4.405 4.676 -0.271 1
1 1211 . 7 1 1 A 98 98 VAL C C 232 174.258 175.202 -0.944 1
1 1212 . 7 1 1 A 98 98 VAL CA C 232 60.937 61.097 -0.160 1
1 1213 . 7 1 1 A 98 98 VAL CB C 232 35.825 33.835 1.990 1
1 1216 . 7 1 1 A 98 98 VAL N N 232 130.544 129.172 1.372 1
1 1217 . 7 1 1 A 99 99 LYS H H 233 8.800 9.013 -0.213 1
1 1218 . 7 1 1 A 99 99 LYS HA H 233 4.853 4.781 0.072 1
1 1227 . 7 1 1 A 99 99 LYS C C 233 175.274 175.280 -0.006 1
1 1228 . 7 1 1 A 99 99 LYS CA C 233 55.499 55.971 -0.472 1
1 1229 . 7 1 1 A 99 99 LYS CB C 233 34.452 33.386 1.066 1
1 1233 . 7 1 1 A 99 99 LYS N N 233 130.477 129.214 1.263 1
1 1234 . 7 1 1 A 100 100 SER H H 234 9.585 8.717 0.868 1
1 1235 . 7 1 1 A 100 100 SER HA H 234 5.150 4.842 0.308 1
1 1238 . 7 1 1 A 100 100 SER C C 234 175.493 173.439 2.054 1
1 1239 . 7 1 1 A 100 100 SER CA C 234 56.927 55.998 0.929 1
1 1240 . 7 1 1 A 100 100 SER CB C 234 67.309 65.358 1.951 1
1 1241 . 7 1 1 A 100 100 SER N N 234 125.814 120.512 5.302 1
1 1242 . 7 1 1 A 101 101 SER H H 235 8.631 8.755 -0.124 1
1 1243 . 7 1 1 A 101 101 SER HA H 235 4.106 4.068 0.038 1
1 1246 . 7 1 1 A 101 101 SER C C 235 175.385 175.428 -0.043 1
1 1247 . 7 1 1 A 101 101 SER CA C 235 61.123 61.513 -0.390 1
1 1248 . 7 1 1 A 101 101 SER CB C 235 62.818 62.473 0.345 1
1 1249 . 7 1 1 A 101 101 SER N N 235 115.089 118.750 -3.661 1
1 1250 . 7 1 1 A 102 102 PHE H H 236 8.957 7.595 1.362 1
1 1251 . 7 1 1 A 102 102 PHE HA H 236 4.610 4.608 0.002 1
1 1259 . 7 1 1 A 102 102 PHE C C 236 176.453 175.774 0.679 1
1 1260 . 7 1 1 A 102 102 PHE CA C 236 58.382 58.116 0.266 1
1 1261 . 7 1 1 A 102 102 PHE CB C 236 40.275 39.621 0.654 1
1 1263 . 7 1 1 A 102 102 PHE N N 236 119.917 117.514 2.403 1
1 1264 . 7 1 1 A 103 103 GLY H H 237 7.377 7.295 0.082 1
1 1265 . 7 1 1 A 103 103 GLY HA2 H 237 4.453 3.938 0.515 1
1 1266 . 7 1 1 A 103 103 GLY HA3 H 237 3.472 4.109 -0.637 1
1 1267 . 7 1 1 A 103 103 GLY C C 237 169.627 172.114 -2.487 1
1 1268 . 7 1 1 A 103 103 GLY CA C 237 45.384 44.808 0.576 1
1 1269 . 7 1 1 A 103 103 GLY N N 237 108.809 106.257 2.552 1
1 1270 . 7 1 1 A 104 104 TYR H H 238 8.632 8.523 0.109 1
1 1271 . 7 1 1 A 104 104 TYR HA H 238 5.322 5.638 -0.316 1
1 1278 . 7 1 1 A 104 104 TYR C C 238 175.043 175.107 -0.064 1
1 1279 . 7 1 1 A 104 104 TYR CA C 238 57.627 56.541 1.086 1
1 1280 . 7 1 1 A 104 104 TYR CB C 238 41.711 42.695 -0.984 1
1 1283 . 7 1 1 A 104 104 TYR N N 238 120.030 121.558 -1.528 1
1 1284 . 7 1 1 A 105 105 HIS H H 239 10.070 9.516 0.554 1
1 1285 . 7 1 1 A 105 105 HIS HA H 239 6.046 5.616 0.430 1
1 1290 . 7 1 1 A 105 105 HIS C C 239 175.734 174.779 0.955 1
1 1291 . 7 1 1 A 105 105 HIS CA C 239 53.945 54.233 -0.288 1
1 1292 . 7 1 1 A 105 105 HIS CB C 239 32.450 34.411 -1.961 1
1 1295 . 7 1 1 A 105 105 HIS N N 239 119.504 118.696 0.808 1
1 1296 . 7 1 1 A 106 106 ILE H H 240 8.660 8.770 -0.110 1
1 1297 . 7 1 1 A 106 106 ILE HA H 240 4.120 4.885 -0.765 1
1 1307 . 7 1 1 A 106 106 ILE C C 240 174.758 175.387 -0.629 1
1 1308 . 7 1 1 A 106 106 ILE CA C 240 63.446 59.900 3.546 1
1 1309 . 7 1 1 A 106 106 ILE CB C 240 40.786 41.274 -0.488 1
1 1313 . 7 1 1 A 106 106 ILE N N 240 120.639 119.848 0.791 1
1 1314 . 7 1 1 A 107 107 ILE H H 241 9.033 8.997 0.036 1
1 1315 . 7 1 1 A 107 107 ILE HA H 241 4.799 5.078 -0.279 1
1 1325 . 7 1 1 A 107 107 ILE C C 241 172.880 173.959 -1.079 1
1 1326 . 7 1 1 A 107 107 ILE CA C 241 60.563 59.738 0.825 1
1 1327 . 7 1 1 A 107 107 ILE CB C 241 41.652 40.951 0.701 1
1 1331 . 7 1 1 A 107 107 ILE N N 241 129.098 127.252 1.846 1
1 1332 . 7 1 1 A 108 108 LYS H H 242 8.692 9.026 -0.334 1
1 1333 . 7 1 1 A 108 108 LYS HA H 242 5.012 4.953 0.059 1
1 1342 . 7 1 1 A 108 108 LYS C C 242 174.484 175.532 -1.048 1
1 1343 . 7 1 1 A 108 108 LYS CA C 242 54.317 53.939 0.378 1
1 1344 . 7 1 1 A 108 108 LYS CB C 242 35.619 35.531 0.088 1
1 1348 . 7 1 1 A 108 108 LYS N N 242 127.179 128.404 -1.225 1
1 1349 . 7 1 1 A 109 109 ALA H H 243 7.816 8.890 -1.074 1
1 1350 . 7 1 1 A 109 109 ALA HA H 243 4.604 4.579 0.025 1
1 1354 . 7 1 1 A 109 109 ALA C C 243 176.231 176.522 -0.291 1
1 1355 . 7 1 1 A 109 109 ALA CA C 243 50.505 51.325 -0.820 1
1 1356 . 7 1 1 A 109 109 ALA CB C 243 19.584 19.501 0.083 1
1 1357 . 7 1 1 A 109 109 ALA N N 243 129.619 127.945 1.674 1
1 1358 . 7 1 1 A 110 110 ASP H H 244 7.578 8.581 -1.003 1
1 1359 . 7 1 1 A 110 110 ASP HA H 244 4.424 4.950 -0.526 1
1 1362 . 7 1 1 A 110 110 ASP C C 244 175.259 176.332 -1.073 1
1 1363 . 7 1 1 A 110 110 ASP CA C 244 54.489 53.253 1.236 1
1 1364 . 7 1 1 A 110 110 ASP CB C 244 42.693 42.547 0.146 1
1 1365 . 7 1 1 A 110 110 ASP N N 244 125.434 122.397 3.037 1
1 4 . 8 1 1 A 2 2 PRO HA H -4 4.403 4.582 -0.179 1
1 11 . 8 1 1 A 2 2 PRO C C -4 176.990 176.788 0.202 1
1 12 . 8 1 1 A 2 2 PRO CA C -4 63.131 62.592 0.539 1
1 13 . 8 1 1 A 2 2 PRO CB C -4 32.342 32.554 -0.212 1
1 16 . 8 1 1 A 3 3 LEU H H -3 8.483 8.720 -0.237 1
1 17 . 8 1 1 A 3 3 LEU HA H -3 4.333 4.140 0.193 1
1 27 . 8 1 1 A 3 3 LEU C C -3 177.991 176.716 1.275 1
1 28 . 8 1 1 A 3 3 LEU CA C -3 55.314 56.528 -1.214 1
1 29 . 8 1 1 A 3 3 LEU CB C -3 42.244 43.532 -1.288 1
1 33 . 8 1 1 A 3 3 LEU N N -3 122.986 123.000 -0.014 1
1 34 . 8 1 1 A 4 4 GLY H H -2 8.397 7.883 0.514 1
1 35 . 8 1 1 A 4 4 GLY HA2 H -2 4.024 4.110 -0.086 1
1 36 . 8 1 1 A 4 4 GLY HA3 H -2 3.976 4.118 -0.142 1
1 37 . 8 1 1 A 4 4 GLY C C -2 174.360 174.750 -0.390 1
1 38 . 8 1 1 A 4 4 GLY CA C -2 45.434 44.712 0.722 1
1 39 . 8 1 1 A 4 4 GLY N N -2 110.666 107.015 3.651 1
1 56 . 8 1 1 A 7 7 SER H H 141 7.913 7.852 0.061 1
1 57 . 8 1 1 A 7 7 SER HA H 141 5.657 5.284 0.373 1
1 60 . 8 1 1 A 7 7 SER C C 141 173.753 172.137 1.616 1
1 61 . 8 1 1 A 7 7 SER CA C 141 56.758 57.726 -0.968 1
1 62 . 8 1 1 A 7 7 SER CB C 141 66.774 65.743 1.031 1
1 63 . 8 1 1 A 7 7 SER N N 141 113.824 111.893 1.931 1
1 64 . 8 1 1 A 8 8 LYS H H 142 8.656 8.193 0.463 1
1 65 . 8 1 1 A 8 8 LYS HA H 142 4.543 4.948 -0.405 1
1 74 . 8 1 1 A 8 8 LYS C C 142 174.403 174.675 -0.272 1
1 75 . 8 1 1 A 8 8 LYS CA C 142 55.578 54.364 1.214 1
1 76 . 8 1 1 A 8 8 LYS CB C 142 36.561 35.787 0.774 1
1 80 . 8 1 1 A 8 8 LYS N N 142 123.076 120.236 2.840 1
1 81 . 8 1 1 A 9 9 LYS H H 143 8.623 8.445 0.178 1
1 82 . 8 1 1 A 9 9 LYS HA H 143 4.119 4.367 -0.248 1
1 91 . 8 1 1 A 9 9 LYS C C 143 176.144 175.556 0.588 1
1 92 . 8 1 1 A 9 9 LYS CA C 143 56.683 56.130 0.553 1
1 93 . 8 1 1 A 9 9 LYS CB C 143 32.580 32.507 0.073 1
1 97 . 8 1 1 A 9 9 LYS N N 143 129.542 123.655 5.887 1
1 98 . 8 1 1 A 10 10 ALA H H 144 8.151 8.733 -0.582 1
1 99 . 8 1 1 A 10 10 ALA HA H 144 5.208 4.885 0.323 1
1 103 . 8 1 1 A 10 10 ALA C C 144 175.577 175.078 0.499 1
1 104 . 8 1 1 A 10 10 ALA CA C 144 51.226 51.250 -0.024 1
1 105 . 8 1 1 A 10 10 ALA CB C 144 25.299 24.072 1.227 1
1 106 . 8 1 1 A 10 10 ALA N N 144 127.933 127.823 0.110 1
1 107 . 8 1 1 A 11 11 SER H H 145 8.679 8.805 -0.126 1
1 108 . 8 1 1 A 11 11 SER HA H 145 5.431 5.746 -0.315 1
1 111 . 8 1 1 A 11 11 SER C C 145 173.072 173.235 -0.163 1
1 112 . 8 1 1 A 11 11 SER CA C 145 57.772 57.172 0.600 1
1 113 . 8 1 1 A 11 11 SER CB C 145 67.301 66.191 1.110 1
1 114 . 8 1 1 A 11 11 SER N N 145 116.245 115.455 0.790 1
1 115 . 8 1 1 A 12 12 HIS H H 146 9.962 9.607 0.355 1
1 116 . 8 1 1 A 12 12 HIS HA H 146 6.332 6.010 0.322 1
1 121 . 8 1 1 A 12 12 HIS C C 146 173.006 172.385 0.621 1
1 122 . 8 1 1 A 12 12 HIS CA C 146 55.020 54.253 0.767 1
1 123 . 8 1 1 A 12 12 HIS CB C 146 37.071 33.716 3.355 1
1 126 . 8 1 1 A 12 12 HIS N N 146 119.181 118.421 0.760 1
1 127 . 8 1 1 A 13 13 ILE H H 147 8.976 8.947 0.029 1
1 128 . 8 1 1 A 13 13 ILE HA H 147 3.528 4.563 -1.035 1
1 138 . 8 1 1 A 13 13 ILE C C 147 173.010 173.795 -0.785 1
1 139 . 8 1 1 A 13 13 ILE CA C 147 61.273 59.681 1.592 1
1 140 . 8 1 1 A 13 13 ILE CB C 147 41.773 41.732 0.041 1
1 144 . 8 1 1 A 13 13 ILE N N 147 121.873 119.430 2.443 1
1 145 . 8 1 1 A 14 14 LEU H H 148 7.627 9.012 -1.385 1
1 146 . 8 1 1 A 14 14 LEU HA H 148 4.814 4.890 -0.076 1
1 156 . 8 1 1 A 14 14 LEU C C 148 174.112 174.315 -0.203 1
1 157 . 8 1 1 A 14 14 LEU CA C 148 52.574 53.053 -0.479 1
1 158 . 8 1 1 A 14 14 LEU CB C 148 45.643 44.883 0.760 1
1 162 . 8 1 1 A 14 14 LEU N N 148 127.112 129.691 -2.579 1
1 163 . 8 1 1 A 15 15 ILE H H 149 9.524 9.282 0.242 1
1 164 . 8 1 1 A 15 15 ILE HA H 149 4.362 4.625 -0.263 1
1 174 . 8 1 1 A 15 15 ILE C C 149 175.452 175.466 -0.014 1
1 175 . 8 1 1 A 15 15 ILE CA C 149 58.516 60.692 -2.176 1
1 176 . 8 1 1 A 15 15 ILE CB C 149 36.560 39.689 -3.129 1
1 180 . 8 1 1 A 15 15 ILE N N 149 128.652 127.009 1.643 1
1 181 . 8 1 1 A 16 16 LYS H H 150 8.035 8.380 -0.345 1
1 182 . 8 1 1 A 16 16 LYS HA H 150 4.319 4.448 -0.129 1
1 191 . 8 1 1 A 16 16 LYS C C 150 175.038 176.350 -1.312 1
1 192 . 8 1 1 A 16 16 LYS CA C 150 57.817 56.455 1.362 1
1 193 . 8 1 1 A 16 16 LYS CB C 150 34.853 33.115 1.738 1
1 197 . 8 1 1 A 16 16 LYS N N 150 129.153 128.007 1.146 1
1 198 . 8 1 1 A 17 17 VAL H H 151 8.016 8.930 -0.914 1
1 199 . 8 1 1 A 17 17 VAL HA H 151 4.873 4.908 -0.035 1
1 207 . 8 1 1 A 17 17 VAL C C 151 176.647 175.432 1.215 1
1 208 . 8 1 1 A 17 17 VAL CA C 151 60.088 61.281 -1.193 1
1 209 . 8 1 1 A 17 17 VAL CB C 151 34.082 33.480 0.602 1
1 212 . 8 1 1 A 17 17 VAL N N 151 121.288 123.634 -2.346 1
1 213 . 8 1 1 A 18 18 LYS H H 152 8.443 8.972 -0.529 1
1 214 . 8 1 1 A 18 18 LYS HA H 152 4.334 4.818 -0.484 1
1 223 . 8 1 1 A 18 18 LYS C C 152 176.345 176.964 -0.619 1
1 224 . 8 1 1 A 18 18 LYS CA C 152 57.016 54.469 2.547 1
1 225 . 8 1 1 A 18 18 LYS CB C 152 33.222 35.089 -1.867 1
1 229 . 8 1 1 A 18 18 LYS N N 152 128.408 127.175 1.233 1
1 230 . 8 1 1 A 19 19 SER H H 153 9.067 8.675 0.392 1
1 231 . 8 1 1 A 19 19 SER HA H 153 4.457 4.347 0.110 1
1 234 . 8 1 1 A 19 19 SER C C 153 174.236 174.522 -0.286 1
1 235 . 8 1 1 A 19 19 SER CA C 153 59.642 59.760 -0.118 1
1 236 . 8 1 1 A 19 19 SER CB C 153 64.347 63.410 0.937 1
1 237 . 8 1 1 A 19 19 SER N N 153 121.522 116.013 5.509 1
1 238 . 8 1 1 A 20 20 LYS H H 154 7.961 7.667 0.294 1
1 239 . 8 1 1 A 20 20 LYS HA H 154 4.558 4.531 0.027 1
1 244 . 8 1 1 A 20 20 LYS C C 154 177.256 177.208 0.048 1
1 245 . 8 1 1 A 20 20 LYS CA C 154 55.249 54.866 0.383 1
1 246 . 8 1 1 A 20 20 LYS CB C 154 34.531 33.498 1.033 1
1 248 . 8 1 1 A 20 20 LYS N N 154 120.270 122.418 -2.148 1
1 249 . 8 1 1 A 21 21 LYS HA H 155 4.003 4.065 -0.062 1
1 258 . 8 1 1 A 21 21 LYS C C 155 177.015 177.744 -0.729 1
1 259 . 8 1 1 A 21 21 LYS CA C 155 59.091 58.957 0.134 1
1 260 . 8 1 1 A 21 21 LYS CB C 155 32.394 32.186 0.208 1
1 264 . 8 1 1 A 22 22 SER H H 156 7.625 7.613 0.012 1
1 265 . 8 1 1 A 22 22 SER HA H 156 4.293 4.619 -0.326 1
1 268 . 8 1 1 A 22 22 SER C C 156 174.843 173.744 1.099 1
1 269 . 8 1 1 A 22 22 SER CA C 156 57.966 58.228 -0.262 1
1 270 . 8 1 1 A 22 22 SER CB C 156 63.369 63.860 -0.491 1
1 271 . 8 1 1 A 22 22 SER N N 156 109.549 112.762 -3.213 1
1 272 . 8 1 1 A 23 23 ASP H H 157 7.701 7.776 -0.075 1
1 273 . 8 1 1 A 23 23 ASP HA H 157 4.548 4.520 0.028 1
1 276 . 8 1 1 A 23 23 ASP C C 157 176.544 176.115 0.429 1
1 277 . 8 1 1 A 23 23 ASP CA C 157 55.242 54.547 0.695 1
1 278 . 8 1 1 A 23 23 ASP CB C 157 41.103 42.175 -1.072 1
1 279 . 8 1 1 A 23 23 ASP N N 157 124.536 123.688 0.848 1
1 280 . 8 1 1 A 24 24 LYS H H 158 8.583 9.172 -0.589 1
1 281 . 8 1 1 A 24 24 LYS HA H 158 4.252 4.382 -0.130 1
1 290 . 8 1 1 A 24 24 LYS C C 158 176.813 177.368 -0.555 1
1 291 . 8 1 1 A 24 24 LYS CA C 158 57.148 56.778 0.370 1
1 292 . 8 1 1 A 24 24 LYS CB C 158 33.200 32.798 0.402 1
1 296 . 8 1 1 A 24 24 LYS N N 158 122.372 125.956 -3.584 1
1 297 . 8 1 1 A 25 25 GLU H H 159 8.001 8.253 -0.252 1
1 298 . 8 1 1 A 25 25 GLU HA H 159 4.521 4.439 0.082 1
1 303 . 8 1 1 A 25 25 GLU C C 159 175.995 175.811 0.184 1
1 304 . 8 1 1 A 25 25 GLU CA C 159 55.727 56.418 -0.691 1
1 305 . 8 1 1 A 25 25 GLU CB C 159 31.918 30.741 1.177 1
1 307 . 8 1 1 A 25 25 GLU N N 159 118.705 117.137 1.568 1
1 308 . 8 1 1 A 26 26 GLY H H 160 8.458 7.442 1.016 1
1 309 . 8 1 1 A 26 26 GLY HA2 H 160 3.946 4.100 -0.154 1
1 310 . 8 1 1 A 26 26 GLY HA3 H 160 3.511 4.112 -0.601 1
1 311 . 8 1 1 A 26 26 GLY C C 160 172.201 171.629 0.572 1
1 312 . 8 1 1 A 26 26 GLY CA C 160 44.038 45.472 -1.434 1
1 313 . 8 1 1 A 26 26 GLY N N 160 107.642 106.488 1.154 1
1 314 . 8 1 1 A 27 27 LEU H H 161 8.259 8.684 -0.425 1
1 315 . 8 1 1 A 27 27 LEU HA H 161 4.775 4.778 -0.003 1
1 325 . 8 1 1 A 27 27 LEU C C 161 177.422 175.973 1.449 1
1 326 . 8 1 1 A 27 27 LEU CA C 161 53.322 53.908 -0.586 1
1 327 . 8 1 1 A 27 27 LEU CB C 161 45.576 43.013 2.563 1
1 331 . 8 1 1 A 27 27 LEU N N 161 119.856 122.032 -2.176 1
1 332 . 8 1 1 A 28 28 ASP H H 162 8.848 8.350 0.498 1
1 333 . 8 1 1 A 28 28 ASP HA H 162 4.644 4.532 0.112 1
1 336 . 8 1 1 A 28 28 ASP C C 162 176.630 177.201 -0.571 1
1 337 . 8 1 1 A 28 28 ASP CA C 162 55.195 54.655 0.540 1
1 338 . 8 1 1 A 28 28 ASP CB C 162 41.673 42.882 -1.209 1
1 339 . 8 1 1 A 28 28 ASP N N 162 122.434 121.716 0.718 1
1 340 . 8 1 1 A 29 29 ASP H H 163 8.720 9.182 -0.462 1
1 341 . 8 1 1 A 29 29 ASP HA H 163 4.386 4.362 0.024 1
1 344 . 8 1 1 A 29 29 ASP C C 163 176.604 178.093 -1.489 1
1 345 . 8 1 1 A 29 29 ASP CA C 163 59.690 58.287 1.403 1
1 346 . 8 1 1 A 29 29 ASP CB C 163 42.964 41.061 1.903 1
1 347 . 8 1 1 A 29 29 ASP N N 163 121.460 126.671 -5.211 1
1 348 . 8 1 1 A 30 30 LYS H H 164 8.434 7.839 0.595 1
1 349 . 8 1 1 A 30 30 LYS HA H 164 3.901 4.143 -0.242 1
1 358 . 8 1 1 A 30 30 LYS C C 164 179.479 179.244 0.235 1
1 359 . 8 1 1 A 30 30 LYS CA C 164 60.047 59.264 0.783 1
1 360 . 8 1 1 A 30 30 LYS CB C 164 32.038 32.280 -0.242 1
1 364 . 8 1 1 A 30 30 LYS N N 164 116.627 118.770 -2.143 1
1 365 . 8 1 1 A 31 31 GLU H H 165 7.755 8.280 -0.525 1
1 366 . 8 1 1 A 31 31 GLU HA H 165 3.998 3.990 0.008 1
1 371 . 8 1 1 A 31 31 GLU C C 165 179.031 179.238 -0.207 1
1 372 . 8 1 1 A 31 31 GLU CA C 165 59.335 59.182 0.153 1
1 373 . 8 1 1 A 31 31 GLU CB C 165 29.972 29.329 0.643 1
1 375 . 8 1 1 A 31 31 GLU N N 165 120.456 120.373 0.083 1
1 376 . 8 1 1 A 32 32 ALA H H 166 9.060 8.528 0.532 1
1 377 . 8 1 1 A 32 32 ALA HA H 166 3.871 4.030 -0.159 1
1 381 . 8 1 1 A 32 32 ALA C C 166 178.029 179.031 -1.002 1
1 382 . 8 1 1 A 32 32 ALA CA C 166 54.997 55.236 -0.239 1
1 383 . 8 1 1 A 32 32 ALA CB C 166 19.727 18.449 1.278 1
1 384 . 8 1 1 A 32 32 ALA N N 166 124.406 122.494 1.912 1
1 385 . 8 1 1 A 33 33 LYS H H 167 8.228 7.658 0.570 1
1 386 . 8 1 1 A 33 33 LYS HA H 167 2.595 2.852 -0.257 1
1 395 . 8 1 1 A 33 33 LYS C C 167 177.938 178.155 -0.217 1
1 396 . 8 1 1 A 33 33 LYS CA C 167 59.573 59.290 0.283 1
1 397 . 8 1 1 A 33 33 LYS CB C 167 32.098 32.185 -0.087 1
1 401 . 8 1 1 A 33 33 LYS N N 167 119.833 118.045 1.788 1
1 402 . 8 1 1 A 34 34 GLN H H 168 7.392 7.495 -0.103 1
1 403 . 8 1 1 A 34 34 GLN HA H 168 3.943 3.916 0.027 1
1 410 . 8 1 1 A 34 34 GLN C C 168 178.323 178.454 -0.131 1
1 411 . 8 1 1 A 34 34 GLN CA C 168 58.883 59.342 -0.459 1
1 412 . 8 1 1 A 34 34 GLN CB C 168 28.485 28.126 0.359 1
1 414 . 8 1 1 A 34 34 GLN N N 168 117.208 117.927 -0.719 1
1 416 . 8 1 1 A 35 35 LYS H H 169 7.994 8.083 -0.089 1
1 417 . 8 1 1 A 35 35 LYS HA H 169 4.067 4.017 0.050 1
1 426 . 8 1 1 A 35 35 LYS C C 169 178.161 178.534 -0.373 1
1 427 . 8 1 1 A 35 35 LYS CA C 169 58.437 59.100 -0.663 1
1 428 . 8 1 1 A 35 35 LYS CB C 169 31.611 32.128 -0.517 1
1 432 . 8 1 1 A 35 35 LYS N N 169 120.898 119.768 1.130 1
1 433 . 8 1 1 A 36 36 ALA H H 170 8.431 8.320 0.111 1
1 434 . 8 1 1 A 36 36 ALA HA H 170 3.738 4.020 -0.282 1
1 438 . 8 1 1 A 36 36 ALA C C 170 178.862 179.665 -0.803 1
1 439 . 8 1 1 A 36 36 ALA CA C 170 55.351 55.015 0.336 1
1 440 . 8 1 1 A 36 36 ALA CB C 170 18.295 18.508 -0.213 1
1 441 . 8 1 1 A 36 36 ALA N N 170 120.641 120.738 -0.097 1
1 442 . 8 1 1 A 37 37 GLU H H 171 8.412 8.065 0.347 1
1 443 . 8 1 1 A 37 37 GLU HA H 171 3.867 3.935 -0.068 1
1 448 . 8 1 1 A 37 37 GLU C C 171 179.255 178.800 0.455 1
1 449 . 8 1 1 A 37 37 GLU CA C 171 59.543 59.632 -0.089 1
1 450 . 8 1 1 A 37 37 GLU CB C 171 29.569 29.387 0.182 1
1 452 . 8 1 1 A 37 37 GLU N N 171 118.224 117.797 0.427 1
1 453 . 8 1 1 A 38 38 GLU H H 172 8.019 8.304 -0.285 1
1 454 . 8 1 1 A 38 38 GLU HA H 172 3.952 4.062 -0.110 1
1 459 . 8 1 1 A 38 38 GLU C C 172 180.250 178.466 1.784 1
1 460 . 8 1 1 A 38 38 GLU CA C 172 59.627 59.133 0.494 1
1 461 . 8 1 1 A 38 38 GLU CB C 172 29.368 28.806 0.562 1
1 463 . 8 1 1 A 38 38 GLU N N 172 121.250 118.272 2.978 1
1 464 . 8 1 1 A 39 39 ILE H H 173 8.174 7.468 0.706 1
1 465 . 8 1 1 A 39 39 ILE HA H 173 3.643 3.801 -0.158 1
1 475 . 8 1 1 A 39 39 ILE C C 173 177.568 177.978 -0.410 1
1 476 . 8 1 1 A 39 39 ILE CA C 173 64.869 63.843 1.026 1
1 477 . 8 1 1 A 39 39 ILE CB C 173 38.160 37.457 0.703 1
1 481 . 8 1 1 A 39 39 ILE N N 173 121.527 117.490 4.037 1
1 482 . 8 1 1 A 40 40 GLN H H 174 8.860 8.360 0.500 1
1 483 . 8 1 1 A 40 40 GLN HA H 174 3.533 4.011 -0.478 1
1 490 . 8 1 1 A 40 40 GLN C C 174 179.022 179.010 0.012 1
1 491 . 8 1 1 A 40 40 GLN CA C 174 61.316 59.356 1.960 1
1 492 . 8 1 1 A 40 40 GLN CB C 174 26.604 28.478 -1.874 1
1 494 . 8 1 1 A 40 40 GLN N N 174 121.956 121.268 0.688 1
1 496 . 8 1 1 A 41 41 LYS H H 175 7.879 8.080 -0.201 1
1 497 . 8 1 1 A 41 41 LYS HA H 175 3.777 4.166 -0.389 1
1 506 . 8 1 1 A 41 41 LYS C C 175 178.779 178.051 0.728 1
1 507 . 8 1 1 A 41 41 LYS CA C 175 59.701 58.713 0.988 1
1 508 . 8 1 1 A 41 41 LYS CB C 175 32.581 32.235 0.346 1
1 512 . 8 1 1 A 41 41 LYS N N 175 119.012 118.267 0.745 1
1 513 . 8 1 1 A 42 42 GLU H H 176 7.447 7.809 -0.362 1
1 514 . 8 1 1 A 42 42 GLU HA H 176 4.059 4.277 -0.218 1
1 519 . 8 1 1 A 42 42 GLU C C 176 180.058 178.991 1.067 1
1 520 . 8 1 1 A 42 42 GLU CA C 176 59.456 58.734 0.722 1
1 521 . 8 1 1 A 42 42 GLU CB C 176 29.923 30.427 -0.504 1
1 523 . 8 1 1 A 42 42 GLU N N 176 120.054 118.477 1.577 1
1 524 . 8 1 1 A 43 43 VAL H H 177 8.618 8.121 0.497 1
1 525 . 8 1 1 A 43 43 VAL HA H 177 3.986 3.910 0.076 1
1 533 . 8 1 1 A 43 43 VAL C C 177 176.459 177.550 -1.091 1
1 534 . 8 1 1 A 43 43 VAL CA C 177 63.923 64.741 -0.818 1
1 535 . 8 1 1 A 43 43 VAL CB C 177 31.899 31.246 0.653 1
1 538 . 8 1 1 A 43 43 VAL N N 177 114.191 117.279 -3.088 1
1 539 . 8 1 1 A 44 44 SER H H 178 8.052 8.343 -0.291 1
1 540 . 8 1 1 A 44 44 SER HA H 178 4.098 4.248 -0.150 1
1 543 . 8 1 1 A 44 44 SER C C 178 176.548 176.020 0.528 1
1 544 . 8 1 1 A 44 44 SER CA C 178 61.160 61.150 0.010 1
1 545 . 8 1 1 A 44 44 SER CB C 178 62.959 62.606 0.353 1
1 546 . 8 1 1 A 44 44 SER N N 178 114.202 115.735 -1.533 1
1 547 . 8 1 1 A 45 45 LYS H H 179 7.083 8.133 -1.050 1
1 548 . 8 1 1 A 45 45 LYS HA H 179 4.140 4.232 -0.092 1
1 557 . 8 1 1 A 45 45 LYS C C 179 177.288 176.098 1.190 1
1 558 . 8 1 1 A 45 45 LYS CA C 179 58.469 57.901 0.568 1
1 559 . 8 1 1 A 45 45 LYS CB C 179 32.671 31.673 0.998 1
1 563 . 8 1 1 A 45 45 LYS N N 179 120.935 117.667 3.268 1
1 564 . 8 1 1 A 46 46 ASP H H 180 7.098 7.937 -0.839 1
1 565 . 8 1 1 A 46 46 ASP HA H 180 4.917 4.994 -0.077 1
1 568 . 8 1 1 A 46 46 ASP CA C 180 51.492 51.641 -0.149 1
1 569 . 8 1 1 A 46 46 ASP CB C 180 40.595 41.358 -0.763 1
1 570 . 8 1 1 A 46 46 ASP N N 180 112.836 120.433 -7.597 1
1 571 . 8 1 1 A 47 47 PRO HA H 181 4.681 4.549 0.132 1
1 578 . 8 1 1 A 47 47 PRO C C 181 179.248 177.779 1.469 1
1 579 . 8 1 1 A 47 47 PRO CA C 181 64.718 64.316 0.402 1
1 580 . 8 1 1 A 47 47 PRO CB C 181 32.159 32.004 0.155 1
1 583 . 8 1 1 A 48 48 SER H H 182 8.248 8.329 -0.081 1
1 584 . 8 1 1 A 48 48 SER HA H 182 4.378 4.260 0.118 1
1 587 . 8 1 1 A 48 48 SER C C 182 176.071 175.459 0.612 1
1 588 . 8 1 1 A 48 48 SER CA C 182 61.377 60.947 0.430 1
1 589 . 8 1 1 A 48 48 SER CB C 182 62.455 63.080 -0.625 1
1 590 . 8 1 1 A 48 48 SER N N 182 116.986 114.000 2.986 1
1 591 . 8 1 1 A 49 49 LYS H H 183 7.842 7.329 0.513 1
1 592 . 8 1 1 A 49 49 LYS HA H 183 4.482 4.375 0.107 1
1 601 . 8 1 1 A 49 49 LYS C C 183 175.605 177.466 -1.861 1
1 602 . 8 1 1 A 49 49 LYS CA C 183 55.824 56.437 -0.613 1
1 603 . 8 1 1 A 49 49 LYS CB C 183 32.834 32.541 0.293 1
1 607 . 8 1 1 A 49 49 LYS N N 183 121.698 118.861 2.837 1
1 608 . 8 1 1 A 50 50 PHE H H 184 7.634 7.700 -0.066 1
1 609 . 8 1 1 A 50 50 PHE HA H 184 3.510 4.183 -0.673 1
1 617 . 8 1 1 A 50 50 PHE C C 184 176.214 177.608 -1.394 1
1 618 . 8 1 1 A 50 50 PHE CA C 184 63.276 61.068 2.208 1
1 619 . 8 1 1 A 50 50 PHE CB C 184 40.948 39.148 1.800 1
1 623 . 8 1 1 A 50 50 PHE N N 184 120.120 121.575 -1.455 1
1 624 . 8 1 1 A 51 51 GLY H H 185 8.855 8.608 0.247 1
1 625 . 8 1 1 A 51 51 GLY HA2 H 185 3.993 3.882 0.111 1
1 626 . 8 1 1 A 51 51 GLY HA3 H 185 3.958 3.922 0.036 1
1 627 . 8 1 1 A 51 51 GLY C C 185 175.169 176.292 -1.123 1
1 628 . 8 1 1 A 51 51 GLY CA C 185 47.475 47.515 -0.040 1
1 629 . 8 1 1 A 51 51 GLY N N 185 105.550 106.290 -0.740 1
1 630 . 8 1 1 A 52 52 GLU H H 186 7.917 7.958 -0.041 1
1 631 . 8 1 1 A 52 52 GLU HA H 186 4.006 4.049 -0.043 1
1 636 . 8 1 1 A 52 52 GLU C C 186 179.499 179.626 -0.127 1
1 637 . 8 1 1 A 52 52 GLU CA C 186 58.904 59.221 -0.317 1
1 638 . 8 1 1 A 52 52 GLU CB C 186 29.700 29.350 0.350 1
1 640 . 8 1 1 A 52 52 GLU N N 186 121.929 121.772 0.157 1
1 641 . 8 1 1 A 53 53 ILE H H 187 7.936 8.033 -0.097 1
1 642 . 8 1 1 A 53 53 ILE HA H 187 3.648 3.744 -0.096 1
1 652 . 8 1 1 A 53 53 ILE C C 187 177.886 177.823 0.063 1
1 653 . 8 1 1 A 53 53 ILE CA C 187 64.366 64.671 -0.305 1
1 654 . 8 1 1 A 53 53 ILE CB C 187 36.478 37.373 -0.895 1
1 658 . 8 1 1 A 53 53 ILE N N 187 120.991 121.856 -0.865 1
1 659 . 8 1 1 A 54 54 ALA H H 188 8.895 8.548 0.347 1
1 660 . 8 1 1 A 54 54 ALA HA H 188 3.629 3.790 -0.161 1
1 664 . 8 1 1 A 54 54 ALA C C 188 179.437 179.077 0.360 1
1 665 . 8 1 1 A 54 54 ALA CA C 188 55.974 55.616 0.358 1
1 666 . 8 1 1 A 54 54 ALA CB C 188 17.591 18.706 -1.115 1
1 667 . 8 1 1 A 54 54 ALA N N 188 125.308 122.286 3.022 1
1 668 . 8 1 1 A 55 55 LYS H H 189 8.049 7.767 0.282 1
1 669 . 8 1 1 A 55 55 LYS HA H 189 4.106 3.884 0.222 1
1 678 . 8 1 1 A 55 55 LYS C C 189 178.995 178.252 0.743 1
1 679 . 8 1 1 A 55 55 LYS CA C 189 59.312 59.234 0.078 1
1 680 . 8 1 1 A 55 55 LYS CB C 189 32.647 31.965 0.682 1
1 684 . 8 1 1 A 55 55 LYS N N 189 116.835 118.400 -1.565 1
1 685 . 8 1 1 A 56 56 LYS H H 190 7.215 7.773 -0.558 1
1 686 . 8 1 1 A 56 56 LYS HA H 190 4.172 4.273 -0.101 1
1 695 . 8 1 1 A 56 56 LYS C C 190 177.897 177.924 -0.027 1
1 696 . 8 1 1 A 56 56 LYS CA C 190 58.418 57.969 0.449 1
1 697 . 8 1 1 A 56 56 LYS CB C 190 34.652 33.420 1.232 1
1 701 . 8 1 1 A 56 56 LYS N N 190 117.170 117.949 -0.779 1
1 702 . 8 1 1 A 57 57 GLU H H 191 8.572 7.981 0.591 1
1 703 . 8 1 1 A 57 57 GLU HA H 191 4.643 4.412 0.231 1
1 708 . 8 1 1 A 57 57 GLU C C 191 177.903 176.020 1.883 1
1 709 . 8 1 1 A 57 57 GLU CA C 191 55.708 55.829 -0.121 1
1 710 . 8 1 1 A 57 57 GLU CB C 191 32.460 31.157 1.303 1
1 712 . 8 1 1 A 57 57 GLU N N 191 113.316 116.691 -3.375 1
1 713 . 8 1 1 A 58 58 SER H H 192 8.550 7.670 0.880 1
1 714 . 8 1 1 A 58 58 SER HA H 192 4.149 4.406 -0.257 1
1 717 . 8 1 1 A 58 58 SER C C 192 176.161 175.117 1.044 1
1 718 . 8 1 1 A 58 58 SER CA C 192 58.403 57.988 0.415 1
1 719 . 8 1 1 A 58 58 SER CB C 192 64.392 64.369 0.023 1
1 720 . 8 1 1 A 58 58 SER N N 192 109.861 116.098 -6.237 1
1 721 . 8 1 1 A 59 59 MET H H 193 9.533 8.867 0.666 1
1 722 . 8 1 1 A 59 59 MET HA H 193 4.457 4.587 -0.130 1
1 730 . 8 1 1 A 59 59 MET C C 193 175.204 175.617 -0.413 1
1 731 . 8 1 1 A 59 59 MET CA C 193 55.781 55.255 0.526 1
1 732 . 8 1 1 A 59 59 MET CB C 193 32.855 32.706 0.149 1
1 735 . 8 1 1 A 59 59 MET N N 193 124.493 123.294 1.199 1
1 736 . 8 1 1 A 60 60 ASP H H 194 7.514 7.363 0.151 1
1 737 . 8 1 1 A 60 60 ASP HA H 194 4.886 4.553 0.333 1
1 740 . 8 1 1 A 60 60 ASP C C 194 175.517 176.803 -1.286 1
1 741 . 8 1 1 A 60 60 ASP CA C 194 52.286 53.291 -1.005 1
1 742 . 8 1 1 A 60 60 ASP CB C 194 40.222 41.056 -0.834 1
1 743 . 8 1 1 A 60 60 ASP N N 194 117.785 122.073 -4.288 1
1 744 . 8 1 1 A 61 61 THR H H 195 8.118 8.427 -0.309 1
1 745 . 8 1 1 A 61 61 THR HA H 195 3.918 3.969 -0.051 1
1 750 . 8 1 1 A 61 61 THR C C 195 176.269 176.692 -0.423 1
1 751 . 8 1 1 A 61 61 THR CA C 195 65.469 64.670 0.799 1
1 752 . 8 1 1 A 61 61 THR CB C 195 68.741 68.753 -0.012 1
1 754 . 8 1 1 A 61 61 THR N N 195 120.765 118.425 2.340 1
1 755 . 8 1 1 A 62 62 GLY H H 196 8.399 8.110 0.289 1
1 756 . 8 1 1 A 62 62 GLY HA2 H 196 3.932 3.813 0.119 1
1 757 . 8 1 1 A 62 62 GLY HA3 H 196 3.900 3.816 0.084 1
1 758 . 8 1 1 A 62 62 GLY C C 196 174.948 176.362 -1.414 1
1 759 . 8 1 1 A 62 62 GLY CA C 196 46.768 47.535 -0.767 1
1 760 . 8 1 1 A 62 62 GLY N N 196 108.183 111.928 -3.745 1
1 761 . 8 1 1 A 63 63 SER H H 197 7.265 8.283 -1.018 1
1 762 . 8 1 1 A 63 63 SER HA H 197 4.554 4.201 0.353 1
1 765 . 8 1 1 A 63 63 SER C C 197 177.630 176.923 0.707 1
1 766 . 8 1 1 A 63 63 SER CA C 197 59.550 61.401 -1.851 1
1 767 . 8 1 1 A 63 63 SER CB C 197 65.504 62.901 2.603 1
1 768 . 8 1 1 A 63 63 SER N N 197 111.815 117.011 -5.196 1
1 769 . 8 1 1 A 64 64 ALA H H 198 8.675 8.435 0.240 1
1 770 . 8 1 1 A 64 64 ALA HA H 198 3.801 3.969 -0.168 1
1 774 . 8 1 1 A 64 64 ALA C C 198 178.492 179.686 -1.194 1
1 775 . 8 1 1 A 64 64 ALA CA C 198 56.794 55.398 1.396 1
1 776 . 8 1 1 A 64 64 ALA CB C 198 18.951 18.467 0.484 1
1 777 . 8 1 1 A 64 64 ALA N N 198 131.710 123.793 7.917 1
1 778 . 8 1 1 A 65 65 LYS H H 199 7.666 7.441 0.225 1
1 779 . 8 1 1 A 65 65 LYS HA H 199 4.175 4.150 0.025 1
1 788 . 8 1 1 A 65 65 LYS C C 199 177.159 177.074 0.085 1
1 789 . 8 1 1 A 65 65 LYS CA C 199 57.735 58.104 -0.369 1
1 790 . 8 1 1 A 65 65 LYS CB C 199 31.948 32.153 -0.205 1
1 794 . 8 1 1 A 65 65 LYS N N 199 111.375 117.599 -6.224 1
1 795 . 8 1 1 A 66 66 LYS H H 200 7.545 7.647 -0.102 1
1 796 . 8 1 1 A 66 66 LYS HA H 200 4.612 4.513 0.099 1
1 805 . 8 1 1 A 66 66 LYS C C 200 175.609 175.927 -0.318 1
1 806 . 8 1 1 A 66 66 LYS CA C 200 54.468 55.386 -0.918 1
1 807 . 8 1 1 A 66 66 LYS CB C 200 31.525 32.651 -1.126 1
1 811 . 8 1 1 A 66 66 LYS N N 200 121.421 119.423 1.998 1
1 812 . 8 1 1 A 67 67 ASP H H 201 7.630 8.101 -0.471 1
1 813 . 8 1 1 A 67 67 ASP HA H 201 4.306 4.365 -0.059 1
1 816 . 8 1 1 A 67 67 ASP C C 201 175.025 176.359 -1.334 1
1 817 . 8 1 1 A 67 67 ASP CA C 201 56.400 55.401 0.999 1
1 818 . 8 1 1 A 67 67 ASP CB C 201 38.315 39.119 -0.804 1
1 819 . 8 1 1 A 67 67 ASP N N 201 116.216 116.725 -0.509 1
1 820 . 8 1 1 A 68 68 GLY H H 202 8.368 8.701 -0.333 1
1 821 . 8 1 1 A 68 68 GLY HA2 H 202 4.316 3.943 0.373 1
1 822 . 8 1 1 A 68 68 GLY HA3 H 202 3.731 4.042 -0.311 1
1 823 . 8 1 1 A 68 68 GLY C C 202 174.139 174.469 -0.330 1
1 824 . 8 1 1 A 68 68 GLY CA C 202 45.514 45.423 0.091 1
1 825 . 8 1 1 A 68 68 GLY N N 202 105.095 104.659 0.436 1
1 826 . 8 1 1 A 69 69 GLU H H 203 7.534 7.601 -0.067 1
1 827 . 8 1 1 A 69 69 GLU HA H 203 4.479 4.530 -0.051 1
1 832 . 8 1 1 A 69 69 GLU C C 203 176.961 176.584 0.377 1
1 833 . 8 1 1 A 69 69 GLU CA C 203 58.549 57.191 1.358 1
1 834 . 8 1 1 A 69 69 GLU CB C 203 30.998 30.633 0.365 1
1 836 . 8 1 1 A 69 69 GLU N N 203 120.426 120.756 -0.330 1
1 837 . 8 1 1 A 70 70 LEU H H 204 8.962 8.947 0.015 1
1 838 . 8 1 1 A 70 70 LEU HA H 204 4.438 4.620 -0.182 1
1 848 . 8 1 1 A 70 70 LEU C C 204 178.648 177.375 1.273 1
1 849 . 8 1 1 A 70 70 LEU CA C 204 53.977 55.049 -1.072 1
1 850 . 8 1 1 A 70 70 LEU CB C 204 43.612 43.630 -0.018 1
1 854 . 8 1 1 A 70 70 LEU N N 204 122.066 125.638 -3.572 1
1 855 . 8 1 1 A 71 71 GLY H H 205 8.104 7.719 0.385 1
1 856 . 8 1 1 A 71 71 GLY HA2 H 205 4.165 4.022 0.143 1
1 857 . 8 1 1 A 71 71 GLY HA3 H 205 3.552 4.112 -0.560 1
1 858 . 8 1 1 A 71 71 GLY C C 205 173.098 173.404 -0.306 1
1 859 . 8 1 1 A 71 71 GLY CA C 205 44.723 44.942 -0.219 1
1 860 . 8 1 1 A 71 71 GLY N N 205 110.168 106.822 3.346 1
1 861 . 8 1 1 A 72 72 TYR H H 206 8.457 8.650 -0.193 1
1 862 . 8 1 1 A 72 72 TYR HA H 206 4.184 4.653 -0.469 1
1 869 . 8 1 1 A 72 72 TYR C C 206 175.975 175.490 0.485 1
1 870 . 8 1 1 A 72 72 TYR CA C 206 59.722 59.015 0.707 1
1 871 . 8 1 1 A 72 72 TYR CB C 206 38.378 38.258 0.120 1
1 874 . 8 1 1 A 72 72 TYR N N 206 120.171 122.105 -1.934 1
1 875 . 8 1 1 A 73 73 VAL H H 207 8.782 9.152 -0.370 1
1 876 . 8 1 1 A 73 73 VAL HA H 207 4.056 4.494 -0.438 1
1 884 . 8 1 1 A 73 73 VAL C C 207 174.901 175.802 -0.901 1
1 885 . 8 1 1 A 73 73 VAL CA C 207 62.202 62.630 -0.428 1
1 886 . 8 1 1 A 73 73 VAL CB C 207 33.071 32.053 1.018 1
1 889 . 8 1 1 A 73 73 VAL N N 207 128.847 125.408 3.439 1
1 890 . 8 1 1 A 74 74 LEU H H 208 8.146 8.806 -0.660 1
1 891 . 8 1 1 A 74 74 LEU HA H 208 4.944 4.440 0.504 1
1 901 . 8 1 1 A 74 74 LEU C C 208 178.400 177.578 0.822 1
1 902 . 8 1 1 A 74 74 LEU CA C 208 53.520 54.764 -1.244 1
1 903 . 8 1 1 A 74 74 LEU CB C 208 43.499 42.383 1.116 1
1 907 . 8 1 1 A 74 74 LEU N N 208 127.599 129.382 -1.783 1
1 908 . 8 1 1 A 75 75 LYS H H 209 8.403 8.316 0.087 1
1 909 . 8 1 1 A 75 75 LYS HA H 209 3.771 3.930 -0.159 1
1 918 . 8 1 1 A 75 75 LYS C C 209 177.536 177.466 0.070 1
1 919 . 8 1 1 A 75 75 LYS CA C 209 58.385 58.884 -0.499 1
1 920 . 8 1 1 A 75 75 LYS CB C 209 32.459 32.062 0.397 1
1 924 . 8 1 1 A 75 75 LYS N N 209 123.798 122.837 0.961 1
1 925 . 8 1 1 A 76 76 GLY H H 210 9.997 9.380 0.617 1
1 926 . 8 1 1 A 76 76 GLY HA2 H 210 4.255 4.008 0.247 1
1 927 . 8 1 1 A 76 76 GLY HA3 H 210 3.791 4.011 -0.220 1
1 928 . 8 1 1 A 76 76 GLY C C 210 175.091 175.765 -0.674 1
1 929 . 8 1 1 A 76 76 GLY CA C 210 45.465 45.475 -0.010 1
1 930 . 8 1 1 A 76 76 GLY N N 210 114.705 113.186 1.519 1
1 931 . 8 1 1 A 77 77 GLN H H 211 7.726 7.955 -0.229 1
1 932 . 8 1 1 A 77 77 GLN HA H 211 4.373 4.200 0.173 1
1 939 . 8 1 1 A 77 77 GLN C C 211 176.301 175.932 0.369 1
1 940 . 8 1 1 A 77 77 GLN CA C 211 57.074 57.241 -0.167 1
1 941 . 8 1 1 A 77 77 GLN CB C 211 30.798 29.367 1.431 1
1 943 . 8 1 1 A 77 77 GLN N N 211 118.702 117.959 0.743 1
1 945 . 8 1 1 A 78 78 THR H H 212 8.225 7.425 0.800 1
1 946 . 8 1 1 A 78 78 THR HA H 212 4.620 4.621 -0.001 1
1 951 . 8 1 1 A 78 78 THR C C 212 173.920 174.240 -0.320 1
1 952 . 8 1 1 A 78 78 THR CA C 212 60.087 59.426 0.661 1
1 953 . 8 1 1 A 78 78 THR CB C 212 71.412 70.846 0.566 1
1 955 . 8 1 1 A 78 78 THR N N 212 111.935 110.589 1.346 1
1 956 . 8 1 1 A 79 79 ASP H H 213 8.372 8.494 -0.122 1
1 957 . 8 1 1 A 79 79 ASP HA H 213 4.470 4.542 -0.072 1
1 960 . 8 1 1 A 79 79 ASP C C 213 176.759 177.698 -0.939 1
1 961 . 8 1 1 A 79 79 ASP CA C 213 54.927 54.289 0.638 1
1 962 . 8 1 1 A 79 79 ASP CB C 213 43.859 41.506 2.353 1
1 963 . 8 1 1 A 79 79 ASP N N 213 122.093 121.397 0.696 1
1 964 . 8 1 1 A 80 80 LYS H H 214 8.740 8.940 -0.200 1
1 965 . 8 1 1 A 80 80 LYS HA H 214 4.027 3.929 0.098 1
1 974 . 8 1 1 A 80 80 LYS C C 214 178.493 178.234 0.259 1
1 975 . 8 1 1 A 80 80 LYS CA C 214 59.802 59.701 0.101 1
1 976 . 8 1 1 A 80 80 LYS CB C 214 32.374 32.180 0.194 1
1 980 . 8 1 1 A 80 80 LYS N N 214 124.685 123.275 1.410 1
1 981 . 8 1 1 A 81 81 ASP H H 215 8.556 8.187 0.369 1
1 982 . 8 1 1 A 81 81 ASP HA H 215 4.566 4.383 0.183 1
1 985 . 8 1 1 A 81 81 ASP C C 215 178.889 178.551 0.338 1
1 986 . 8 1 1 A 81 81 ASP CA C 215 58.046 57.276 0.770 1
1 987 . 8 1 1 A 81 81 ASP CB C 215 40.872 40.415 0.457 1
1 988 . 8 1 1 A 81 81 ASP N N 215 121.413 119.577 1.836 1
1 989 . 8 1 1 A 82 82 PHE H H 216 8.205 8.373 -0.168 1
1 990 . 8 1 1 A 82 82 PHE HA H 216 3.686 4.081 -0.395 1
1 998 . 8 1 1 A 82 82 PHE C C 216 175.919 177.364 -1.445 1
1 999 . 8 1 1 A 82 82 PHE CA C 216 61.648 60.713 0.935 1
1 1000 . 8 1 1 A 82 82 PHE CB C 216 39.743 39.104 0.639 1
1 1004 . 8 1 1 A 82 82 PHE N N 216 124.401 122.942 1.459 1
1 1005 . 8 1 1 A 83 83 GLU H H 217 8.887 8.846 0.041 1
1 1006 . 8 1 1 A 83 83 GLU HA H 217 3.704 4.144 -0.440 1
1 1011 . 8 1 1 A 83 83 GLU C C 217 177.788 178.804 -1.016 1
1 1012 . 8 1 1 A 83 83 GLU CA C 217 60.545 60.299 0.246 1
1 1013 . 8 1 1 A 83 83 GLU CB C 217 30.639 29.571 1.068 1
1 1015 . 8 1 1 A 83 83 GLU N N 217 119.421 119.278 0.143 1
1 1016 . 8 1 1 A 84 84 LYS H H 218 8.055 7.933 0.122 1
1 1017 . 8 1 1 A 84 84 LYS HA H 218 3.947 4.084 -0.137 1
1 1026 . 8 1 1 A 84 84 LYS C C 218 178.783 178.771 0.012 1
1 1027 . 8 1 1 A 84 84 LYS CA C 218 59.327 59.056 0.271 1
1 1028 . 8 1 1 A 84 84 LYS CB C 218 32.539 32.219 0.320 1
1 1032 . 8 1 1 A 84 84 LYS N N 218 117.821 119.563 -1.742 1
1 1033 . 8 1 1 A 85 85 ALA H H 219 7.059 7.589 -0.530 1
1 1034 . 8 1 1 A 85 85 ALA HA H 219 4.040 4.057 -0.017 1
1 1038 . 8 1 1 A 85 85 ALA C C 219 179.794 180.147 -0.353 1
1 1039 . 8 1 1 A 85 85 ALA CA C 219 54.407 54.852 -0.445 1
1 1040 . 8 1 1 A 85 85 ALA CB C 219 20.130 18.289 1.841 1
1 1041 . 8 1 1 A 85 85 ALA N N 219 118.905 121.302 -2.397 1
1 1042 . 8 1 1 A 86 86 LEU H H 220 8.157 8.307 -0.150 1
1 1043 . 8 1 1 A 86 86 LEU HA H 220 3.692 3.997 -0.305 1
1 1053 . 8 1 1 A 86 86 LEU C C 220 178.330 178.644 -0.314 1
1 1054 . 8 1 1 A 86 86 LEU CA C 220 57.752 58.123 -0.371 1
1 1055 . 8 1 1 A 86 86 LEU CB C 220 41.464 41.807 -0.343 1
1 1059 . 8 1 1 A 86 86 LEU N N 220 118.606 120.363 -1.757 1
1 1060 . 8 1 1 A 87 87 PHE H H 221 8.349 8.044 0.305 1
1 1061 . 8 1 1 A 87 87 PHE HA H 221 3.861 4.549 -0.688 1
1 1069 . 8 1 1 A 87 87 PHE C C 221 176.176 177.732 -1.556 1
1 1070 . 8 1 1 A 87 87 PHE CA C 221 61.780 61.292 0.488 1
1 1071 . 8 1 1 A 87 87 PHE CB C 221 37.549 37.913 -0.364 1
1 1075 . 8 1 1 A 87 87 PHE N N 221 112.449 116.516 -4.067 1
1 1076 . 8 1 1 A 88 88 LYS H H 222 7.061 7.932 -0.871 1
1 1077 . 8 1 1 A 88 88 LYS HA H 222 4.380 4.190 0.190 1
1 1086 . 8 1 1 A 88 88 LYS C C 222 177.089 177.158 -0.069 1
1 1087 . 8 1 1 A 88 88 LYS CA C 222 56.726 58.109 -1.383 1
1 1088 . 8 1 1 A 88 88 LYS CB C 222 33.738 32.608 1.130 1
1 1092 . 8 1 1 A 88 88 LYS N N 222 118.308 120.648 -2.340 1
1 1093 . 8 1 1 A 89 89 LEU H H 223 7.270 7.158 0.112 1
1 1094 . 8 1 1 A 89 89 LEU HA H 223 4.168 4.227 -0.059 1
1 1104 . 8 1 1 A 89 89 LEU C C 223 177.528 177.036 0.492 1
1 1105 . 8 1 1 A 89 89 LEU CA C 223 55.279 54.489 0.790 1
1 1106 . 8 1 1 A 89 89 LEU CB C 223 43.240 42.664 0.576 1
1 1110 . 8 1 1 A 89 89 LEU N N 223 121.317 122.604 -1.287 1
1 1111 . 8 1 1 A 90 90 LYS H H 224 8.788 8.330 0.458 1
1 1112 . 8 1 1 A 90 90 LYS HA H 224 4.359 4.279 0.080 1
1 1121 . 8 1 1 A 90 90 LYS C C 224 175.839 176.548 -0.709 1
1 1122 . 8 1 1 A 90 90 LYS CA C 224 54.772 56.148 -1.376 1
1 1123 . 8 1 1 A 90 90 LYS CB C 224 33.232 33.255 -0.023 1
1 1127 . 8 1 1 A 90 90 LYS N N 224 123.558 123.047 0.511 1
1 1128 . 8 1 1 A 91 91 ASP H H 225 8.125 8.772 -0.647 1
1 1129 . 8 1 1 A 91 91 ASP HA H 225 3.958 4.160 -0.202 1
1 1132 . 8 1 1 A 91 91 ASP C C 225 177.452 177.039 0.413 1
1 1133 . 8 1 1 A 91 91 ASP CA C 225 56.642 56.241 0.401 1
1 1134 . 8 1 1 A 91 91 ASP CB C 225 40.269 40.152 0.117 1
1 1135 . 8 1 1 A 91 91 ASP N N 225 119.419 122.270 -2.851 1
1 1136 . 8 1 1 A 92 92 GLY H H 226 8.681 8.506 0.175 1
1 1137 . 8 1 1 A 92 92 GLY HA2 H 226 4.131 3.852 0.279 1
1 1138 . 8 1 1 A 92 92 GLY HA3 H 226 3.579 3.878 -0.299 1
1 1139 . 8 1 1 A 92 92 GLY C C 226 173.614 174.229 -0.615 1
1 1140 . 8 1 1 A 92 92 GLY CA C 226 45.564 45.160 0.404 1
1 1141 . 8 1 1 A 92 92 GLY N N 226 113.802 111.686 2.116 1
1 1142 . 8 1 1 A 93 93 GLU H H 227 8.104 7.740 0.364 1
1 1143 . 8 1 1 A 93 93 GLU HA H 227 4.232 4.537 -0.305 1
1 1148 . 8 1 1 A 93 93 GLU C C 227 174.282 175.185 -0.903 1
1 1149 . 8 1 1 A 93 93 GLU CA C 227 56.651 55.918 0.733 1
1 1150 . 8 1 1 A 93 93 GLU CB C 227 32.190 31.300 0.890 1
1 1152 . 8 1 1 A 93 93 GLU N N 227 121.527 120.068 1.459 1
1 1153 . 8 1 1 A 94 94 VAL H H 228 7.918 8.481 -0.563 1
1 1154 . 8 1 1 A 94 94 VAL HA H 228 4.857 4.738 0.119 1
1 1162 . 8 1 1 A 94 94 VAL C C 228 176.556 175.596 0.960 1
1 1163 . 8 1 1 A 94 94 VAL CA C 228 60.309 60.461 -0.152 1
1 1164 . 8 1 1 A 94 94 VAL CB C 228 33.847 35.806 -1.959 1
1 1167 . 8 1 1 A 94 94 VAL N N 228 119.768 121.392 -1.624 1
1 1168 . 8 1 1 A 95 95 SER H H 229 9.659 9.362 0.297 1
1 1169 . 8 1 1 A 95 95 SER HA H 229 4.313 4.702 -0.389 1
1 1172 . 8 1 1 A 95 95 SER C C 229 174.641 174.498 0.143 1
1 1173 . 8 1 1 A 95 95 SER CA C 229 59.208 57.818 1.390 1
1 1174 . 8 1 1 A 95 95 SER CB C 229 66.080 65.588 0.492 1
1 1175 . 8 1 1 A 95 95 SER N N 229 124.903 121.289 3.614 1
1 1176 . 8 1 1 A 96 96 GLU H H 230 8.014 8.379 -0.365 1
1 1177 . 8 1 1 A 96 96 GLU HA H 230 4.376 4.305 0.071 1
1 1182 . 8 1 1 A 96 96 GLU C C 230 176.641 175.933 0.708 1
1 1183 . 8 1 1 A 96 96 GLU CA C 230 56.236 55.958 0.278 1
1 1184 . 8 1 1 A 96 96 GLU CB C 230 30.324 30.358 -0.034 1
1 1186 . 8 1 1 A 96 96 GLU N N 230 115.510 119.386 -3.876 1
1 1187 . 8 1 1 A 97 97 VAL H H 231 8.741 8.294 0.447 1
1 1188 . 8 1 1 A 97 97 VAL HA H 231 4.171 4.136 0.035 1
1 1196 . 8 1 1 A 97 97 VAL C C 231 176.684 175.709 0.975 1
1 1197 . 8 1 1 A 97 97 VAL CA C 231 65.418 63.139 2.279 1
1 1198 . 8 1 1 A 97 97 VAL CB C 231 31.218 31.631 -0.413 1
1 1201 . 8 1 1 A 97 97 VAL N N 231 121.289 120.587 0.702 1
1 1202 . 8 1 1 A 98 98 VAL H H 232 9.218 9.353 -0.135 1
1 1203 . 8 1 1 A 98 98 VAL HA H 232 4.405 4.685 -0.280 1
1 1211 . 8 1 1 A 98 98 VAL C C 232 174.258 174.334 -0.076 1
1 1212 . 8 1 1 A 98 98 VAL CA C 232 60.937 61.160 -0.223 1
1 1213 . 8 1 1 A 98 98 VAL CB C 232 35.825 33.957 1.868 1
1 1216 . 8 1 1 A 98 98 VAL N N 232 130.544 128.359 2.185 1
1 1217 . 8 1 1 A 99 99 LYS H H 233 8.800 8.801 -0.001 1
1 1218 . 8 1 1 A 99 99 LYS HA H 233 4.853 5.208 -0.355 1
1 1227 . 8 1 1 A 99 99 LYS C C 233 175.274 175.129 0.145 1
1 1228 . 8 1 1 A 99 99 LYS CA C 233 55.499 54.716 0.783 1
1 1229 . 8 1 1 A 99 99 LYS CB C 233 34.452 34.900 -0.448 1
1 1233 . 8 1 1 A 99 99 LYS N N 233 130.477 128.062 2.415 1
1 1234 . 8 1 1 A 100 100 SER H H 234 9.585 9.079 0.506 1
1 1235 . 8 1 1 A 100 100 SER HA H 234 5.150 4.918 0.232 1
1 1238 . 8 1 1 A 100 100 SER C C 234 175.493 174.935 0.558 1
1 1239 . 8 1 1 A 100 100 SER CA C 234 56.927 57.404 -0.477 1
1 1240 . 8 1 1 A 100 100 SER CB C 234 67.309 67.157 0.152 1
1 1241 . 8 1 1 A 100 100 SER N N 234 125.814 122.556 3.258 1
1 1242 . 8 1 1 A 101 101 SER H H 235 8.631 8.441 0.190 1
1 1243 . 8 1 1 A 101 101 SER HA H 235 4.106 4.045 0.061 1
1 1246 . 8 1 1 A 101 101 SER C C 235 175.385 175.523 -0.138 1
1 1247 . 8 1 1 A 101 101 SER CA C 235 61.123 60.580 0.543 1
1 1248 . 8 1 1 A 101 101 SER CB C 235 62.818 62.898 -0.080 1
1 1249 . 8 1 1 A 101 101 SER N N 235 115.089 117.511 -2.422 1
1 1250 . 8 1 1 A 102 102 PHE H H 236 8.957 7.825 1.132 1
1 1251 . 8 1 1 A 102 102 PHE HA H 236 4.610 4.640 -0.030 1
1 1259 . 8 1 1 A 102 102 PHE C C 236 176.453 175.830 0.623 1
1 1260 . 8 1 1 A 102 102 PHE CA C 236 58.382 58.132 0.250 1
1 1261 . 8 1 1 A 102 102 PHE CB C 236 40.275 39.532 0.743 1
1 1263 . 8 1 1 A 102 102 PHE N N 236 119.917 119.233 0.684 1
1 1264 . 8 1 1 A 103 103 GLY H H 237 7.377 7.269 0.108 1
1 1265 . 8 1 1 A 103 103 GLY HA2 H 237 4.453 4.050 0.403 1
1 1266 . 8 1 1 A 103 103 GLY HA3 H 237 3.472 4.181 -0.709 1
1 1267 . 8 1 1 A 103 103 GLY C C 237 169.627 172.538 -2.911 1
1 1268 . 8 1 1 A 103 103 GLY CA C 237 45.384 44.675 0.709 1
1 1269 . 8 1 1 A 103 103 GLY N N 237 108.809 106.287 2.522 1
1 1270 . 8 1 1 A 104 104 TYR H H 238 8.632 8.544 0.088 1
1 1271 . 8 1 1 A 104 104 TYR HA H 238 5.322 5.437 -0.115 1
1 1278 . 8 1 1 A 104 104 TYR C C 238 175.043 175.201 -0.158 1
1 1279 . 8 1 1 A 104 104 TYR CA C 238 57.627 57.128 0.499 1
1 1280 . 8 1 1 A 104 104 TYR CB C 238 41.711 41.666 0.045 1
1 1283 . 8 1 1 A 104 104 TYR N N 238 120.030 121.896 -1.866 1
1 1284 . 8 1 1 A 105 105 HIS H H 239 10.070 9.442 0.628 1
1 1285 . 8 1 1 A 105 105 HIS HA H 239 6.046 5.548 0.498 1
1 1290 . 8 1 1 A 105 105 HIS C C 239 175.734 174.698 1.036 1
1 1291 . 8 1 1 A 105 105 HIS CA C 239 53.945 54.587 -0.642 1
1 1292 . 8 1 1 A 105 105 HIS CB C 239 32.450 34.033 -1.583 1
1 1295 . 8 1 1 A 105 105 HIS N N 239 119.504 118.328 1.176 1
1 1296 . 8 1 1 A 106 106 ILE H H 240 8.660 8.951 -0.291 1
1 1297 . 8 1 1 A 106 106 ILE HA H 240 4.120 4.850 -0.730 1
1 1307 . 8 1 1 A 106 106 ILE C C 240 174.758 175.264 -0.506 1
1 1308 . 8 1 1 A 106 106 ILE CA C 240 63.446 60.103 3.343 1
1 1309 . 8 1 1 A 106 106 ILE CB C 240 40.786 41.845 -1.059 1
1 1313 . 8 1 1 A 106 106 ILE N N 240 120.639 120.213 0.426 1
1 1314 . 8 1 1 A 107 107 ILE H H 241 9.033 9.043 -0.010 1
1 1315 . 8 1 1 A 107 107 ILE HA H 241 4.799 5.005 -0.206 1
1 1325 . 8 1 1 A 107 107 ILE C C 241 172.880 173.832 -0.952 1
1 1326 . 8 1 1 A 107 107 ILE CA C 241 60.563 59.888 0.675 1
1 1327 . 8 1 1 A 107 107 ILE CB C 241 41.652 40.803 0.849 1
1 1331 . 8 1 1 A 107 107 ILE N N 241 129.098 126.955 2.143 1
1 1332 . 8 1 1 A 108 108 LYS H H 242 8.692 8.961 -0.269 1
1 1333 . 8 1 1 A 108 108 LYS HA H 242 5.012 4.915 0.097 1
1 1342 . 8 1 1 A 108 108 LYS C C 242 174.484 175.385 -0.901 1
1 1343 . 8 1 1 A 108 108 LYS CA C 242 54.317 54.168 0.149 1
1 1344 . 8 1 1 A 108 108 LYS CB C 242 35.619 34.950 0.669 1
1 1348 . 8 1 1 A 108 108 LYS N N 242 127.179 128.340 -1.161 1
1 1349 . 8 1 1 A 109 109 ALA H H 243 7.816 8.888 -1.072 1
1 1350 . 8 1 1 A 109 109 ALA HA H 243 4.604 4.562 0.042 1
1 1354 . 8 1 1 A 109 109 ALA C C 243 176.231 176.665 -0.434 1
1 1355 . 8 1 1 A 109 109 ALA CA C 243 50.505 51.425 -0.920 1
1 1356 . 8 1 1 A 109 109 ALA CB C 243 19.584 19.398 0.186 1
1 1357 . 8 1 1 A 109 109 ALA N N 243 129.619 128.925 0.694 1
1 1358 . 8 1 1 A 110 110 ASP H H 244 7.578 8.959 -1.381 1
1 1359 . 8 1 1 A 110 110 ASP HA H 244 4.424 4.520 -0.096 1
1 1362 . 8 1 1 A 110 110 ASP C C 244 175.259 175.071 0.188 1
1 1363 . 8 1 1 A 110 110 ASP CA C 244 54.489 52.660 1.829 1
1 1364 . 8 1 1 A 110 110 ASP CB C 244 42.693 42.845 -0.152 1
1 1365 . 8 1 1 A 110 110 ASP N N 244 125.434 122.139 3.295 1
1 4 . 9 1 1 A 2 2 PRO HA H -4 4.403 4.426 -0.023 1
1 11 . 9 1 1 A 2 2 PRO C C -4 176.990 176.622 0.368 1
1 12 . 9 1 1 A 2 2 PRO CA C -4 63.131 62.417 0.714 1
1 13 . 9 1 1 A 2 2 PRO CB C -4 32.342 32.272 0.070 1
1 16 . 9 1 1 A 3 3 LEU H H -3 8.483 8.874 -0.391 1
1 17 . 9 1 1 A 3 3 LEU HA H -3 4.333 4.145 0.188 1
1 27 . 9 1 1 A 3 3 LEU C C -3 177.991 176.952 1.039 1
1 28 . 9 1 1 A 3 3 LEU CA C -3 55.314 56.147 -0.833 1
1 29 . 9 1 1 A 3 3 LEU CB C -3 42.244 42.695 -0.451 1
1 33 . 9 1 1 A 3 3 LEU N N -3 122.986 120.386 2.600 1
1 34 . 9 1 1 A 4 4 GLY H H -2 8.397 7.620 0.777 1
1 35 . 9 1 1 A 4 4 GLY HA2 H -2 4.024 4.003 0.021 1
1 36 . 9 1 1 A 4 4 GLY HA3 H -2 3.976 4.012 -0.036 1
1 37 . 9 1 1 A 4 4 GLY C C -2 174.360 172.755 1.605 1
1 38 . 9 1 1 A 4 4 GLY CA C -2 45.434 45.372 0.062 1
1 39 . 9 1 1 A 4 4 GLY N N -2 110.666 105.241 5.425 1
1 56 . 9 1 1 A 7 7 SER H H 141 7.913 7.723 0.190 1
1 57 . 9 1 1 A 7 7 SER HA H 141 5.657 5.608 0.049 1
1 60 . 9 1 1 A 7 7 SER C C 141 173.753 172.593 1.160 1
1 61 . 9 1 1 A 7 7 SER CA C 141 56.758 57.554 -0.796 1
1 62 . 9 1 1 A 7 7 SER CB C 141 66.774 66.315 0.459 1
1 63 . 9 1 1 A 7 7 SER N N 141 113.824 111.848 1.976 1
1 64 . 9 1 1 A 8 8 LYS H H 142 8.656 8.280 0.376 1
1 65 . 9 1 1 A 8 8 LYS HA H 142 4.543 4.908 -0.365 1
1 74 . 9 1 1 A 8 8 LYS C C 142 174.403 174.871 -0.468 1
1 75 . 9 1 1 A 8 8 LYS CA C 142 55.578 54.342 1.236 1
1 76 . 9 1 1 A 8 8 LYS CB C 142 36.561 35.837 0.724 1
1 80 . 9 1 1 A 8 8 LYS N N 142 123.076 120.378 2.698 1
1 81 . 9 1 1 A 9 9 LYS H H 143 8.623 8.361 0.262 1
1 82 . 9 1 1 A 9 9 LYS HA H 143 4.119 4.294 -0.175 1
1 91 . 9 1 1 A 9 9 LYS C C 143 176.144 175.544 0.600 1
1 92 . 9 1 1 A 9 9 LYS CA C 143 56.683 56.215 0.468 1
1 93 . 9 1 1 A 9 9 LYS CB C 143 32.580 32.299 0.281 1
1 97 . 9 1 1 A 9 9 LYS N N 143 129.542 123.676 5.866 1
1 98 . 9 1 1 A 10 10 ALA H H 144 8.151 8.705 -0.554 1
1 99 . 9 1 1 A 10 10 ALA HA H 144 5.208 4.889 0.319 1
1 103 . 9 1 1 A 10 10 ALA C C 144 175.577 175.009 0.568 1
1 104 . 9 1 1 A 10 10 ALA CA C 144 51.226 51.212 0.014 1
1 105 . 9 1 1 A 10 10 ALA CB C 144 25.299 24.123 1.176 1
1 106 . 9 1 1 A 10 10 ALA N N 144 127.933 128.091 -0.158 1
1 107 . 9 1 1 A 11 11 SER H H 145 8.679 8.734 -0.055 1
1 108 . 9 1 1 A 11 11 SER HA H 145 5.431 5.697 -0.266 1
1 111 . 9 1 1 A 11 11 SER C C 145 173.072 173.235 -0.163 1
1 112 . 9 1 1 A 11 11 SER CA C 145 57.772 57.114 0.658 1
1 113 . 9 1 1 A 11 11 SER CB C 145 67.301 66.072 1.229 1
1 114 . 9 1 1 A 11 11 SER N N 145 116.245 115.442 0.803 1
1 115 . 9 1 1 A 12 12 HIS H H 146 9.962 9.518 0.444 1
1 116 . 9 1 1 A 12 12 HIS HA H 146 6.332 5.984 0.348 1
1 121 . 9 1 1 A 12 12 HIS C C 146 173.006 172.337 0.669 1
1 122 . 9 1 1 A 12 12 HIS CA C 146 55.020 54.329 0.691 1
1 123 . 9 1 1 A 12 12 HIS CB C 146 37.071 32.950 4.121 1
1 126 . 9 1 1 A 12 12 HIS N N 146 119.181 118.334 0.847 1
1 127 . 9 1 1 A 13 13 ILE H H 147 8.976 9.001 -0.025 1
1 128 . 9 1 1 A 13 13 ILE HA H 147 3.528 4.624 -1.096 1
1 138 . 9 1 1 A 13 13 ILE C C 147 173.010 174.256 -1.246 1
1 139 . 9 1 1 A 13 13 ILE CA C 147 61.273 59.445 1.828 1
1 140 . 9 1 1 A 13 13 ILE CB C 147 41.773 41.016 0.757 1
1 144 . 9 1 1 A 13 13 ILE N N 147 121.873 119.287 2.586 1
1 145 . 9 1 1 A 14 14 LEU H H 148 7.627 8.936 -1.309 1
1 146 . 9 1 1 A 14 14 LEU HA H 148 4.814 5.166 -0.352 1
1 156 . 9 1 1 A 14 14 LEU C C 148 174.112 174.428 -0.316 1
1 157 . 9 1 1 A 14 14 LEU CA C 148 52.574 53.173 -0.599 1
1 158 . 9 1 1 A 14 14 LEU CB C 148 45.643 46.465 -0.822 1
1 162 . 9 1 1 A 14 14 LEU N N 148 127.112 127.817 -0.705 1
1 163 . 9 1 1 A 15 15 ILE H H 149 9.524 9.305 0.219 1
1 164 . 9 1 1 A 15 15 ILE HA H 149 4.362 4.675 -0.313 1
1 174 . 9 1 1 A 15 15 ILE C C 149 175.452 175.415 0.037 1
1 175 . 9 1 1 A 15 15 ILE CA C 149 58.516 60.577 -2.061 1
1 176 . 9 1 1 A 15 15 ILE CB C 149 36.560 39.036 -2.476 1
1 180 . 9 1 1 A 15 15 ILE N N 149 128.652 127.155 1.497 1
1 181 . 9 1 1 A 16 16 LYS H H 150 8.035 8.621 -0.586 1
1 182 . 9 1 1 A 16 16 LYS HA H 150 4.319 4.500 -0.181 1
1 191 . 9 1 1 A 16 16 LYS C C 150 175.038 176.409 -1.371 1
1 192 . 9 1 1 A 16 16 LYS CA C 150 57.817 56.502 1.315 1
1 193 . 9 1 1 A 16 16 LYS CB C 150 34.853 33.152 1.701 1
1 197 . 9 1 1 A 16 16 LYS N N 150 129.153 127.834 1.319 1
1 198 . 9 1 1 A 17 17 VAL H H 151 8.016 9.111 -1.095 1
1 199 . 9 1 1 A 17 17 VAL HA H 151 4.873 4.972 -0.099 1
1 207 . 9 1 1 A 17 17 VAL C C 151 176.647 175.192 1.455 1
1 208 . 9 1 1 A 17 17 VAL CA C 151 60.088 61.047 -0.959 1
1 209 . 9 1 1 A 17 17 VAL CB C 151 34.082 34.294 -0.212 1
1 212 . 9 1 1 A 17 17 VAL N N 151 121.288 124.089 -2.801 1
1 213 . 9 1 1 A 18 18 LYS H H 152 8.443 8.780 -0.337 1
1 214 . 9 1 1 A 18 18 LYS HA H 152 4.334 4.698 -0.364 1
1 223 . 9 1 1 A 18 18 LYS C C 152 176.345 177.015 -0.670 1
1 224 . 9 1 1 A 18 18 LYS CA C 152 57.016 54.360 2.656 1
1 225 . 9 1 1 A 18 18 LYS CB C 152 33.222 34.898 -1.676 1
1 229 . 9 1 1 A 18 18 LYS N N 152 128.408 126.221 2.187 1
1 230 . 9 1 1 A 19 19 SER H H 153 9.067 8.651 0.416 1
1 231 . 9 1 1 A 19 19 SER HA H 153 4.457 4.597 -0.140 1
1 234 . 9 1 1 A 19 19 SER C C 153 174.236 174.463 -0.227 1
1 235 . 9 1 1 A 19 19 SER CA C 153 59.642 59.318 0.324 1
1 236 . 9 1 1 A 19 19 SER CB C 153 64.347 63.934 0.413 1
1 237 . 9 1 1 A 19 19 SER N N 153 121.522 116.412 5.110 1
1 238 . 9 1 1 A 20 20 LYS H H 154 7.961 7.691 0.270 1
1 239 . 9 1 1 A 20 20 LYS HA H 154 4.558 4.782 -0.224 1
1 244 . 9 1 1 A 20 20 LYS C C 154 177.256 175.870 1.386 1
1 245 . 9 1 1 A 20 20 LYS CA C 154 55.249 55.268 -0.019 1
1 246 . 9 1 1 A 20 20 LYS CB C 154 34.531 35.483 -0.952 1
1 248 . 9 1 1 A 20 20 LYS N N 154 120.270 120.882 -0.612 1
1 249 . 9 1 1 A 21 21 LYS HA H 155 4.003 4.032 -0.029 1
1 258 . 9 1 1 A 21 21 LYS C C 155 177.015 177.723 -0.708 1
1 259 . 9 1 1 A 21 21 LYS CA C 155 59.091 59.128 -0.037 1
1 260 . 9 1 1 A 21 21 LYS CB C 155 32.394 32.063 0.331 1
1 264 . 9 1 1 A 22 22 SER H H 156 7.625 7.723 -0.098 1
1 265 . 9 1 1 A 22 22 SER HA H 156 4.293 4.376 -0.083 1
1 268 . 9 1 1 A 22 22 SER C C 156 174.843 174.517 0.326 1
1 269 . 9 1 1 A 22 22 SER CA C 156 57.966 58.965 -0.999 1
1 270 . 9 1 1 A 22 22 SER CB C 156 63.369 63.464 -0.095 1
1 271 . 9 1 1 A 22 22 SER N N 156 109.549 112.489 -2.940 1
1 272 . 9 1 1 A 23 23 ASP H H 157 7.701 7.442 0.259 1
1 273 . 9 1 1 A 23 23 ASP HA H 157 4.548 4.533 0.015 1
1 276 . 9 1 1 A 23 23 ASP C C 157 176.544 176.291 0.253 1
1 277 . 9 1 1 A 23 23 ASP CA C 157 55.242 54.537 0.705 1
1 278 . 9 1 1 A 23 23 ASP CB C 157 41.103 41.767 -0.664 1
1 279 . 9 1 1 A 23 23 ASP N N 157 124.536 122.568 1.968 1
1 280 . 9 1 1 A 24 24 LYS H H 158 8.583 8.695 -0.112 1
1 281 . 9 1 1 A 24 24 LYS HA H 158 4.252 4.552 -0.300 1
1 290 . 9 1 1 A 24 24 LYS C C 158 176.813 177.300 -0.487 1
1 291 . 9 1 1 A 24 24 LYS CA C 158 57.148 56.170 0.978 1
1 292 . 9 1 1 A 24 24 LYS CB C 158 33.200 32.569 0.631 1
1 296 . 9 1 1 A 24 24 LYS N N 158 122.372 126.043 -3.671 1
1 297 . 9 1 1 A 25 25 GLU H H 159 8.001 8.188 -0.187 1
1 298 . 9 1 1 A 25 25 GLU HA H 159 4.521 4.175 0.346 1
1 303 . 9 1 1 A 25 25 GLU C C 159 175.995 176.586 -0.591 1
1 304 . 9 1 1 A 25 25 GLU CA C 159 55.727 59.061 -3.334 1
1 305 . 9 1 1 A 25 25 GLU CB C 159 31.918 30.253 1.665 1
1 307 . 9 1 1 A 25 25 GLU N N 159 118.705 119.735 -1.030 1
1 308 . 9 1 1 A 26 26 GLY H H 160 8.458 7.359 1.099 1
1 309 . 9 1 1 A 26 26 GLY HA2 H 160 3.946 4.073 -0.127 1
1 310 . 9 1 1 A 26 26 GLY HA3 H 160 3.511 4.081 -0.570 1
1 311 . 9 1 1 A 26 26 GLY C C 160 172.201 173.307 -1.106 1
1 312 . 9 1 1 A 26 26 GLY CA C 160 44.038 44.606 -0.568 1
1 313 . 9 1 1 A 26 26 GLY N N 160 107.642 108.271 -0.629 1
1 314 . 9 1 1 A 27 27 LEU H H 161 8.259 8.729 -0.470 1
1 315 . 9 1 1 A 27 27 LEU HA H 161 4.775 4.935 -0.160 1
1 325 . 9 1 1 A 27 27 LEU C C 161 177.422 176.008 1.414 1
1 326 . 9 1 1 A 27 27 LEU CA C 161 53.322 53.318 0.004 1
1 327 . 9 1 1 A 27 27 LEU CB C 161 45.576 43.455 2.121 1
1 331 . 9 1 1 A 27 27 LEU N N 161 119.856 121.130 -1.274 1
1 332 . 9 1 1 A 28 28 ASP H H 162 8.848 8.822 0.026 1
1 333 . 9 1 1 A 28 28 ASP HA H 162 4.644 4.741 -0.097 1
1 336 . 9 1 1 A 28 28 ASP C C 162 176.630 177.375 -0.745 1
1 337 . 9 1 1 A 28 28 ASP CA C 162 55.195 54.167 1.028 1
1 338 . 9 1 1 A 28 28 ASP CB C 162 41.673 41.813 -0.140 1
1 339 . 9 1 1 A 28 28 ASP N N 162 122.434 120.279 2.155 1
1 340 . 9 1 1 A 29 29 ASP H H 163 8.720 9.115 -0.395 1
1 341 . 9 1 1 A 29 29 ASP HA H 163 4.386 4.322 0.064 1
1 344 . 9 1 1 A 29 29 ASP C C 163 176.604 177.876 -1.272 1
1 345 . 9 1 1 A 29 29 ASP CA C 163 59.690 58.563 1.127 1
1 346 . 9 1 1 A 29 29 ASP CB C 163 42.964 41.423 1.541 1
1 347 . 9 1 1 A 29 29 ASP N N 163 121.460 124.098 -2.638 1
1 348 . 9 1 1 A 30 30 LYS H H 164 8.434 7.948 0.486 1
1 349 . 9 1 1 A 30 30 LYS HA H 164 3.901 4.097 -0.196 1
1 358 . 9 1 1 A 30 30 LYS C C 164 179.479 179.190 0.289 1
1 359 . 9 1 1 A 30 30 LYS CA C 164 60.047 59.304 0.743 1
1 360 . 9 1 1 A 30 30 LYS CB C 164 32.038 32.072 -0.034 1
1 364 . 9 1 1 A 30 30 LYS N N 164 116.627 118.498 -1.871 1
1 365 . 9 1 1 A 31 31 GLU H H 165 7.755 8.215 -0.460 1
1 366 . 9 1 1 A 31 31 GLU HA H 165 3.998 4.001 -0.003 1
1 371 . 9 1 1 A 31 31 GLU C C 165 179.031 179.162 -0.131 1
1 372 . 9 1 1 A 31 31 GLU CA C 165 59.335 59.147 0.188 1
1 373 . 9 1 1 A 31 31 GLU CB C 165 29.972 29.453 0.519 1
1 375 . 9 1 1 A 31 31 GLU N N 165 120.456 120.582 -0.126 1
1 376 . 9 1 1 A 32 32 ALA H H 166 9.060 8.472 0.588 1
1 377 . 9 1 1 A 32 32 ALA HA H 166 3.871 3.985 -0.114 1
1 381 . 9 1 1 A 32 32 ALA C C 166 178.029 179.008 -0.979 1
1 382 . 9 1 1 A 32 32 ALA CA C 166 54.997 55.373 -0.376 1
1 383 . 9 1 1 A 32 32 ALA CB C 166 19.727 18.293 1.434 1
1 384 . 9 1 1 A 32 32 ALA N N 166 124.406 122.233 2.173 1
1 385 . 9 1 1 A 33 33 LYS H H 167 8.228 7.779 0.449 1
1 386 . 9 1 1 A 33 33 LYS HA H 167 2.595 2.946 -0.351 1
1 395 . 9 1 1 A 33 33 LYS C C 167 177.938 178.411 -0.473 1
1 396 . 9 1 1 A 33 33 LYS CA C 167 59.573 59.280 0.293 1
1 397 . 9 1 1 A 33 33 LYS CB C 167 32.098 32.131 -0.033 1
1 401 . 9 1 1 A 33 33 LYS N N 167 119.833 117.965 1.868 1
1 402 . 9 1 1 A 34 34 GLN H H 168 7.392 7.709 -0.317 1
1 403 . 9 1 1 A 34 34 GLN HA H 168 3.943 3.920 0.023 1
1 410 . 9 1 1 A 34 34 GLN C C 168 178.323 178.355 -0.032 1
1 411 . 9 1 1 A 34 34 GLN CA C 168 58.883 59.418 -0.535 1
1 412 . 9 1 1 A 34 34 GLN CB C 168 28.485 28.097 0.388 1
1 414 . 9 1 1 A 34 34 GLN N N 168 117.208 118.069 -0.861 1
1 416 . 9 1 1 A 35 35 LYS H H 169 7.994 8.018 -0.024 1
1 417 . 9 1 1 A 35 35 LYS HA H 169 4.067 4.030 0.037 1
1 426 . 9 1 1 A 35 35 LYS C C 169 178.161 178.520 -0.359 1
1 427 . 9 1 1 A 35 35 LYS CA C 169 58.437 59.194 -0.757 1
1 428 . 9 1 1 A 35 35 LYS CB C 169 31.611 32.169 -0.558 1
1 432 . 9 1 1 A 35 35 LYS N N 169 120.898 119.647 1.251 1
1 433 . 9 1 1 A 36 36 ALA H H 170 8.431 8.269 0.162 1
1 434 . 9 1 1 A 36 36 ALA HA H 170 3.738 4.044 -0.306 1
1 438 . 9 1 1 A 36 36 ALA C C 170 178.862 179.931 -1.069 1
1 439 . 9 1 1 A 36 36 ALA CA C 170 55.351 54.959 0.392 1
1 440 . 9 1 1 A 36 36 ALA CB C 170 18.295 18.469 -0.174 1
1 441 . 9 1 1 A 36 36 ALA N N 170 120.641 119.887 0.754 1
1 442 . 9 1 1 A 37 37 GLU H H 171 8.412 8.268 0.144 1
1 443 . 9 1 1 A 37 37 GLU HA H 171 3.867 3.951 -0.084 1
1 448 . 9 1 1 A 37 37 GLU C C 171 179.255 178.932 0.323 1
1 449 . 9 1 1 A 37 37 GLU CA C 171 59.543 59.575 -0.032 1
1 450 . 9 1 1 A 37 37 GLU CB C 171 29.569 29.414 0.155 1
1 452 . 9 1 1 A 37 37 GLU N N 171 118.224 117.678 0.546 1
1 453 . 9 1 1 A 38 38 GLU H H 172 8.019 7.957 0.062 1
1 454 . 9 1 1 A 38 38 GLU HA H 172 3.952 4.037 -0.085 1
1 459 . 9 1 1 A 38 38 GLU C C 172 180.250 179.290 0.960 1
1 460 . 9 1 1 A 38 38 GLU CA C 172 59.627 59.006 0.621 1
1 461 . 9 1 1 A 38 38 GLU CB C 172 29.368 29.425 -0.057 1
1 463 . 9 1 1 A 38 38 GLU N N 172 121.250 119.918 1.332 1
1 464 . 9 1 1 A 39 39 ILE H H 173 8.174 7.699 0.475 1
1 465 . 9 1 1 A 39 39 ILE HA H 173 3.643 3.807 -0.164 1
1 475 . 9 1 1 A 39 39 ILE C C 173 177.568 177.863 -0.295 1
1 476 . 9 1 1 A 39 39 ILE CA C 173 64.869 63.627 1.242 1
1 477 . 9 1 1 A 39 39 ILE CB C 173 38.160 37.179 0.981 1
1 481 . 9 1 1 A 39 39 ILE N N 173 121.527 117.787 3.740 1
1 482 . 9 1 1 A 40 40 GLN H H 174 8.860 8.449 0.411 1
1 483 . 9 1 1 A 40 40 GLN HA H 174 3.533 3.987 -0.454 1
1 490 . 9 1 1 A 40 40 GLN C C 174 179.022 178.611 0.411 1
1 491 . 9 1 1 A 40 40 GLN CA C 174 61.316 59.148 2.168 1
1 492 . 9 1 1 A 40 40 GLN CB C 174 26.604 28.166 -1.562 1
1 494 . 9 1 1 A 40 40 GLN N N 174 121.956 121.078 0.878 1
1 496 . 9 1 1 A 41 41 LYS H H 175 7.879 7.630 0.249 1
1 497 . 9 1 1 A 41 41 LYS HA H 175 3.777 4.196 -0.419 1
1 506 . 9 1 1 A 41 41 LYS C C 175 178.779 179.335 -0.556 1
1 507 . 9 1 1 A 41 41 LYS CA C 175 59.701 59.094 0.607 1
1 508 . 9 1 1 A 41 41 LYS CB C 175 32.581 31.945 0.636 1
1 512 . 9 1 1 A 41 41 LYS N N 175 119.012 118.281 0.731 1
1 513 . 9 1 1 A 42 42 GLU H H 176 7.447 7.634 -0.187 1
1 514 . 9 1 1 A 42 42 GLU HA H 176 4.059 4.130 -0.071 1
1 519 . 9 1 1 A 42 42 GLU C C 176 180.058 178.860 1.198 1
1 520 . 9 1 1 A 42 42 GLU CA C 176 59.456 59.202 0.254 1
1 521 . 9 1 1 A 42 42 GLU CB C 176 29.923 29.367 0.556 1
1 523 . 9 1 1 A 42 42 GLU N N 176 120.054 119.537 0.517 1
1 524 . 9 1 1 A 43 43 VAL H H 177 8.618 7.944 0.674 1
1 525 . 9 1 1 A 43 43 VAL HA H 177 3.986 3.890 0.096 1
1 533 . 9 1 1 A 43 43 VAL C C 177 176.459 177.578 -1.119 1
1 534 . 9 1 1 A 43 43 VAL CA C 177 63.923 64.799 -0.876 1
1 535 . 9 1 1 A 43 43 VAL CB C 177 31.899 31.437 0.462 1
1 538 . 9 1 1 A 43 43 VAL N N 177 114.191 117.121 -2.930 1
1 539 . 9 1 1 A 44 44 SER H H 178 8.052 8.378 -0.326 1
1 540 . 9 1 1 A 44 44 SER HA H 178 4.098 4.237 -0.139 1
1 543 . 9 1 1 A 44 44 SER C C 178 176.548 175.917 0.631 1
1 544 . 9 1 1 A 44 44 SER CA C 178 61.160 61.074 0.086 1
1 545 . 9 1 1 A 44 44 SER CB C 178 62.959 62.640 0.319 1
1 546 . 9 1 1 A 44 44 SER N N 178 114.202 115.660 -1.458 1
1 547 . 9 1 1 A 45 45 LYS H H 179 7.083 7.679 -0.596 1
1 548 . 9 1 1 A 45 45 LYS HA H 179 4.140 4.197 -0.057 1
1 557 . 9 1 1 A 45 45 LYS C C 179 177.288 176.159 1.129 1
1 558 . 9 1 1 A 45 45 LYS CA C 179 58.469 57.948 0.521 1
1 559 . 9 1 1 A 45 45 LYS CB C 179 32.671 31.728 0.943 1
1 563 . 9 1 1 A 45 45 LYS N N 179 120.935 117.855 3.080 1
1 564 . 9 1 1 A 46 46 ASP H H 180 7.098 7.876 -0.778 1
1 565 . 9 1 1 A 46 46 ASP HA H 180 4.917 4.957 -0.040 1
1 568 . 9 1 1 A 46 46 ASP CA C 180 51.492 51.487 0.005 1
1 569 . 9 1 1 A 46 46 ASP CB C 180 40.595 41.593 -0.998 1
1 570 . 9 1 1 A 46 46 ASP N N 180 112.836 119.793 -6.957 1
1 571 . 9 1 1 A 47 47 PRO HA H 181 4.681 4.543 0.138 1
1 578 . 9 1 1 A 47 47 PRO C C 181 179.248 177.629 1.619 1
1 579 . 9 1 1 A 47 47 PRO CA C 181 64.718 64.248 0.470 1
1 580 . 9 1 1 A 47 47 PRO CB C 181 32.159 31.976 0.183 1
1 583 . 9 1 1 A 48 48 SER H H 182 8.248 8.028 0.220 1
1 584 . 9 1 1 A 48 48 SER HA H 182 4.378 4.362 0.016 1
1 587 . 9 1 1 A 48 48 SER C C 182 176.071 175.723 0.348 1
1 588 . 9 1 1 A 48 48 SER CA C 182 61.377 60.681 0.696 1
1 589 . 9 1 1 A 48 48 SER CB C 182 62.455 63.105 -0.650 1
1 590 . 9 1 1 A 48 48 SER N N 182 116.986 114.201 2.785 1
1 591 . 9 1 1 A 49 49 LYS H H 183 7.842 7.321 0.521 1
1 592 . 9 1 1 A 49 49 LYS HA H 183 4.482 4.312 0.170 1
1 601 . 9 1 1 A 49 49 LYS C C 183 175.605 177.732 -2.127 1
1 602 . 9 1 1 A 49 49 LYS CA C 183 55.824 57.142 -1.318 1
1 603 . 9 1 1 A 49 49 LYS CB C 183 32.834 32.377 0.457 1
1 607 . 9 1 1 A 49 49 LYS N N 183 121.698 119.817 1.881 1
1 608 . 9 1 1 A 50 50 PHE H H 184 7.634 7.681 -0.047 1
1 609 . 9 1 1 A 50 50 PHE HA H 184 3.510 4.267 -0.757 1
1 617 . 9 1 1 A 50 50 PHE C C 184 176.214 177.997 -1.783 1
1 618 . 9 1 1 A 50 50 PHE CA C 184 63.276 61.282 1.994 1
1 619 . 9 1 1 A 50 50 PHE CB C 184 40.948 39.107 1.841 1
1 623 . 9 1 1 A 50 50 PHE N N 184 120.120 121.706 -1.586 1
1 624 . 9 1 1 A 51 51 GLY H H 185 8.855 8.685 0.170 1
1 625 . 9 1 1 A 51 51 GLY HA2 H 185 3.993 3.948 0.045 1
1 626 . 9 1 1 A 51 51 GLY HA3 H 185 3.958 3.983 -0.025 1
1 627 . 9 1 1 A 51 51 GLY C C 185 175.169 175.851 -0.682 1
1 628 . 9 1 1 A 51 51 GLY CA C 185 47.475 46.591 0.884 1
1 629 . 9 1 1 A 51 51 GLY N N 185 105.550 105.692 -0.142 1
1 630 . 9 1 1 A 52 52 GLU H H 186 7.917 7.844 0.073 1
1 631 . 9 1 1 A 52 52 GLU HA H 186 4.006 4.173 -0.167 1
1 636 . 9 1 1 A 52 52 GLU C C 186 179.499 179.233 0.266 1
1 637 . 9 1 1 A 52 52 GLU CA C 186 58.904 59.209 -0.305 1
1 638 . 9 1 1 A 52 52 GLU CB C 186 29.700 30.072 -0.372 1
1 640 . 9 1 1 A 52 52 GLU N N 186 121.929 120.287 1.642 1
1 641 . 9 1 1 A 53 53 ILE H H 187 7.936 8.140 -0.204 1
1 642 . 9 1 1 A 53 53 ILE HA H 187 3.648 3.638 0.010 1
1 652 . 9 1 1 A 53 53 ILE C C 187 177.886 177.625 0.261 1
1 653 . 9 1 1 A 53 53 ILE CA C 187 64.366 65.198 -0.832 1
1 654 . 9 1 1 A 53 53 ILE CB C 187 36.478 37.711 -1.233 1
1 658 . 9 1 1 A 53 53 ILE N N 187 120.991 120.846 0.145 1
1 659 . 9 1 1 A 54 54 ALA H H 188 8.895 8.395 0.500 1
1 660 . 9 1 1 A 54 54 ALA HA H 188 3.629 3.795 -0.166 1
1 664 . 9 1 1 A 54 54 ALA C C 188 179.437 178.960 0.477 1
1 665 . 9 1 1 A 54 54 ALA CA C 188 55.974 55.450 0.524 1
1 666 . 9 1 1 A 54 54 ALA CB C 188 17.591 18.216 -0.625 1
1 667 . 9 1 1 A 54 54 ALA N N 188 125.308 122.151 3.157 1
1 668 . 9 1 1 A 55 55 LYS H H 189 8.049 7.834 0.215 1
1 669 . 9 1 1 A 55 55 LYS HA H 189 4.106 3.868 0.238 1
1 678 . 9 1 1 A 55 55 LYS C C 189 178.995 178.589 0.406 1
1 679 . 9 1 1 A 55 55 LYS CA C 189 59.312 59.290 0.022 1
1 680 . 9 1 1 A 55 55 LYS CB C 189 32.647 32.056 0.591 1
1 684 . 9 1 1 A 55 55 LYS N N 189 116.835 118.320 -1.485 1
1 685 . 9 1 1 A 56 56 LYS H H 190 7.215 7.726 -0.511 1
1 686 . 9 1 1 A 56 56 LYS HA H 190 4.172 4.252 -0.080 1
1 695 . 9 1 1 A 56 56 LYS C C 190 177.897 177.900 -0.003 1
1 696 . 9 1 1 A 56 56 LYS CA C 190 58.418 58.539 -0.121 1
1 697 . 9 1 1 A 56 56 LYS CB C 190 34.652 33.359 1.293 1
1 701 . 9 1 1 A 56 56 LYS N N 190 117.170 118.063 -0.893 1
1 702 . 9 1 1 A 57 57 GLU H H 191 8.572 7.960 0.612 1
1 703 . 9 1 1 A 57 57 GLU HA H 191 4.643 4.419 0.224 1
1 708 . 9 1 1 A 57 57 GLU C C 191 177.903 176.073 1.830 1
1 709 . 9 1 1 A 57 57 GLU CA C 191 55.708 55.919 -0.211 1
1 710 . 9 1 1 A 57 57 GLU CB C 191 32.460 31.223 1.237 1
1 712 . 9 1 1 A 57 57 GLU N N 191 113.316 116.640 -3.324 1
1 713 . 9 1 1 A 58 58 SER H H 192 8.550 7.647 0.903 1
1 714 . 9 1 1 A 58 58 SER HA H 192 4.149 4.364 -0.215 1
1 717 . 9 1 1 A 58 58 SER C C 192 176.161 175.090 1.071 1
1 718 . 9 1 1 A 58 58 SER CA C 192 58.403 58.247 0.156 1
1 719 . 9 1 1 A 58 58 SER CB C 192 64.392 64.318 0.074 1
1 720 . 9 1 1 A 58 58 SER N N 192 109.861 116.127 -6.266 1
1 721 . 9 1 1 A 59 59 MET H H 193 9.533 8.737 0.796 1
1 722 . 9 1 1 A 59 59 MET HA H 193 4.457 4.654 -0.197 1
1 730 . 9 1 1 A 59 59 MET C C 193 175.204 175.556 -0.352 1
1 731 . 9 1 1 A 59 59 MET CA C 193 55.781 54.648 1.133 1
1 732 . 9 1 1 A 59 59 MET CB C 193 32.855 32.343 0.512 1
1 735 . 9 1 1 A 59 59 MET N N 193 124.493 123.985 0.508 1
1 736 . 9 1 1 A 60 60 ASP H H 194 7.514 7.853 -0.339 1
1 737 . 9 1 1 A 60 60 ASP HA H 194 4.886 4.613 0.273 1
1 740 . 9 1 1 A 60 60 ASP C C 194 175.517 176.715 -1.198 1
1 741 . 9 1 1 A 60 60 ASP CA C 194 52.286 53.389 -1.103 1
1 742 . 9 1 1 A 60 60 ASP CB C 194 40.222 41.255 -1.033 1
1 743 . 9 1 1 A 60 60 ASP N N 194 117.785 122.266 -4.481 1
1 744 . 9 1 1 A 61 61 THR H H 195 8.118 8.479 -0.361 1
1 745 . 9 1 1 A 61 61 THR HA H 195 3.918 3.953 -0.035 1
1 750 . 9 1 1 A 61 61 THR C C 195 176.269 177.242 -0.973 1
1 751 . 9 1 1 A 61 61 THR CA C 195 65.469 65.350 0.119 1
1 752 . 9 1 1 A 61 61 THR CB C 195 68.741 68.359 0.382 1
1 754 . 9 1 1 A 61 61 THR N N 195 120.765 118.545 2.220 1
1 755 . 9 1 1 A 62 62 GLY H H 196 8.399 8.562 -0.163 1
1 756 . 9 1 1 A 62 62 GLY HA2 H 196 3.932 3.870 0.062 1
1 757 . 9 1 1 A 62 62 GLY HA3 H 196 3.900 3.872 0.028 1
1 758 . 9 1 1 A 62 62 GLY C C 196 174.948 176.779 -1.831 1
1 759 . 9 1 1 A 62 62 GLY CA C 196 46.768 47.286 -0.518 1
1 760 . 9 1 1 A 62 62 GLY N N 196 108.183 111.362 -3.179 1
1 761 . 9 1 1 A 63 63 SER H H 197 7.265 8.173 -0.908 1
1 762 . 9 1 1 A 63 63 SER HA H 197 4.554 4.451 0.103 1
1 765 . 9 1 1 A 63 63 SER C C 197 177.630 175.954 1.676 1
1 766 . 9 1 1 A 63 63 SER CA C 197 59.550 62.393 -2.843 1
1 767 . 9 1 1 A 63 63 SER CB C 197 65.504 63.639 1.865 1
1 768 . 9 1 1 A 63 63 SER N N 197 111.815 119.250 -7.435 1
1 769 . 9 1 1 A 64 64 ALA H H 198 8.675 8.423 0.252 1
1 770 . 9 1 1 A 64 64 ALA HA H 198 3.801 4.029 -0.228 1
1 774 . 9 1 1 A 64 64 ALA C C 198 178.492 179.844 -1.352 1
1 775 . 9 1 1 A 64 64 ALA CA C 198 56.794 55.511 1.283 1
1 776 . 9 1 1 A 64 64 ALA CB C 198 18.951 18.167 0.784 1
1 777 . 9 1 1 A 64 64 ALA N N 198 131.710 123.523 8.187 1
1 778 . 9 1 1 A 65 65 LYS H H 199 7.666 7.966 -0.300 1
1 779 . 9 1 1 A 65 65 LYS HA H 199 4.175 4.137 0.038 1
1 788 . 9 1 1 A 65 65 LYS C C 199 177.159 177.346 -0.187 1
1 789 . 9 1 1 A 65 65 LYS CA C 199 57.735 58.307 -0.572 1
1 790 . 9 1 1 A 65 65 LYS CB C 199 31.948 32.297 -0.349 1
1 794 . 9 1 1 A 65 65 LYS N N 199 111.375 117.877 -6.502 1
1 795 . 9 1 1 A 66 66 LYS H H 200 7.545 7.397 0.148 1
1 796 . 9 1 1 A 66 66 LYS HA H 200 4.612 4.485 0.127 1
1 805 . 9 1 1 A 66 66 LYS C C 200 175.609 175.789 -0.180 1
1 806 . 9 1 1 A 66 66 LYS CA C 200 54.468 55.887 -1.419 1
1 807 . 9 1 1 A 66 66 LYS CB C 200 31.525 32.943 -1.418 1
1 811 . 9 1 1 A 66 66 LYS N N 200 121.421 118.650 2.771 1
1 812 . 9 1 1 A 67 67 ASP H H 201 7.630 8.215 -0.585 1
1 813 . 9 1 1 A 67 67 ASP HA H 201 4.306 4.395 -0.089 1
1 816 . 9 1 1 A 67 67 ASP C C 201 175.025 176.284 -1.259 1
1 817 . 9 1 1 A 67 67 ASP CA C 201 56.400 55.383 1.017 1
1 818 . 9 1 1 A 67 67 ASP CB C 201 38.315 39.036 -0.721 1
1 819 . 9 1 1 A 67 67 ASP N N 201 116.216 117.277 -1.061 1
1 820 . 9 1 1 A 68 68 GLY H H 202 8.368 8.642 -0.274 1
1 821 . 9 1 1 A 68 68 GLY HA2 H 202 4.316 3.953 0.363 1
1 822 . 9 1 1 A 68 68 GLY HA3 H 202 3.731 4.052 -0.321 1
1 823 . 9 1 1 A 68 68 GLY C C 202 174.139 174.589 -0.450 1
1 824 . 9 1 1 A 68 68 GLY CA C 202 45.514 45.321 0.193 1
1 825 . 9 1 1 A 68 68 GLY N N 202 105.095 105.114 -0.019 1
1 826 . 9 1 1 A 69 69 GLU H H 203 7.534 8.115 -0.581 1
1 827 . 9 1 1 A 69 69 GLU HA H 203 4.479 4.413 0.066 1
1 832 . 9 1 1 A 69 69 GLU C C 203 176.961 176.118 0.843 1
1 833 . 9 1 1 A 69 69 GLU CA C 203 58.549 56.526 2.023 1
1 834 . 9 1 1 A 69 69 GLU CB C 203 30.998 30.623 0.375 1
1 836 . 9 1 1 A 69 69 GLU N N 203 120.426 120.050 0.376 1
1 837 . 9 1 1 A 70 70 LEU H H 204 8.962 9.087 -0.125 1
1 838 . 9 1 1 A 70 70 LEU HA H 204 4.438 4.670 -0.232 1
1 848 . 9 1 1 A 70 70 LEU C C 204 178.648 177.291 1.357 1
1 849 . 9 1 1 A 70 70 LEU CA C 204 53.977 54.557 -0.580 1
1 850 . 9 1 1 A 70 70 LEU CB C 204 43.612 43.688 -0.076 1
1 854 . 9 1 1 A 70 70 LEU N N 204 122.066 123.253 -1.187 1
1 855 . 9 1 1 A 71 71 GLY H H 205 8.104 7.582 0.522 1
1 856 . 9 1 1 A 71 71 GLY HA2 H 205 4.165 4.051 0.114 1
1 857 . 9 1 1 A 71 71 GLY HA3 H 205 3.552 4.134 -0.582 1
1 858 . 9 1 1 A 71 71 GLY C C 205 173.098 173.557 -0.459 1
1 859 . 9 1 1 A 71 71 GLY CA C 205 44.723 45.144 -0.421 1
1 860 . 9 1 1 A 71 71 GLY N N 205 110.168 106.906 3.262 1
1 861 . 9 1 1 A 72 72 TYR H H 206 8.457 8.682 -0.225 1
1 862 . 9 1 1 A 72 72 TYR HA H 206 4.184 4.614 -0.430 1
1 869 . 9 1 1 A 72 72 TYR C C 206 175.975 175.469 0.506 1
1 870 . 9 1 1 A 72 72 TYR CA C 206 59.722 58.794 0.928 1
1 871 . 9 1 1 A 72 72 TYR CB C 206 38.378 38.041 0.337 1
1 874 . 9 1 1 A 72 72 TYR N N 206 120.171 122.079 -1.908 1
1 875 . 9 1 1 A 73 73 VAL H H 207 8.782 9.029 -0.247 1
1 876 . 9 1 1 A 73 73 VAL HA H 207 4.056 4.439 -0.383 1
1 884 . 9 1 1 A 73 73 VAL C C 207 174.901 175.977 -1.076 1
1 885 . 9 1 1 A 73 73 VAL CA C 207 62.202 62.821 -0.619 1
1 886 . 9 1 1 A 73 73 VAL CB C 207 33.071 31.895 1.176 1
1 889 . 9 1 1 A 73 73 VAL N N 207 128.847 125.514 3.333 1
1 890 . 9 1 1 A 74 74 LEU H H 208 8.146 8.635 -0.489 1
1 891 . 9 1 1 A 74 74 LEU HA H 208 4.944 4.455 0.489 1
1 901 . 9 1 1 A 74 74 LEU C C 208 178.400 177.693 0.707 1
1 902 . 9 1 1 A 74 74 LEU CA C 208 53.520 55.241 -1.721 1
1 903 . 9 1 1 A 74 74 LEU CB C 208 43.499 42.166 1.333 1
1 907 . 9 1 1 A 74 74 LEU N N 208 127.599 129.353 -1.754 1
1 908 . 9 1 1 A 75 75 LYS H H 209 8.403 8.658 -0.255 1
1 909 . 9 1 1 A 75 75 LYS HA H 209 3.771 3.900 -0.129 1
1 918 . 9 1 1 A 75 75 LYS C C 209 177.536 177.457 0.079 1
1 919 . 9 1 1 A 75 75 LYS CA C 209 58.385 58.855 -0.470 1
1 920 . 9 1 1 A 75 75 LYS CB C 209 32.459 32.006 0.453 1
1 924 . 9 1 1 A 75 75 LYS N N 209 123.798 123.025 0.773 1
1 925 . 9 1 1 A 76 76 GLY H H 210 9.997 9.365 0.632 1
1 926 . 9 1 1 A 76 76 GLY HA2 H 210 4.255 4.006 0.249 1
1 927 . 9 1 1 A 76 76 GLY HA3 H 210 3.791 4.006 -0.215 1
1 928 . 9 1 1 A 76 76 GLY C C 210 175.091 175.717 -0.626 1
1 929 . 9 1 1 A 76 76 GLY CA C 210 45.465 45.426 0.039 1
1 930 . 9 1 1 A 76 76 GLY N N 210 114.705 112.929 1.776 1
1 931 . 9 1 1 A 77 77 GLN H H 211 7.726 7.884 -0.158 1
1 932 . 9 1 1 A 77 77 GLN HA H 211 4.373 4.204 0.169 1
1 939 . 9 1 1 A 77 77 GLN C C 211 176.301 175.918 0.383 1
1 940 . 9 1 1 A 77 77 GLN CA C 211 57.074 56.984 0.090 1
1 941 . 9 1 1 A 77 77 GLN CB C 211 30.798 29.380 1.418 1
1 943 . 9 1 1 A 77 77 GLN N N 211 118.702 117.924 0.778 1
1 945 . 9 1 1 A 78 78 THR H H 212 8.225 7.402 0.823 1
1 946 . 9 1 1 A 78 78 THR HA H 212 4.620 4.642 -0.022 1
1 951 . 9 1 1 A 78 78 THR C C 212 173.920 173.962 -0.042 1
1 952 . 9 1 1 A 78 78 THR CA C 212 60.087 59.066 1.021 1
1 953 . 9 1 1 A 78 78 THR CB C 212 71.412 70.950 0.462 1
1 955 . 9 1 1 A 78 78 THR N N 212 111.935 110.291 1.644 1
1 956 . 9 1 1 A 79 79 ASP H H 213 8.372 8.543 -0.171 1
1 957 . 9 1 1 A 79 79 ASP HA H 213 4.470 4.591 -0.121 1
1 960 . 9 1 1 A 79 79 ASP C C 213 176.759 177.884 -1.125 1
1 961 . 9 1 1 A 79 79 ASP CA C 213 54.927 54.402 0.525 1
1 962 . 9 1 1 A 79 79 ASP CB C 213 43.859 41.656 2.203 1
1 963 . 9 1 1 A 79 79 ASP N N 213 122.093 121.675 0.418 1
1 964 . 9 1 1 A 80 80 LYS H H 214 8.740 8.857 -0.117 1
1 965 . 9 1 1 A 80 80 LYS HA H 214 4.027 4.061 -0.034 1
1 974 . 9 1 1 A 80 80 LYS C C 214 178.493 178.336 0.157 1
1 975 . 9 1 1 A 80 80 LYS CA C 214 59.802 58.778 1.024 1
1 976 . 9 1 1 A 80 80 LYS CB C 214 32.374 32.005 0.369 1
1 980 . 9 1 1 A 80 80 LYS N N 214 124.685 122.147 2.538 1
1 981 . 9 1 1 A 81 81 ASP H H 215 8.556 8.057 0.499 1
1 982 . 9 1 1 A 81 81 ASP HA H 215 4.566 4.429 0.137 1
1 985 . 9 1 1 A 81 81 ASP C C 215 178.889 178.594 0.295 1
1 986 . 9 1 1 A 81 81 ASP CA C 215 58.046 57.114 0.932 1
1 987 . 9 1 1 A 81 81 ASP CB C 215 40.872 40.828 0.044 1
1 988 . 9 1 1 A 81 81 ASP N N 215 121.413 119.793 1.620 1
1 989 . 9 1 1 A 82 82 PHE H H 216 8.205 8.240 -0.035 1
1 990 . 9 1 1 A 82 82 PHE HA H 216 3.686 4.058 -0.372 1
1 998 . 9 1 1 A 82 82 PHE C C 216 175.919 177.342 -1.423 1
1 999 . 9 1 1 A 82 82 PHE CA C 216 61.648 60.785 0.863 1
1 1000 . 9 1 1 A 82 82 PHE CB C 216 39.743 39.159 0.584 1
1 1004 . 9 1 1 A 82 82 PHE N N 216 124.401 121.949 2.452 1
1 1005 . 9 1 1 A 83 83 GLU H H 217 8.887 8.912 -0.025 1
1 1006 . 9 1 1 A 83 83 GLU HA H 217 3.704 4.149 -0.445 1
1 1011 . 9 1 1 A 83 83 GLU C C 217 177.788 179.006 -1.218 1
1 1012 . 9 1 1 A 83 83 GLU CA C 217 60.545 60.309 0.236 1
1 1013 . 9 1 1 A 83 83 GLU CB C 217 30.639 29.598 1.041 1
1 1015 . 9 1 1 A 83 83 GLU N N 217 119.421 119.089 0.332 1
1 1016 . 9 1 1 A 84 84 LYS H H 218 8.055 7.639 0.416 1
1 1017 . 9 1 1 A 84 84 LYS HA H 218 3.947 4.137 -0.190 1
1 1026 . 9 1 1 A 84 84 LYS C C 218 178.783 178.667 0.116 1
1 1027 . 9 1 1 A 84 84 LYS CA C 218 59.327 58.843 0.484 1
1 1028 . 9 1 1 A 84 84 LYS CB C 218 32.539 32.270 0.269 1
1 1032 . 9 1 1 A 84 84 LYS N N 218 117.821 119.391 -1.570 1
1 1033 . 9 1 1 A 85 85 ALA H H 219 7.059 7.692 -0.633 1
1 1034 . 9 1 1 A 85 85 ALA HA H 219 4.040 4.053 -0.013 1
1 1038 . 9 1 1 A 85 85 ALA C C 219 179.794 180.042 -0.248 1
1 1039 . 9 1 1 A 85 85 ALA CA C 219 54.407 54.844 -0.437 1
1 1040 . 9 1 1 A 85 85 ALA CB C 219 20.130 18.258 1.872 1
1 1041 . 9 1 1 A 85 85 ALA N N 219 118.905 121.301 -2.396 1
1 1042 . 9 1 1 A 86 86 LEU H H 220 8.157 8.281 -0.124 1
1 1043 . 9 1 1 A 86 86 LEU HA H 220 3.692 3.964 -0.272 1
1 1053 . 9 1 1 A 86 86 LEU C C 220 178.330 178.577 -0.247 1
1 1054 . 9 1 1 A 86 86 LEU CA C 220 57.752 57.989 -0.237 1
1 1055 . 9 1 1 A 86 86 LEU CB C 220 41.464 41.936 -0.472 1
1 1059 . 9 1 1 A 86 86 LEU N N 220 118.606 120.252 -1.646 1
1 1060 . 9 1 1 A 87 87 PHE H H 221 8.349 8.237 0.112 1
1 1061 . 9 1 1 A 87 87 PHE HA H 221 3.861 4.463 -0.602 1
1 1069 . 9 1 1 A 87 87 PHE C C 221 176.176 177.806 -1.630 1
1 1070 . 9 1 1 A 87 87 PHE CA C 221 61.780 61.327 0.453 1
1 1071 . 9 1 1 A 87 87 PHE CB C 221 37.549 37.856 -0.307 1
1 1075 . 9 1 1 A 87 87 PHE N N 221 112.449 116.888 -4.439 1
1 1076 . 9 1 1 A 88 88 LYS H H 222 7.061 8.148 -1.087 1
1 1077 . 9 1 1 A 88 88 LYS HA H 222 4.380 4.107 0.273 1
1 1086 . 9 1 1 A 88 88 LYS C C 222 177.089 177.246 -0.157 1
1 1087 . 9 1 1 A 88 88 LYS CA C 222 56.726 58.520 -1.794 1
1 1088 . 9 1 1 A 88 88 LYS CB C 222 33.738 32.412 1.326 1
1 1092 . 9 1 1 A 88 88 LYS N N 222 118.308 121.120 -2.812 1
1 1093 . 9 1 1 A 89 89 LEU H H 223 7.270 7.377 -0.107 1
1 1094 . 9 1 1 A 89 89 LEU HA H 223 4.168 4.146 0.022 1
1 1104 . 9 1 1 A 89 89 LEU C C 223 177.528 176.884 0.644 1
1 1105 . 9 1 1 A 89 89 LEU CA C 223 55.279 55.047 0.232 1
1 1106 . 9 1 1 A 89 89 LEU CB C 223 43.240 42.260 0.980 1
1 1110 . 9 1 1 A 89 89 LEU N N 223 121.317 121.702 -0.385 1
1 1111 . 9 1 1 A 90 90 LYS H H 224 8.788 8.515 0.273 1
1 1112 . 9 1 1 A 90 90 LYS HA H 224 4.359 4.345 0.014 1
1 1121 . 9 1 1 A 90 90 LYS C C 224 175.839 175.555 0.284 1
1 1122 . 9 1 1 A 90 90 LYS CA C 224 54.772 55.625 -0.853 1
1 1123 . 9 1 1 A 90 90 LYS CB C 224 33.232 33.101 0.131 1
1 1127 . 9 1 1 A 90 90 LYS N N 224 123.558 122.842 0.716 1
1 1128 . 9 1 1 A 91 91 ASP H H 225 8.125 8.656 -0.531 1
1 1129 . 9 1 1 A 91 91 ASP HA H 225 3.958 4.355 -0.397 1
1 1132 . 9 1 1 A 91 91 ASP C C 225 177.452 176.560 0.892 1
1 1133 . 9 1 1 A 91 91 ASP CA C 225 56.642 55.520 1.122 1
1 1134 . 9 1 1 A 91 91 ASP CB C 225 40.269 40.175 0.094 1
1 1135 . 9 1 1 A 91 91 ASP N N 225 119.419 121.664 -2.245 1
1 1136 . 9 1 1 A 92 92 GLY H H 226 8.681 8.903 -0.222 1
1 1137 . 9 1 1 A 92 92 GLY HA2 H 226 4.131 3.885 0.246 1
1 1138 . 9 1 1 A 92 92 GLY HA3 H 226 3.579 3.910 -0.331 1
1 1139 . 9 1 1 A 92 92 GLY C C 226 173.614 174.174 -0.560 1
1 1140 . 9 1 1 A 92 92 GLY CA C 226 45.564 44.880 0.684 1
1 1141 . 9 1 1 A 92 92 GLY N N 226 113.802 112.129 1.673 1
1 1142 . 9 1 1 A 93 93 GLU H H 227 8.104 8.097 0.007 1
1 1143 . 9 1 1 A 93 93 GLU HA H 227 4.232 4.419 -0.187 1
1 1148 . 9 1 1 A 93 93 GLU C C 227 174.282 175.715 -1.433 1
1 1149 . 9 1 1 A 93 93 GLU CA C 227 56.651 56.186 0.465 1
1 1150 . 9 1 1 A 93 93 GLU CB C 227 32.190 31.017 1.173 1
1 1152 . 9 1 1 A 93 93 GLU N N 227 121.527 122.008 -0.481 1
1 1153 . 9 1 1 A 94 94 VAL H H 228 7.918 8.498 -0.580 1
1 1154 . 9 1 1 A 94 94 VAL HA H 228 4.857 4.704 0.153 1
1 1162 . 9 1 1 A 94 94 VAL C C 228 176.556 175.662 0.894 1
1 1163 . 9 1 1 A 94 94 VAL CA C 228 60.309 60.434 -0.125 1
1 1164 . 9 1 1 A 94 94 VAL CB C 228 33.847 35.121 -1.274 1
1 1167 . 9 1 1 A 94 94 VAL N N 228 119.768 125.988 -6.220 1
1 1168 . 9 1 1 A 95 95 SER H H 229 9.659 9.442 0.217 1
1 1169 . 9 1 1 A 95 95 SER HA H 229 4.313 4.691 -0.378 1
1 1172 . 9 1 1 A 95 95 SER C C 229 174.641 174.453 0.188 1
1 1173 . 9 1 1 A 95 95 SER CA C 229 59.208 57.857 1.351 1
1 1174 . 9 1 1 A 95 95 SER CB C 229 66.080 65.588 0.492 1
1 1175 . 9 1 1 A 95 95 SER N N 229 124.903 121.827 3.076 1
1 1176 . 9 1 1 A 96 96 GLU H H 230 8.014 8.647 -0.633 1
1 1177 . 9 1 1 A 96 96 GLU HA H 230 4.376 4.403 -0.027 1
1 1182 . 9 1 1 A 96 96 GLU C C 230 176.641 177.153 -0.512 1
1 1183 . 9 1 1 A 96 96 GLU CA C 230 56.236 56.689 -0.453 1
1 1184 . 9 1 1 A 96 96 GLU CB C 230 30.324 30.708 -0.384 1
1 1186 . 9 1 1 A 96 96 GLU N N 230 115.510 120.935 -5.425 1
1 1187 . 9 1 1 A 97 97 VAL H H 231 8.741 8.342 0.399 1
1 1188 . 9 1 1 A 97 97 VAL HA H 231 4.171 4.135 0.036 1
1 1196 . 9 1 1 A 97 97 VAL C C 231 176.684 175.716 0.968 1
1 1197 . 9 1 1 A 97 97 VAL CA C 231 65.418 63.251 2.167 1
1 1198 . 9 1 1 A 97 97 VAL CB C 231 31.218 31.456 -0.238 1
1 1201 . 9 1 1 A 97 97 VAL N N 231 121.289 121.587 -0.298 1
1 1202 . 9 1 1 A 98 98 VAL H H 232 9.218 9.411 -0.193 1
1 1203 . 9 1 1 A 98 98 VAL HA H 232 4.405 4.671 -0.266 1
1 1211 . 9 1 1 A 98 98 VAL C C 232 174.258 174.412 -0.154 1
1 1212 . 9 1 1 A 98 98 VAL CA C 232 60.937 61.158 -0.221 1
1 1213 . 9 1 1 A 98 98 VAL CB C 232 35.825 33.864 1.961 1
1 1216 . 9 1 1 A 98 98 VAL N N 232 130.544 128.828 1.716 1
1 1217 . 9 1 1 A 99 99 LYS H H 233 8.800 8.836 -0.036 1
1 1218 . 9 1 1 A 99 99 LYS HA H 233 4.853 5.179 -0.326 1
1 1227 . 9 1 1 A 99 99 LYS C C 233 175.274 175.406 -0.132 1
1 1228 . 9 1 1 A 99 99 LYS CA C 233 55.499 54.671 0.828 1
1 1229 . 9 1 1 A 99 99 LYS CB C 233 34.452 35.054 -0.602 1
1 1233 . 9 1 1 A 99 99 LYS N N 233 130.477 128.108 2.369 1
1 1234 . 9 1 1 A 100 100 SER H H 234 9.585 8.802 0.783 1
1 1235 . 9 1 1 A 100 100 SER HA H 234 5.150 4.968 0.182 1
1 1238 . 9 1 1 A 100 100 SER C C 234 175.493 174.639 0.854 1
1 1239 . 9 1 1 A 100 100 SER CA C 234 56.927 56.433 0.494 1
1 1240 . 9 1 1 A 100 100 SER CB C 234 67.309 66.725 0.584 1
1 1241 . 9 1 1 A 100 100 SER N N 234 125.814 119.959 5.855 1
1 1242 . 9 1 1 A 101 101 SER H H 235 8.631 8.884 -0.253 1
1 1243 . 9 1 1 A 101 101 SER HA H 235 4.106 4.072 0.034 1
1 1246 . 9 1 1 A 101 101 SER C C 235 175.385 175.079 0.306 1
1 1247 . 9 1 1 A 101 101 SER CA C 235 61.123 61.106 0.017 1
1 1248 . 9 1 1 A 101 101 SER CB C 235 62.818 62.700 0.118 1
1 1249 . 9 1 1 A 101 101 SER N N 235 115.089 116.232 -1.143 1
1 1250 . 9 1 1 A 102 102 PHE H H 236 8.957 7.200 1.757 1
1 1251 . 9 1 1 A 102 102 PHE HA H 236 4.610 4.617 -0.007 1
1 1259 . 9 1 1 A 102 102 PHE C C 236 176.453 175.761 0.692 1
1 1260 . 9 1 1 A 102 102 PHE CA C 236 58.382 58.058 0.324 1
1 1261 . 9 1 1 A 102 102 PHE CB C 236 40.275 39.715 0.560 1
1 1263 . 9 1 1 A 102 102 PHE N N 236 119.917 117.576 2.341 1
1 1264 . 9 1 1 A 103 103 GLY H H 237 7.377 7.099 0.278 1
1 1265 . 9 1 1 A 103 103 GLY HA2 H 237 4.453 4.012 0.441 1
1 1266 . 9 1 1 A 103 103 GLY HA3 H 237 3.472 4.154 -0.682 1
1 1267 . 9 1 1 A 103 103 GLY C C 237 169.627 171.929 -2.302 1
1 1268 . 9 1 1 A 103 103 GLY CA C 237 45.384 44.938 0.446 1
1 1269 . 9 1 1 A 103 103 GLY N N 237 108.809 106.011 2.798 1
1 1270 . 9 1 1 A 104 104 TYR H H 238 8.632 8.572 0.060 1
1 1271 . 9 1 1 A 104 104 TYR HA H 238 5.322 5.663 -0.341 1
1 1278 . 9 1 1 A 104 104 TYR C C 238 175.043 174.943 0.100 1
1 1279 . 9 1 1 A 104 104 TYR CA C 238 57.627 56.381 1.246 1
1 1280 . 9 1 1 A 104 104 TYR CB C 238 41.711 42.462 -0.751 1
1 1283 . 9 1 1 A 104 104 TYR N N 238 120.030 121.092 -1.062 1
1 1284 . 9 1 1 A 105 105 HIS H H 239 10.070 9.537 0.533 1
1 1285 . 9 1 1 A 105 105 HIS HA H 239 6.046 5.757 0.289 1
1 1290 . 9 1 1 A 105 105 HIS C C 239 175.734 174.748 0.986 1
1 1291 . 9 1 1 A 105 105 HIS CA C 239 53.945 54.245 -0.300 1
1 1292 . 9 1 1 A 105 105 HIS CB C 239 32.450 34.631 -2.181 1
1 1295 . 9 1 1 A 105 105 HIS N N 239 119.504 119.592 -0.088 1
1 1296 . 9 1 1 A 106 106 ILE H H 240 8.660 8.689 -0.029 1
1 1297 . 9 1 1 A 106 106 ILE HA H 240 4.120 4.890 -0.770 1
1 1307 . 9 1 1 A 106 106 ILE C C 240 174.758 175.453 -0.695 1
1 1308 . 9 1 1 A 106 106 ILE CA C 240 63.446 59.912 3.534 1
1 1309 . 9 1 1 A 106 106 ILE CB C 240 40.786 41.740 -0.954 1
1 1313 . 9 1 1 A 106 106 ILE N N 240 120.639 119.073 1.566 1
1 1314 . 9 1 1 A 107 107 ILE H H 241 9.033 9.077 -0.044 1
1 1315 . 9 1 1 A 107 107 ILE HA H 241 4.799 5.115 -0.316 1
1 1325 . 9 1 1 A 107 107 ILE C C 241 172.880 174.024 -1.144 1
1 1326 . 9 1 1 A 107 107 ILE CA C 241 60.563 59.586 0.977 1
1 1327 . 9 1 1 A 107 107 ILE CB C 241 41.652 40.593 1.059 1
1 1331 . 9 1 1 A 107 107 ILE N N 241 129.098 127.083 2.015 1
1 1332 . 9 1 1 A 108 108 LYS H H 242 8.692 9.075 -0.383 1
1 1333 . 9 1 1 A 108 108 LYS HA H 242 5.012 5.020 -0.008 1
1 1342 . 9 1 1 A 108 108 LYS C C 242 174.484 175.561 -1.077 1
1 1343 . 9 1 1 A 108 108 LYS CA C 242 54.317 54.045 0.272 1
1 1344 . 9 1 1 A 108 108 LYS CB C 242 35.619 35.644 -0.025 1
1 1348 . 9 1 1 A 108 108 LYS N N 242 127.179 127.794 -0.615 1
1 1349 . 9 1 1 A 109 109 ALA H H 243 7.816 9.024 -1.208 1
1 1350 . 9 1 1 A 109 109 ALA HA H 243 4.604 4.678 -0.074 1
1 1354 . 9 1 1 A 109 109 ALA C C 243 176.231 176.115 0.116 1
1 1355 . 9 1 1 A 109 109 ALA CA C 243 50.505 50.989 -0.484 1
1 1356 . 9 1 1 A 109 109 ALA CB C 243 19.584 20.133 -0.549 1
1 1357 . 9 1 1 A 109 109 ALA N N 243 129.619 128.023 1.596 1
1 1358 . 9 1 1 A 110 110 ASP H H 244 7.578 8.555 -0.977 1
1 1359 . 9 1 1 A 110 110 ASP HA H 244 4.424 5.128 -0.704 1
1 1362 . 9 1 1 A 110 110 ASP C C 244 175.259 175.179 0.080 1
1 1363 . 9 1 1 A 110 110 ASP CA C 244 54.489 52.433 2.056 1
1 1364 . 9 1 1 A 110 110 ASP CB C 244 42.693 44.447 -1.754 1
1 1365 . 9 1 1 A 110 110 ASP N N 244 125.434 121.902 3.532 1
1 4 . 10 1 1 A 2 2 PRO HA H -4 4.403 4.545 -0.142 1
1 11 . 10 1 1 A 2 2 PRO C C -4 176.990 176.414 0.576 1
1 12 . 10 1 1 A 2 2 PRO CA C -4 63.131 62.794 0.337 1
1 13 . 10 1 1 A 2 2 PRO CB C -4 32.342 32.073 0.269 1
1 16 . 10 1 1 A 3 3 LEU H H -3 8.483 8.351 0.132 1
1 17 . 10 1 1 A 3 3 LEU HA H -3 4.333 4.421 -0.088 1
1 27 . 10 1 1 A 3 3 LEU C C -3 177.991 177.445 0.546 1
1 28 . 10 1 1 A 3 3 LEU CA C -3 55.314 55.398 -0.084 1
1 29 . 10 1 1 A 3 3 LEU CB C -3 42.244 43.022 -0.778 1
1 33 . 10 1 1 A 3 3 LEU N N -3 122.986 122.707 0.279 1
1 34 . 10 1 1 A 4 4 GLY H H -2 8.397 8.612 -0.215 1
1 35 . 10 1 1 A 4 4 GLY HA2 H -2 4.024 3.998 0.026 1
1 36 . 10 1 1 A 4 4 GLY HA3 H -2 3.976 4.012 -0.036 1
1 37 . 10 1 1 A 4 4 GLY C C -2 174.360 174.894 -0.534 1
1 38 . 10 1 1 A 4 4 GLY CA C -2 45.434 45.029 0.405 1
1 39 . 10 1 1 A 4 4 GLY N N -2 110.666 110.471 0.195 1
1 56 . 10 1 1 A 7 7 SER H H 141 7.913 7.994 -0.081 1
1 57 . 10 1 1 A 7 7 SER HA H 141 5.657 5.269 0.388 1
1 60 . 10 1 1 A 7 7 SER C C 141 173.753 172.447 1.306 1
1 61 . 10 1 1 A 7 7 SER CA C 141 56.758 57.747 -0.989 1
1 62 . 10 1 1 A 7 7 SER CB C 141 66.774 65.536 1.238 1
1 63 . 10 1 1 A 7 7 SER N N 141 113.824 112.139 1.685 1
1 64 . 10 1 1 A 8 8 LYS H H 142 8.656 8.603 0.053 1
1 65 . 10 1 1 A 8 8 LYS HA H 142 4.543 5.098 -0.555 1
1 74 . 10 1 1 A 8 8 LYS C C 142 174.403 174.433 -0.030 1
1 75 . 10 1 1 A 8 8 LYS CA C 142 55.578 54.487 1.091 1
1 76 . 10 1 1 A 8 8 LYS CB C 142 36.561 36.139 0.422 1
1 80 . 10 1 1 A 8 8 LYS N N 142 123.076 119.847 3.229 1
1 81 . 10 1 1 A 9 9 LYS H H 143 8.623 8.255 0.368 1
1 82 . 10 1 1 A 9 9 LYS HA H 143 4.119 4.361 -0.242 1
1 91 . 10 1 1 A 9 9 LYS C C 143 176.144 175.558 0.586 1
1 92 . 10 1 1 A 9 9 LYS CA C 143 56.683 56.051 0.632 1
1 93 . 10 1 1 A 9 9 LYS CB C 143 32.580 32.571 0.009 1
1 97 . 10 1 1 A 9 9 LYS N N 143 129.542 122.731 6.811 1
1 98 . 10 1 1 A 10 10 ALA H H 144 8.151 8.625 -0.474 1
1 99 . 10 1 1 A 10 10 ALA HA H 144 5.208 4.952 0.256 1
1 103 . 10 1 1 A 10 10 ALA C C 144 175.577 174.976 0.601 1
1 104 . 10 1 1 A 10 10 ALA CA C 144 51.226 51.143 0.083 1
1 105 . 10 1 1 A 10 10 ALA CB C 144 25.299 24.345 0.954 1
1 106 . 10 1 1 A 10 10 ALA N N 144 127.933 127.896 0.037 1
1 107 . 10 1 1 A 11 11 SER H H 145 8.679 8.785 -0.106 1
1 108 . 10 1 1 A 11 11 SER HA H 145 5.431 5.763 -0.332 1
1 111 . 10 1 1 A 11 11 SER C C 145 173.072 173.147 -0.075 1
1 112 . 10 1 1 A 11 11 SER CA C 145 57.772 57.164 0.608 1
1 113 . 10 1 1 A 11 11 SER CB C 145 67.301 66.307 0.994 1
1 114 . 10 1 1 A 11 11 SER N N 145 116.245 115.483 0.762 1
1 115 . 10 1 1 A 12 12 HIS H H 146 9.962 9.434 0.528 1
1 116 . 10 1 1 A 12 12 HIS HA H 146 6.332 6.027 0.305 1
1 121 . 10 1 1 A 12 12 HIS C C 146 173.006 172.388 0.618 1
1 122 . 10 1 1 A 12 12 HIS CA C 146 55.020 54.308 0.712 1
1 123 . 10 1 1 A 12 12 HIS CB C 146 37.071 33.405 3.666 1
1 126 . 10 1 1 A 12 12 HIS N N 146 119.181 118.412 0.769 1
1 127 . 10 1 1 A 13 13 ILE H H 147 8.976 8.994 -0.018 1
1 128 . 10 1 1 A 13 13 ILE HA H 147 3.528 4.507 -0.979 1
1 138 . 10 1 1 A 13 13 ILE C C 147 173.010 173.766 -0.756 1
1 139 . 10 1 1 A 13 13 ILE CA C 147 61.273 59.587 1.686 1
1 140 . 10 1 1 A 13 13 ILE CB C 147 41.773 41.663 0.110 1
1 144 . 10 1 1 A 13 13 ILE N N 147 121.873 119.283 2.590 1
1 145 . 10 1 1 A 14 14 LEU H H 148 7.627 8.916 -1.289 1
1 146 . 10 1 1 A 14 14 LEU HA H 148 4.814 5.019 -0.205 1
1 156 . 10 1 1 A 14 14 LEU C C 148 174.112 174.353 -0.241 1
1 157 . 10 1 1 A 14 14 LEU CA C 148 52.574 52.912 -0.338 1
1 158 . 10 1 1 A 14 14 LEU CB C 148 45.643 45.054 0.589 1
1 162 . 10 1 1 A 14 14 LEU N N 148 127.112 129.741 -2.629 1
1 163 . 10 1 1 A 15 15 ILE H H 149 9.524 9.304 0.220 1
1 164 . 10 1 1 A 15 15 ILE HA H 149 4.362 4.683 -0.321 1
1 174 . 10 1 1 A 15 15 ILE C C 149 175.452 175.555 -0.103 1
1 175 . 10 1 1 A 15 15 ILE CA C 149 58.516 60.478 -1.962 1
1 176 . 10 1 1 A 15 15 ILE CB C 149 36.560 39.906 -3.346 1
1 180 . 10 1 1 A 15 15 ILE N N 149 128.652 126.848 1.804 1
1 181 . 10 1 1 A 16 16 LYS H H 150 8.035 8.399 -0.364 1
1 182 . 10 1 1 A 16 16 LYS HA H 150 4.319 4.386 -0.067 1
1 191 . 10 1 1 A 16 16 LYS C C 150 175.038 176.357 -1.319 1
1 192 . 10 1 1 A 16 16 LYS CA C 150 57.817 56.592 1.225 1
1 193 . 10 1 1 A 16 16 LYS CB C 150 34.853 32.567 2.286 1
1 197 . 10 1 1 A 16 16 LYS N N 150 129.153 128.115 1.038 1
1 198 . 10 1 1 A 17 17 VAL H H 151 8.016 8.551 -0.535 1
1 199 . 10 1 1 A 17 17 VAL HA H 151 4.873 4.606 0.267 1
1 207 . 10 1 1 A 17 17 VAL C C 151 176.647 175.606 1.041 1
1 208 . 10 1 1 A 17 17 VAL CA C 151 60.088 61.827 -1.739 1
1 209 . 10 1 1 A 17 17 VAL CB C 151 34.082 32.526 1.556 1
1 212 . 10 1 1 A 17 17 VAL N N 151 121.288 125.003 -3.715 1
1 213 . 10 1 1 A 18 18 LYS H H 152 8.443 9.021 -0.578 1
1 214 . 10 1 1 A 18 18 LYS HA H 152 4.334 4.671 -0.337 1
1 223 . 10 1 1 A 18 18 LYS C C 152 176.345 177.589 -1.244 1
1 224 . 10 1 1 A 18 18 LYS CA C 152 57.016 54.394 2.622 1
1 225 . 10 1 1 A 18 18 LYS CB C 152 33.222 35.053 -1.831 1
1 229 . 10 1 1 A 18 18 LYS N N 152 128.408 128.227 0.181 1
1 230 . 10 1 1 A 19 19 SER H H 153 9.067 8.807 0.260 1
1 231 . 10 1 1 A 19 19 SER HA H 153 4.457 4.309 0.148 1
1 234 . 10 1 1 A 19 19 SER C C 153 174.236 174.187 0.049 1
1 235 . 10 1 1 A 19 19 SER CA C 153 59.642 59.828 -0.186 1
1 236 . 10 1 1 A 19 19 SER CB C 153 64.347 63.577 0.770 1
1 237 . 10 1 1 A 19 19 SER N N 153 121.522 115.490 6.032 1
1 238 . 10 1 1 A 20 20 LYS H H 154 7.961 7.587 0.374 1
1 239 . 10 1 1 A 20 20 LYS HA H 154 4.558 4.673 -0.115 1
1 244 . 10 1 1 A 20 20 LYS C C 154 177.256 175.929 1.327 1
1 245 . 10 1 1 A 20 20 LYS CA C 154 55.249 55.485 -0.236 1
1 246 . 10 1 1 A 20 20 LYS CB C 154 34.531 35.846 -1.315 1
1 248 . 10 1 1 A 20 20 LYS N N 154 120.270 119.899 0.371 1
1 249 . 10 1 1 A 21 21 LYS HA H 155 4.003 4.001 0.002 1
1 258 . 10 1 1 A 21 21 LYS C C 155 177.015 178.041 -1.026 1
1 259 . 10 1 1 A 21 21 LYS CA C 155 59.091 58.622 0.469 1
1 260 . 10 1 1 A 21 21 LYS CB C 155 32.394 32.327 0.067 1
1 264 . 10 1 1 A 22 22 SER H H 156 7.625 7.854 -0.229 1
1 265 . 10 1 1 A 22 22 SER HA H 156 4.293 4.393 -0.100 1
1 268 . 10 1 1 A 22 22 SER C C 156 174.843 174.526 0.317 1
1 269 . 10 1 1 A 22 22 SER CA C 156 57.966 60.492 -2.526 1
1 270 . 10 1 1 A 22 22 SER CB C 156 63.369 63.412 -0.043 1
1 271 . 10 1 1 A 22 22 SER N N 156 109.549 113.410 -3.861 1
1 272 . 10 1 1 A 23 23 ASP H H 157 7.701 7.045 0.656 1
1 273 . 10 1 1 A 23 23 ASP HA H 157 4.548 4.553 -0.005 1
1 276 . 10 1 1 A 23 23 ASP C C 157 176.544 176.286 0.258 1
1 277 . 10 1 1 A 23 23 ASP CA C 157 55.242 54.118 1.124 1
1 278 . 10 1 1 A 23 23 ASP CB C 157 41.103 41.160 -0.057 1
1 279 . 10 1 1 A 23 23 ASP N N 157 124.536 120.773 3.763 1
1 280 . 10 1 1 A 24 24 LYS H H 158 8.583 9.061 -0.478 1
1 281 . 10 1 1 A 24 24 LYS HA H 158 4.252 4.133 0.119 1
1 290 . 10 1 1 A 24 24 LYS C C 158 176.813 177.381 -0.568 1
1 291 . 10 1 1 A 24 24 LYS CA C 158 57.148 58.869 -1.721 1
1 292 . 10 1 1 A 24 24 LYS CB C 158 33.200 32.307 0.893 1
1 296 . 10 1 1 A 24 24 LYS N N 158 122.372 124.015 -1.643 1
1 297 . 10 1 1 A 25 25 GLU H H 159 8.001 8.219 -0.218 1
1 298 . 10 1 1 A 25 25 GLU HA H 159 4.521 4.242 0.279 1
1 303 . 10 1 1 A 25 25 GLU C C 159 175.995 176.153 -0.158 1
1 304 . 10 1 1 A 25 25 GLU CA C 159 55.727 56.088 -0.361 1
1 305 . 10 1 1 A 25 25 GLU CB C 159 31.918 29.479 2.439 1
1 307 . 10 1 1 A 25 25 GLU N N 159 118.705 115.994 2.711 1
1 308 . 10 1 1 A 26 26 GLY H H 160 8.458 7.521 0.937 1
1 309 . 10 1 1 A 26 26 GLY HA2 H 160 3.946 4.055 -0.109 1
1 310 . 10 1 1 A 26 26 GLY HA3 H 160 3.511 4.062 -0.551 1
1 311 . 10 1 1 A 26 26 GLY C C 160 172.201 171.541 0.660 1
1 312 . 10 1 1 A 26 26 GLY CA C 160 44.038 46.074 -2.036 1
1 313 . 10 1 1 A 26 26 GLY N N 160 107.642 108.112 -0.470 1
1 314 . 10 1 1 A 27 27 LEU H H 161 8.259 8.140 0.119 1
1 315 . 10 1 1 A 27 27 LEU HA H 161 4.775 5.135 -0.360 1
1 325 . 10 1 1 A 27 27 LEU C C 161 177.422 175.274 2.148 1
1 326 . 10 1 1 A 27 27 LEU CA C 161 53.322 53.227 0.095 1
1 327 . 10 1 1 A 27 27 LEU CB C 161 45.576 45.773 -0.197 1
1 331 . 10 1 1 A 27 27 LEU N N 161 119.856 122.213 -2.357 1
1 332 . 10 1 1 A 28 28 ASP H H 162 8.848 8.671 0.177 1
1 333 . 10 1 1 A 28 28 ASP HA H 162 4.644 4.448 0.196 1
1 336 . 10 1 1 A 28 28 ASP C C 162 176.630 177.138 -0.508 1
1 337 . 10 1 1 A 28 28 ASP CA C 162 55.195 54.955 0.240 1
1 338 . 10 1 1 A 28 28 ASP CB C 162 41.673 42.709 -1.036 1
1 339 . 10 1 1 A 28 28 ASP N N 162 122.434 123.086 -0.652 1
1 340 . 10 1 1 A 29 29 ASP H H 163 8.720 9.104 -0.384 1
1 341 . 10 1 1 A 29 29 ASP HA H 163 4.386 4.392 -0.006 1
1 344 . 10 1 1 A 29 29 ASP C C 163 176.604 178.456 -1.852 1
1 345 . 10 1 1 A 29 29 ASP CA C 163 59.690 57.013 2.677 1
1 346 . 10 1 1 A 29 29 ASP CB C 163 42.964 39.947 3.017 1
1 347 . 10 1 1 A 29 29 ASP N N 163 121.460 125.264 -3.804 1
1 348 . 10 1 1 A 30 30 LYS H H 164 8.434 8.120 0.314 1
1 349 . 10 1 1 A 30 30 LYS HA H 164 3.901 4.161 -0.260 1
1 358 . 10 1 1 A 30 30 LYS C C 164 179.479 179.040 0.439 1
1 359 . 10 1 1 A 30 30 LYS CA C 164 60.047 59.097 0.950 1
1 360 . 10 1 1 A 30 30 LYS CB C 164 32.038 32.581 -0.543 1
1 364 . 10 1 1 A 30 30 LYS N N 164 116.627 118.834 -2.207 1
1 365 . 10 1 1 A 31 31 GLU H H 165 7.755 8.324 -0.569 1
1 366 . 10 1 1 A 31 31 GLU HA H 165 3.998 3.996 0.002 1
1 371 . 10 1 1 A 31 31 GLU C C 165 179.031 179.244 -0.213 1
1 372 . 10 1 1 A 31 31 GLU CA C 165 59.335 59.381 -0.046 1
1 373 . 10 1 1 A 31 31 GLU CB C 165 29.972 29.350 0.622 1
1 375 . 10 1 1 A 31 31 GLU N N 165 120.456 120.509 -0.053 1
1 376 . 10 1 1 A 32 32 ALA H H 166 9.060 8.561 0.499 1
1 377 . 10 1 1 A 32 32 ALA HA H 166 3.871 4.033 -0.162 1
1 381 . 10 1 1 A 32 32 ALA C C 166 178.029 179.052 -1.023 1
1 382 . 10 1 1 A 32 32 ALA CA C 166 54.997 55.490 -0.493 1
1 383 . 10 1 1 A 32 32 ALA CB C 166 19.727 18.380 1.347 1
1 384 . 10 1 1 A 32 32 ALA N N 166 124.406 122.276 2.130 1
1 385 . 10 1 1 A 33 33 LYS H H 167 8.228 7.759 0.469 1
1 386 . 10 1 1 A 33 33 LYS HA H 167 2.595 3.022 -0.427 1
1 395 . 10 1 1 A 33 33 LYS C C 167 177.938 178.084 -0.146 1
1 396 . 10 1 1 A 33 33 LYS CA C 167 59.573 59.384 0.189 1
1 397 . 10 1 1 A 33 33 LYS CB C 167 32.098 32.224 -0.126 1
1 401 . 10 1 1 A 33 33 LYS N N 167 119.833 118.336 1.497 1
1 402 . 10 1 1 A 34 34 GLN H H 168 7.392 7.729 -0.337 1
1 403 . 10 1 1 A 34 34 GLN HA H 168 3.943 3.912 0.031 1
1 410 . 10 1 1 A 34 34 GLN C C 168 178.323 178.429 -0.106 1
1 411 . 10 1 1 A 34 34 GLN CA C 168 58.883 59.261 -0.378 1
1 412 . 10 1 1 A 34 34 GLN CB C 168 28.485 28.096 0.389 1
1 414 . 10 1 1 A 34 34 GLN N N 168 117.208 117.858 -0.650 1
1 416 . 10 1 1 A 35 35 LYS H H 169 7.994 7.980 0.014 1
1 417 . 10 1 1 A 35 35 LYS HA H 169 4.067 4.005 0.062 1
1 426 . 10 1 1 A 35 35 LYS C C 169 178.161 178.646 -0.485 1
1 427 . 10 1 1 A 35 35 LYS CA C 169 58.437 59.029 -0.592 1
1 428 . 10 1 1 A 35 35 LYS CB C 169 31.611 32.178 -0.567 1
1 432 . 10 1 1 A 35 35 LYS N N 169 120.898 119.707 1.191 1
1 433 . 10 1 1 A 36 36 ALA H H 170 8.431 8.253 0.178 1
1 434 . 10 1 1 A 36 36 ALA HA H 170 3.738 4.046 -0.308 1
1 438 . 10 1 1 A 36 36 ALA C C 170 178.862 179.743 -0.881 1
1 439 . 10 1 1 A 36 36 ALA CA C 170 55.351 55.126 0.225 1
1 440 . 10 1 1 A 36 36 ALA CB C 170 18.295 18.312 -0.017 1
1 441 . 10 1 1 A 36 36 ALA N N 170 120.641 121.106 -0.465 1
1 442 . 10 1 1 A 37 37 GLU H H 171 8.412 7.985 0.427 1
1 443 . 10 1 1 A 37 37 GLU HA H 171 3.867 3.978 -0.111 1
1 448 . 10 1 1 A 37 37 GLU C C 171 179.255 179.238 0.017 1
1 449 . 10 1 1 A 37 37 GLU CA C 171 59.543 59.453 0.090 1
1 450 . 10 1 1 A 37 37 GLU CB C 171 29.569 29.173 0.396 1
1 452 . 10 1 1 A 37 37 GLU N N 171 118.224 117.611 0.613 1
1 453 . 10 1 1 A 38 38 GLU H H 172 8.019 8.253 -0.234 1
1 454 . 10 1 1 A 38 38 GLU HA H 172 3.952 4.026 -0.074 1
1 459 . 10 1 1 A 38 38 GLU C C 172 180.250 179.020 1.230 1
1 460 . 10 1 1 A 38 38 GLU CA C 172 59.627 59.056 0.571 1
1 461 . 10 1 1 A 38 38 GLU CB C 172 29.368 29.401 -0.033 1
1 463 . 10 1 1 A 38 38 GLU N N 172 121.250 119.967 1.283 1
1 464 . 10 1 1 A 39 39 ILE H H 173 8.174 7.474 0.700 1
1 465 . 10 1 1 A 39 39 ILE HA H 173 3.643 3.811 -0.168 1
1 475 . 10 1 1 A 39 39 ILE C C 173 177.568 178.099 -0.531 1
1 476 . 10 1 1 A 39 39 ILE CA C 173 64.869 64.016 0.853 1
1 477 . 10 1 1 A 39 39 ILE CB C 173 38.160 37.425 0.735 1
1 481 . 10 1 1 A 39 39 ILE N N 173 121.527 117.579 3.948 1
1 482 . 10 1 1 A 40 40 GLN H H 174 8.860 8.251 0.609 1
1 483 . 10 1 1 A 40 40 GLN HA H 174 3.533 3.959 -0.426 1
1 490 . 10 1 1 A 40 40 GLN C C 174 179.022 178.252 0.770 1
1 491 . 10 1 1 A 40 40 GLN CA C 174 61.316 59.230 2.086 1
1 492 . 10 1 1 A 40 40 GLN CB C 174 26.604 28.186 -1.582 1
1 494 . 10 1 1 A 40 40 GLN N N 174 121.956 121.109 0.847 1
1 496 . 10 1 1 A 41 41 LYS H H 175 7.879 7.820 0.059 1
1 497 . 10 1 1 A 41 41 LYS HA H 175 3.777 4.197 -0.420 1
1 506 . 10 1 1 A 41 41 LYS C C 175 178.779 178.601 0.178 1
1 507 . 10 1 1 A 41 41 LYS CA C 175 59.701 58.549 1.152 1
1 508 . 10 1 1 A 41 41 LYS CB C 175 32.581 31.509 1.072 1
1 512 . 10 1 1 A 41 41 LYS N N 175 119.012 118.184 0.828 1
1 513 . 10 1 1 A 42 42 GLU H H 176 7.447 7.865 -0.418 1
1 514 . 10 1 1 A 42 42 GLU HA H 176 4.059 4.155 -0.096 1
1 519 . 10 1 1 A 42 42 GLU C C 176 180.058 178.972 1.086 1
1 520 . 10 1 1 A 42 42 GLU CA C 176 59.456 58.878 0.578 1
1 521 . 10 1 1 A 42 42 GLU CB C 176 29.923 30.055 -0.132 1
1 523 . 10 1 1 A 42 42 GLU N N 176 120.054 118.865 1.189 1
1 524 . 10 1 1 A 43 43 VAL H H 177 8.618 7.918 0.700 1
1 525 . 10 1 1 A 43 43 VAL HA H 177 3.986 4.000 -0.014 1
1 533 . 10 1 1 A 43 43 VAL C C 177 176.459 177.544 -1.085 1
1 534 . 10 1 1 A 43 43 VAL CA C 177 63.923 64.760 -0.837 1
1 535 . 10 1 1 A 43 43 VAL CB C 177 31.899 31.385 0.514 1
1 538 . 10 1 1 A 43 43 VAL N N 177 114.191 116.967 -2.776 1
1 539 . 10 1 1 A 44 44 SER H H 178 8.052 7.907 0.145 1
1 540 . 10 1 1 A 44 44 SER HA H 178 4.098 4.231 -0.133 1
1 543 . 10 1 1 A 44 44 SER C C 178 176.548 176.066 0.482 1
1 544 . 10 1 1 A 44 44 SER CA C 178 61.160 61.497 -0.337 1
1 545 . 10 1 1 A 44 44 SER CB C 178 62.959 62.563 0.396 1
1 546 . 10 1 1 A 44 44 SER N N 178 114.202 116.426 -2.224 1
1 547 . 10 1 1 A 45 45 LYS H H 179 7.083 8.334 -1.251 1
1 548 . 10 1 1 A 45 45 LYS HA H 179 4.140 4.179 -0.039 1
1 557 . 10 1 1 A 45 45 LYS C C 179 177.288 176.544 0.744 1
1 558 . 10 1 1 A 45 45 LYS CA C 179 58.469 58.107 0.362 1
1 559 . 10 1 1 A 45 45 LYS CB C 179 32.671 31.695 0.976 1
1 563 . 10 1 1 A 45 45 LYS N N 179 120.935 118.196 2.739 1
1 564 . 10 1 1 A 46 46 ASP H H 180 7.098 7.851 -0.753 1
1 565 . 10 1 1 A 46 46 ASP HA H 180 4.917 5.136 -0.219 1
1 568 . 10 1 1 A 46 46 ASP CA C 180 51.492 51.322 0.170 1
1 569 . 10 1 1 A 46 46 ASP CB C 180 40.595 41.241 -0.646 1
1 570 . 10 1 1 A 46 46 ASP N N 180 112.836 120.407 -7.571 1
1 571 . 10 1 1 A 47 47 PRO HA H 181 4.681 4.418 0.263 1
1 578 . 10 1 1 A 47 47 PRO C C 181 179.248 178.110 1.138 1
1 579 . 10 1 1 A 47 47 PRO CA C 181 64.718 64.889 -0.171 1
1 580 . 10 1 1 A 47 47 PRO CB C 181 32.159 32.003 0.156 1
1 583 . 10 1 1 A 48 48 SER H H 182 8.248 8.320 -0.072 1
1 584 . 10 1 1 A 48 48 SER HA H 182 4.378 4.285 0.093 1
1 587 . 10 1 1 A 48 48 SER C C 182 176.071 175.442 0.629 1
1 588 . 10 1 1 A 48 48 SER CA C 182 61.377 60.819 0.558 1
1 589 . 10 1 1 A 48 48 SER CB C 182 62.455 63.179 -0.724 1
1 590 . 10 1 1 A 48 48 SER N N 182 116.986 113.060 3.926 1
1 591 . 10 1 1 A 49 49 LYS H H 183 7.842 7.558 0.284 1
1 592 . 10 1 1 A 49 49 LYS HA H 183 4.482 4.304 0.178 1
1 601 . 10 1 1 A 49 49 LYS C C 183 175.605 177.716 -2.111 1
1 602 . 10 1 1 A 49 49 LYS CA C 183 55.824 56.815 -0.991 1
1 603 . 10 1 1 A 49 49 LYS CB C 183 32.834 32.919 -0.085 1
1 607 . 10 1 1 A 49 49 LYS N N 183 121.698 120.032 1.666 1
1 608 . 10 1 1 A 50 50 PHE H H 184 7.634 7.683 -0.049 1
1 609 . 10 1 1 A 50 50 PHE HA H 184 3.510 4.212 -0.702 1
1 617 . 10 1 1 A 50 50 PHE C C 184 176.214 177.498 -1.284 1
1 618 . 10 1 1 A 50 50 PHE CA C 184 63.276 61.098 2.178 1
1 619 . 10 1 1 A 50 50 PHE CB C 184 40.948 39.047 1.901 1
1 623 . 10 1 1 A 50 50 PHE N N 184 120.120 121.550 -1.430 1
1 624 . 10 1 1 A 51 51 GLY H H 185 8.855 8.570 0.285 1
1 625 . 10 1 1 A 51 51 GLY HA2 H 185 3.993 3.869 0.124 1
1 626 . 10 1 1 A 51 51 GLY HA3 H 185 3.958 3.909 0.049 1
1 627 . 10 1 1 A 51 51 GLY C C 185 175.169 176.247 -1.078 1
1 628 . 10 1 1 A 51 51 GLY CA C 185 47.475 47.510 -0.035 1
1 629 . 10 1 1 A 51 51 GLY N N 185 105.550 106.138 -0.588 1
1 630 . 10 1 1 A 52 52 GLU H H 186 7.917 8.000 -0.083 1
1 631 . 10 1 1 A 52 52 GLU HA H 186 4.006 4.052 -0.046 1
1 636 . 10 1 1 A 52 52 GLU C C 186 179.499 179.564 -0.065 1
1 637 . 10 1 1 A 52 52 GLU CA C 186 58.904 59.223 -0.319 1
1 638 . 10 1 1 A 52 52 GLU CB C 186 29.700 29.422 0.278 1
1 640 . 10 1 1 A 52 52 GLU N N 186 121.929 121.711 0.218 1
1 641 . 10 1 1 A 53 53 ILE H H 187 7.936 8.087 -0.151 1
1 642 . 10 1 1 A 53 53 ILE HA H 187 3.648 3.709 -0.061 1
1 652 . 10 1 1 A 53 53 ILE C C 187 177.886 177.740 0.146 1
1 653 . 10 1 1 A 53 53 ILE CA C 187 64.366 65.020 -0.654 1
1 654 . 10 1 1 A 53 53 ILE CB C 187 36.478 37.432 -0.954 1
1 658 . 10 1 1 A 53 53 ILE N N 187 120.991 121.864 -0.873 1
1 659 . 10 1 1 A 54 54 ALA H H 188 8.895 8.605 0.290 1
1 660 . 10 1 1 A 54 54 ALA HA H 188 3.629 3.790 -0.161 1
1 664 . 10 1 1 A 54 54 ALA C C 188 179.437 179.073 0.364 1
1 665 . 10 1 1 A 54 54 ALA CA C 188 55.974 55.658 0.316 1
1 666 . 10 1 1 A 54 54 ALA CB C 188 17.591 18.769 -1.178 1
1 667 . 10 1 1 A 54 54 ALA N N 188 125.308 122.276 3.032 1
1 668 . 10 1 1 A 55 55 LYS H H 189 8.049 7.699 0.350 1
1 669 . 10 1 1 A 55 55 LYS HA H 189 4.106 3.879 0.227 1
1 678 . 10 1 1 A 55 55 LYS C C 189 178.995 178.123 0.872 1
1 679 . 10 1 1 A 55 55 LYS CA C 189 59.312 59.281 0.031 1
1 680 . 10 1 1 A 55 55 LYS CB C 189 32.647 32.068 0.579 1
1 684 . 10 1 1 A 55 55 LYS N N 189 116.835 118.460 -1.625 1
1 685 . 10 1 1 A 56 56 LYS H H 190 7.215 7.767 -0.552 1
1 686 . 10 1 1 A 56 56 LYS HA H 190 4.172 4.285 -0.113 1
1 695 . 10 1 1 A 56 56 LYS C C 190 177.897 177.899 -0.002 1
1 696 . 10 1 1 A 56 56 LYS CA C 190 58.418 57.946 0.472 1
1 697 . 10 1 1 A 56 56 LYS CB C 190 34.652 33.416 1.236 1
1 701 . 10 1 1 A 56 56 LYS N N 190 117.170 117.919 -0.749 1
1 702 . 10 1 1 A 57 57 GLU H H 191 8.572 7.907 0.665 1
1 703 . 10 1 1 A 57 57 GLU HA H 191 4.643 4.414 0.229 1
1 708 . 10 1 1 A 57 57 GLU C C 191 177.903 176.004 1.899 1
1 709 . 10 1 1 A 57 57 GLU CA C 191 55.708 55.893 -0.185 1
1 710 . 10 1 1 A 57 57 GLU CB C 191 32.460 31.117 1.343 1
1 712 . 10 1 1 A 57 57 GLU N N 191 113.316 116.748 -3.432 1
1 713 . 10 1 1 A 58 58 SER H H 192 8.550 7.707 0.843 1
1 714 . 10 1 1 A 58 58 SER HA H 192 4.149 4.411 -0.262 1
1 717 . 10 1 1 A 58 58 SER C C 192 176.161 175.198 0.963 1
1 718 . 10 1 1 A 58 58 SER CA C 192 58.403 58.025 0.378 1
1 719 . 10 1 1 A 58 58 SER CB C 192 64.392 64.206 0.186 1
1 720 . 10 1 1 A 58 58 SER N N 192 109.861 116.104 -6.243 1
1 721 . 10 1 1 A 59 59 MET H H 193 9.533 8.962 0.571 1
1 722 . 10 1 1 A 59 59 MET HA H 193 4.457 4.681 -0.224 1
1 730 . 10 1 1 A 59 59 MET C C 193 175.204 175.893 -0.689 1
1 731 . 10 1 1 A 59 59 MET CA C 193 55.781 54.552 1.229 1
1 732 . 10 1 1 A 59 59 MET CB C 193 32.855 32.374 0.481 1
1 735 . 10 1 1 A 59 59 MET N N 193 124.493 123.893 0.600 1
1 736 . 10 1 1 A 60 60 ASP H H 194 7.514 7.469 0.045 1
1 737 . 10 1 1 A 60 60 ASP HA H 194 4.886 4.572 0.314 1
1 740 . 10 1 1 A 60 60 ASP C C 194 175.517 176.893 -1.376 1
1 741 . 10 1 1 A 60 60 ASP CA C 194 52.286 53.066 -0.780 1
1 742 . 10 1 1 A 60 60 ASP CB C 194 40.222 39.865 0.357 1
1 743 . 10 1 1 A 60 60 ASP N N 194 117.785 122.368 -4.583 1
1 744 . 10 1 1 A 61 61 THR H H 195 8.118 7.796 0.322 1
1 745 . 10 1 1 A 61 61 THR HA H 195 3.918 4.007 -0.089 1
1 750 . 10 1 1 A 61 61 THR C C 195 176.269 176.239 0.030 1
1 751 . 10 1 1 A 61 61 THR CA C 195 65.469 64.906 0.563 1
1 752 . 10 1 1 A 61 61 THR CB C 195 68.741 68.571 0.170 1
1 754 . 10 1 1 A 61 61 THR N N 195 120.765 118.578 2.187 1
1 755 . 10 1 1 A 62 62 GLY H H 196 8.399 8.519 -0.120 1
1 756 . 10 1 1 A 62 62 GLY HA2 H 196 3.932 3.952 -0.020 1
1 757 . 10 1 1 A 62 62 GLY HA3 H 196 3.900 3.953 -0.053 1
1 758 . 10 1 1 A 62 62 GLY C C 196 174.948 174.961 -0.013 1
1 759 . 10 1 1 A 62 62 GLY CA C 196 46.768 46.194 0.574 1
1 760 . 10 1 1 A 62 62 GLY N N 196 108.183 111.764 -3.581 1
1 761 . 10 1 1 A 63 63 SER H H 197 7.265 7.896 -0.631 1
1 762 . 10 1 1 A 63 63 SER HA H 197 4.554 4.742 -0.188 1
1 765 . 10 1 1 A 63 63 SER C C 197 177.630 175.876 1.754 1
1 766 . 10 1 1 A 63 63 SER CA C 197 59.550 59.485 0.065 1
1 767 . 10 1 1 A 63 63 SER CB C 197 65.504 64.510 0.994 1
1 768 . 10 1 1 A 63 63 SER N N 197 111.815 116.640 -4.825 1
1 769 . 10 1 1 A 64 64 ALA H H 198 8.675 8.551 0.124 1
1 770 . 10 1 1 A 64 64 ALA HA H 198 3.801 3.944 -0.143 1
1 774 . 10 1 1 A 64 64 ALA C C 198 178.492 179.880 -1.388 1
1 775 . 10 1 1 A 64 64 ALA CA C 198 56.794 55.440 1.354 1
1 776 . 10 1 1 A 64 64 ALA CB C 198 18.951 18.708 0.243 1
1 777 . 10 1 1 A 64 64 ALA N N 198 131.710 123.782 7.928 1
1 778 . 10 1 1 A 65 65 LYS H H 199 7.666 7.980 -0.314 1
1 779 . 10 1 1 A 65 65 LYS HA H 199 4.175 4.159 0.016 1
1 788 . 10 1 1 A 65 65 LYS C C 199 177.159 177.197 -0.038 1
1 789 . 10 1 1 A 65 65 LYS CA C 199 57.735 58.341 -0.606 1
1 790 . 10 1 1 A 65 65 LYS CB C 199 31.948 32.226 -0.278 1
1 794 . 10 1 1 A 65 65 LYS N N 199 111.375 117.624 -6.249 1
1 795 . 10 1 1 A 66 66 LYS H H 200 7.545 7.629 -0.084 1
1 796 . 10 1 1 A 66 66 LYS HA H 200 4.612 4.496 0.116 1
1 805 . 10 1 1 A 66 66 LYS C C 200 175.609 175.863 -0.254 1
1 806 . 10 1 1 A 66 66 LYS CA C 200 54.468 55.621 -1.153 1
1 807 . 10 1 1 A 66 66 LYS CB C 200 31.525 32.811 -1.286 1
1 811 . 10 1 1 A 66 66 LYS N N 200 121.421 118.749 2.672 1
1 812 . 10 1 1 A 67 67 ASP H H 201 7.630 8.187 -0.557 1
1 813 . 10 1 1 A 67 67 ASP HA H 201 4.306 4.364 -0.058 1
1 816 . 10 1 1 A 67 67 ASP C C 201 175.025 176.219 -1.194 1
1 817 . 10 1 1 A 67 67 ASP CA C 201 56.400 55.323 1.077 1
1 818 . 10 1 1 A 67 67 ASP CB C 201 38.315 39.064 -0.749 1
1 819 . 10 1 1 A 67 67 ASP N N 201 116.216 117.119 -0.903 1
1 820 . 10 1 1 A 68 68 GLY H H 202 8.368 8.710 -0.342 1
1 821 . 10 1 1 A 68 68 GLY HA2 H 202 4.316 3.909 0.407 1
1 822 . 10 1 1 A 68 68 GLY HA3 H 202 3.731 3.953 -0.222 1
1 823 . 10 1 1 A 68 68 GLY C C 202 174.139 174.655 -0.516 1
1 824 . 10 1 1 A 68 68 GLY CA C 202 45.514 45.382 0.132 1
1 825 . 10 1 1 A 68 68 GLY N N 202 105.095 105.286 -0.191 1
1 826 . 10 1 1 A 69 69 GLU H H 203 7.534 8.032 -0.498 1
1 827 . 10 1 1 A 69 69 GLU HA H 203 4.479 4.449 0.030 1
1 832 . 10 1 1 A 69 69 GLU C C 203 176.961 176.296 0.665 1
1 833 . 10 1 1 A 69 69 GLU CA C 203 58.549 56.327 2.222 1
1 834 . 10 1 1 A 69 69 GLU CB C 203 30.998 30.216 0.782 1
1 836 . 10 1 1 A 69 69 GLU N N 203 120.426 120.397 0.029 1
1 837 . 10 1 1 A 70 70 LEU H H 204 8.962 9.189 -0.227 1
1 838 . 10 1 1 A 70 70 LEU HA H 204 4.438 4.555 -0.117 1
1 848 . 10 1 1 A 70 70 LEU C C 204 178.648 177.122 1.526 1
1 849 . 10 1 1 A 70 70 LEU CA C 204 53.977 55.344 -1.367 1
1 850 . 10 1 1 A 70 70 LEU CB C 204 43.612 43.451 0.161 1
1 854 . 10 1 1 A 70 70 LEU N N 204 122.066 124.079 -2.013 1
1 855 . 10 1 1 A 71 71 GLY H H 205 8.104 7.498 0.606 1
1 856 . 10 1 1 A 71 71 GLY HA2 H 205 4.165 4.063 0.102 1
1 857 . 10 1 1 A 71 71 GLY HA3 H 205 3.552 4.137 -0.585 1
1 858 . 10 1 1 A 71 71 GLY C C 205 173.098 173.486 -0.388 1
1 859 . 10 1 1 A 71 71 GLY CA C 205 44.723 45.089 -0.366 1
1 860 . 10 1 1 A 71 71 GLY N N 205 110.168 106.665 3.503 1
1 861 . 10 1 1 A 72 72 TYR H H 206 8.457 8.671 -0.214 1
1 862 . 10 1 1 A 72 72 TYR HA H 206 4.184 4.854 -0.670 1
1 869 . 10 1 1 A 72 72 TYR C C 206 175.975 175.469 0.506 1
1 870 . 10 1 1 A 72 72 TYR CA C 206 59.722 59.140 0.582 1
1 871 . 10 1 1 A 72 72 TYR CB C 206 38.378 38.529 -0.151 1
1 874 . 10 1 1 A 72 72 TYR N N 206 120.171 122.127 -1.956 1
1 875 . 10 1 1 A 73 73 VAL H H 207 8.782 9.137 -0.355 1
1 876 . 10 1 1 A 73 73 VAL HA H 207 4.056 4.546 -0.490 1
1 884 . 10 1 1 A 73 73 VAL C C 207 174.901 175.580 -0.679 1
1 885 . 10 1 1 A 73 73 VAL CA C 207 62.202 62.135 0.067 1
1 886 . 10 1 1 A 73 73 VAL CB C 207 33.071 32.610 0.461 1
1 889 . 10 1 1 A 73 73 VAL N N 207 128.847 124.518 4.329 1
1 890 . 10 1 1 A 74 74 LEU H H 208 8.146 8.939 -0.793 1
1 891 . 10 1 1 A 74 74 LEU HA H 208 4.944 4.879 0.065 1
1 901 . 10 1 1 A 74 74 LEU C C 208 178.400 177.534 0.866 1
1 902 . 10 1 1 A 74 74 LEU CA C 208 53.520 53.767 -0.247 1
1 903 . 10 1 1 A 74 74 LEU CB C 208 43.499 42.820 0.679 1
1 907 . 10 1 1 A 74 74 LEU N N 208 127.599 129.356 -1.757 1
1 908 . 10 1 1 A 75 75 LYS H H 209 8.403 8.339 0.064 1
1 909 . 10 1 1 A 75 75 LYS HA H 209 3.771 3.778 -0.007 1
1 918 . 10 1 1 A 75 75 LYS C C 209 177.536 177.378 0.158 1
1 919 . 10 1 1 A 75 75 LYS CA C 209 58.385 58.922 -0.537 1
1 920 . 10 1 1 A 75 75 LYS CB C 209 32.459 32.000 0.459 1
1 924 . 10 1 1 A 75 75 LYS N N 209 123.798 122.692 1.106 1
1 925 . 10 1 1 A 76 76 GLY H H 210 9.997 9.403 0.594 1
1 926 . 10 1 1 A 76 76 GLY HA2 H 210 4.255 4.004 0.251 1
1 927 . 10 1 1 A 76 76 GLY HA3 H 210 3.791 4.007 -0.216 1
1 928 . 10 1 1 A 76 76 GLY C C 210 175.091 175.694 -0.603 1
1 929 . 10 1 1 A 76 76 GLY CA C 210 45.465 45.464 0.001 1
1 930 . 10 1 1 A 76 76 GLY N N 210 114.705 113.127 1.578 1
1 931 . 10 1 1 A 77 77 GLN H H 211 7.726 7.975 -0.249 1
1 932 . 10 1 1 A 77 77 GLN HA H 211 4.373 4.215 0.158 1
1 939 . 10 1 1 A 77 77 GLN C C 211 176.301 175.873 0.428 1
1 940 . 10 1 1 A 77 77 GLN CA C 211 57.074 57.110 -0.036 1
1 941 . 10 1 1 A 77 77 GLN CB C 211 30.798 29.332 1.466 1
1 943 . 10 1 1 A 77 77 GLN N N 211 118.702 117.956 0.746 1
1 945 . 10 1 1 A 78 78 THR H H 212 8.225 7.480 0.745 1
1 946 . 10 1 1 A 78 78 THR HA H 212 4.620 4.676 -0.056 1
1 951 . 10 1 1 A 78 78 THR C C 212 173.920 174.274 -0.354 1
1 952 . 10 1 1 A 78 78 THR CA C 212 60.087 59.496 0.591 1
1 953 . 10 1 1 A 78 78 THR CB C 212 71.412 71.028 0.384 1
1 955 . 10 1 1 A 78 78 THR N N 212 111.935 110.681 1.254 1
1 956 . 10 1 1 A 79 79 ASP H H 213 8.372 8.548 -0.176 1
1 957 . 10 1 1 A 79 79 ASP HA H 213 4.470 4.577 -0.107 1
1 960 . 10 1 1 A 79 79 ASP C C 213 176.759 177.470 -0.711 1
1 961 . 10 1 1 A 79 79 ASP CA C 213 54.927 54.349 0.578 1
1 962 . 10 1 1 A 79 79 ASP CB C 213 43.859 41.592 2.267 1
1 963 . 10 1 1 A 79 79 ASP N N 213 122.093 121.409 0.684 1
1 964 . 10 1 1 A 80 80 LYS H H 214 8.740 8.873 -0.133 1
1 965 . 10 1 1 A 80 80 LYS HA H 214 4.027 3.933 0.094 1
1 974 . 10 1 1 A 80 80 LYS C C 214 178.493 178.101 0.392 1
1 975 . 10 1 1 A 80 80 LYS CA C 214 59.802 60.144 -0.342 1
1 976 . 10 1 1 A 80 80 LYS CB C 214 32.374 32.002 0.372 1
1 980 . 10 1 1 A 80 80 LYS N N 214 124.685 123.572 1.113 1
1 981 . 10 1 1 A 81 81 ASP H H 215 8.556 8.311 0.245 1
1 982 . 10 1 1 A 81 81 ASP HA H 215 4.566 4.393 0.173 1
1 985 . 10 1 1 A 81 81 ASP C C 215 178.889 178.674 0.215 1
1 986 . 10 1 1 A 81 81 ASP CA C 215 58.046 57.299 0.747 1
1 987 . 10 1 1 A 81 81 ASP CB C 215 40.872 40.371 0.501 1
1 988 . 10 1 1 A 81 81 ASP N N 215 121.413 119.454 1.959 1
1 989 . 10 1 1 A 82 82 PHE H H 216 8.205 8.357 -0.152 1
1 990 . 10 1 1 A 82 82 PHE HA H 216 3.686 4.078 -0.392 1
1 998 . 10 1 1 A 82 82 PHE C C 216 175.919 177.373 -1.454 1
1 999 . 10 1 1 A 82 82 PHE CA C 216 61.648 60.873 0.775 1
1 1000 . 10 1 1 A 82 82 PHE CB C 216 39.743 39.199 0.544 1
1 1004 . 10 1 1 A 82 82 PHE N N 216 124.401 122.970 1.431 1
1 1005 . 10 1 1 A 83 83 GLU H H 217 8.887 8.920 -0.033 1
1 1006 . 10 1 1 A 83 83 GLU HA H 217 3.704 4.204 -0.500 1
1 1011 . 10 1 1 A 83 83 GLU C C 217 177.788 179.045 -1.257 1
1 1012 . 10 1 1 A 83 83 GLU CA C 217 60.545 60.248 0.297 1
1 1013 . 10 1 1 A 83 83 GLU CB C 217 30.639 29.422 1.217 1
1 1015 . 10 1 1 A 83 83 GLU N N 217 119.421 118.939 0.482 1
1 1016 . 10 1 1 A 84 84 LYS H H 218 8.055 7.887 0.168 1
1 1017 . 10 1 1 A 84 84 LYS HA H 218 3.947 4.134 -0.187 1
1 1026 . 10 1 1 A 84 84 LYS C C 218 178.783 178.565 0.218 1
1 1027 . 10 1 1 A 84 84 LYS CA C 218 59.327 58.515 0.812 1
1 1028 . 10 1 1 A 84 84 LYS CB C 218 32.539 32.123 0.416 1
1 1032 . 10 1 1 A 84 84 LYS N N 218 117.821 119.549 -1.728 1
1 1033 . 10 1 1 A 85 85 ALA H H 219 7.059 7.642 -0.583 1
1 1034 . 10 1 1 A 85 85 ALA HA H 219 4.040 4.058 -0.018 1
1 1038 . 10 1 1 A 85 85 ALA C C 219 179.794 179.810 -0.016 1
1 1039 . 10 1 1 A 85 85 ALA CA C 219 54.407 54.781 -0.374 1
1 1040 . 10 1 1 A 85 85 ALA CB C 219 20.130 18.206 1.924 1
1 1041 . 10 1 1 A 85 85 ALA N N 219 118.905 121.788 -2.883 1
1 1042 . 10 1 1 A 86 86 LEU H H 220 8.157 8.250 -0.093 1
1 1043 . 10 1 1 A 86 86 LEU HA H 220 3.692 3.962 -0.270 1
1 1053 . 10 1 1 A 86 86 LEU C C 220 178.330 178.442 -0.112 1
1 1054 . 10 1 1 A 86 86 LEU CA C 220 57.752 57.843 -0.091 1
1 1055 . 10 1 1 A 86 86 LEU CB C 220 41.464 41.996 -0.532 1
1 1059 . 10 1 1 A 86 86 LEU N N 220 118.606 120.079 -1.473 1
1 1060 . 10 1 1 A 87 87 PHE H H 221 8.349 8.294 0.055 1
1 1061 . 10 1 1 A 87 87 PHE HA H 221 3.861 4.379 -0.518 1
1 1069 . 10 1 1 A 87 87 PHE C C 221 176.176 178.026 -1.850 1
1 1070 . 10 1 1 A 87 87 PHE CA C 221 61.780 61.864 -0.084 1
1 1071 . 10 1 1 A 87 87 PHE CB C 221 37.549 37.952 -0.403 1
1 1075 . 10 1 1 A 87 87 PHE N N 221 112.449 116.936 -4.487 1
1 1076 . 10 1 1 A 88 88 LYS H H 222 7.061 8.273 -1.212 1
1 1077 . 10 1 1 A 88 88 LYS HA H 222 4.380 4.107 0.273 1
1 1086 . 10 1 1 A 88 88 LYS C C 222 177.089 177.348 -0.259 1
1 1087 . 10 1 1 A 88 88 LYS CA C 222 56.726 58.537 -1.811 1
1 1088 . 10 1 1 A 88 88 LYS CB C 222 33.738 32.270 1.468 1
1 1092 . 10 1 1 A 88 88 LYS N N 222 118.308 120.879 -2.571 1
1 1093 . 10 1 1 A 89 89 LEU H H 223 7.270 7.301 -0.031 1
1 1094 . 10 1 1 A 89 89 LEU HA H 223 4.168 4.100 0.068 1
1 1104 . 10 1 1 A 89 89 LEU C C 223 177.528 177.038 0.490 1
1 1105 . 10 1 1 A 89 89 LEU CA C 223 55.279 55.350 -0.071 1
1 1106 . 10 1 1 A 89 89 LEU CB C 223 43.240 42.279 0.961 1
1 1110 . 10 1 1 A 89 89 LEU N N 223 121.317 122.079 -0.762 1
1 1111 . 10 1 1 A 90 90 LYS H H 224 8.788 8.490 0.298 1
1 1112 . 10 1 1 A 90 90 LYS HA H 224 4.359 4.359 0.000 1
1 1121 . 10 1 1 A 90 90 LYS C C 224 175.839 175.253 0.586 1
1 1122 . 10 1 1 A 90 90 LYS CA C 224 54.772 55.865 -1.093 1
1 1123 . 10 1 1 A 90 90 LYS CB C 224 33.232 33.194 0.038 1
1 1127 . 10 1 1 A 90 90 LYS N N 224 123.558 122.775 0.783 1
1 1128 . 10 1 1 A 91 91 ASP H H 225 8.125 8.632 -0.507 1
1 1129 . 10 1 1 A 91 91 ASP HA H 225 3.958 4.384 -0.426 1
1 1132 . 10 1 1 A 91 91 ASP C C 225 177.452 176.602 0.850 1
1 1133 . 10 1 1 A 91 91 ASP CA C 225 56.642 55.533 1.109 1
1 1134 . 10 1 1 A 91 91 ASP CB C 225 40.269 40.169 0.100 1
1 1135 . 10 1 1 A 91 91 ASP N N 225 119.419 121.121 -1.702 1
1 1136 . 10 1 1 A 92 92 GLY H H 226 8.681 8.691 -0.010 1
1 1137 . 10 1 1 A 92 92 GLY HA2 H 226 4.131 3.882 0.249 1
1 1138 . 10 1 1 A 92 92 GLY HA3 H 226 3.579 3.908 -0.329 1
1 1139 . 10 1 1 A 92 92 GLY C C 226 173.614 173.985 -0.371 1
1 1140 . 10 1 1 A 92 92 GLY CA C 226 45.564 45.051 0.513 1
1 1141 . 10 1 1 A 92 92 GLY N N 226 113.802 112.026 1.776 1
1 1142 . 10 1 1 A 93 93 GLU H H 227 8.104 7.943 0.161 1
1 1143 . 10 1 1 A 93 93 GLU HA H 227 4.232 4.366 -0.134 1
1 1148 . 10 1 1 A 93 93 GLU C C 227 174.282 175.979 -1.697 1
1 1149 . 10 1 1 A 93 93 GLU CA C 227 56.651 56.240 0.411 1
1 1150 . 10 1 1 A 93 93 GLU CB C 227 32.190 31.153 1.037 1
1 1152 . 10 1 1 A 93 93 GLU N N 227 121.527 121.931 -0.404 1
1 1153 . 10 1 1 A 94 94 VAL H H 228 7.918 8.620 -0.702 1
1 1154 . 10 1 1 A 94 94 VAL HA H 228 4.857 4.872 -0.015 1
1 1162 . 10 1 1 A 94 94 VAL C C 228 176.556 175.439 1.117 1
1 1163 . 10 1 1 A 94 94 VAL CA C 228 60.309 59.509 0.800 1
1 1164 . 10 1 1 A 94 94 VAL CB C 228 33.847 34.960 -1.113 1
1 1167 . 10 1 1 A 94 94 VAL N N 228 119.768 120.015 -0.247 1
1 1168 . 10 1 1 A 95 95 SER H H 229 9.659 9.119 0.540 1
1 1169 . 10 1 1 A 95 95 SER HA H 229 4.313 4.716 -0.403 1
1 1172 . 10 1 1 A 95 95 SER C C 229 174.641 174.502 0.139 1
1 1173 . 10 1 1 A 95 95 SER CA C 229 59.208 57.636 1.572 1
1 1174 . 10 1 1 A 95 95 SER CB C 229 66.080 65.731 0.349 1
1 1175 . 10 1 1 A 95 95 SER N N 229 124.903 116.207 8.696 1
1 1176 . 10 1 1 A 96 96 GLU H H 230 8.014 8.623 -0.609 1
1 1177 . 10 1 1 A 96 96 GLU HA H 230 4.376 4.416 -0.040 1
1 1182 . 10 1 1 A 96 96 GLU C C 230 176.641 177.194 -0.553 1
1 1183 . 10 1 1 A 96 96 GLU CA C 230 56.236 56.512 -0.276 1
1 1184 . 10 1 1 A 96 96 GLU CB C 230 30.324 30.755 -0.431 1
1 1186 . 10 1 1 A 96 96 GLU N N 230 115.510 121.024 -5.514 1
1 1187 . 10 1 1 A 97 97 VAL H H 231 8.741 7.913 0.828 1
1 1188 . 10 1 1 A 97 97 VAL HA H 231 4.171 4.147 0.024 1
1 1196 . 10 1 1 A 97 97 VAL C C 231 176.684 175.801 0.883 1
1 1197 . 10 1 1 A 97 97 VAL CA C 231 65.418 63.236 2.182 1
1 1198 . 10 1 1 A 97 97 VAL CB C 231 31.218 31.489 -0.271 1
1 1201 . 10 1 1 A 97 97 VAL N N 231 121.289 121.566 -0.277 1
1 1202 . 10 1 1 A 98 98 VAL H H 232 9.218 9.529 -0.311 1
1 1203 . 10 1 1 A 98 98 VAL HA H 232 4.405 4.708 -0.303 1
1 1211 . 10 1 1 A 98 98 VAL C C 232 174.258 174.435 -0.177 1
1 1212 . 10 1 1 A 98 98 VAL CA C 232 60.937 61.278 -0.341 1
1 1213 . 10 1 1 A 98 98 VAL CB C 232 35.825 33.831 1.994 1
1 1216 . 10 1 1 A 98 98 VAL N N 232 130.544 128.841 1.703 1
1 1217 . 10 1 1 A 99 99 LYS H H 233 8.800 8.771 0.029 1
1 1218 . 10 1 1 A 99 99 LYS HA H 233 4.853 5.296 -0.443 1
1 1227 . 10 1 1 A 99 99 LYS C C 233 175.274 175.111 0.163 1
1 1228 . 10 1 1 A 99 99 LYS CA C 233 55.499 54.760 0.739 1
1 1229 . 10 1 1 A 99 99 LYS CB C 233 34.452 35.482 -1.030 1
1 1233 . 10 1 1 A 99 99 LYS N N 233 130.477 127.782 2.695 1
1 1234 . 10 1 1 A 100 100 SER H H 234 9.585 9.070 0.515 1
1 1235 . 10 1 1 A 100 100 SER HA H 234 5.150 4.946 0.204 1
1 1238 . 10 1 1 A 100 100 SER C C 234 175.493 174.102 1.391 1
1 1239 . 10 1 1 A 100 100 SER CA C 234 56.927 57.372 -0.445 1
1 1240 . 10 1 1 A 100 100 SER CB C 234 67.309 67.388 -0.079 1
1 1241 . 10 1 1 A 100 100 SER N N 234 125.814 122.805 3.009 1
1 1242 . 10 1 1 A 101 101 SER H H 235 8.631 8.934 -0.303 1
1 1243 . 10 1 1 A 101 101 SER HA H 235 4.106 4.087 0.019 1
1 1246 . 10 1 1 A 101 101 SER C C 235 175.385 175.532 -0.147 1
1 1247 . 10 1 1 A 101 101 SER CA C 235 61.123 61.561 -0.438 1
1 1248 . 10 1 1 A 101 101 SER CB C 235 62.818 62.522 0.296 1
1 1249 . 10 1 1 A 101 101 SER N N 235 115.089 117.230 -2.141 1
1 1250 . 10 1 1 A 102 102 PHE H H 236 8.957 7.734 1.223 1
1 1251 . 10 1 1 A 102 102 PHE HA H 236 4.610 4.626 -0.016 1
1 1259 . 10 1 1 A 102 102 PHE C C 236 176.453 175.716 0.737 1
1 1260 . 10 1 1 A 102 102 PHE CA C 236 58.382 58.145 0.237 1
1 1261 . 10 1 1 A 102 102 PHE CB C 236 40.275 39.681 0.594 1
1 1263 . 10 1 1 A 102 102 PHE N N 236 119.917 117.689 2.228 1
1 1264 . 10 1 1 A 103 103 GLY H H 237 7.377 7.367 0.010 1
1 1265 . 10 1 1 A 103 103 GLY HA2 H 237 4.453 3.961 0.492 1
1 1266 . 10 1 1 A 103 103 GLY HA3 H 237 3.472 4.105 -0.633 1
1 1267 . 10 1 1 A 103 103 GLY C C 237 169.627 172.440 -2.813 1
1 1268 . 10 1 1 A 103 103 GLY CA C 237 45.384 44.170 1.214 1
1 1269 . 10 1 1 A 103 103 GLY N N 237 108.809 106.551 2.258 1
1 1270 . 10 1 1 A 104 104 TYR H H 238 8.632 8.270 0.362 1
1 1271 . 10 1 1 A 104 104 TYR HA H 238 5.322 5.308 0.014 1
1 1278 . 10 1 1 A 104 104 TYR C C 238 175.043 174.887 0.156 1
1 1279 . 10 1 1 A 104 104 TYR CA C 238 57.627 58.107 -0.480 1
1 1280 . 10 1 1 A 104 104 TYR CB C 238 41.711 41.246 0.465 1
1 1283 . 10 1 1 A 104 104 TYR N N 238 120.030 121.839 -1.809 1
1 1284 . 10 1 1 A 105 105 HIS H H 239 10.070 9.541 0.529 1
1 1285 . 10 1 1 A 105 105 HIS HA H 239 6.046 5.637 0.409 1
1 1290 . 10 1 1 A 105 105 HIS C C 239 175.734 174.841 0.893 1
1 1291 . 10 1 1 A 105 105 HIS CA C 239 53.945 54.366 -0.421 1
1 1292 . 10 1 1 A 105 105 HIS CB C 239 32.450 34.503 -2.053 1
1 1295 . 10 1 1 A 105 105 HIS N N 239 119.504 118.936 0.568 1
1 1296 . 10 1 1 A 106 106 ILE H H 240 8.660 8.903 -0.243 1
1 1297 . 10 1 1 A 106 106 ILE HA H 240 4.120 4.896 -0.776 1
1 1307 . 10 1 1 A 106 106 ILE C C 240 174.758 175.387 -0.629 1
1 1308 . 10 1 1 A 106 106 ILE CA C 240 63.446 59.958 3.488 1
1 1309 . 10 1 1 A 106 106 ILE CB C 240 40.786 41.850 -1.064 1
1 1313 . 10 1 1 A 106 106 ILE N N 240 120.639 120.125 0.514 1
1 1314 . 10 1 1 A 107 107 ILE H H 241 9.033 9.210 -0.177 1
1 1315 . 10 1 1 A 107 107 ILE HA H 241 4.799 5.158 -0.359 1
1 1325 . 10 1 1 A 107 107 ILE C C 241 172.880 174.412 -1.532 1
1 1326 . 10 1 1 A 107 107 ILE CA C 241 60.563 59.610 0.953 1
1 1327 . 10 1 1 A 107 107 ILE CB C 241 41.652 40.828 0.824 1
1 1331 . 10 1 1 A 107 107 ILE N N 241 129.098 126.945 2.153 1
1 1332 . 10 1 1 A 108 108 LYS H H 242 8.692 8.934 -0.242 1
1 1333 . 10 1 1 A 108 108 LYS HA H 242 5.012 4.989 0.023 1
1 1342 . 10 1 1 A 108 108 LYS C C 242 174.484 175.201 -0.717 1
1 1343 . 10 1 1 A 108 108 LYS CA C 242 54.317 54.041 0.276 1
1 1344 . 10 1 1 A 108 108 LYS CB C 242 35.619 35.400 0.219 1
1 1348 . 10 1 1 A 108 108 LYS N N 242 127.179 125.914 1.265 1
1 1349 . 10 1 1 A 109 109 ALA H H 243 7.816 9.033 -1.217 1
1 1350 . 10 1 1 A 109 109 ALA HA H 243 4.604 4.759 -0.155 1
1 1354 . 10 1 1 A 109 109 ALA C C 243 176.231 175.945 0.286 1
1 1355 . 10 1 1 A 109 109 ALA CA C 243 50.505 50.832 -0.327 1
1 1356 . 10 1 1 A 109 109 ALA CB C 243 19.584 20.256 -0.672 1
1 1357 . 10 1 1 A 109 109 ALA N N 243 129.619 127.845 1.774 1
1 1358 . 10 1 1 A 110 110 ASP H H 244 7.578 8.625 -1.047 1
1 1359 . 10 1 1 A 110 110 ASP HA H 244 4.424 5.210 -0.786 1
1 1362 . 10 1 1 A 110 110 ASP C C 244 175.259 175.060 0.199 1
1 1363 . 10 1 1 A 110 110 ASP CA C 244 54.489 52.525 1.964 1
1 1364 . 10 1 1 A 110 110 ASP CB C 244 42.693 43.994 -1.301 1
1 1365 . 10 1 1 A 110 110 ASP N N 244 125.434 121.949 3.485 1
1 4 . 11 1 1 A 2 2 PRO HA H -4 4.403 4.609 -0.206 1
1 11 . 11 1 1 A 2 2 PRO C C -4 176.990 175.233 1.757 1
1 12 . 11 1 1 A 2 2 PRO CA C -4 63.131 62.974 0.157 1
1 13 . 11 1 1 A 2 2 PRO CB C -4 32.342 33.103 -0.761 1
1 16 . 11 1 1 A 3 3 LEU H H -3 8.483 8.690 -0.207 1
1 17 . 11 1 1 A 3 3 LEU HA H -3 4.333 4.715 -0.382 1
1 27 . 11 1 1 A 3 3 LEU C C -3 177.991 174.743 3.248 1
1 28 . 11 1 1 A 3 3 LEU CA C -3 55.314 54.204 1.110 1
1 29 . 11 1 1 A 3 3 LEU CB C -3 42.244 46.060 -3.816 1
1 33 . 11 1 1 A 3 3 LEU N N -3 122.986 122.730 0.256 1
1 34 . 11 1 1 A 4 4 GLY H H -2 8.397 9.246 -0.849 1
1 35 . 11 1 1 A 4 4 GLY HA2 H -2 4.024 4.215 -0.191 1
1 36 . 11 1 1 A 4 4 GLY HA3 H -2 3.976 4.361 -0.385 1
1 37 . 11 1 1 A 4 4 GLY C C -2 174.360 173.839 0.521 1
1 38 . 11 1 1 A 4 4 GLY CA C -2 45.434 45.159 0.275 1
1 39 . 11 1 1 A 4 4 GLY N N -2 110.666 114.902 -4.236 1
1 56 . 11 1 1 A 7 7 SER H H 141 7.913 7.891 0.022 1
1 57 . 11 1 1 A 7 7 SER HA H 141 5.657 5.461 0.196 1
1 60 . 11 1 1 A 7 7 SER C C 141 173.753 172.224 1.529 1
1 61 . 11 1 1 A 7 7 SER CA C 141 56.758 57.706 -0.948 1
1 62 . 11 1 1 A 7 7 SER CB C 141 66.774 65.930 0.844 1
1 63 . 11 1 1 A 7 7 SER N N 141 113.824 112.539 1.285 1
1 64 . 11 1 1 A 8 8 LYS H H 142 8.656 8.264 0.392 1
1 65 . 11 1 1 A 8 8 LYS HA H 142 4.543 4.995 -0.452 1
1 74 . 11 1 1 A 8 8 LYS C C 142 174.403 174.816 -0.413 1
1 75 . 11 1 1 A 8 8 LYS CA C 142 55.578 54.245 1.333 1
1 76 . 11 1 1 A 8 8 LYS CB C 142 36.561 35.844 0.717 1
1 80 . 11 1 1 A 8 8 LYS N N 142 123.076 120.128 2.948 1
1 81 . 11 1 1 A 9 9 LYS H H 143 8.623 8.577 0.046 1
1 82 . 11 1 1 A 9 9 LYS HA H 143 4.119 4.573 -0.454 1
1 91 . 11 1 1 A 9 9 LYS C C 143 176.144 175.642 0.502 1
1 92 . 11 1 1 A 9 9 LYS CA C 143 56.683 56.153 0.530 1
1 93 . 11 1 1 A 9 9 LYS CB C 143 32.580 32.777 -0.197 1
1 97 . 11 1 1 A 9 9 LYS N N 143 129.542 123.163 6.379 1
1 98 . 11 1 1 A 10 10 ALA H H 144 8.151 8.801 -0.650 1
1 99 . 11 1 1 A 10 10 ALA HA H 144 5.208 4.935 0.273 1
1 103 . 11 1 1 A 10 10 ALA C C 144 175.577 175.011 0.566 1
1 104 . 11 1 1 A 10 10 ALA CA C 144 51.226 51.233 -0.007 1
1 105 . 11 1 1 A 10 10 ALA CB C 144 25.299 24.189 1.110 1
1 106 . 11 1 1 A 10 10 ALA N N 144 127.933 127.469 0.464 1
1 107 . 11 1 1 A 11 11 SER H H 145 8.679 8.834 -0.155 1
1 108 . 11 1 1 A 11 11 SER HA H 145 5.431 5.801 -0.370 1
1 111 . 11 1 1 A 11 11 SER C C 145 173.072 173.173 -0.101 1
1 112 . 11 1 1 A 11 11 SER CA C 145 57.772 57.004 0.768 1
1 113 . 11 1 1 A 11 11 SER CB C 145 67.301 66.309 0.992 1
1 114 . 11 1 1 A 11 11 SER N N 145 116.245 115.518 0.727 1
1 115 . 11 1 1 A 12 12 HIS H H 146 9.962 9.451 0.511 1
1 116 . 11 1 1 A 12 12 HIS HA H 146 6.332 6.028 0.304 1
1 121 . 11 1 1 A 12 12 HIS C C 146 173.006 172.658 0.348 1
1 122 . 11 1 1 A 12 12 HIS CA C 146 55.020 54.347 0.673 1
1 123 . 11 1 1 A 12 12 HIS CB C 146 37.071 32.949 4.122 1
1 126 . 11 1 1 A 12 12 HIS N N 146 119.181 118.294 0.887 1
1 127 . 11 1 1 A 13 13 ILE H H 147 8.976 8.932 0.044 1
1 128 . 11 1 1 A 13 13 ILE HA H 147 3.528 4.501 -0.973 1
1 138 . 11 1 1 A 13 13 ILE C C 147 173.010 173.604 -0.594 1
1 139 . 11 1 1 A 13 13 ILE CA C 147 61.273 59.528 1.745 1
1 140 . 11 1 1 A 13 13 ILE CB C 147 41.773 41.836 -0.063 1
1 144 . 11 1 1 A 13 13 ILE N N 147 121.873 119.166 2.707 1
1 145 . 11 1 1 A 14 14 LEU H H 148 7.627 9.016 -1.389 1
1 146 . 11 1 1 A 14 14 LEU HA H 148 4.814 4.900 -0.086 1
1 156 . 11 1 1 A 14 14 LEU C C 148 174.112 174.339 -0.227 1
1 157 . 11 1 1 A 14 14 LEU CA C 148 52.574 53.098 -0.524 1
1 158 . 11 1 1 A 14 14 LEU CB C 148 45.643 44.927 0.716 1
1 162 . 11 1 1 A 14 14 LEU N N 148 127.112 129.731 -2.619 1
1 163 . 11 1 1 A 15 15 ILE H H 149 9.524 9.291 0.233 1
1 164 . 11 1 1 A 15 15 ILE HA H 149 4.362 4.689 -0.327 1
1 174 . 11 1 1 A 15 15 ILE C C 149 175.452 175.433 0.019 1
1 175 . 11 1 1 A 15 15 ILE CA C 149 58.516 60.440 -1.924 1
1 176 . 11 1 1 A 15 15 ILE CB C 149 36.560 39.996 -3.436 1
1 180 . 11 1 1 A 15 15 ILE N N 149 128.652 126.852 1.800 1
1 181 . 11 1 1 A 16 16 LYS H H 150 8.035 8.470 -0.435 1
1 182 . 11 1 1 A 16 16 LYS HA H 150 4.319 4.515 -0.196 1
1 191 . 11 1 1 A 16 16 LYS C C 150 175.038 176.330 -1.292 1
1 192 . 11 1 1 A 16 16 LYS CA C 150 57.817 56.525 1.292 1
1 193 . 11 1 1 A 16 16 LYS CB C 150 34.853 33.078 1.775 1
1 197 . 11 1 1 A 16 16 LYS N N 150 129.153 128.032 1.121 1
1 198 . 11 1 1 A 17 17 VAL H H 151 8.016 9.022 -1.006 1
1 199 . 11 1 1 A 17 17 VAL HA H 151 4.873 4.782 0.091 1
1 207 . 11 1 1 A 17 17 VAL C C 151 176.647 175.243 1.404 1
1 208 . 11 1 1 A 17 17 VAL CA C 151 60.088 61.412 -1.324 1
1 209 . 11 1 1 A 17 17 VAL CB C 151 34.082 33.534 0.548 1
1 212 . 11 1 1 A 17 17 VAL N N 151 121.288 124.397 -3.109 1
1 213 . 11 1 1 A 18 18 LYS H H 152 8.443 8.562 -0.119 1
1 214 . 11 1 1 A 18 18 LYS HA H 152 4.334 4.732 -0.398 1
1 223 . 11 1 1 A 18 18 LYS C C 152 176.345 177.201 -0.856 1
1 224 . 11 1 1 A 18 18 LYS CA C 152 57.016 54.471 2.545 1
1 225 . 11 1 1 A 18 18 LYS CB C 152 33.222 34.626 -1.404 1
1 229 . 11 1 1 A 18 18 LYS N N 152 128.408 127.638 0.770 1
1 230 . 11 1 1 A 19 19 SER H H 153 9.067 8.662 0.405 1
1 231 . 11 1 1 A 19 19 SER HA H 153 4.457 4.447 0.010 1
1 234 . 11 1 1 A 19 19 SER C C 153 174.236 174.713 -0.477 1
1 235 . 11 1 1 A 19 19 SER CA C 153 59.642 60.197 -0.555 1
1 236 . 11 1 1 A 19 19 SER CB C 153 64.347 64.066 0.281 1
1 237 . 11 1 1 A 19 19 SER N N 153 121.522 116.290 5.232 1
1 238 . 11 1 1 A 20 20 LYS H H 154 7.961 7.751 0.210 1
1 239 . 11 1 1 A 20 20 LYS HA H 154 4.558 4.760 -0.202 1
1 244 . 11 1 1 A 20 20 LYS C C 154 177.256 176.492 0.764 1
1 245 . 11 1 1 A 20 20 LYS CA C 154 55.249 54.642 0.607 1
1 246 . 11 1 1 A 20 20 LYS CB C 154 34.531 35.440 -0.909 1
1 248 . 11 1 1 A 20 20 LYS N N 154 120.270 118.801 1.469 1
1 249 . 11 1 1 A 21 21 LYS HA H 155 4.003 3.972 0.031 1
1 258 . 11 1 1 A 21 21 LYS C C 155 177.015 178.100 -1.085 1
1 259 . 11 1 1 A 21 21 LYS CA C 155 59.091 58.861 0.230 1
1 260 . 11 1 1 A 21 21 LYS CB C 155 32.394 32.241 0.153 1
1 264 . 11 1 1 A 22 22 SER H H 156 7.625 7.825 -0.200 1
1 265 . 11 1 1 A 22 22 SER HA H 156 4.293 4.408 -0.115 1
1 268 . 11 1 1 A 22 22 SER C C 156 174.843 174.403 0.440 1
1 269 . 11 1 1 A 22 22 SER CA C 156 57.966 60.233 -2.267 1
1 270 . 11 1 1 A 22 22 SER CB C 156 63.369 63.579 -0.210 1
1 271 . 11 1 1 A 22 22 SER N N 156 109.549 113.454 -3.905 1
1 272 . 11 1 1 A 23 23 ASP H H 157 7.701 7.228 0.473 1
1 273 . 11 1 1 A 23 23 ASP HA H 157 4.548 4.717 -0.169 1
1 276 . 11 1 1 A 23 23 ASP C C 157 176.544 176.662 -0.118 1
1 277 . 11 1 1 A 23 23 ASP CA C 157 55.242 54.033 1.209 1
1 278 . 11 1 1 A 23 23 ASP CB C 157 41.103 40.854 0.249 1
1 279 . 11 1 1 A 23 23 ASP N N 157 124.536 120.942 3.594 1
1 280 . 11 1 1 A 24 24 LYS H H 158 8.583 8.493 0.090 1
1 281 . 11 1 1 A 24 24 LYS HA H 158 4.252 4.125 0.127 1
1 290 . 11 1 1 A 24 24 LYS C C 158 176.813 178.855 -2.042 1
1 291 . 11 1 1 A 24 24 LYS CA C 158 57.148 58.416 -1.268 1
1 292 . 11 1 1 A 24 24 LYS CB C 158 33.200 31.861 1.339 1
1 296 . 11 1 1 A 24 24 LYS N N 158 122.372 124.396 -2.024 1
1 297 . 11 1 1 A 25 25 GLU H H 159 8.001 7.867 0.134 1
1 298 . 11 1 1 A 25 25 GLU HA H 159 4.521 4.043 0.478 1
1 303 . 11 1 1 A 25 25 GLU C C 159 175.995 176.618 -0.623 1
1 304 . 11 1 1 A 25 25 GLU CA C 159 55.727 59.427 -3.700 1
1 305 . 11 1 1 A 25 25 GLU CB C 159 31.918 29.673 2.245 1
1 307 . 11 1 1 A 25 25 GLU N N 159 118.705 120.640 -1.935 1
1 308 . 11 1 1 A 26 26 GLY H H 160 8.458 7.798 0.660 1
1 309 . 11 1 1 A 26 26 GLY HA2 H 160 3.946 4.079 -0.133 1
1 310 . 11 1 1 A 26 26 GLY HA3 H 160 3.511 4.089 -0.578 1
1 311 . 11 1 1 A 26 26 GLY C C 160 172.201 172.854 -0.653 1
1 312 . 11 1 1 A 26 26 GLY CA C 160 44.038 45.047 -1.009 1
1 313 . 11 1 1 A 26 26 GLY N N 160 107.642 107.672 -0.030 1
1 314 . 11 1 1 A 27 27 LEU H H 161 8.259 8.411 -0.152 1
1 315 . 11 1 1 A 27 27 LEU HA H 161 4.775 5.174 -0.399 1
1 325 . 11 1 1 A 27 27 LEU C C 161 177.422 175.186 2.236 1
1 326 . 11 1 1 A 27 27 LEU CA C 161 53.322 53.258 0.064 1
1 327 . 11 1 1 A 27 27 LEU CB C 161 45.576 45.313 0.263 1
1 331 . 11 1 1 A 27 27 LEU N N 161 119.856 122.066 -2.210 1
1 332 . 11 1 1 A 28 28 ASP H H 162 8.848 8.639 0.209 1
1 333 . 11 1 1 A 28 28 ASP HA H 162 4.644 4.500 0.144 1
1 336 . 11 1 1 A 28 28 ASP C C 162 176.630 177.114 -0.484 1
1 337 . 11 1 1 A 28 28 ASP CA C 162 55.195 54.668 0.527 1
1 338 . 11 1 1 A 28 28 ASP CB C 162 41.673 42.727 -1.054 1
1 339 . 11 1 1 A 28 28 ASP N N 162 122.434 122.096 0.338 1
1 340 . 11 1 1 A 29 29 ASP H H 163 8.720 9.083 -0.363 1
1 341 . 11 1 1 A 29 29 ASP HA H 163 4.386 4.421 -0.035 1
1 344 . 11 1 1 A 29 29 ASP C C 163 176.604 178.588 -1.984 1
1 345 . 11 1 1 A 29 29 ASP CA C 163 59.690 56.670 3.020 1
1 346 . 11 1 1 A 29 29 ASP CB C 163 42.964 39.962 3.002 1
1 347 . 11 1 1 A 29 29 ASP N N 163 121.460 125.300 -3.840 1
1 348 . 11 1 1 A 30 30 LYS H H 164 8.434 8.020 0.414 1
1 349 . 11 1 1 A 30 30 LYS HA H 164 3.901 4.142 -0.241 1
1 358 . 11 1 1 A 30 30 LYS C C 164 179.479 179.000 0.479 1
1 359 . 11 1 1 A 30 30 LYS CA C 164 60.047 59.058 0.989 1
1 360 . 11 1 1 A 30 30 LYS CB C 164 32.038 32.625 -0.587 1
1 364 . 11 1 1 A 30 30 LYS N N 164 116.627 119.248 -2.621 1
1 365 . 11 1 1 A 31 31 GLU H H 165 7.755 8.264 -0.509 1
1 366 . 11 1 1 A 31 31 GLU HA H 165 3.998 3.992 0.006 1
1 371 . 11 1 1 A 31 31 GLU C C 165 179.031 179.294 -0.263 1
1 372 . 11 1 1 A 31 31 GLU CA C 165 59.335 59.331 0.004 1
1 373 . 11 1 1 A 31 31 GLU CB C 165 29.972 29.274 0.698 1
1 375 . 11 1 1 A 31 31 GLU N N 165 120.456 120.222 0.234 1
1 376 . 11 1 1 A 32 32 ALA H H 166 9.060 8.613 0.447 1
1 377 . 11 1 1 A 32 32 ALA HA H 166 3.871 4.028 -0.157 1
1 381 . 11 1 1 A 32 32 ALA C C 166 178.029 178.953 -0.924 1
1 382 . 11 1 1 A 32 32 ALA CA C 166 54.997 55.431 -0.434 1
1 383 . 11 1 1 A 32 32 ALA CB C 166 19.727 18.479 1.248 1
1 384 . 11 1 1 A 32 32 ALA N N 166 124.406 122.374 2.032 1
1 385 . 11 1 1 A 33 33 LYS H H 167 8.228 7.531 0.697 1
1 386 . 11 1 1 A 33 33 LYS HA H 167 2.595 3.126 -0.531 1
1 395 . 11 1 1 A 33 33 LYS C C 167 177.938 177.989 -0.051 1
1 396 . 11 1 1 A 33 33 LYS CA C 167 59.573 59.237 0.336 1
1 397 . 11 1 1 A 33 33 LYS CB C 167 32.098 32.138 -0.040 1
1 401 . 11 1 1 A 33 33 LYS N N 167 119.833 118.309 1.524 1
1 402 . 11 1 1 A 34 34 GLN H H 168 7.392 7.762 -0.370 1
1 403 . 11 1 1 A 34 34 GLN HA H 168 3.943 3.924 0.019 1
1 410 . 11 1 1 A 34 34 GLN C C 168 178.323 178.405 -0.082 1
1 411 . 11 1 1 A 34 34 GLN CA C 168 58.883 59.275 -0.392 1
1 412 . 11 1 1 A 34 34 GLN CB C 168 28.485 28.085 0.400 1
1 414 . 11 1 1 A 34 34 GLN N N 168 117.208 117.469 -0.261 1
1 416 . 11 1 1 A 35 35 LYS H H 169 7.994 7.937 0.057 1
1 417 . 11 1 1 A 35 35 LYS HA H 169 4.067 3.991 0.076 1
1 426 . 11 1 1 A 35 35 LYS C C 169 178.161 178.513 -0.352 1
1 427 . 11 1 1 A 35 35 LYS CA C 169 58.437 59.247 -0.810 1
1 428 . 11 1 1 A 35 35 LYS CB C 169 31.611 32.255 -0.644 1
1 432 . 11 1 1 A 35 35 LYS N N 169 120.898 119.920 0.978 1
1 433 . 11 1 1 A 36 36 ALA H H 170 8.431 8.307 0.124 1
1 434 . 11 1 1 A 36 36 ALA HA H 170 3.738 4.026 -0.288 1
1 438 . 11 1 1 A 36 36 ALA C C 170 178.862 179.633 -0.771 1
1 439 . 11 1 1 A 36 36 ALA CA C 170 55.351 54.948 0.403 1
1 440 . 11 1 1 A 36 36 ALA CB C 170 18.295 18.495 -0.200 1
1 441 . 11 1 1 A 36 36 ALA N N 170 120.641 119.736 0.905 1
1 442 . 11 1 1 A 37 37 GLU H H 171 8.412 8.127 0.285 1
1 443 . 11 1 1 A 37 37 GLU HA H 171 3.867 3.917 -0.050 1
1 448 . 11 1 1 A 37 37 GLU C C 171 179.255 179.087 0.168 1
1 449 . 11 1 1 A 37 37 GLU CA C 171 59.543 59.574 -0.031 1
1 450 . 11 1 1 A 37 37 GLU CB C 171 29.569 29.634 -0.065 1
1 452 . 11 1 1 A 37 37 GLU N N 171 118.224 117.759 0.465 1
1 453 . 11 1 1 A 38 38 GLU H H 172 8.019 8.353 -0.334 1
1 454 . 11 1 1 A 38 38 GLU HA H 172 3.952 4.059 -0.107 1
1 459 . 11 1 1 A 38 38 GLU C C 172 180.250 178.399 1.851 1
1 460 . 11 1 1 A 38 38 GLU CA C 172 59.627 59.133 0.494 1
1 461 . 11 1 1 A 38 38 GLU CB C 172 29.368 28.746 0.622 1
1 463 . 11 1 1 A 38 38 GLU N N 172 121.250 118.387 2.863 1
1 464 . 11 1 1 A 39 39 ILE H H 173 8.174 7.534 0.640 1
1 465 . 11 1 1 A 39 39 ILE HA H 173 3.643 3.791 -0.148 1
1 475 . 11 1 1 A 39 39 ILE C C 173 177.568 177.938 -0.370 1
1 476 . 11 1 1 A 39 39 ILE CA C 173 64.869 63.734 1.135 1
1 477 . 11 1 1 A 39 39 ILE CB C 173 38.160 37.373 0.787 1
1 481 . 11 1 1 A 39 39 ILE N N 173 121.527 117.287 4.240 1
1 482 . 11 1 1 A 40 40 GLN H H 174 8.860 8.193 0.667 1
1 483 . 11 1 1 A 40 40 GLN HA H 174 3.533 4.008 -0.475 1
1 490 . 11 1 1 A 40 40 GLN C C 174 179.022 179.112 -0.090 1
1 491 . 11 1 1 A 40 40 GLN CA C 174 61.316 59.242 2.074 1
1 492 . 11 1 1 A 40 40 GLN CB C 174 26.604 28.351 -1.747 1
1 494 . 11 1 1 A 40 40 GLN N N 174 121.956 121.022 0.934 1
1 496 . 11 1 1 A 41 41 LYS H H 175 7.879 8.079 -0.200 1
1 497 . 11 1 1 A 41 41 LYS HA H 175 3.777 4.182 -0.405 1
1 506 . 11 1 1 A 41 41 LYS C C 175 178.779 177.851 0.928 1
1 507 . 11 1 1 A 41 41 LYS CA C 175 59.701 58.715 0.986 1
1 508 . 11 1 1 A 41 41 LYS CB C 175 32.581 32.228 0.353 1
1 512 . 11 1 1 A 41 41 LYS N N 175 119.012 118.192 0.820 1
1 513 . 11 1 1 A 42 42 GLU H H 176 7.447 8.044 -0.597 1
1 514 . 11 1 1 A 42 42 GLU HA H 176 4.059 4.272 -0.213 1
1 519 . 11 1 1 A 42 42 GLU C C 176 180.058 179.023 1.035 1
1 520 . 11 1 1 A 42 42 GLU CA C 176 59.456 58.746 0.710 1
1 521 . 11 1 1 A 42 42 GLU CB C 176 29.923 30.298 -0.375 1
1 523 . 11 1 1 A 42 42 GLU N N 176 120.054 118.256 1.798 1
1 524 . 11 1 1 A 43 43 VAL H H 177 8.618 8.050 0.568 1
1 525 . 11 1 1 A 43 43 VAL HA H 177 3.986 3.963 0.023 1
1 533 . 11 1 1 A 43 43 VAL C C 177 176.459 177.543 -1.084 1
1 534 . 11 1 1 A 43 43 VAL CA C 177 63.923 64.897 -0.974 1
1 535 . 11 1 1 A 43 43 VAL CB C 177 31.899 31.301 0.598 1
1 538 . 11 1 1 A 43 43 VAL N N 177 114.191 117.363 -3.172 1
1 539 . 11 1 1 A 44 44 SER H H 178 8.052 8.170 -0.118 1
1 540 . 11 1 1 A 44 44 SER HA H 178 4.098 4.231 -0.133 1
1 543 . 11 1 1 A 44 44 SER C C 178 176.548 176.032 0.516 1
1 544 . 11 1 1 A 44 44 SER CA C 178 61.160 61.373 -0.213 1
1 545 . 11 1 1 A 44 44 SER CB C 178 62.959 62.584 0.375 1
1 546 . 11 1 1 A 44 44 SER N N 178 114.202 116.157 -1.955 1
1 547 . 11 1 1 A 45 45 LYS H H 179 7.083 8.038 -0.955 1
1 548 . 11 1 1 A 45 45 LYS HA H 179 4.140 4.239 -0.099 1
1 557 . 11 1 1 A 45 45 LYS C C 179 177.288 176.096 1.192 1
1 558 . 11 1 1 A 45 45 LYS CA C 179 58.469 57.797 0.672 1
1 559 . 11 1 1 A 45 45 LYS CB C 179 32.671 31.786 0.885 1
1 563 . 11 1 1 A 45 45 LYS N N 179 120.935 117.552 3.383 1
1 564 . 11 1 1 A 46 46 ASP H H 180 7.098 7.405 -0.307 1
1 565 . 11 1 1 A 46 46 ASP HA H 180 4.917 4.941 -0.024 1
1 568 . 11 1 1 A 46 46 ASP CA C 180 51.492 51.432 0.060 1
1 569 . 11 1 1 A 46 46 ASP CB C 180 40.595 41.660 -1.065 1
1 570 . 11 1 1 A 46 46 ASP N N 180 112.836 119.957 -7.121 1
1 571 . 11 1 1 A 47 47 PRO HA H 181 4.681 4.572 0.109 1
1 578 . 11 1 1 A 47 47 PRO C C 181 179.248 177.489 1.759 1
1 579 . 11 1 1 A 47 47 PRO CA C 181 64.718 64.075 0.643 1
1 580 . 11 1 1 A 47 47 PRO CB C 181 32.159 32.127 0.032 1
1 583 . 11 1 1 A 48 48 SER H H 182 8.248 8.399 -0.151 1
1 584 . 11 1 1 A 48 48 SER HA H 182 4.378 4.353 0.025 1
1 587 . 11 1 1 A 48 48 SER C C 182 176.071 175.608 0.463 1
1 588 . 11 1 1 A 48 48 SER CA C 182 61.377 60.825 0.552 1
1 589 . 11 1 1 A 48 48 SER CB C 182 62.455 63.358 -0.903 1
1 590 . 11 1 1 A 48 48 SER N N 182 116.986 113.910 3.076 1
1 591 . 11 1 1 A 49 49 LYS H H 183 7.842 7.700 0.142 1
1 592 . 11 1 1 A 49 49 LYS HA H 183 4.482 4.309 0.173 1
1 601 . 11 1 1 A 49 49 LYS C C 183 175.605 177.363 -1.758 1
1 602 . 11 1 1 A 49 49 LYS CA C 183 55.824 57.073 -1.249 1
1 603 . 11 1 1 A 49 49 LYS CB C 183 32.834 32.360 0.474 1
1 607 . 11 1 1 A 49 49 LYS N N 183 121.698 119.899 1.799 1
1 608 . 11 1 1 A 50 50 PHE H H 184 7.634 7.989 -0.355 1
1 609 . 11 1 1 A 50 50 PHE HA H 184 3.510 4.208 -0.698 1
1 617 . 11 1 1 A 50 50 PHE C C 184 176.214 177.592 -1.378 1
1 618 . 11 1 1 A 50 50 PHE CA C 184 63.276 61.047 2.229 1
1 619 . 11 1 1 A 50 50 PHE CB C 184 40.948 39.097 1.851 1
1 623 . 11 1 1 A 50 50 PHE N N 184 120.120 121.586 -1.466 1
1 624 . 11 1 1 A 51 51 GLY H H 185 8.855 8.594 0.261 1
1 625 . 11 1 1 A 51 51 GLY HA2 H 185 3.993 3.850 0.143 1
1 626 . 11 1 1 A 51 51 GLY HA3 H 185 3.958 3.901 0.057 1
1 627 . 11 1 1 A 51 51 GLY C C 185 175.169 176.371 -1.202 1
1 628 . 11 1 1 A 51 51 GLY CA C 185 47.475 47.443 0.032 1
1 629 . 11 1 1 A 51 51 GLY N N 185 105.550 106.200 -0.650 1
1 630 . 11 1 1 A 52 52 GLU H H 186 7.917 7.995 -0.078 1
1 631 . 11 1 1 A 52 52 GLU HA H 186 4.006 4.062 -0.056 1
1 636 . 11 1 1 A 52 52 GLU C C 186 179.499 179.637 -0.138 1
1 637 . 11 1 1 A 52 52 GLU CA C 186 58.904 59.235 -0.331 1
1 638 . 11 1 1 A 52 52 GLU CB C 186 29.700 29.814 -0.114 1
1 640 . 11 1 1 A 52 52 GLU N N 186 121.929 121.769 0.160 1
1 641 . 11 1 1 A 53 53 ILE H H 187 7.936 8.235 -0.299 1
1 642 . 11 1 1 A 53 53 ILE HA H 187 3.648 3.649 -0.001 1
1 652 . 11 1 1 A 53 53 ILE C C 187 177.886 177.651 0.235 1
1 653 . 11 1 1 A 53 53 ILE CA C 187 64.366 64.679 -0.313 1
1 654 . 11 1 1 A 53 53 ILE CB C 187 36.478 37.488 -1.010 1
1 658 . 11 1 1 A 53 53 ILE N N 187 120.991 121.128 -0.137 1
1 659 . 11 1 1 A 54 54 ALA H H 188 8.895 8.421 0.474 1
1 660 . 11 1 1 A 54 54 ALA HA H 188 3.629 3.876 -0.247 1
1 664 . 11 1 1 A 54 54 ALA C C 188 179.437 178.754 0.683 1
1 665 . 11 1 1 A 54 54 ALA CA C 188 55.974 55.538 0.436 1
1 666 . 11 1 1 A 54 54 ALA CB C 188 17.591 19.211 -1.620 1
1 667 . 11 1 1 A 54 54 ALA N N 188 125.308 122.239 3.069 1
1 668 . 11 1 1 A 55 55 LYS H H 189 8.049 7.704 0.345 1
1 669 . 11 1 1 A 55 55 LYS HA H 189 4.106 3.861 0.245 1
1 678 . 11 1 1 A 55 55 LYS C C 189 178.995 178.557 0.438 1
1 679 . 11 1 1 A 55 55 LYS CA C 189 59.312 59.465 -0.153 1
1 680 . 11 1 1 A 55 55 LYS CB C 189 32.647 32.155 0.492 1
1 684 . 11 1 1 A 55 55 LYS N N 189 116.835 118.510 -1.675 1
1 685 . 11 1 1 A 56 56 LYS H H 190 7.215 7.675 -0.460 1
1 686 . 11 1 1 A 56 56 LYS HA H 190 4.172 4.131 0.041 1
1 695 . 11 1 1 A 56 56 LYS C C 190 177.897 177.955 -0.058 1
1 696 . 11 1 1 A 56 56 LYS CA C 190 58.418 59.230 -0.812 1
1 697 . 11 1 1 A 56 56 LYS CB C 190 34.652 33.142 1.510 1
1 701 . 11 1 1 A 56 56 LYS N N 190 117.170 118.153 -0.983 1
1 702 . 11 1 1 A 57 57 GLU H H 191 8.572 7.857 0.715 1
1 703 . 11 1 1 A 57 57 GLU HA H 191 4.643 4.400 0.243 1
1 708 . 11 1 1 A 57 57 GLU C C 191 177.903 176.040 1.863 1
1 709 . 11 1 1 A 57 57 GLU CA C 191 55.708 55.953 -0.245 1
1 710 . 11 1 1 A 57 57 GLU CB C 191 32.460 31.171 1.289 1
1 712 . 11 1 1 A 57 57 GLU N N 191 113.316 116.757 -3.441 1
1 713 . 11 1 1 A 58 58 SER H H 192 8.550 7.691 0.859 1
1 714 . 11 1 1 A 58 58 SER HA H 192 4.149 4.400 -0.251 1
1 717 . 11 1 1 A 58 58 SER C C 192 176.161 175.167 0.994 1
1 718 . 11 1 1 A 58 58 SER CA C 192 58.403 58.190 0.213 1
1 719 . 11 1 1 A 58 58 SER CB C 192 64.392 64.229 0.163 1
1 720 . 11 1 1 A 58 58 SER N N 192 109.861 115.967 -6.106 1
1 721 . 11 1 1 A 59 59 MET H H 193 9.533 8.943 0.590 1
1 722 . 11 1 1 A 59 59 MET HA H 193 4.457 4.632 -0.175 1
1 730 . 11 1 1 A 59 59 MET C C 193 175.204 175.492 -0.288 1
1 731 . 11 1 1 A 59 59 MET CA C 193 55.781 55.021 0.760 1
1 732 . 11 1 1 A 59 59 MET CB C 193 32.855 32.255 0.600 1
1 735 . 11 1 1 A 59 59 MET N N 193 124.493 123.299 1.194 1
1 736 . 11 1 1 A 60 60 ASP H H 194 7.514 7.356 0.158 1
1 737 . 11 1 1 A 60 60 ASP HA H 194 4.886 4.618 0.268 1
1 740 . 11 1 1 A 60 60 ASP C C 194 175.517 176.564 -1.047 1
1 741 . 11 1 1 A 60 60 ASP CA C 194 52.286 53.133 -0.847 1
1 742 . 11 1 1 A 60 60 ASP CB C 194 40.222 40.770 -0.548 1
1 743 . 11 1 1 A 60 60 ASP N N 194 117.785 122.308 -4.523 1
1 744 . 11 1 1 A 61 61 THR H H 195 8.118 8.295 -0.177 1
1 745 . 11 1 1 A 61 61 THR HA H 195 3.918 3.866 0.052 1
1 750 . 11 1 1 A 61 61 THR C C 195 176.269 177.000 -0.731 1
1 751 . 11 1 1 A 61 61 THR CA C 195 65.469 66.505 -1.036 1
1 752 . 11 1 1 A 61 61 THR CB C 195 68.741 68.300 0.441 1
1 754 . 11 1 1 A 61 61 THR N N 195 120.765 118.492 2.273 1
1 755 . 11 1 1 A 62 62 GLY H H 196 8.399 8.524 -0.125 1
1 756 . 11 1 1 A 62 62 GLY HA2 H 196 3.932 3.823 0.109 1
1 757 . 11 1 1 A 62 62 GLY HA3 H 196 3.900 3.827 0.073 1
1 758 . 11 1 1 A 62 62 GLY C C 196 174.948 176.640 -1.692 1
1 759 . 11 1 1 A 62 62 GLY CA C 196 46.768 47.672 -0.904 1
1 760 . 11 1 1 A 62 62 GLY N N 196 108.183 108.560 -0.377 1
1 761 . 11 1 1 A 63 63 SER H H 197 7.265 8.204 -0.939 1
1 762 . 11 1 1 A 63 63 SER HA H 197 4.554 4.417 0.137 1
1 765 . 11 1 1 A 63 63 SER C C 197 177.630 176.174 1.456 1
1 766 . 11 1 1 A 63 63 SER CA C 197 59.550 62.377 -2.827 1
1 767 . 11 1 1 A 63 63 SER CB C 197 65.504 63.326 2.178 1
1 768 . 11 1 1 A 63 63 SER N N 197 111.815 119.404 -7.589 1
1 769 . 11 1 1 A 64 64 ALA H H 198 8.675 8.386 0.289 1
1 770 . 11 1 1 A 64 64 ALA HA H 198 3.801 3.982 -0.181 1
1 774 . 11 1 1 A 64 64 ALA C C 198 178.492 179.811 -1.319 1
1 775 . 11 1 1 A 64 64 ALA CA C 198 56.794 55.375 1.419 1
1 776 . 11 1 1 A 64 64 ALA CB C 198 18.951 18.526 0.425 1
1 777 . 11 1 1 A 64 64 ALA N N 198 131.710 123.392 8.318 1
1 778 . 11 1 1 A 65 65 LYS H H 199 7.666 8.072 -0.406 1
1 779 . 11 1 1 A 65 65 LYS HA H 199 4.175 4.082 0.093 1
1 788 . 11 1 1 A 65 65 LYS C C 199 177.159 177.364 -0.205 1
1 789 . 11 1 1 A 65 65 LYS CA C 199 57.735 58.399 -0.664 1
1 790 . 11 1 1 A 65 65 LYS CB C 199 31.948 31.675 0.273 1
1 794 . 11 1 1 A 65 65 LYS N N 199 111.375 118.013 -6.638 1
1 795 . 11 1 1 A 66 66 LYS H H 200 7.545 7.397 0.148 1
1 796 . 11 1 1 A 66 66 LYS HA H 200 4.612 4.474 0.138 1
1 805 . 11 1 1 A 66 66 LYS C C 200 175.609 175.787 -0.178 1
1 806 . 11 1 1 A 66 66 LYS CA C 200 54.468 55.804 -1.336 1
1 807 . 11 1 1 A 66 66 LYS CB C 200 31.525 33.005 -1.480 1
1 811 . 11 1 1 A 66 66 LYS N N 200 121.421 118.311 3.110 1
1 812 . 11 1 1 A 67 67 ASP H H 201 7.630 8.157 -0.527 1
1 813 . 11 1 1 A 67 67 ASP HA H 201 4.306 4.387 -0.081 1
1 816 . 11 1 1 A 67 67 ASP C C 201 175.025 176.382 -1.357 1
1 817 . 11 1 1 A 67 67 ASP CA C 201 56.400 55.355 1.045 1
1 818 . 11 1 1 A 67 67 ASP CB C 201 38.315 39.081 -0.766 1
1 819 . 11 1 1 A 67 67 ASP N N 201 116.216 117.272 -1.056 1
1 820 . 11 1 1 A 68 68 GLY H H 202 8.368 8.661 -0.293 1
1 821 . 11 1 1 A 68 68 GLY HA2 H 202 4.316 3.940 0.376 1
1 822 . 11 1 1 A 68 68 GLY HA3 H 202 3.731 4.009 -0.278 1
1 823 . 11 1 1 A 68 68 GLY C C 202 174.139 174.614 -0.475 1
1 824 . 11 1 1 A 68 68 GLY CA C 202 45.514 45.296 0.218 1
1 825 . 11 1 1 A 68 68 GLY N N 202 105.095 104.777 0.318 1
1 826 . 11 1 1 A 69 69 GLU H H 203 7.534 8.067 -0.533 1
1 827 . 11 1 1 A 69 69 GLU HA H 203 4.479 4.436 0.043 1
1 832 . 11 1 1 A 69 69 GLU C C 203 176.961 175.901 1.060 1
1 833 . 11 1 1 A 69 69 GLU CA C 203 58.549 56.660 1.889 1
1 834 . 11 1 1 A 69 69 GLU CB C 203 30.998 30.359 0.639 1
1 836 . 11 1 1 A 69 69 GLU N N 203 120.426 120.236 0.190 1
1 837 . 11 1 1 A 70 70 LEU H H 204 8.962 9.102 -0.140 1
1 838 . 11 1 1 A 70 70 LEU HA H 204 4.438 4.599 -0.161 1
1 848 . 11 1 1 A 70 70 LEU C C 204 178.648 177.306 1.342 1
1 849 . 11 1 1 A 70 70 LEU CA C 204 53.977 55.300 -1.323 1
1 850 . 11 1 1 A 70 70 LEU CB C 204 43.612 43.569 0.043 1
1 854 . 11 1 1 A 70 70 LEU N N 204 122.066 124.047 -1.981 1
1 855 . 11 1 1 A 71 71 GLY H H 205 8.104 7.638 0.466 1
1 856 . 11 1 1 A 71 71 GLY HA2 H 205 4.165 3.954 0.211 1
1 857 . 11 1 1 A 71 71 GLY HA3 H 205 3.552 4.069 -0.517 1
1 858 . 11 1 1 A 71 71 GLY C C 205 173.098 173.466 -0.368 1
1 859 . 11 1 1 A 71 71 GLY CA C 205 44.723 44.850 -0.127 1
1 860 . 11 1 1 A 71 71 GLY N N 205 110.168 106.514 3.654 1
1 861 . 11 1 1 A 72 72 TYR H H 206 8.457 8.528 -0.071 1
1 862 . 11 1 1 A 72 72 TYR HA H 206 4.184 4.667 -0.483 1
1 869 . 11 1 1 A 72 72 TYR C C 206 175.975 175.488 0.487 1
1 870 . 11 1 1 A 72 72 TYR CA C 206 59.722 59.025 0.697 1
1 871 . 11 1 1 A 72 72 TYR CB C 206 38.378 38.250 0.128 1
1 874 . 11 1 1 A 72 72 TYR N N 206 120.171 122.101 -1.930 1
1 875 . 11 1 1 A 73 73 VAL H H 207 8.782 9.117 -0.335 1
1 876 . 11 1 1 A 73 73 VAL HA H 207 4.056 4.509 -0.453 1
1 884 . 11 1 1 A 73 73 VAL C C 207 174.901 175.897 -0.996 1
1 885 . 11 1 1 A 73 73 VAL CA C 207 62.202 62.621 -0.419 1
1 886 . 11 1 1 A 73 73 VAL CB C 207 33.071 32.222 0.849 1
1 889 . 11 1 1 A 73 73 VAL N N 207 128.847 125.450 3.397 1
1 890 . 11 1 1 A 74 74 LEU H H 208 8.146 8.826 -0.680 1
1 891 . 11 1 1 A 74 74 LEU HA H 208 4.944 4.488 0.456 1
1 901 . 11 1 1 A 74 74 LEU C C 208 178.400 177.417 0.983 1
1 902 . 11 1 1 A 74 74 LEU CA C 208 53.520 54.736 -1.216 1
1 903 . 11 1 1 A 74 74 LEU CB C 208 43.499 42.368 1.131 1
1 907 . 11 1 1 A 74 74 LEU N N 208 127.599 129.342 -1.743 1
1 908 . 11 1 1 A 75 75 LYS H H 209 8.403 8.810 -0.407 1
1 909 . 11 1 1 A 75 75 LYS HA H 209 3.771 3.939 -0.168 1
1 918 . 11 1 1 A 75 75 LYS C C 209 177.536 177.471 0.065 1
1 919 . 11 1 1 A 75 75 LYS CA C 209 58.385 59.014 -0.629 1
1 920 . 11 1 1 A 75 75 LYS CB C 209 32.459 32.176 0.283 1
1 924 . 11 1 1 A 75 75 LYS N N 209 123.798 123.049 0.749 1
1 925 . 11 1 1 A 76 76 GLY H H 210 9.997 9.298 0.699 1
1 926 . 11 1 1 A 76 76 GLY HA2 H 210 4.255 4.009 0.246 1
1 927 . 11 1 1 A 76 76 GLY HA3 H 210 3.791 4.009 -0.218 1
1 928 . 11 1 1 A 76 76 GLY C C 210 175.091 175.775 -0.684 1
1 929 . 11 1 1 A 76 76 GLY CA C 210 45.465 45.391 0.074 1
1 930 . 11 1 1 A 76 76 GLY N N 210 114.705 113.388 1.317 1
1 931 . 11 1 1 A 77 77 GLN H H 211 7.726 8.114 -0.388 1
1 932 . 11 1 1 A 77 77 GLN HA H 211 4.373 4.188 0.185 1
1 939 . 11 1 1 A 77 77 GLN C C 211 176.301 176.060 0.241 1
1 940 . 11 1 1 A 77 77 GLN CA C 211 57.074 57.459 -0.385 1
1 941 . 11 1 1 A 77 77 GLN CB C 211 30.798 29.313 1.485 1
1 943 . 11 1 1 A 77 77 GLN N N 211 118.702 117.949 0.753 1
1 945 . 11 1 1 A 78 78 THR H H 212 8.225 7.462 0.763 1
1 946 . 11 1 1 A 78 78 THR HA H 212 4.620 4.623 -0.003 1
1 951 . 11 1 1 A 78 78 THR C C 212 173.920 173.876 0.044 1
1 952 . 11 1 1 A 78 78 THR CA C 212 60.087 59.637 0.450 1
1 953 . 11 1 1 A 78 78 THR CB C 212 71.412 70.817 0.595 1
1 955 . 11 1 1 A 78 78 THR N N 212 111.935 110.838 1.097 1
1 956 . 11 1 1 A 79 79 ASP H H 213 8.372 8.277 0.095 1
1 957 . 11 1 1 A 79 79 ASP HA H 213 4.470 4.457 0.013 1
1 960 . 11 1 1 A 79 79 ASP C C 213 176.759 177.627 -0.868 1
1 961 . 11 1 1 A 79 79 ASP CA C 213 54.927 54.515 0.412 1
1 962 . 11 1 1 A 79 79 ASP CB C 213 43.859 42.586 1.273 1
1 963 . 11 1 1 A 79 79 ASP N N 213 122.093 122.616 -0.523 1
1 964 . 11 1 1 A 80 80 LYS H H 214 8.740 8.887 -0.147 1
1 965 . 11 1 1 A 80 80 LYS HA H 214 4.027 3.977 0.050 1
1 974 . 11 1 1 A 80 80 LYS C C 214 178.493 178.061 0.432 1
1 975 . 11 1 1 A 80 80 LYS CA C 214 59.802 59.626 0.176 1
1 976 . 11 1 1 A 80 80 LYS CB C 214 32.374 32.175 0.199 1
1 980 . 11 1 1 A 80 80 LYS N N 214 124.685 126.472 -1.787 1
1 981 . 11 1 1 A 81 81 ASP H H 215 8.556 8.220 0.336 1
1 982 . 11 1 1 A 81 81 ASP HA H 215 4.566 4.435 0.131 1
1 985 . 11 1 1 A 81 81 ASP C C 215 178.889 178.512 0.377 1
1 986 . 11 1 1 A 81 81 ASP CA C 215 58.046 57.256 0.790 1
1 987 . 11 1 1 A 81 81 ASP CB C 215 40.872 40.745 0.127 1
1 988 . 11 1 1 A 81 81 ASP N N 215 121.413 119.281 2.132 1
1 989 . 11 1 1 A 82 82 PHE H H 216 8.205 8.251 -0.046 1
1 990 . 11 1 1 A 82 82 PHE HA H 216 3.686 4.113 -0.427 1
1 998 . 11 1 1 A 82 82 PHE C C 216 175.919 177.440 -1.521 1
1 999 . 11 1 1 A 82 82 PHE CA C 216 61.648 60.769 0.879 1
1 1000 . 11 1 1 A 82 82 PHE CB C 216 39.743 39.221 0.522 1
1 1004 . 11 1 1 A 82 82 PHE N N 216 124.401 122.774 1.627 1
1 1005 . 11 1 1 A 83 83 GLU H H 217 8.887 8.883 0.004 1
1 1006 . 11 1 1 A 83 83 GLU HA H 217 3.704 4.185 -0.481 1
1 1011 . 11 1 1 A 83 83 GLU C C 217 177.788 178.986 -1.198 1
1 1012 . 11 1 1 A 83 83 GLU CA C 217 60.545 60.340 0.205 1
1 1013 . 11 1 1 A 83 83 GLU CB C 217 30.639 29.456 1.183 1
1 1015 . 11 1 1 A 83 83 GLU N N 217 119.421 118.976 0.445 1
1 1016 . 11 1 1 A 84 84 LYS H H 218 8.055 7.923 0.132 1
1 1017 . 11 1 1 A 84 84 LYS HA H 218 3.947 4.133 -0.186 1
1 1026 . 11 1 1 A 84 84 LYS C C 218 178.783 178.548 0.235 1
1 1027 . 11 1 1 A 84 84 LYS CA C 218 59.327 58.911 0.416 1
1 1028 . 11 1 1 A 84 84 LYS CB C 218 32.539 32.215 0.324 1
1 1032 . 11 1 1 A 84 84 LYS N N 218 117.821 119.561 -1.740 1
1 1033 . 11 1 1 A 85 85 ALA H H 219 7.059 7.809 -0.750 1
1 1034 . 11 1 1 A 85 85 ALA HA H 219 4.040 4.154 -0.114 1
1 1038 . 11 1 1 A 85 85 ALA C C 219 179.794 179.594 0.200 1
1 1039 . 11 1 1 A 85 85 ALA CA C 219 54.407 54.026 0.381 1
1 1040 . 11 1 1 A 85 85 ALA CB C 219 20.130 18.293 1.837 1
1 1041 . 11 1 1 A 85 85 ALA N N 219 118.905 121.285 -2.380 1
1 1042 . 11 1 1 A 86 86 LEU H H 220 8.157 8.144 0.013 1
1 1043 . 11 1 1 A 86 86 LEU HA H 220 3.692 4.044 -0.352 1
1 1053 . 11 1 1 A 86 86 LEU C C 220 178.330 178.454 -0.124 1
1 1054 . 11 1 1 A 86 86 LEU CA C 220 57.752 57.629 0.123 1
1 1055 . 11 1 1 A 86 86 LEU CB C 220 41.464 41.890 -0.426 1
1 1059 . 11 1 1 A 86 86 LEU N N 220 118.606 120.517 -1.911 1
1 1060 . 11 1 1 A 87 87 PHE H H 221 8.349 8.295 0.054 1
1 1061 . 11 1 1 A 87 87 PHE HA H 221 3.861 4.490 -0.629 1
1 1069 . 11 1 1 A 87 87 PHE C C 221 176.176 176.856 -0.680 1
1 1070 . 11 1 1 A 87 87 PHE CA C 221 61.780 61.580 0.200 1
1 1071 . 11 1 1 A 87 87 PHE CB C 221 37.549 38.015 -0.466 1
1 1075 . 11 1 1 A 87 87 PHE N N 221 112.449 116.911 -4.462 1
1 1076 . 11 1 1 A 88 88 LYS H H 222 7.061 8.049 -0.988 1
1 1077 . 11 1 1 A 88 88 LYS HA H 222 4.380 4.449 -0.069 1
1 1086 . 11 1 1 A 88 88 LYS C C 222 177.089 176.703 0.386 1
1 1087 . 11 1 1 A 88 88 LYS CA C 222 56.726 57.872 -1.146 1
1 1088 . 11 1 1 A 88 88 LYS CB C 222 33.738 32.287 1.451 1
1 1092 . 11 1 1 A 88 88 LYS N N 222 118.308 114.144 4.164 1
1 1093 . 11 1 1 A 89 89 LEU H H 223 7.270 7.178 0.092 1
1 1094 . 11 1 1 A 89 89 LEU HA H 223 4.168 4.204 -0.036 1
1 1104 . 11 1 1 A 89 89 LEU C C 223 177.528 176.864 0.664 1
1 1105 . 11 1 1 A 89 89 LEU CA C 223 55.279 54.605 0.674 1
1 1106 . 11 1 1 A 89 89 LEU CB C 223 43.240 42.262 0.978 1
1 1110 . 11 1 1 A 89 89 LEU N N 223 121.317 122.222 -0.905 1
1 1111 . 11 1 1 A 90 90 LYS H H 224 8.788 8.391 0.397 1
1 1112 . 11 1 1 A 90 90 LYS HA H 224 4.359 4.243 0.116 1
1 1121 . 11 1 1 A 90 90 LYS C C 224 175.839 175.701 0.138 1
1 1122 . 11 1 1 A 90 90 LYS CA C 224 54.772 56.164 -1.392 1
1 1123 . 11 1 1 A 90 90 LYS CB C 224 33.232 33.301 -0.069 1
1 1127 . 11 1 1 A 90 90 LYS N N 224 123.558 123.407 0.151 1
1 1128 . 11 1 1 A 91 91 ASP H H 225 8.125 8.653 -0.528 1
1 1129 . 11 1 1 A 91 91 ASP HA H 225 3.958 4.389 -0.431 1
1 1132 . 11 1 1 A 91 91 ASP C C 225 177.452 176.598 0.854 1
1 1133 . 11 1 1 A 91 91 ASP CA C 225 56.642 55.514 1.128 1
1 1134 . 11 1 1 A 91 91 ASP CB C 225 40.269 40.224 0.045 1
1 1135 . 11 1 1 A 91 91 ASP N N 225 119.419 121.376 -1.957 1
1 1136 . 11 1 1 A 92 92 GLY H H 226 8.681 8.676 0.005 1
1 1137 . 11 1 1 A 92 92 GLY HA2 H 226 4.131 3.889 0.242 1
1 1138 . 11 1 1 A 92 92 GLY HA3 H 226 3.579 3.914 -0.335 1
1 1139 . 11 1 1 A 92 92 GLY C C 226 173.614 173.902 -0.288 1
1 1140 . 11 1 1 A 92 92 GLY CA C 226 45.564 45.074 0.490 1
1 1141 . 11 1 1 A 92 92 GLY N N 226 113.802 111.991 1.811 1
1 1142 . 11 1 1 A 93 93 GLU H H 227 8.104 7.945 0.159 1
1 1143 . 11 1 1 A 93 93 GLU HA H 227 4.232 4.416 -0.184 1
1 1148 . 11 1 1 A 93 93 GLU C C 227 174.282 176.069 -1.787 1
1 1149 . 11 1 1 A 93 93 GLU CA C 227 56.651 56.171 0.480 1
1 1150 . 11 1 1 A 93 93 GLU CB C 227 32.190 31.027 1.163 1
1 1152 . 11 1 1 A 93 93 GLU N N 227 121.527 121.896 -0.369 1
1 1153 . 11 1 1 A 94 94 VAL H H 228 7.918 8.590 -0.672 1
1 1154 . 11 1 1 A 94 94 VAL HA H 228 4.857 4.802 0.055 1
1 1162 . 11 1 1 A 94 94 VAL C C 228 176.556 175.797 0.759 1
1 1163 . 11 1 1 A 94 94 VAL CA C 228 60.309 59.727 0.582 1
1 1164 . 11 1 1 A 94 94 VAL CB C 228 33.847 34.296 -0.449 1
1 1167 . 11 1 1 A 94 94 VAL N N 228 119.768 120.309 -0.541 1
1 1168 . 11 1 1 A 95 95 SER H H 229 9.659 9.147 0.512 1
1 1169 . 11 1 1 A 95 95 SER HA H 229 4.313 4.702 -0.389 1
1 1172 . 11 1 1 A 95 95 SER C C 229 174.641 174.474 0.167 1
1 1173 . 11 1 1 A 95 95 SER CA C 229 59.208 57.671 1.537 1
1 1174 . 11 1 1 A 95 95 SER CB C 229 66.080 65.721 0.359 1
1 1175 . 11 1 1 A 95 95 SER N N 229 124.903 116.180 8.723 1
1 1176 . 11 1 1 A 96 96 GLU H H 230 8.014 8.658 -0.644 1
1 1177 . 11 1 1 A 96 96 GLU HA H 230 4.376 4.428 -0.052 1
1 1182 . 11 1 1 A 96 96 GLU C C 230 176.641 177.177 -0.536 1
1 1183 . 11 1 1 A 96 96 GLU CA C 230 56.236 56.523 -0.287 1
1 1184 . 11 1 1 A 96 96 GLU CB C 230 30.324 30.837 -0.513 1
1 1186 . 11 1 1 A 96 96 GLU N N 230 115.510 120.729 -5.219 1
1 1187 . 11 1 1 A 97 97 VAL H H 231 8.741 8.422 0.319 1
1 1188 . 11 1 1 A 97 97 VAL HA H 231 4.171 4.192 -0.021 1
1 1196 . 11 1 1 A 97 97 VAL C C 231 176.684 175.846 0.838 1
1 1197 . 11 1 1 A 97 97 VAL CA C 231 65.418 63.148 2.270 1
1 1198 . 11 1 1 A 97 97 VAL CB C 231 31.218 31.317 -0.099 1
1 1201 . 11 1 1 A 97 97 VAL N N 231 121.289 121.600 -0.311 1
1 1202 . 11 1 1 A 98 98 VAL H H 232 9.218 9.393 -0.175 1
1 1203 . 11 1 1 A 98 98 VAL HA H 232 4.405 4.644 -0.239 1
1 1211 . 11 1 1 A 98 98 VAL C C 232 174.258 174.557 -0.299 1
1 1212 . 11 1 1 A 98 98 VAL CA C 232 60.937 61.456 -0.519 1
1 1213 . 11 1 1 A 98 98 VAL CB C 232 35.825 33.590 2.235 1
1 1216 . 11 1 1 A 98 98 VAL N N 232 130.544 128.849 1.695 1
1 1217 . 11 1 1 A 99 99 LYS H H 233 8.800 8.751 0.049 1
1 1218 . 11 1 1 A 99 99 LYS HA H 233 4.853 5.351 -0.498 1
1 1227 . 11 1 1 A 99 99 LYS C C 233 175.274 175.210 0.064 1
1 1228 . 11 1 1 A 99 99 LYS CA C 233 55.499 54.541 0.958 1
1 1229 . 11 1 1 A 99 99 LYS CB C 233 34.452 35.737 -1.285 1
1 1233 . 11 1 1 A 99 99 LYS N N 233 130.477 127.532 2.945 1
1 1234 . 11 1 1 A 100 100 SER H H 234 9.585 9.193 0.392 1
1 1235 . 11 1 1 A 100 100 SER HA H 234 5.150 4.940 0.210 1
1 1238 . 11 1 1 A 100 100 SER C C 234 175.493 174.063 1.430 1
1 1239 . 11 1 1 A 100 100 SER CA C 234 56.927 57.553 -0.626 1
1 1240 . 11 1 1 A 100 100 SER CB C 234 67.309 67.457 -0.148 1
1 1241 . 11 1 1 A 100 100 SER N N 234 125.814 122.697 3.117 1
1 1242 . 11 1 1 A 101 101 SER H H 235 8.631 8.838 -0.207 1
1 1243 . 11 1 1 A 101 101 SER HA H 235 4.106 4.081 0.025 1
1 1246 . 11 1 1 A 101 101 SER C C 235 175.385 175.625 -0.240 1
1 1247 . 11 1 1 A 101 101 SER CA C 235 61.123 61.523 -0.400 1
1 1248 . 11 1 1 A 101 101 SER CB C 235 62.818 62.537 0.281 1
1 1249 . 11 1 1 A 101 101 SER N N 235 115.089 117.157 -2.068 1
1 1250 . 11 1 1 A 102 102 PHE H H 236 8.957 7.631 1.326 1
1 1251 . 11 1 1 A 102 102 PHE HA H 236 4.610 4.597 0.013 1
1 1259 . 11 1 1 A 102 102 PHE C C 236 176.453 175.866 0.587 1
1 1260 . 11 1 1 A 102 102 PHE CA C 236 58.382 58.165 0.217 1
1 1261 . 11 1 1 A 102 102 PHE CB C 236 40.275 39.433 0.842 1
1 1263 . 11 1 1 A 102 102 PHE N N 236 119.917 117.909 2.008 1
1 1264 . 11 1 1 A 103 103 GLY H H 237 7.377 7.377 0.000 1
1 1265 . 11 1 1 A 103 103 GLY HA2 H 237 4.453 3.951 0.502 1
1 1266 . 11 1 1 A 103 103 GLY HA3 H 237 3.472 4.118 -0.646 1
1 1267 . 11 1 1 A 103 103 GLY C C 237 169.627 172.356 -2.729 1
1 1268 . 11 1 1 A 103 103 GLY CA C 237 45.384 44.437 0.947 1
1 1269 . 11 1 1 A 103 103 GLY N N 237 108.809 106.191 2.618 1
1 1270 . 11 1 1 A 104 104 TYR H H 238 8.632 8.504 0.128 1
1 1271 . 11 1 1 A 104 104 TYR HA H 238 5.322 5.478 -0.156 1
1 1278 . 11 1 1 A 104 104 TYR C C 238 175.043 175.099 -0.056 1
1 1279 . 11 1 1 A 104 104 TYR CA C 238 57.627 57.544 0.083 1
1 1280 . 11 1 1 A 104 104 TYR CB C 238 41.711 41.682 0.029 1
1 1283 . 11 1 1 A 104 104 TYR N N 238 120.030 121.819 -1.789 1
1 1284 . 11 1 1 A 105 105 HIS H H 239 10.070 9.402 0.668 1
1 1285 . 11 1 1 A 105 105 HIS HA H 239 6.046 5.530 0.516 1
1 1290 . 11 1 1 A 105 105 HIS C C 239 175.734 174.532 1.202 1
1 1291 . 11 1 1 A 105 105 HIS CA C 239 53.945 54.649 -0.704 1
1 1292 . 11 1 1 A 105 105 HIS CB C 239 32.450 34.224 -1.774 1
1 1295 . 11 1 1 A 105 105 HIS N N 239 119.504 118.404 1.100 1
1 1296 . 11 1 1 A 106 106 ILE H H 240 8.660 8.652 0.008 1
1 1297 . 11 1 1 A 106 106 ILE HA H 240 4.120 4.852 -0.732 1
1 1307 . 11 1 1 A 106 106 ILE C C 240 174.758 175.499 -0.741 1
1 1308 . 11 1 1 A 106 106 ILE CA C 240 63.446 59.712 3.734 1
1 1309 . 11 1 1 A 106 106 ILE CB C 240 40.786 41.889 -1.103 1
1 1313 . 11 1 1 A 106 106 ILE N N 240 120.639 119.275 1.364 1
1 1314 . 11 1 1 A 107 107 ILE H H 241 9.033 9.233 -0.200 1
1 1315 . 11 1 1 A 107 107 ILE HA H 241 4.799 5.176 -0.377 1
1 1325 . 11 1 1 A 107 107 ILE C C 241 172.880 174.443 -1.563 1
1 1326 . 11 1 1 A 107 107 ILE CA C 241 60.563 59.673 0.890 1
1 1327 . 11 1 1 A 107 107 ILE CB C 241 41.652 40.837 0.815 1
1 1331 . 11 1 1 A 107 107 ILE N N 241 129.098 127.016 2.082 1
1 1332 . 11 1 1 A 108 108 LYS H H 242 8.692 8.913 -0.221 1
1 1333 . 11 1 1 A 108 108 LYS HA H 242 5.012 5.035 -0.023 1
1 1342 . 11 1 1 A 108 108 LYS C C 242 174.484 175.272 -0.788 1
1 1343 . 11 1 1 A 108 108 LYS CA C 242 54.317 54.074 0.243 1
1 1344 . 11 1 1 A 108 108 LYS CB C 242 35.619 35.445 0.174 1
1 1348 . 11 1 1 A 108 108 LYS N N 242 127.179 126.032 1.147 1
1 1349 . 11 1 1 A 109 109 ALA H H 243 7.816 8.958 -1.142 1
1 1350 . 11 1 1 A 109 109 ALA HA H 243 4.604 4.706 -0.102 1
1 1354 . 11 1 1 A 109 109 ALA C C 243 176.231 176.494 -0.263 1
1 1355 . 11 1 1 A 109 109 ALA CA C 243 50.505 51.099 -0.594 1
1 1356 . 11 1 1 A 109 109 ALA CB C 243 19.584 19.766 -0.182 1
1 1357 . 11 1 1 A 109 109 ALA N N 243 129.619 127.867 1.752 1
1 1358 . 11 1 1 A 110 110 ASP H H 244 7.578 8.408 -0.830 1
1 1359 . 11 1 1 A 110 110 ASP HA H 244 4.424 4.826 -0.402 1
1 1362 . 11 1 1 A 110 110 ASP C C 244 175.259 176.177 -0.918 1
1 1363 . 11 1 1 A 110 110 ASP CA C 244 54.489 52.765 1.724 1
1 1364 . 11 1 1 A 110 110 ASP CB C 244 42.693 42.605 0.088 1
1 1365 . 11 1 1 A 110 110 ASP N N 244 125.434 121.688 3.746 1
1 4 . 12 1 1 A 2 2 PRO HA H -4 4.403 4.532 -0.129 1
1 11 . 12 1 1 A 2 2 PRO C C -4 176.990 176.824 0.166 1
1 12 . 12 1 1 A 2 2 PRO CA C -4 63.131 62.722 0.409 1
1 13 . 12 1 1 A 2 2 PRO CB C -4 32.342 32.455 -0.113 1
1 16 . 12 1 1 A 3 3 LEU H H -3 8.483 8.439 0.044 1
1 17 . 12 1 1 A 3 3 LEU HA H -3 4.333 4.455 -0.122 1
1 27 . 12 1 1 A 3 3 LEU C C -3 177.991 176.664 1.327 1
1 28 . 12 1 1 A 3 3 LEU CA C -3 55.314 54.928 0.386 1
1 29 . 12 1 1 A 3 3 LEU CB C -3 42.244 41.986 0.258 1
1 33 . 12 1 1 A 3 3 LEU N N -3 122.986 119.160 3.826 1
1 34 . 12 1 1 A 4 4 GLY H H -2 8.397 7.918 0.479 1
1 35 . 12 1 1 A 4 4 GLY HA2 H -2 4.024 3.969 0.055 1
1 36 . 12 1 1 A 4 4 GLY HA3 H -2 3.976 3.974 0.002 1
1 37 . 12 1 1 A 4 4 GLY C C -2 174.360 173.509 0.851 1
1 38 . 12 1 1 A 4 4 GLY CA C -2 45.434 45.578 -0.144 1
1 39 . 12 1 1 A 4 4 GLY N N -2 110.666 110.295 0.371 1
1 56 . 12 1 1 A 7 7 SER H H 141 7.913 7.838 0.075 1
1 57 . 12 1 1 A 7 7 SER HA H 141 5.657 5.284 0.373 1
1 60 . 12 1 1 A 7 7 SER C C 141 173.753 172.768 0.985 1
1 61 . 12 1 1 A 7 7 SER CA C 141 56.758 57.758 -1.000 1
1 62 . 12 1 1 A 7 7 SER CB C 141 66.774 65.775 0.999 1
1 63 . 12 1 1 A 7 7 SER N N 141 113.824 112.186 1.638 1
1 64 . 12 1 1 A 8 8 LYS H H 142 8.656 8.716 -0.060 1
1 65 . 12 1 1 A 8 8 LYS HA H 142 4.543 4.879 -0.336 1
1 74 . 12 1 1 A 8 8 LYS C C 142 174.403 174.628 -0.225 1
1 75 . 12 1 1 A 8 8 LYS CA C 142 55.578 55.078 0.500 1
1 76 . 12 1 1 A 8 8 LYS CB C 142 36.561 35.934 0.627 1
1 80 . 12 1 1 A 8 8 LYS N N 142 123.076 122.080 0.996 1
1 81 . 12 1 1 A 9 9 LYS H H 143 8.623 8.606 0.017 1
1 82 . 12 1 1 A 9 9 LYS HA H 143 4.119 4.430 -0.311 1
1 91 . 12 1 1 A 9 9 LYS C C 143 176.144 175.652 0.492 1
1 92 . 12 1 1 A 9 9 LYS CA C 143 56.683 56.136 0.547 1
1 93 . 12 1 1 A 9 9 LYS CB C 143 32.580 32.700 -0.120 1
1 97 . 12 1 1 A 9 9 LYS N N 143 129.542 127.634 1.908 1
1 98 . 12 1 1 A 10 10 ALA H H 144 8.151 8.752 -0.601 1
1 99 . 12 1 1 A 10 10 ALA HA H 144 5.208 5.025 0.183 1
1 103 . 12 1 1 A 10 10 ALA C C 144 175.577 174.965 0.612 1
1 104 . 12 1 1 A 10 10 ALA CA C 144 51.226 51.129 0.097 1
1 105 . 12 1 1 A 10 10 ALA CB C 144 25.299 24.270 1.029 1
1 106 . 12 1 1 A 10 10 ALA N N 144 127.933 127.995 -0.062 1
1 107 . 12 1 1 A 11 11 SER H H 145 8.679 8.839 -0.160 1
1 108 . 12 1 1 A 11 11 SER HA H 145 5.431 5.756 -0.325 1
1 111 . 12 1 1 A 11 11 SER C C 145 173.072 173.169 -0.097 1
1 112 . 12 1 1 A 11 11 SER CA C 145 57.772 56.969 0.803 1
1 113 . 12 1 1 A 11 11 SER CB C 145 67.301 66.139 1.162 1
1 114 . 12 1 1 A 11 11 SER N N 145 116.245 115.233 1.012 1
1 115 . 12 1 1 A 12 12 HIS H H 146 9.962 9.489 0.473 1
1 116 . 12 1 1 A 12 12 HIS HA H 146 6.332 5.999 0.333 1
1 121 . 12 1 1 A 12 12 HIS C C 146 173.006 172.395 0.611 1
1 122 . 12 1 1 A 12 12 HIS CA C 146 55.020 54.337 0.683 1
1 123 . 12 1 1 A 12 12 HIS CB C 146 37.071 33.013 4.058 1
1 126 . 12 1 1 A 12 12 HIS N N 146 119.181 118.491 0.690 1
1 127 . 12 1 1 A 13 13 ILE H H 147 8.976 8.981 -0.005 1
1 128 . 12 1 1 A 13 13 ILE HA H 147 3.528 4.582 -1.054 1
1 138 . 12 1 1 A 13 13 ILE C C 147 173.010 173.824 -0.814 1
1 139 . 12 1 1 A 13 13 ILE CA C 147 61.273 59.529 1.744 1
1 140 . 12 1 1 A 13 13 ILE CB C 147 41.773 41.508 0.265 1
1 144 . 12 1 1 A 13 13 ILE N N 147 121.873 119.314 2.559 1
1 145 . 12 1 1 A 14 14 LEU H H 148 7.627 8.974 -1.347 1
1 146 . 12 1 1 A 14 14 LEU HA H 148 4.814 4.959 -0.145 1
1 156 . 12 1 1 A 14 14 LEU C C 148 174.112 174.323 -0.211 1
1 157 . 12 1 1 A 14 14 LEU CA C 148 52.574 52.899 -0.325 1
1 158 . 12 1 1 A 14 14 LEU CB C 148 45.643 45.061 0.582 1
1 162 . 12 1 1 A 14 14 LEU N N 148 127.112 129.368 -2.256 1
1 163 . 12 1 1 A 15 15 ILE H H 149 9.524 9.296 0.228 1
1 164 . 12 1 1 A 15 15 ILE HA H 149 4.362 4.681 -0.319 1
1 174 . 12 1 1 A 15 15 ILE C C 149 175.452 175.413 0.039 1
1 175 . 12 1 1 A 15 15 ILE CA C 149 58.516 60.352 -1.836 1
1 176 . 12 1 1 A 15 15 ILE CB C 149 36.560 39.977 -3.417 1
1 180 . 12 1 1 A 15 15 ILE N N 149 128.652 126.510 2.142 1
1 181 . 12 1 1 A 16 16 LYS H H 150 8.035 8.394 -0.359 1
1 182 . 12 1 1 A 16 16 LYS HA H 150 4.319 4.431 -0.112 1
1 191 . 12 1 1 A 16 16 LYS C C 150 175.038 176.313 -1.275 1
1 192 . 12 1 1 A 16 16 LYS CA C 150 57.817 56.487 1.330 1
1 193 . 12 1 1 A 16 16 LYS CB C 150 34.853 33.093 1.760 1
1 197 . 12 1 1 A 16 16 LYS N N 150 129.153 127.838 1.315 1
1 198 . 12 1 1 A 17 17 VAL H H 151 8.016 8.842 -0.826 1
1 199 . 12 1 1 A 17 17 VAL HA H 151 4.873 4.657 0.216 1
1 207 . 12 1 1 A 17 17 VAL C C 151 176.647 175.613 1.034 1
1 208 . 12 1 1 A 17 17 VAL CA C 151 60.088 61.146 -1.058 1
1 209 . 12 1 1 A 17 17 VAL CB C 151 34.082 34.107 -0.025 1
1 212 . 12 1 1 A 17 17 VAL N N 151 121.288 123.356 -2.068 1
1 213 . 12 1 1 A 18 18 LYS H H 152 8.443 8.683 -0.240 1
1 214 . 12 1 1 A 18 18 LYS HA H 152 4.334 4.318 0.016 1
1 223 . 12 1 1 A 18 18 LYS C C 152 176.345 177.210 -0.865 1
1 224 . 12 1 1 A 18 18 LYS CA C 152 57.016 56.907 0.109 1
1 225 . 12 1 1 A 18 18 LYS CB C 152 33.222 32.614 0.608 1
1 229 . 12 1 1 A 18 18 LYS N N 152 128.408 126.826 1.582 1
1 230 . 12 1 1 A 19 19 SER H H 153 9.067 8.749 0.318 1
1 231 . 12 1 1 A 19 19 SER HA H 153 4.457 4.608 -0.151 1
1 234 . 12 1 1 A 19 19 SER C C 153 174.236 174.166 0.070 1
1 235 . 12 1 1 A 19 19 SER CA C 153 59.642 59.203 0.439 1
1 236 . 12 1 1 A 19 19 SER CB C 153 64.347 64.469 -0.122 1
1 237 . 12 1 1 A 19 19 SER N N 153 121.522 117.343 4.179 1
1 238 . 12 1 1 A 20 20 LYS H H 154 7.961 7.529 0.432 1
1 239 . 12 1 1 A 20 20 LYS HA H 154 4.558 4.729 -0.171 1
1 244 . 12 1 1 A 20 20 LYS C C 154 177.256 176.729 0.527 1
1 245 . 12 1 1 A 20 20 LYS CA C 154 55.249 54.756 0.493 1
1 246 . 12 1 1 A 20 20 LYS CB C 154 34.531 36.045 -1.514 1
1 248 . 12 1 1 A 20 20 LYS N N 154 120.270 118.668 1.602 1
1 249 . 12 1 1 A 21 21 LYS HA H 155 4.003 4.011 -0.008 1
1 258 . 12 1 1 A 21 21 LYS C C 155 177.015 178.140 -1.125 1
1 259 . 12 1 1 A 21 21 LYS CA C 155 59.091 59.340 -0.249 1
1 260 . 12 1 1 A 21 21 LYS CB C 155 32.394 32.091 0.303 1
1 264 . 12 1 1 A 22 22 SER H H 156 7.625 7.741 -0.116 1
1 265 . 12 1 1 A 22 22 SER HA H 156 4.293 4.532 -0.239 1
1 268 . 12 1 1 A 22 22 SER C C 156 174.843 173.884 0.959 1
1 269 . 12 1 1 A 22 22 SER CA C 156 57.966 58.661 -0.695 1
1 270 . 12 1 1 A 22 22 SER CB C 156 63.369 63.593 -0.224 1
1 271 . 12 1 1 A 22 22 SER N N 156 109.549 112.498 -2.949 1
1 272 . 12 1 1 A 23 23 ASP H H 157 7.701 7.474 0.227 1
1 273 . 12 1 1 A 23 23 ASP HA H 157 4.548 4.610 -0.062 1
1 276 . 12 1 1 A 23 23 ASP C C 157 176.544 176.105 0.439 1
1 277 . 12 1 1 A 23 23 ASP CA C 157 55.242 54.387 0.855 1
1 278 . 12 1 1 A 23 23 ASP CB C 157 41.103 42.041 -0.938 1
1 279 . 12 1 1 A 23 23 ASP N N 157 124.536 122.928 1.608 1
1 280 . 12 1 1 A 24 24 LYS H H 158 8.583 8.688 -0.105 1
1 281 . 12 1 1 A 24 24 LYS HA H 158 4.252 4.576 -0.324 1
1 290 . 12 1 1 A 24 24 LYS C C 158 176.813 176.755 0.058 1
1 291 . 12 1 1 A 24 24 LYS CA C 158 57.148 55.983 1.165 1
1 292 . 12 1 1 A 24 24 LYS CB C 158 33.200 33.410 -0.210 1
1 296 . 12 1 1 A 24 24 LYS N N 158 122.372 122.603 -0.231 1
1 297 . 12 1 1 A 25 25 GLU H H 159 8.001 8.350 -0.349 1
1 298 . 12 1 1 A 25 25 GLU HA H 159 4.521 4.072 0.449 1
1 303 . 12 1 1 A 25 25 GLU C C 159 175.995 176.642 -0.647 1
1 304 . 12 1 1 A 25 25 GLU CA C 159 55.727 59.251 -3.524 1
1 305 . 12 1 1 A 25 25 GLU CB C 159 31.918 30.294 1.624 1
1 307 . 12 1 1 A 25 25 GLU N N 159 118.705 120.598 -1.893 1
1 308 . 12 1 1 A 26 26 GLY H H 160 8.458 7.782 0.676 1
1 309 . 12 1 1 A 26 26 GLY HA2 H 160 3.946 4.080 -0.134 1
1 310 . 12 1 1 A 26 26 GLY HA3 H 160 3.511 4.091 -0.580 1
1 311 . 12 1 1 A 26 26 GLY C C 160 172.201 173.001 -0.800 1
1 312 . 12 1 1 A 26 26 GLY CA C 160 44.038 45.200 -1.162 1
1 313 . 12 1 1 A 26 26 GLY N N 160 107.642 107.013 0.629 1
1 314 . 12 1 1 A 27 27 LEU H H 161 8.259 8.707 -0.448 1
1 315 . 12 1 1 A 27 27 LEU HA H 161 4.775 4.865 -0.090 1
1 325 . 12 1 1 A 27 27 LEU C C 161 177.422 176.758 0.664 1
1 326 . 12 1 1 A 27 27 LEU CA C 161 53.322 53.632 -0.310 1
1 327 . 12 1 1 A 27 27 LEU CB C 161 45.576 43.083 2.493 1
1 331 . 12 1 1 A 27 27 LEU N N 161 119.856 122.006 -2.150 1
1 332 . 12 1 1 A 28 28 ASP H H 162 8.848 8.726 0.122 1
1 333 . 12 1 1 A 28 28 ASP HA H 162 4.644 4.677 -0.033 1
1 336 . 12 1 1 A 28 28 ASP C C 162 176.630 177.454 -0.824 1
1 337 . 12 1 1 A 28 28 ASP CA C 162 55.195 54.475 0.720 1
1 338 . 12 1 1 A 28 28 ASP CB C 162 41.673 41.816 -0.143 1
1 339 . 12 1 1 A 28 28 ASP N N 162 122.434 120.794 1.640 1
1 340 . 12 1 1 A 29 29 ASP H H 163 8.720 9.100 -0.380 1
1 341 . 12 1 1 A 29 29 ASP HA H 163 4.386 4.437 -0.051 1
1 344 . 12 1 1 A 29 29 ASP C C 163 176.604 178.619 -2.015 1
1 345 . 12 1 1 A 29 29 ASP CA C 163 59.690 57.107 2.583 1
1 346 . 12 1 1 A 29 29 ASP CB C 163 42.964 39.909 3.055 1
1 347 . 12 1 1 A 29 29 ASP N N 163 121.460 122.695 -1.235 1
1 348 . 12 1 1 A 30 30 LYS H H 164 8.434 8.052 0.382 1
1 349 . 12 1 1 A 30 30 LYS HA H 164 3.901 4.114 -0.213 1
1 358 . 12 1 1 A 30 30 LYS C C 164 179.479 179.323 0.156 1
1 359 . 12 1 1 A 30 30 LYS CA C 164 60.047 59.458 0.589 1
1 360 . 12 1 1 A 30 30 LYS CB C 164 32.038 32.023 0.015 1
1 364 . 12 1 1 A 30 30 LYS N N 164 116.627 119.335 -2.708 1
1 365 . 12 1 1 A 31 31 GLU H H 165 7.755 8.007 -0.252 1
1 366 . 12 1 1 A 31 31 GLU HA H 165 3.998 3.987 0.011 1
1 371 . 12 1 1 A 31 31 GLU C C 165 179.031 179.289 -0.258 1
1 372 . 12 1 1 A 31 31 GLU CA C 165 59.335 59.299 0.036 1
1 373 . 12 1 1 A 31 31 GLU CB C 165 29.972 29.282 0.690 1
1 375 . 12 1 1 A 31 31 GLU N N 165 120.456 120.291 0.165 1
1 376 . 12 1 1 A 32 32 ALA H H 166 9.060 8.536 0.524 1
1 377 . 12 1 1 A 32 32 ALA HA H 166 3.871 4.004 -0.133 1
1 381 . 12 1 1 A 32 32 ALA C C 166 178.029 179.106 -1.077 1
1 382 . 12 1 1 A 32 32 ALA CA C 166 54.997 55.482 -0.485 1
1 383 . 12 1 1 A 32 32 ALA CB C 166 19.727 18.394 1.333 1
1 384 . 12 1 1 A 32 32 ALA N N 166 124.406 122.343 2.063 1
1 385 . 12 1 1 A 33 33 LYS H H 167 8.228 7.711 0.517 1
1 386 . 12 1 1 A 33 33 LYS HA H 167 2.595 2.982 -0.387 1
1 395 . 12 1 1 A 33 33 LYS C C 167 177.938 178.266 -0.328 1
1 396 . 12 1 1 A 33 33 LYS CA C 167 59.573 59.295 0.278 1
1 397 . 12 1 1 A 33 33 LYS CB C 167 32.098 32.118 -0.020 1
1 401 . 12 1 1 A 33 33 LYS N N 167 119.833 118.171 1.662 1
1 402 . 12 1 1 A 34 34 GLN H H 168 7.392 7.615 -0.223 1
1 403 . 12 1 1 A 34 34 GLN HA H 168 3.943 3.884 0.059 1
1 410 . 12 1 1 A 34 34 GLN C C 168 178.323 178.376 -0.053 1
1 411 . 12 1 1 A 34 34 GLN CA C 168 58.883 59.468 -0.585 1
1 412 . 12 1 1 A 34 34 GLN CB C 168 28.485 28.097 0.388 1
1 414 . 12 1 1 A 34 34 GLN N N 168 117.208 117.934 -0.726 1
1 416 . 12 1 1 A 35 35 LYS H H 169 7.994 8.160 -0.166 1
1 417 . 12 1 1 A 35 35 LYS HA H 169 4.067 4.027 0.040 1
1 426 . 12 1 1 A 35 35 LYS C C 169 178.161 178.426 -0.265 1
1 427 . 12 1 1 A 35 35 LYS CA C 169 58.437 58.923 -0.486 1
1 428 . 12 1 1 A 35 35 LYS CB C 169 31.611 32.125 -0.514 1
1 432 . 12 1 1 A 35 35 LYS N N 169 120.898 119.456 1.442 1
1 433 . 12 1 1 A 36 36 ALA H H 170 8.431 8.314 0.117 1
1 434 . 12 1 1 A 36 36 ALA HA H 170 3.738 4.020 -0.282 1
1 438 . 12 1 1 A 36 36 ALA C C 170 178.862 179.530 -0.668 1
1 439 . 12 1 1 A 36 36 ALA CA C 170 55.351 54.919 0.432 1
1 440 . 12 1 1 A 36 36 ALA CB C 170 18.295 18.237 0.058 1
1 441 . 12 1 1 A 36 36 ALA N N 170 120.641 120.680 -0.039 1
1 442 . 12 1 1 A 37 37 GLU H H 171 8.412 8.082 0.330 1
1 443 . 12 1 1 A 37 37 GLU HA H 171 3.867 3.945 -0.078 1
1 448 . 12 1 1 A 37 37 GLU C C 171 179.255 179.022 0.233 1
1 449 . 12 1 1 A 37 37 GLU CA C 171 59.543 59.610 -0.067 1
1 450 . 12 1 1 A 37 37 GLU CB C 171 29.569 29.701 -0.132 1
1 452 . 12 1 1 A 37 37 GLU N N 171 118.224 117.837 0.387 1
1 453 . 12 1 1 A 38 38 GLU H H 172 8.019 8.332 -0.313 1
1 454 . 12 1 1 A 38 38 GLU HA H 172 3.952 4.065 -0.113 1
1 459 . 12 1 1 A 38 38 GLU C C 172 180.250 178.453 1.797 1
1 460 . 12 1 1 A 38 38 GLU CA C 172 59.627 59.038 0.589 1
1 461 . 12 1 1 A 38 38 GLU CB C 172 29.368 28.837 0.531 1
1 463 . 12 1 1 A 38 38 GLU N N 172 121.250 118.358 2.892 1
1 464 . 12 1 1 A 39 39 ILE H H 173 8.174 7.373 0.801 1
1 465 . 12 1 1 A 39 39 ILE HA H 173 3.643 3.796 -0.153 1
1 475 . 12 1 1 A 39 39 ILE C C 173 177.568 178.030 -0.462 1
1 476 . 12 1 1 A 39 39 ILE CA C 173 64.869 63.967 0.902 1
1 477 . 12 1 1 A 39 39 ILE CB C 173 38.160 37.419 0.741 1
1 481 . 12 1 1 A 39 39 ILE N N 173 121.527 117.378 4.149 1
1 482 . 12 1 1 A 40 40 GLN H H 174 8.860 8.373 0.487 1
1 483 . 12 1 1 A 40 40 GLN HA H 174 3.533 4.003 -0.470 1
1 490 . 12 1 1 A 40 40 GLN C C 174 179.022 178.565 0.457 1
1 491 . 12 1 1 A 40 40 GLN CA C 174 61.316 59.445 1.871 1
1 492 . 12 1 1 A 40 40 GLN CB C 174 26.604 28.581 -1.977 1
1 494 . 12 1 1 A 40 40 GLN N N 174 121.956 121.039 0.917 1
1 496 . 12 1 1 A 41 41 LYS H H 175 7.879 7.901 -0.022 1
1 497 . 12 1 1 A 41 41 LYS HA H 175 3.777 4.082 -0.305 1
1 506 . 12 1 1 A 41 41 LYS C C 175 178.779 178.215 0.564 1
1 507 . 12 1 1 A 41 41 LYS CA C 175 59.701 58.858 0.843 1
1 508 . 12 1 1 A 41 41 LYS CB C 175 32.581 32.169 0.412 1
1 512 . 12 1 1 A 41 41 LYS N N 175 119.012 117.842 1.170 1
1 513 . 12 1 1 A 42 42 GLU H H 176 7.447 7.779 -0.332 1
1 514 . 12 1 1 A 42 42 GLU HA H 176 4.059 4.343 -0.284 1
1 519 . 12 1 1 A 42 42 GLU C C 176 180.058 178.957 1.101 1
1 520 . 12 1 1 A 42 42 GLU CA C 176 59.456 58.270 1.186 1
1 521 . 12 1 1 A 42 42 GLU CB C 176 29.923 30.519 -0.596 1
1 523 . 12 1 1 A 42 42 GLU N N 176 120.054 118.349 1.705 1
1 524 . 12 1 1 A 43 43 VAL H H 177 8.618 8.184 0.434 1
1 525 . 12 1 1 A 43 43 VAL HA H 177 3.986 3.892 0.094 1
1 533 . 12 1 1 A 43 43 VAL C C 177 176.459 177.533 -1.074 1
1 534 . 12 1 1 A 43 43 VAL CA C 177 63.923 64.750 -0.827 1
1 535 . 12 1 1 A 43 43 VAL CB C 177 31.899 31.166 0.733 1
1 538 . 12 1 1 A 43 43 VAL N N 177 114.191 117.240 -3.049 1
1 539 . 12 1 1 A 44 44 SER H H 178 8.052 8.199 -0.147 1
1 540 . 12 1 1 A 44 44 SER HA H 178 4.098 4.313 -0.215 1
1 543 . 12 1 1 A 44 44 SER C C 178 176.548 176.038 0.510 1
1 544 . 12 1 1 A 44 44 SER CA C 178 61.160 61.099 0.061 1
1 545 . 12 1 1 A 44 44 SER CB C 178 62.959 62.757 0.202 1
1 546 . 12 1 1 A 44 44 SER N N 178 114.202 115.946 -1.744 1
1 547 . 12 1 1 A 45 45 LYS H H 179 7.083 8.159 -1.076 1
1 548 . 12 1 1 A 45 45 LYS HA H 179 4.140 4.186 -0.046 1
1 557 . 12 1 1 A 45 45 LYS C C 179 177.288 176.148 1.140 1
1 558 . 12 1 1 A 45 45 LYS CA C 179 58.469 57.977 0.492 1
1 559 . 12 1 1 A 45 45 LYS CB C 179 32.671 31.453 1.218 1
1 563 . 12 1 1 A 45 45 LYS N N 179 120.935 118.151 2.784 1
1 564 . 12 1 1 A 46 46 ASP H H 180 7.098 7.930 -0.832 1
1 565 . 12 1 1 A 46 46 ASP HA H 180 4.917 4.998 -0.081 1
1 568 . 12 1 1 A 46 46 ASP CA C 180 51.492 51.554 -0.062 1
1 569 . 12 1 1 A 46 46 ASP CB C 180 40.595 41.413 -0.818 1
1 570 . 12 1 1 A 46 46 ASP N N 180 112.836 120.401 -7.565 1
1 571 . 12 1 1 A 47 47 PRO HA H 181 4.681 4.441 0.240 1
1 578 . 12 1 1 A 47 47 PRO C C 181 179.248 177.938 1.310 1
1 579 . 12 1 1 A 47 47 PRO CA C 181 64.718 64.622 0.096 1
1 580 . 12 1 1 A 47 47 PRO CB C 181 32.159 31.999 0.160 1
1 583 . 12 1 1 A 48 48 SER H H 182 8.248 7.843 0.405 1
1 584 . 12 1 1 A 48 48 SER HA H 182 4.378 4.309 0.069 1
1 587 . 12 1 1 A 48 48 SER C C 182 176.071 175.323 0.748 1
1 588 . 12 1 1 A 48 48 SER CA C 182 61.377 60.826 0.551 1
1 589 . 12 1 1 A 48 48 SER CB C 182 62.455 63.196 -0.741 1
1 590 . 12 1 1 A 48 48 SER N N 182 116.986 112.972 4.014 1
1 591 . 12 1 1 A 49 49 LYS H H 183 7.842 7.545 0.297 1
1 592 . 12 1 1 A 49 49 LYS HA H 183 4.482 4.335 0.147 1
1 601 . 12 1 1 A 49 49 LYS C C 183 175.605 177.515 -1.910 1
1 602 . 12 1 1 A 49 49 LYS CA C 183 55.824 56.628 -0.804 1
1 603 . 12 1 1 A 49 49 LYS CB C 183 32.834 32.794 0.040 1
1 607 . 12 1 1 A 49 49 LYS N N 183 121.698 119.436 2.262 1
1 608 . 12 1 1 A 50 50 PHE H H 184 7.634 7.948 -0.314 1
1 609 . 12 1 1 A 50 50 PHE HA H 184 3.510 4.209 -0.699 1
1 617 . 12 1 1 A 50 50 PHE C C 184 176.214 177.617 -1.403 1
1 618 . 12 1 1 A 50 50 PHE CA C 184 63.276 61.070 2.206 1
1 619 . 12 1 1 A 50 50 PHE CB C 184 40.948 39.166 1.782 1
1 623 . 12 1 1 A 50 50 PHE N N 184 120.120 121.476 -1.356 1
1 624 . 12 1 1 A 51 51 GLY H H 185 8.855 8.591 0.264 1
1 625 . 12 1 1 A 51 51 GLY HA2 H 185 3.993 3.845 0.148 1
1 626 . 12 1 1 A 51 51 GLY HA3 H 185 3.958 3.897 0.061 1
1 627 . 12 1 1 A 51 51 GLY C C 185 175.169 176.155 -0.986 1
1 628 . 12 1 1 A 51 51 GLY CA C 185 47.475 47.616 -0.141 1
1 629 . 12 1 1 A 51 51 GLY N N 185 105.550 106.194 -0.644 1
1 630 . 12 1 1 A 52 52 GLU H H 186 7.917 7.980 -0.063 1
1 631 . 12 1 1 A 52 52 GLU HA H 186 4.006 4.035 -0.029 1
1 636 . 12 1 1 A 52 52 GLU C C 186 179.499 179.568 -0.069 1
1 637 . 12 1 1 A 52 52 GLU CA C 186 58.904 59.236 -0.332 1
1 638 . 12 1 1 A 52 52 GLU CB C 186 29.700 29.850 -0.150 1
1 640 . 12 1 1 A 52 52 GLU N N 186 121.929 121.739 0.190 1
1 641 . 12 1 1 A 53 53 ILE H H 187 7.936 8.033 -0.097 1
1 642 . 12 1 1 A 53 53 ILE HA H 187 3.648 3.758 -0.110 1
1 652 . 12 1 1 A 53 53 ILE C C 187 177.886 177.880 0.006 1
1 653 . 12 1 1 A 53 53 ILE CA C 187 64.366 64.541 -0.175 1
1 654 . 12 1 1 A 53 53 ILE CB C 187 36.478 37.359 -0.881 1
1 658 . 12 1 1 A 53 53 ILE N N 187 120.991 120.949 0.042 1
1 659 . 12 1 1 A 54 54 ALA H H 188 8.895 8.567 0.328 1
1 660 . 12 1 1 A 54 54 ALA HA H 188 3.629 3.765 -0.136 1
1 664 . 12 1 1 A 54 54 ALA C C 188 179.437 179.432 0.005 1
1 665 . 12 1 1 A 54 54 ALA CA C 188 55.974 55.584 0.390 1
1 666 . 12 1 1 A 54 54 ALA CB C 188 17.591 18.410 -0.819 1
1 667 . 12 1 1 A 54 54 ALA N N 188 125.308 122.053 3.255 1
1 668 . 12 1 1 A 55 55 LYS H H 189 8.049 7.645 0.404 1
1 669 . 12 1 1 A 55 55 LYS HA H 189 4.106 3.941 0.165 1
1 678 . 12 1 1 A 55 55 LYS C C 189 178.995 177.806 1.189 1
1 679 . 12 1 1 A 55 55 LYS CA C 189 59.312 59.003 0.309 1
1 680 . 12 1 1 A 55 55 LYS CB C 189 32.647 31.840 0.807 1
1 684 . 12 1 1 A 55 55 LYS N N 189 116.835 118.426 -1.591 1
1 685 . 12 1 1 A 56 56 LYS H H 190 7.215 7.711 -0.496 1
1 686 . 12 1 1 A 56 56 LYS HA H 190 4.172 4.328 -0.156 1
1 695 . 12 1 1 A 56 56 LYS C C 190 177.897 178.096 -0.199 1
1 696 . 12 1 1 A 56 56 LYS CA C 190 58.418 57.518 0.900 1
1 697 . 12 1 1 A 56 56 LYS CB C 190 34.652 33.408 1.244 1
1 701 . 12 1 1 A 56 56 LYS N N 190 117.170 118.261 -1.091 1
1 702 . 12 1 1 A 57 57 GLU H H 191 8.572 7.965 0.607 1
1 703 . 12 1 1 A 57 57 GLU HA H 191 4.643 4.361 0.282 1
1 708 . 12 1 1 A 57 57 GLU C C 191 177.903 176.049 1.854 1
1 709 . 12 1 1 A 57 57 GLU CA C 191 55.708 56.094 -0.386 1
1 710 . 12 1 1 A 57 57 GLU CB C 191 32.460 30.879 1.581 1
1 712 . 12 1 1 A 57 57 GLU N N 191 113.316 116.900 -3.584 1
1 713 . 12 1 1 A 58 58 SER H H 192 8.550 7.710 0.840 1
1 714 . 12 1 1 A 58 58 SER HA H 192 4.149 4.388 -0.239 1
1 717 . 12 1 1 A 58 58 SER C C 192 176.161 174.995 1.166 1
1 718 . 12 1 1 A 58 58 SER CA C 192 58.403 58.011 0.392 1
1 719 . 12 1 1 A 58 58 SER CB C 192 64.392 64.370 0.022 1
1 720 . 12 1 1 A 58 58 SER N N 192 109.861 115.673 -5.812 1
1 721 . 12 1 1 A 59 59 MET H H 193 9.533 8.892 0.641 1
1 722 . 12 1 1 A 59 59 MET HA H 193 4.457 4.602 -0.145 1
1 730 . 12 1 1 A 59 59 MET C C 193 175.204 175.564 -0.360 1
1 731 . 12 1 1 A 59 59 MET CA C 193 55.781 55.826 -0.045 1
1 732 . 12 1 1 A 59 59 MET CB C 193 32.855 32.792 0.063 1
1 735 . 12 1 1 A 59 59 MET N N 193 124.493 123.279 1.214 1
1 736 . 12 1 1 A 60 60 ASP H H 194 7.514 7.351 0.163 1
1 737 . 12 1 1 A 60 60 ASP HA H 194 4.886 4.594 0.292 1
1 740 . 12 1 1 A 60 60 ASP C C 194 175.517 176.688 -1.171 1
1 741 . 12 1 1 A 60 60 ASP CA C 194 52.286 53.138 -0.852 1
1 742 . 12 1 1 A 60 60 ASP CB C 194 40.222 40.537 -0.315 1
1 743 . 12 1 1 A 60 60 ASP N N 194 117.785 121.667 -3.882 1
1 744 . 12 1 1 A 61 61 THR H H 195 8.118 8.396 -0.278 1
1 745 . 12 1 1 A 61 61 THR HA H 195 3.918 3.953 -0.035 1
1 750 . 12 1 1 A 61 61 THR C C 195 176.269 177.068 -0.799 1
1 751 . 12 1 1 A 61 61 THR CA C 195 65.469 65.246 0.223 1
1 752 . 12 1 1 A 61 61 THR CB C 195 68.741 68.468 0.273 1
1 754 . 12 1 1 A 61 61 THR N N 195 120.765 118.742 2.023 1
1 755 . 12 1 1 A 62 62 GLY H H 196 8.399 8.484 -0.085 1
1 756 . 12 1 1 A 62 62 GLY HA2 H 196 3.932 3.866 0.066 1
1 757 . 12 1 1 A 62 62 GLY HA3 H 196 3.900 3.868 0.032 1
1 758 . 12 1 1 A 62 62 GLY C C 196 174.948 176.498 -1.550 1
1 759 . 12 1 1 A 62 62 GLY CA C 196 46.768 47.269 -0.501 1
1 760 . 12 1 1 A 62 62 GLY N N 196 108.183 111.342 -3.159 1
1 761 . 12 1 1 A 63 63 SER H H 197 7.265 7.983 -0.718 1
1 762 . 12 1 1 A 63 63 SER HA H 197 4.554 4.402 0.152 1
1 765 . 12 1 1 A 63 63 SER C C 197 177.630 176.221 1.409 1
1 766 . 12 1 1 A 63 63 SER CA C 197 59.550 61.816 -2.266 1
1 767 . 12 1 1 A 63 63 SER CB C 197 65.504 63.738 1.766 1
1 768 . 12 1 1 A 63 63 SER N N 197 111.815 118.377 -6.562 1
1 769 . 12 1 1 A 64 64 ALA H H 198 8.675 8.500 0.175 1
1 770 . 12 1 1 A 64 64 ALA HA H 198 3.801 4.014 -0.213 1
1 774 . 12 1 1 A 64 64 ALA C C 198 178.492 179.242 -0.750 1
1 775 . 12 1 1 A 64 64 ALA CA C 198 56.794 55.463 1.331 1
1 776 . 12 1 1 A 64 64 ALA CB C 198 18.951 18.233 0.718 1
1 777 . 12 1 1 A 64 64 ALA N N 198 131.710 123.477 8.233 1
1 778 . 12 1 1 A 65 65 LYS H H 199 7.666 7.672 -0.006 1
1 779 . 12 1 1 A 65 65 LYS HA H 199 4.175 3.934 0.241 1
1 788 . 12 1 1 A 65 65 LYS C C 199 177.159 178.304 -1.145 1
1 789 . 12 1 1 A 65 65 LYS CA C 199 57.735 59.261 -1.526 1
1 790 . 12 1 1 A 65 65 LYS CB C 199 31.948 31.842 0.106 1
1 794 . 12 1 1 A 65 65 LYS N N 199 111.375 118.426 -7.051 1
1 795 . 12 1 1 A 66 66 LYS H H 200 7.545 7.718 -0.173 1
1 796 . 12 1 1 A 66 66 LYS HA H 200 4.612 4.405 0.207 1
1 805 . 12 1 1 A 66 66 LYS C C 200 175.609 175.792 -0.183 1
1 806 . 12 1 1 A 66 66 LYS CA C 200 54.468 56.760 -2.292 1
1 807 . 12 1 1 A 66 66 LYS CB C 200 31.525 33.098 -1.573 1
1 811 . 12 1 1 A 66 66 LYS N N 200 121.421 119.091 2.330 1
1 812 . 12 1 1 A 67 67 ASP H H 201 7.630 8.303 -0.673 1
1 813 . 12 1 1 A 67 67 ASP HA H 201 4.306 4.422 -0.116 1
1 816 . 12 1 1 A 67 67 ASP C C 201 175.025 176.346 -1.321 1
1 817 . 12 1 1 A 67 67 ASP CA C 201 56.400 55.366 1.034 1
1 818 . 12 1 1 A 67 67 ASP CB C 201 38.315 38.986 -0.671 1
1 819 . 12 1 1 A 67 67 ASP N N 201 116.216 117.111 -0.895 1
1 820 . 12 1 1 A 68 68 GLY H H 202 8.368 8.546 -0.178 1
1 821 . 12 1 1 A 68 68 GLY HA2 H 202 4.316 3.940 0.376 1
1 822 . 12 1 1 A 68 68 GLY HA3 H 202 3.731 4.019 -0.288 1
1 823 . 12 1 1 A 68 68 GLY C C 202 174.139 174.563 -0.424 1
1 824 . 12 1 1 A 68 68 GLY CA C 202 45.514 45.303 0.211 1
1 825 . 12 1 1 A 68 68 GLY N N 202 105.095 104.927 0.168 1
1 826 . 12 1 1 A 69 69 GLU H H 203 7.534 8.109 -0.575 1
1 827 . 12 1 1 A 69 69 GLU HA H 203 4.479 4.452 0.027 1
1 832 . 12 1 1 A 69 69 GLU C C 203 176.961 176.059 0.902 1
1 833 . 12 1 1 A 69 69 GLU CA C 203 58.549 56.313 2.236 1
1 834 . 12 1 1 A 69 69 GLU CB C 203 30.998 30.664 0.334 1
1 836 . 12 1 1 A 69 69 GLU N N 203 120.426 119.688 0.738 1
1 837 . 12 1 1 A 70 70 LEU H H 204 8.962 9.118 -0.156 1
1 838 . 12 1 1 A 70 70 LEU HA H 204 4.438 4.631 -0.193 1
1 848 . 12 1 1 A 70 70 LEU C C 204 178.648 177.215 1.433 1
1 849 . 12 1 1 A 70 70 LEU CA C 204 53.977 55.148 -1.171 1
1 850 . 12 1 1 A 70 70 LEU CB C 204 43.612 43.636 -0.024 1
1 854 . 12 1 1 A 70 70 LEU N N 204 122.066 123.744 -1.678 1
1 855 . 12 1 1 A 71 71 GLY H H 205 8.104 7.583 0.521 1
1 856 . 12 1 1 A 71 71 GLY HA2 H 205 4.165 3.963 0.202 1
1 857 . 12 1 1 A 71 71 GLY HA3 H 205 3.552 4.087 -0.535 1
1 858 . 12 1 1 A 71 71 GLY C C 205 173.098 173.300 -0.202 1
1 859 . 12 1 1 A 71 71 GLY CA C 205 44.723 44.948 -0.225 1
1 860 . 12 1 1 A 71 71 GLY N N 205 110.168 106.706 3.462 1
1 861 . 12 1 1 A 72 72 TYR H H 206 8.457 8.529 -0.072 1
1 862 . 12 1 1 A 72 72 TYR HA H 206 4.184 4.677 -0.493 1
1 869 . 12 1 1 A 72 72 TYR C C 206 175.975 175.575 0.400 1
1 870 . 12 1 1 A 72 72 TYR CA C 206 59.722 58.941 0.781 1
1 871 . 12 1 1 A 72 72 TYR CB C 206 38.378 38.274 0.104 1
1 874 . 12 1 1 A 72 72 TYR N N 206 120.171 122.030 -1.859 1
1 875 . 12 1 1 A 73 73 VAL H H 207 8.782 9.065 -0.283 1
1 876 . 12 1 1 A 73 73 VAL HA H 207 4.056 4.408 -0.352 1
1 884 . 12 1 1 A 73 73 VAL C C 207 174.901 175.740 -0.839 1
1 885 . 12 1 1 A 73 73 VAL CA C 207 62.202 62.604 -0.402 1
1 886 . 12 1 1 A 73 73 VAL CB C 207 33.071 32.310 0.761 1
1 889 . 12 1 1 A 73 73 VAL N N 207 128.847 124.952 3.895 1
1 890 . 12 1 1 A 74 74 LEU H H 208 8.146 8.838 -0.692 1
1 891 . 12 1 1 A 74 74 LEU HA H 208 4.944 4.692 0.252 1
1 901 . 12 1 1 A 74 74 LEU C C 208 178.400 177.308 1.092 1
1 902 . 12 1 1 A 74 74 LEU CA C 208 53.520 54.020 -0.500 1
1 903 . 12 1 1 A 74 74 LEU CB C 208 43.499 42.466 1.033 1
1 907 . 12 1 1 A 74 74 LEU N N 208 127.599 129.825 -2.226 1
1 908 . 12 1 1 A 75 75 LYS H H 209 8.403 8.359 0.044 1
1 909 . 12 1 1 A 75 75 LYS HA H 209 3.771 3.853 -0.082 1
1 918 . 12 1 1 A 75 75 LYS C C 209 177.536 177.465 0.071 1
1 919 . 12 1 1 A 75 75 LYS CA C 209 58.385 58.946 -0.561 1
1 920 . 12 1 1 A 75 75 LYS CB C 209 32.459 32.151 0.308 1
1 924 . 12 1 1 A 75 75 LYS N N 209 123.798 122.722 1.076 1
1 925 . 12 1 1 A 76 76 GLY H H 210 9.997 9.445 0.552 1
1 926 . 12 1 1 A 76 76 GLY HA2 H 210 4.255 3.999 0.256 1
1 927 . 12 1 1 A 76 76 GLY HA3 H 210 3.791 4.001 -0.210 1
1 928 . 12 1 1 A 76 76 GLY C C 210 175.091 175.492 -0.401 1
1 929 . 12 1 1 A 76 76 GLY CA C 210 45.465 45.529 -0.064 1
1 930 . 12 1 1 A 76 76 GLY N N 210 114.705 113.522 1.183 1
1 931 . 12 1 1 A 77 77 GLN H H 211 7.726 8.006 -0.280 1
1 932 . 12 1 1 A 77 77 GLN HA H 211 4.373 4.213 0.160 1
1 939 . 12 1 1 A 77 77 GLN C C 211 176.301 176.050 0.251 1
1 940 . 12 1 1 A 77 77 GLN CA C 211 57.074 57.129 -0.055 1
1 941 . 12 1 1 A 77 77 GLN CB C 211 30.798 29.373 1.425 1
1 943 . 12 1 1 A 77 77 GLN N N 211 118.702 118.273 0.429 1
1 945 . 12 1 1 A 78 78 THR H H 212 8.225 7.426 0.799 1
1 946 . 12 1 1 A 78 78 THR HA H 212 4.620 4.713 -0.093 1
1 951 . 12 1 1 A 78 78 THR C C 212 173.920 173.654 0.266 1
1 952 . 12 1 1 A 78 78 THR CA C 212 60.087 59.265 0.822 1
1 953 . 12 1 1 A 78 78 THR CB C 212 71.412 71.150 0.262 1
1 955 . 12 1 1 A 78 78 THR N N 212 111.935 110.342 1.593 1
1 956 . 12 1 1 A 79 79 ASP H H 213 8.372 8.516 -0.144 1
1 957 . 12 1 1 A 79 79 ASP HA H 213 4.470 4.547 -0.077 1
1 960 . 12 1 1 A 79 79 ASP C C 213 176.759 177.988 -1.229 1
1 961 . 12 1 1 A 79 79 ASP CA C 213 54.927 54.547 0.380 1
1 962 . 12 1 1 A 79 79 ASP CB C 213 43.859 41.386 2.473 1
1 963 . 12 1 1 A 79 79 ASP N N 213 122.093 121.484 0.609 1
1 964 . 12 1 1 A 80 80 LYS H H 214 8.740 8.737 0.003 1
1 965 . 12 1 1 A 80 80 LYS HA H 214 4.027 4.049 -0.022 1
1 974 . 12 1 1 A 80 80 LYS C C 214 178.493 178.330 0.163 1
1 975 . 12 1 1 A 80 80 LYS CA C 214 59.802 58.675 1.127 1
1 976 . 12 1 1 A 80 80 LYS CB C 214 32.374 32.020 0.354 1
1 980 . 12 1 1 A 80 80 LYS N N 214 124.685 122.245 2.440 1
1 981 . 12 1 1 A 81 81 ASP H H 215 8.556 8.005 0.551 1
1 982 . 12 1 1 A 81 81 ASP HA H 215 4.566 4.392 0.174 1
1 985 . 12 1 1 A 81 81 ASP C C 215 178.889 178.712 0.177 1
1 986 . 12 1 1 A 81 81 ASP CA C 215 58.046 57.185 0.861 1
1 987 . 12 1 1 A 81 81 ASP CB C 215 40.872 40.731 0.141 1
1 988 . 12 1 1 A 81 81 ASP N N 215 121.413 119.780 1.633 1
1 989 . 12 1 1 A 82 82 PHE H H 216 8.205 8.296 -0.091 1
1 990 . 12 1 1 A 82 82 PHE HA H 216 3.686 4.086 -0.400 1
1 998 . 12 1 1 A 82 82 PHE C C 216 175.919 177.410 -1.491 1
1 999 . 12 1 1 A 82 82 PHE CA C 216 61.648 60.951 0.697 1
1 1000 . 12 1 1 A 82 82 PHE CB C 216 39.743 39.304 0.439 1
1 1004 . 12 1 1 A 82 82 PHE N N 216 124.401 121.780 2.621 1
1 1005 . 12 1 1 A 83 83 GLU H H 217 8.887 8.793 0.094 1
1 1006 . 12 1 1 A 83 83 GLU HA H 217 3.704 4.177 -0.473 1
1 1011 . 12 1 1 A 83 83 GLU C C 217 177.788 179.162 -1.374 1
1 1012 . 12 1 1 A 83 83 GLU CA C 217 60.545 60.210 0.335 1
1 1013 . 12 1 1 A 83 83 GLU CB C 217 30.639 29.412 1.227 1
1 1015 . 12 1 1 A 83 83 GLU N N 217 119.421 119.042 0.379 1
1 1016 . 12 1 1 A 84 84 LYS H H 218 8.055 7.736 0.319 1
1 1017 . 12 1 1 A 84 84 LYS HA H 218 3.947 4.173 -0.226 1
1 1026 . 12 1 1 A 84 84 LYS C C 218 178.783 178.645 0.138 1
1 1027 . 12 1 1 A 84 84 LYS CA C 218 59.327 58.408 0.919 1
1 1028 . 12 1 1 A 84 84 LYS CB C 218 32.539 32.081 0.458 1
1 1032 . 12 1 1 A 84 84 LYS N N 218 117.821 119.367 -1.546 1
1 1033 . 12 1 1 A 85 85 ALA H H 219 7.059 7.838 -0.779 1
1 1034 . 12 1 1 A 85 85 ALA HA H 219 4.040 4.054 -0.014 1
1 1038 . 12 1 1 A 85 85 ALA C C 219 179.794 179.994 -0.200 1
1 1039 . 12 1 1 A 85 85 ALA CA C 219 54.407 54.848 -0.441 1
1 1040 . 12 1 1 A 85 85 ALA CB C 219 20.130 18.286 1.844 1
1 1041 . 12 1 1 A 85 85 ALA N N 219 118.905 121.606 -2.701 1
1 1042 . 12 1 1 A 86 86 LEU H H 220 8.157 8.240 -0.083 1
1 1043 . 12 1 1 A 86 86 LEU HA H 220 3.692 3.971 -0.279 1
1 1053 . 12 1 1 A 86 86 LEU C C 220 178.330 178.615 -0.285 1
1 1054 . 12 1 1 A 86 86 LEU CA C 220 57.752 57.982 -0.230 1
1 1055 . 12 1 1 A 86 86 LEU CB C 220 41.464 41.957 -0.493 1
1 1059 . 12 1 1 A 86 86 LEU N N 220 118.606 120.284 -1.678 1
1 1060 . 12 1 1 A 87 87 PHE H H 221 8.349 8.284 0.065 1
1 1061 . 12 1 1 A 87 87 PHE HA H 221 3.861 4.466 -0.605 1
1 1069 . 12 1 1 A 87 87 PHE C C 221 176.176 177.859 -1.683 1
1 1070 . 12 1 1 A 87 87 PHE CA C 221 61.780 61.510 0.270 1
1 1071 . 12 1 1 A 87 87 PHE CB C 221 37.549 37.782 -0.233 1
1 1075 . 12 1 1 A 87 87 PHE N N 221 112.449 116.854 -4.405 1
1 1076 . 12 1 1 A 88 88 LYS H H 222 7.061 8.205 -1.144 1
1 1077 . 12 1 1 A 88 88 LYS HA H 222 4.380 4.121 0.259 1
1 1086 . 12 1 1 A 88 88 LYS C C 222 177.089 177.276 -0.187 1
1 1087 . 12 1 1 A 88 88 LYS CA C 222 56.726 58.499 -1.773 1
1 1088 . 12 1 1 A 88 88 LYS CB C 222 33.738 32.340 1.398 1
1 1092 . 12 1 1 A 88 88 LYS N N 222 118.308 121.296 -2.988 1
1 1093 . 12 1 1 A 89 89 LEU H H 223 7.270 7.262 0.008 1
1 1094 . 12 1 1 A 89 89 LEU HA H 223 4.168 4.205 -0.037 1
1 1104 . 12 1 1 A 89 89 LEU C C 223 177.528 177.107 0.421 1
1 1105 . 12 1 1 A 89 89 LEU CA C 223 55.279 54.695 0.584 1
1 1106 . 12 1 1 A 89 89 LEU CB C 223 43.240 42.396 0.844 1
1 1110 . 12 1 1 A 89 89 LEU N N 223 121.317 122.008 -0.691 1
1 1111 . 12 1 1 A 90 90 LYS H H 224 8.788 8.461 0.327 1
1 1112 . 12 1 1 A 90 90 LYS HA H 224 4.359 4.390 -0.031 1
1 1121 . 12 1 1 A 90 90 LYS C C 224 175.839 176.653 -0.814 1
1 1122 . 12 1 1 A 90 90 LYS CA C 224 54.772 55.685 -0.913 1
1 1123 . 12 1 1 A 90 90 LYS CB C 224 33.232 33.140 0.092 1
1 1127 . 12 1 1 A 90 90 LYS N N 224 123.558 122.383 1.175 1
1 1128 . 12 1 1 A 91 91 ASP H H 225 8.125 8.775 -0.650 1
1 1129 . 12 1 1 A 91 91 ASP HA H 225 3.958 4.153 -0.195 1
1 1132 . 12 1 1 A 91 91 ASP C C 225 177.452 177.097 0.355 1
1 1133 . 12 1 1 A 91 91 ASP CA C 225 56.642 56.223 0.419 1
1 1134 . 12 1 1 A 91 91 ASP CB C 225 40.269 40.059 0.210 1
1 1135 . 12 1 1 A 91 91 ASP N N 225 119.419 122.005 -2.586 1
1 1136 . 12 1 1 A 92 92 GLY H H 226 8.681 8.845 -0.164 1
1 1137 . 12 1 1 A 92 92 GLY HA2 H 226 4.131 3.788 0.343 1
1 1138 . 12 1 1 A 92 92 GLY HA3 H 226 3.579 3.816 -0.237 1
1 1139 . 12 1 1 A 92 92 GLY C C 226 173.614 173.931 -0.317 1
1 1140 . 12 1 1 A 92 92 GLY CA C 226 45.564 45.057 0.507 1
1 1141 . 12 1 1 A 92 92 GLY N N 226 113.802 111.830 1.972 1
1 1142 . 12 1 1 A 93 93 GLU H H 227 8.104 8.090 0.014 1
1 1143 . 12 1 1 A 93 93 GLU HA H 227 4.232 4.430 -0.198 1
1 1148 . 12 1 1 A 93 93 GLU C C 227 174.282 175.545 -1.263 1
1 1149 . 12 1 1 A 93 93 GLU CA C 227 56.651 55.940 0.711 1
1 1150 . 12 1 1 A 93 93 GLU CB C 227 32.190 31.065 1.125 1
1 1152 . 12 1 1 A 93 93 GLU N N 227 121.527 121.772 -0.245 1
1 1153 . 12 1 1 A 94 94 VAL H H 228 7.918 8.456 -0.538 1
1 1154 . 12 1 1 A 94 94 VAL HA H 228 4.857 4.725 0.132 1
1 1162 . 12 1 1 A 94 94 VAL C C 228 176.556 175.684 0.872 1
1 1163 . 12 1 1 A 94 94 VAL CA C 228 60.309 60.375 -0.066 1
1 1164 . 12 1 1 A 94 94 VAL CB C 228 33.847 35.319 -1.472 1
1 1167 . 12 1 1 A 94 94 VAL N N 228 119.768 125.856 -6.088 1
1 1168 . 12 1 1 A 95 95 SER H H 229 9.659 9.463 0.196 1
1 1169 . 12 1 1 A 95 95 SER HA H 229 4.313 4.724 -0.411 1
1 1172 . 12 1 1 A 95 95 SER C C 229 174.641 174.628 0.013 1
1 1173 . 12 1 1 A 95 95 SER CA C 229 59.208 57.817 1.391 1
1 1174 . 12 1 1 A 95 95 SER CB C 229 66.080 65.780 0.300 1
1 1175 . 12 1 1 A 95 95 SER N N 229 124.903 121.273 3.630 1
1 1176 . 12 1 1 A 96 96 GLU H H 230 8.014 8.394 -0.380 1
1 1177 . 12 1 1 A 96 96 GLU HA H 230 4.376 4.379 -0.003 1
1 1182 . 12 1 1 A 96 96 GLU C C 230 176.641 176.119 0.522 1
1 1183 . 12 1 1 A 96 96 GLU CA C 230 56.236 55.651 0.585 1
1 1184 . 12 1 1 A 96 96 GLU CB C 230 30.324 30.240 0.084 1
1 1186 . 12 1 1 A 96 96 GLU N N 230 115.510 118.805 -3.295 1
1 1187 . 12 1 1 A 97 97 VAL H H 231 8.741 8.435 0.306 1
1 1188 . 12 1 1 A 97 97 VAL HA H 231 4.171 4.200 -0.029 1
1 1196 . 12 1 1 A 97 97 VAL C C 231 176.684 175.647 1.037 1
1 1197 . 12 1 1 A 97 97 VAL CA C 231 65.418 63.184 2.234 1
1 1198 . 12 1 1 A 97 97 VAL CB C 231 31.218 31.539 -0.321 1
1 1201 . 12 1 1 A 97 97 VAL N N 231 121.289 120.858 0.431 1
1 1202 . 12 1 1 A 98 98 VAL H H 232 9.218 9.657 -0.439 1
1 1203 . 12 1 1 A 98 98 VAL HA H 232 4.405 4.632 -0.227 1
1 1211 . 12 1 1 A 98 98 VAL C C 232 174.258 174.753 -0.495 1
1 1212 . 12 1 1 A 98 98 VAL CA C 232 60.937 61.206 -0.269 1
1 1213 . 12 1 1 A 98 98 VAL CB C 232 35.825 33.880 1.945 1
1 1216 . 12 1 1 A 98 98 VAL N N 232 130.544 128.897 1.647 1
1 1217 . 12 1 1 A 99 99 LYS H H 233 8.800 8.921 -0.121 1
1 1218 . 12 1 1 A 99 99 LYS HA H 233 4.853 5.014 -0.161 1
1 1227 . 12 1 1 A 99 99 LYS C C 233 175.274 175.253 0.021 1
1 1228 . 12 1 1 A 99 99 LYS CA C 233 55.499 55.090 0.409 1
1 1229 . 12 1 1 A 99 99 LYS CB C 233 34.452 34.320 0.132 1
1 1233 . 12 1 1 A 99 99 LYS N N 233 130.477 128.432 2.045 1
1 1234 . 12 1 1 A 100 100 SER H H 234 9.585 8.930 0.655 1
1 1235 . 12 1 1 A 100 100 SER HA H 234 5.150 4.907 0.243 1
1 1238 . 12 1 1 A 100 100 SER C C 234 175.493 174.046 1.447 1
1 1239 . 12 1 1 A 100 100 SER CA C 234 56.927 57.588 -0.661 1
1 1240 . 12 1 1 A 100 100 SER CB C 234 67.309 67.509 -0.200 1
1 1241 . 12 1 1 A 100 100 SER N N 234 125.814 123.230 2.584 1
1 1242 . 12 1 1 A 101 101 SER H H 235 8.631 8.880 -0.249 1
1 1243 . 12 1 1 A 101 101 SER HA H 235 4.106 4.059 0.047 1
1 1246 . 12 1 1 A 101 101 SER C C 235 175.385 175.080 0.305 1
1 1247 . 12 1 1 A 101 101 SER CA C 235 61.123 61.320 -0.197 1
1 1248 . 12 1 1 A 101 101 SER CB C 235 62.818 62.610 0.208 1
1 1249 . 12 1 1 A 101 101 SER N N 235 115.089 117.783 -2.694 1
1 1250 . 12 1 1 A 102 102 PHE H H 236 8.957 7.544 1.413 1
1 1251 . 12 1 1 A 102 102 PHE HA H 236 4.610 4.616 -0.006 1
1 1259 . 12 1 1 A 102 102 PHE C C 236 176.453 175.767 0.686 1
1 1260 . 12 1 1 A 102 102 PHE CA C 236 58.382 58.098 0.284 1
1 1261 . 12 1 1 A 102 102 PHE CB C 236 40.275 39.484 0.791 1
1 1263 . 12 1 1 A 102 102 PHE N N 236 119.917 117.660 2.257 1
1 1264 . 12 1 1 A 103 103 GLY H H 237 7.377 7.359 0.018 1
1 1265 . 12 1 1 A 103 103 GLY HA2 H 237 4.453 3.972 0.481 1
1 1266 . 12 1 1 A 103 103 GLY HA3 H 237 3.472 4.137 -0.665 1
1 1267 . 12 1 1 A 103 103 GLY C C 237 169.627 172.152 -2.525 1
1 1268 . 12 1 1 A 103 103 GLY CA C 237 45.384 44.734 0.650 1
1 1269 . 12 1 1 A 103 103 GLY N N 237 108.809 106.246 2.563 1
1 1270 . 12 1 1 A 104 104 TYR H H 238 8.632 8.593 0.039 1
1 1271 . 12 1 1 A 104 104 TYR HA H 238 5.322 5.738 -0.416 1
1 1278 . 12 1 1 A 104 104 TYR C C 238 175.043 175.218 -0.175 1
1 1279 . 12 1 1 A 104 104 TYR CA C 238 57.627 56.620 1.007 1
1 1280 . 12 1 1 A 104 104 TYR CB C 238 41.711 43.134 -1.423 1
1 1283 . 12 1 1 A 104 104 TYR N N 238 120.030 121.611 -1.581 1
1 1284 . 12 1 1 A 105 105 HIS H H 239 10.070 9.473 0.597 1
1 1285 . 12 1 1 A 105 105 HIS HA H 239 6.046 5.602 0.444 1
1 1290 . 12 1 1 A 105 105 HIS C C 239 175.734 174.617 1.117 1
1 1291 . 12 1 1 A 105 105 HIS CA C 239 53.945 54.578 -0.633 1
1 1292 . 12 1 1 A 105 105 HIS CB C 239 32.450 34.267 -1.817 1
1 1295 . 12 1 1 A 105 105 HIS N N 239 119.504 118.560 0.944 1
1 1296 . 12 1 1 A 106 106 ILE H H 240 8.660 8.685 -0.025 1
1 1297 . 12 1 1 A 106 106 ILE HA H 240 4.120 4.910 -0.790 1
1 1307 . 12 1 1 A 106 106 ILE C C 240 174.758 175.406 -0.648 1
1 1308 . 12 1 1 A 106 106 ILE CA C 240 63.446 59.870 3.576 1
1 1309 . 12 1 1 A 106 106 ILE CB C 240 40.786 41.438 -0.652 1
1 1313 . 12 1 1 A 106 106 ILE N N 240 120.639 119.487 1.152 1
1 1314 . 12 1 1 A 107 107 ILE H H 241 9.033 9.174 -0.141 1
1 1315 . 12 1 1 A 107 107 ILE HA H 241 4.799 5.065 -0.266 1
1 1325 . 12 1 1 A 107 107 ILE C C 241 172.880 173.951 -1.071 1
1 1326 . 12 1 1 A 107 107 ILE CA C 241 60.563 59.575 0.988 1
1 1327 . 12 1 1 A 107 107 ILE CB C 241 41.652 40.591 1.061 1
1 1331 . 12 1 1 A 107 107 ILE N N 241 129.098 127.206 1.892 1
1 1332 . 12 1 1 A 108 108 LYS H H 242 8.692 9.010 -0.318 1
1 1333 . 12 1 1 A 108 108 LYS HA H 242 5.012 4.996 0.016 1
1 1342 . 12 1 1 A 108 108 LYS C C 242 174.484 175.510 -1.026 1
1 1343 . 12 1 1 A 108 108 LYS CA C 242 54.317 53.967 0.350 1
1 1344 . 12 1 1 A 108 108 LYS CB C 242 35.619 35.383 0.236 1
1 1348 . 12 1 1 A 108 108 LYS N N 242 127.179 126.876 0.303 1
1 1349 . 12 1 1 A 109 109 ALA H H 243 7.816 9.010 -1.194 1
1 1350 . 12 1 1 A 109 109 ALA HA H 243 4.604 4.760 -0.156 1
1 1354 . 12 1 1 A 109 109 ALA C C 243 176.231 176.086 0.145 1
1 1355 . 12 1 1 A 109 109 ALA CA C 243 50.505 50.998 -0.493 1
1 1356 . 12 1 1 A 109 109 ALA CB C 243 19.584 19.930 -0.346 1
1 1357 . 12 1 1 A 109 109 ALA N N 243 129.619 128.045 1.574 1
1 1358 . 12 1 1 A 110 110 ASP H H 244 7.578 8.519 -0.941 1
1 1359 . 12 1 1 A 110 110 ASP HA H 244 4.424 4.942 -0.518 1
1 1362 . 12 1 1 A 110 110 ASP C C 244 175.259 176.138 -0.879 1
1 1363 . 12 1 1 A 110 110 ASP CA C 244 54.489 52.374 2.115 1
1 1364 . 12 1 1 A 110 110 ASP CB C 244 42.693 43.151 -0.458 1
1 1365 . 12 1 1 A 110 110 ASP N N 244 125.434 122.225 3.209 1
1 4 . 13 1 1 A 2 2 PRO HA H -4 4.403 4.518 -0.115 1
1 11 . 13 1 1 A 2 2 PRO C C -4 176.990 176.699 0.291 1
1 12 . 13 1 1 A 2 2 PRO CA C -4 63.131 63.083 0.048 1
1 13 . 13 1 1 A 2 2 PRO CB C -4 32.342 32.165 0.177 1
1 16 . 13 1 1 A 3 3 LEU H H -3 8.483 8.306 0.177 1
1 17 . 13 1 1 A 3 3 LEU HA H -3 4.333 4.733 -0.400 1
1 27 . 13 1 1 A 3 3 LEU C C -3 177.991 177.675 0.316 1
1 28 . 13 1 1 A 3 3 LEU CA C -3 55.314 54.167 1.147 1
1 29 . 13 1 1 A 3 3 LEU CB C -3 42.244 42.952 -0.708 1
1 33 . 13 1 1 A 3 3 LEU N N -3 122.986 122.579 0.407 1
1 34 . 13 1 1 A 4 4 GLY H H -2 8.397 8.473 -0.076 1
1 35 . 13 1 1 A 4 4 GLY HA2 H -2 4.024 4.099 -0.075 1
1 36 . 13 1 1 A 4 4 GLY HA3 H -2 3.976 4.112 -0.136 1
1 37 . 13 1 1 A 4 4 GLY C C -2 174.360 173.777 0.583 1
1 38 . 13 1 1 A 4 4 GLY CA C -2 45.434 45.613 -0.179 1
1 39 . 13 1 1 A 4 4 GLY N N -2 110.666 109.110 1.556 1
1 56 . 13 1 1 A 7 7 SER H H 141 7.913 7.837 0.076 1
1 57 . 13 1 1 A 7 7 SER HA H 141 5.657 5.199 0.458 1
1 60 . 13 1 1 A 7 7 SER C C 141 173.753 172.202 1.551 1
1 61 . 13 1 1 A 7 7 SER CA C 141 56.758 57.782 -1.024 1
1 62 . 13 1 1 A 7 7 SER CB C 141 66.774 65.401 1.373 1
1 63 . 13 1 1 A 7 7 SER N N 141 113.824 112.224 1.600 1
1 64 . 13 1 1 A 8 8 LYS H H 142 8.656 8.335 0.321 1
1 65 . 13 1 1 A 8 8 LYS HA H 142 4.543 4.923 -0.380 1
1 74 . 13 1 1 A 8 8 LYS C C 142 174.403 174.659 -0.256 1
1 75 . 13 1 1 A 8 8 LYS CA C 142 55.578 54.456 1.122 1
1 76 . 13 1 1 A 8 8 LYS CB C 142 36.561 35.906 0.655 1
1 80 . 13 1 1 A 8 8 LYS N N 142 123.076 120.342 2.734 1
1 81 . 13 1 1 A 9 9 LYS H H 143 8.623 8.409 0.214 1
1 82 . 13 1 1 A 9 9 LYS HA H 143 4.119 4.128 -0.009 1
1 91 . 13 1 1 A 9 9 LYS C C 143 176.144 175.564 0.580 1
1 92 . 13 1 1 A 9 9 LYS CA C 143 56.683 56.041 0.642 1
1 93 . 13 1 1 A 9 9 LYS CB C 143 32.580 32.489 0.091 1
1 97 . 13 1 1 A 9 9 LYS N N 143 129.542 123.381 6.161 1
1 98 . 13 1 1 A 10 10 ALA H H 144 8.151 8.792 -0.641 1
1 99 . 13 1 1 A 10 10 ALA HA H 144 5.208 4.941 0.267 1
1 103 . 13 1 1 A 10 10 ALA C C 144 175.577 175.055 0.522 1
1 104 . 13 1 1 A 10 10 ALA CA C 144 51.226 51.233 -0.007 1
1 105 . 13 1 1 A 10 10 ALA CB C 144 25.299 24.139 1.160 1
1 106 . 13 1 1 A 10 10 ALA N N 144 127.933 127.865 0.068 1
1 107 . 13 1 1 A 11 11 SER H H 145 8.679 8.801 -0.122 1
1 108 . 13 1 1 A 11 11 SER HA H 145 5.431 5.737 -0.306 1
1 111 . 13 1 1 A 11 11 SER C C 145 173.072 173.147 -0.075 1
1 112 . 13 1 1 A 11 11 SER CA C 145 57.772 57.046 0.726 1
1 113 . 13 1 1 A 11 11 SER CB C 145 67.301 65.983 1.318 1
1 114 . 13 1 1 A 11 11 SER N N 145 116.245 115.499 0.746 1
1 115 . 13 1 1 A 12 12 HIS H H 146 9.962 9.601 0.361 1
1 116 . 13 1 1 A 12 12 HIS HA H 146 6.332 6.013 0.319 1
1 121 . 13 1 1 A 12 12 HIS C C 146 173.006 172.436 0.570 1
1 122 . 13 1 1 A 12 12 HIS CA C 146 55.020 54.277 0.743 1
1 123 . 13 1 1 A 12 12 HIS CB C 146 37.071 33.382 3.689 1
1 126 . 13 1 1 A 12 12 HIS N N 146 119.181 118.528 0.653 1
1 127 . 13 1 1 A 13 13 ILE H H 147 8.976 8.975 0.001 1
1 128 . 13 1 1 A 13 13 ILE HA H 147 3.528 4.508 -0.980 1
1 138 . 13 1 1 A 13 13 ILE C C 147 173.010 173.993 -0.983 1
1 139 . 13 1 1 A 13 13 ILE CA C 147 61.273 59.591 1.682 1
1 140 . 13 1 1 A 13 13 ILE CB C 147 41.773 41.608 0.165 1
1 144 . 13 1 1 A 13 13 ILE N N 147 121.873 119.398 2.475 1
1 145 . 13 1 1 A 14 14 LEU H H 148 7.627 8.671 -1.044 1
1 146 . 13 1 1 A 14 14 LEU HA H 148 4.814 5.241 -0.427 1
1 156 . 13 1 1 A 14 14 LEU C C 148 174.112 174.401 -0.289 1
1 157 . 13 1 1 A 14 14 LEU CA C 148 52.574 53.039 -0.465 1
1 158 . 13 1 1 A 14 14 LEU CB C 148 45.643 45.359 0.284 1
1 162 . 13 1 1 A 14 14 LEU N N 148 127.112 129.531 -2.419 1
1 163 . 13 1 1 A 15 15 ILE H H 149 9.524 9.297 0.227 1
1 164 . 13 1 1 A 15 15 ILE HA H 149 4.362 4.590 -0.228 1
1 174 . 13 1 1 A 15 15 ILE C C 149 175.452 175.640 -0.188 1
1 175 . 13 1 1 A 15 15 ILE CA C 149 58.516 60.303 -1.787 1
1 176 . 13 1 1 A 15 15 ILE CB C 149 36.560 38.471 -1.911 1
1 180 . 13 1 1 A 15 15 ILE N N 149 128.652 127.199 1.453 1
1 181 . 13 1 1 A 16 16 LYS H H 150 8.035 8.653 -0.618 1
1 182 . 13 1 1 A 16 16 LYS HA H 150 4.319 4.531 -0.212 1
1 191 . 13 1 1 A 16 16 LYS C C 150 175.038 176.401 -1.363 1
1 192 . 13 1 1 A 16 16 LYS CA C 150 57.817 56.471 1.346 1
1 193 . 13 1 1 A 16 16 LYS CB C 150 34.853 33.089 1.764 1
1 197 . 13 1 1 A 16 16 LYS N N 150 129.153 127.648 1.505 1
1 198 . 13 1 1 A 17 17 VAL H H 151 8.016 8.967 -0.951 1
1 199 . 13 1 1 A 17 17 VAL HA H 151 4.873 5.152 -0.279 1
1 207 . 13 1 1 A 17 17 VAL C C 151 176.647 175.066 1.581 1
1 208 . 13 1 1 A 17 17 VAL CA C 151 60.088 60.921 -0.833 1
1 209 . 13 1 1 A 17 17 VAL CB C 151 34.082 34.436 -0.354 1
1 212 . 13 1 1 A 17 17 VAL N N 151 121.288 124.181 -2.893 1
1 213 . 13 1 1 A 18 18 LYS H H 152 8.443 8.888 -0.445 1
1 214 . 13 1 1 A 18 18 LYS HA H 152 4.334 4.696 -0.362 1
1 223 . 13 1 1 A 18 18 LYS C C 152 176.345 177.607 -1.262 1
1 224 . 13 1 1 A 18 18 LYS CA C 152 57.016 54.554 2.462 1
1 225 . 13 1 1 A 18 18 LYS CB C 152 33.222 34.792 -1.570 1
1 229 . 13 1 1 A 18 18 LYS N N 152 128.408 126.647 1.761 1
1 230 . 13 1 1 A 19 19 SER H H 153 9.067 8.720 0.347 1
1 231 . 13 1 1 A 19 19 SER HA H 153 4.457 4.306 0.151 1
1 234 . 13 1 1 A 19 19 SER C C 153 174.236 174.251 -0.015 1
1 235 . 13 1 1 A 19 19 SER CA C 153 59.642 60.184 -0.542 1
1 236 . 13 1 1 A 19 19 SER CB C 153 64.347 63.428 0.919 1
1 237 . 13 1 1 A 19 19 SER N N 153 121.522 115.627 5.895 1
1 238 . 13 1 1 A 20 20 LYS H H 154 7.961 7.524 0.437 1
1 239 . 13 1 1 A 20 20 LYS HA H 154 4.558 4.747 -0.189 1
1 244 . 13 1 1 A 20 20 LYS C C 154 177.256 176.658 0.598 1
1 245 . 13 1 1 A 20 20 LYS CA C 154 55.249 54.675 0.574 1
1 246 . 13 1 1 A 20 20 LYS CB C 154 34.531 36.247 -1.716 1
1 248 . 13 1 1 A 20 20 LYS N N 154 120.270 120.686 -0.416 1
1 249 . 13 1 1 A 21 21 LYS HA H 155 4.003 4.028 -0.025 1
1 258 . 13 1 1 A 21 21 LYS C C 155 177.015 178.087 -1.072 1
1 259 . 13 1 1 A 21 21 LYS CA C 155 59.091 58.607 0.484 1
1 260 . 13 1 1 A 21 21 LYS CB C 155 32.394 32.341 0.053 1
1 264 . 13 1 1 A 22 22 SER H H 156 7.625 7.654 -0.029 1
1 265 . 13 1 1 A 22 22 SER HA H 156 4.293 4.551 -0.258 1
1 268 . 13 1 1 A 22 22 SER C C 156 174.843 174.343 0.500 1
1 269 . 13 1 1 A 22 22 SER CA C 156 57.966 58.486 -0.520 1
1 270 . 13 1 1 A 22 22 SER CB C 156 63.369 63.795 -0.426 1
1 271 . 13 1 1 A 22 22 SER N N 156 109.549 112.494 -2.945 1
1 272 . 13 1 1 A 23 23 ASP H H 157 7.701 7.499 0.202 1
1 273 . 13 1 1 A 23 23 ASP HA H 157 4.548 4.592 -0.044 1
1 276 . 13 1 1 A 23 23 ASP C C 157 176.544 176.871 -0.327 1
1 277 . 13 1 1 A 23 23 ASP CA C 157 55.242 54.673 0.569 1
1 278 . 13 1 1 A 23 23 ASP CB C 157 41.103 41.233 -0.130 1
1 279 . 13 1 1 A 23 23 ASP N N 157 124.536 121.066 3.470 1
1 280 . 13 1 1 A 24 24 LYS H H 158 8.583 8.665 -0.082 1
1 281 . 13 1 1 A 24 24 LYS HA H 158 4.252 4.074 0.178 1
1 290 . 13 1 1 A 24 24 LYS C C 158 176.813 177.904 -1.091 1
1 291 . 13 1 1 A 24 24 LYS CA C 158 57.148 59.197 -2.049 1
1 292 . 13 1 1 A 24 24 LYS CB C 158 33.200 32.286 0.914 1
1 296 . 13 1 1 A 24 24 LYS N N 158 122.372 123.253 -0.881 1
1 297 . 13 1 1 A 25 25 GLU H H 159 8.001 7.675 0.326 1
1 298 . 13 1 1 A 25 25 GLU HA H 159 4.521 4.445 0.076 1
1 303 . 13 1 1 A 25 25 GLU C C 159 175.995 176.364 -0.369 1
1 304 . 13 1 1 A 25 25 GLU CA C 159 55.727 56.882 -1.155 1
1 305 . 13 1 1 A 25 25 GLU CB C 159 31.918 30.478 1.440 1
1 307 . 13 1 1 A 25 25 GLU N N 159 118.705 117.609 1.096 1
1 308 . 13 1 1 A 26 26 GLY H H 160 8.458 7.533 0.925 1
1 309 . 13 1 1 A 26 26 GLY HA2 H 160 3.946 3.998 -0.052 1
1 310 . 13 1 1 A 26 26 GLY HA3 H 160 3.511 4.007 -0.496 1
1 311 . 13 1 1 A 26 26 GLY C C 160 172.201 171.748 0.453 1
1 312 . 13 1 1 A 26 26 GLY CA C 160 44.038 45.297 -1.259 1
1 313 . 13 1 1 A 26 26 GLY N N 160 107.642 107.505 0.137 1
1 314 . 13 1 1 A 27 27 LEU H H 161 8.259 8.837 -0.578 1
1 315 . 13 1 1 A 27 27 LEU HA H 161 4.775 4.564 0.211 1
1 325 . 13 1 1 A 27 27 LEU C C 161 177.422 176.127 1.295 1
1 326 . 13 1 1 A 27 27 LEU CA C 161 53.322 54.244 -0.922 1
1 327 . 13 1 1 A 27 27 LEU CB C 161 45.576 42.391 3.185 1
1 331 . 13 1 1 A 27 27 LEU N N 161 119.856 122.206 -2.350 1
1 332 . 13 1 1 A 28 28 ASP H H 162 8.848 8.309 0.539 1
1 333 . 13 1 1 A 28 28 ASP HA H 162 4.644 4.584 0.060 1
1 336 . 13 1 1 A 28 28 ASP C C 162 176.630 177.037 -0.407 1
1 337 . 13 1 1 A 28 28 ASP CA C 162 55.195 54.604 0.591 1
1 338 . 13 1 1 A 28 28 ASP CB C 162 41.673 42.783 -1.110 1
1 339 . 13 1 1 A 28 28 ASP N N 162 122.434 121.188 1.246 1
1 340 . 13 1 1 A 29 29 ASP H H 163 8.720 9.197 -0.477 1
1 341 . 13 1 1 A 29 29 ASP HA H 163 4.386 4.368 0.018 1
1 344 . 13 1 1 A 29 29 ASP C C 163 176.604 178.154 -1.550 1
1 345 . 13 1 1 A 29 29 ASP CA C 163 59.690 58.301 1.389 1
1 346 . 13 1 1 A 29 29 ASP CB C 163 42.964 41.104 1.860 1
1 347 . 13 1 1 A 29 29 ASP N N 163 121.460 126.798 -5.338 1
1 348 . 13 1 1 A 30 30 LYS H H 164 8.434 7.793 0.641 1
1 349 . 13 1 1 A 30 30 LYS HA H 164 3.901 4.108 -0.207 1
1 358 . 13 1 1 A 30 30 LYS C C 164 179.479 179.305 0.174 1
1 359 . 13 1 1 A 30 30 LYS CA C 164 60.047 59.483 0.564 1
1 360 . 13 1 1 A 30 30 LYS CB C 164 32.038 31.974 0.064 1
1 364 . 13 1 1 A 30 30 LYS N N 164 116.627 118.640 -2.013 1
1 365 . 13 1 1 A 31 31 GLU H H 165 7.755 8.263 -0.508 1
1 366 . 13 1 1 A 31 31 GLU HA H 165 3.998 3.977 0.021 1
1 371 . 13 1 1 A 31 31 GLU C C 165 179.031 179.257 -0.226 1
1 372 . 13 1 1 A 31 31 GLU CA C 165 59.335 59.392 -0.057 1
1 373 . 13 1 1 A 31 31 GLU CB C 165 29.972 29.080 0.892 1
1 375 . 13 1 1 A 31 31 GLU N N 165 120.456 120.466 -0.010 1
1 376 . 13 1 1 A 32 32 ALA H H 166 9.060 8.391 0.669 1
1 377 . 13 1 1 A 32 32 ALA HA H 166 3.871 3.995 -0.124 1
1 381 . 13 1 1 A 32 32 ALA C C 166 178.029 179.160 -1.131 1
1 382 . 13 1 1 A 32 32 ALA CA C 166 54.997 55.511 -0.514 1
1 383 . 13 1 1 A 32 32 ALA CB C 166 19.727 18.373 1.354 1
1 384 . 13 1 1 A 32 32 ALA N N 166 124.406 122.307 2.099 1
1 385 . 13 1 1 A 33 33 LYS H H 167 8.228 7.771 0.457 1
1 386 . 13 1 1 A 33 33 LYS HA H 167 2.595 2.987 -0.392 1
1 395 . 13 1 1 A 33 33 LYS C C 167 177.938 178.208 -0.270 1
1 396 . 13 1 1 A 33 33 LYS CA C 167 59.573 59.259 0.314 1
1 397 . 13 1 1 A 33 33 LYS CB C 167 32.098 32.132 -0.034 1
1 401 . 13 1 1 A 33 33 LYS N N 167 119.833 118.189 1.644 1
1 402 . 13 1 1 A 34 34 GLN H H 168 7.392 7.687 -0.295 1
1 403 . 13 1 1 A 34 34 GLN HA H 168 3.943 3.924 0.019 1
1 410 . 13 1 1 A 34 34 GLN C C 168 178.323 178.449 -0.126 1
1 411 . 13 1 1 A 34 34 GLN CA C 168 58.883 59.312 -0.429 1
1 412 . 13 1 1 A 34 34 GLN CB C 168 28.485 28.094 0.391 1
1 414 . 13 1 1 A 34 34 GLN N N 168 117.208 118.072 -0.864 1
1 416 . 13 1 1 A 35 35 LYS H H 169 7.994 7.976 0.018 1
1 417 . 13 1 1 A 35 35 LYS HA H 169 4.067 4.005 0.062 1
1 426 . 13 1 1 A 35 35 LYS C C 169 178.161 178.469 -0.308 1
1 427 . 13 1 1 A 35 35 LYS CA C 169 58.437 59.243 -0.806 1
1 428 . 13 1 1 A 35 35 LYS CB C 169 31.611 32.227 -0.616 1
1 432 . 13 1 1 A 35 35 LYS N N 169 120.898 119.955 0.943 1
1 433 . 13 1 1 A 36 36 ALA H H 170 8.431 8.293 0.138 1
1 434 . 13 1 1 A 36 36 ALA HA H 170 3.738 4.039 -0.301 1
1 438 . 13 1 1 A 36 36 ALA C C 170 178.862 180.010 -1.148 1
1 439 . 13 1 1 A 36 36 ALA CA C 170 55.351 54.810 0.541 1
1 440 . 13 1 1 A 36 36 ALA CB C 170 18.295 18.300 -0.005 1
1 441 . 13 1 1 A 36 36 ALA N N 170 120.641 119.553 1.088 1
1 442 . 13 1 1 A 37 37 GLU H H 171 8.412 8.067 0.345 1
1 443 . 13 1 1 A 37 37 GLU HA H 171 3.867 3.985 -0.118 1
1 448 . 13 1 1 A 37 37 GLU C C 171 179.255 179.430 -0.175 1
1 449 . 13 1 1 A 37 37 GLU CA C 171 59.543 59.459 0.084 1
1 450 . 13 1 1 A 37 37 GLU CB C 171 29.569 29.070 0.499 1
1 452 . 13 1 1 A 37 37 GLU N N 171 118.224 117.728 0.496 1
1 453 . 13 1 1 A 38 38 GLU H H 172 8.019 7.618 0.401 1
1 454 . 13 1 1 A 38 38 GLU HA H 172 3.952 4.066 -0.114 1
1 459 . 13 1 1 A 38 38 GLU C C 172 180.250 179.319 0.931 1
1 460 . 13 1 1 A 38 38 GLU CA C 172 59.627 59.155 0.472 1
1 461 . 13 1 1 A 38 38 GLU CB C 172 29.368 29.742 -0.374 1
1 463 . 13 1 1 A 38 38 GLU N N 172 121.250 120.131 1.119 1
1 464 . 13 1 1 A 39 39 ILE H H 173 8.174 7.594 0.580 1
1 465 . 13 1 1 A 39 39 ILE HA H 173 3.643 3.789 -0.146 1
1 475 . 13 1 1 A 39 39 ILE C C 173 177.568 177.912 -0.344 1
1 476 . 13 1 1 A 39 39 ILE CA C 173 64.869 63.623 1.246 1
1 477 . 13 1 1 A 39 39 ILE CB C 173 38.160 37.310 0.850 1
1 481 . 13 1 1 A 39 39 ILE N N 173 121.527 118.208 3.319 1
1 482 . 13 1 1 A 40 40 GLN H H 174 8.860 8.292 0.568 1
1 483 . 13 1 1 A 40 40 GLN HA H 174 3.533 3.965 -0.432 1
1 490 . 13 1 1 A 40 40 GLN C C 174 179.022 178.565 0.457 1
1 491 . 13 1 1 A 40 40 GLN CA C 174 61.316 59.267 2.049 1
1 492 . 13 1 1 A 40 40 GLN CB C 174 26.604 28.580 -1.976 1
1 494 . 13 1 1 A 40 40 GLN N N 174 121.956 121.020 0.936 1
1 496 . 13 1 1 A 41 41 LYS H H 175 7.879 7.865 0.014 1
1 497 . 13 1 1 A 41 41 LYS HA H 175 3.777 4.131 -0.354 1
1 506 . 13 1 1 A 41 41 LYS C C 175 178.779 178.637 0.142 1
1 507 . 13 1 1 A 41 41 LYS CA C 175 59.701 58.617 1.084 1
1 508 . 13 1 1 A 41 41 LYS CB C 175 32.581 31.449 1.132 1
1 512 . 13 1 1 A 41 41 LYS N N 175 119.012 118.398 0.614 1
1 513 . 13 1 1 A 42 42 GLU H H 176 7.447 7.858 -0.411 1
1 514 . 13 1 1 A 42 42 GLU HA H 176 4.059 4.165 -0.106 1
1 519 . 13 1 1 A 42 42 GLU C C 176 180.058 178.854 1.204 1
1 520 . 13 1 1 A 42 42 GLU CA C 176 59.456 58.851 0.605 1
1 521 . 13 1 1 A 42 42 GLU CB C 176 29.923 30.150 -0.227 1
1 523 . 13 1 1 A 42 42 GLU N N 176 120.054 118.648 1.406 1
1 524 . 13 1 1 A 43 43 VAL H H 177 8.618 7.963 0.655 1
1 525 . 13 1 1 A 43 43 VAL HA H 177 3.986 3.878 0.108 1
1 533 . 13 1 1 A 43 43 VAL C C 177 176.459 177.689 -1.230 1
1 534 . 13 1 1 A 43 43 VAL CA C 177 63.923 64.814 -0.891 1
1 535 . 13 1 1 A 43 43 VAL CB C 177 31.899 31.340 0.559 1
1 538 . 13 1 1 A 43 43 VAL N N 177 114.191 117.035 -2.844 1
1 539 . 13 1 1 A 44 44 SER H H 178 8.052 8.382 -0.330 1
1 540 . 13 1 1 A 44 44 SER HA H 178 4.098 4.248 -0.150 1
1 543 . 13 1 1 A 44 44 SER C C 178 176.548 176.092 0.456 1
1 544 . 13 1 1 A 44 44 SER CA C 178 61.160 61.590 -0.430 1
1 545 . 13 1 1 A 44 44 SER CB C 178 62.959 62.549 0.410 1
1 546 . 13 1 1 A 44 44 SER N N 178 114.202 115.931 -1.729 1
1 547 . 13 1 1 A 45 45 LYS H H 179 7.083 8.226 -1.143 1
1 548 . 13 1 1 A 45 45 LYS HA H 179 4.140 4.224 -0.084 1
1 557 . 13 1 1 A 45 45 LYS C C 179 177.288 176.082 1.206 1
1 558 . 13 1 1 A 45 45 LYS CA C 179 58.469 57.974 0.495 1
1 559 . 13 1 1 A 45 45 LYS CB C 179 32.671 31.924 0.747 1
1 563 . 13 1 1 A 45 45 LYS N N 179 120.935 117.557 3.378 1
1 564 . 13 1 1 A 46 46 ASP H H 180 7.098 7.908 -0.810 1
1 565 . 13 1 1 A 46 46 ASP HA H 180 4.917 4.999 -0.082 1
1 568 . 13 1 1 A 46 46 ASP CA C 180 51.492 51.592 -0.100 1
1 569 . 13 1 1 A 46 46 ASP CB C 180 40.595 41.371 -0.776 1
1 570 . 13 1 1 A 46 46 ASP N N 180 112.836 120.458 -7.622 1
1 571 . 13 1 1 A 47 47 PRO HA H 181 4.681 4.430 0.251 1
1 578 . 13 1 1 A 47 47 PRO C C 181 179.248 177.752 1.496 1
1 579 . 13 1 1 A 47 47 PRO CA C 181 64.718 64.396 0.322 1
1 580 . 13 1 1 A 47 47 PRO CB C 181 32.159 32.013 0.146 1
1 583 . 13 1 1 A 48 48 SER H H 182 8.248 7.923 0.325 1
1 584 . 13 1 1 A 48 48 SER HA H 182 4.378 4.336 0.042 1
1 587 . 13 1 1 A 48 48 SER C C 182 176.071 175.761 0.310 1
1 588 . 13 1 1 A 48 48 SER CA C 182 61.377 60.812 0.565 1
1 589 . 13 1 1 A 48 48 SER CB C 182 62.455 63.234 -0.779 1
1 590 . 13 1 1 A 48 48 SER N N 182 116.986 113.336 3.650 1
1 591 . 13 1 1 A 49 49 LYS H H 183 7.842 7.482 0.360 1
1 592 . 13 1 1 A 49 49 LYS HA H 183 4.482 4.285 0.197 1
1 601 . 13 1 1 A 49 49 LYS C C 183 175.605 177.640 -2.035 1
1 602 . 13 1 1 A 49 49 LYS CA C 183 55.824 56.998 -1.174 1
1 603 . 13 1 1 A 49 49 LYS CB C 183 32.834 32.654 0.180 1
1 607 . 13 1 1 A 49 49 LYS N N 183 121.698 120.104 1.594 1
1 608 . 13 1 1 A 50 50 PHE H H 184 7.634 7.981 -0.347 1
1 609 . 13 1 1 A 50 50 PHE HA H 184 3.510 4.209 -0.699 1
1 617 . 13 1 1 A 50 50 PHE C C 184 176.214 177.610 -1.396 1
1 618 . 13 1 1 A 50 50 PHE CA C 184 63.276 60.960 2.316 1
1 619 . 13 1 1 A 50 50 PHE CB C 184 40.948 39.050 1.898 1
1 623 . 13 1 1 A 50 50 PHE N N 184 120.120 121.580 -1.460 1
1 624 . 13 1 1 A 51 51 GLY H H 185 8.855 8.565 0.290 1
1 625 . 13 1 1 A 51 51 GLY HA2 H 185 3.993 3.816 0.177 1
1 626 . 13 1 1 A 51 51 GLY HA3 H 185 3.958 3.865 0.093 1
1 627 . 13 1 1 A 51 51 GLY C C 185 175.169 176.196 -1.027 1
1 628 . 13 1 1 A 51 51 GLY CA C 185 47.475 47.626 -0.151 1
1 629 . 13 1 1 A 51 51 GLY N N 185 105.550 106.347 -0.797 1
1 630 . 13 1 1 A 52 52 GLU H H 186 7.917 7.949 -0.032 1
1 631 . 13 1 1 A 52 52 GLU HA H 186 4.006 4.024 -0.018 1
1 636 . 13 1 1 A 52 52 GLU C C 186 179.499 179.592 -0.093 1
1 637 . 13 1 1 A 52 52 GLU CA C 186 58.904 59.148 -0.244 1
1 638 . 13 1 1 A 52 52 GLU CB C 186 29.700 29.795 -0.095 1
1 640 . 13 1 1 A 52 52 GLU N N 186 121.929 121.736 0.193 1
1 641 . 13 1 1 A 53 53 ILE H H 187 7.936 8.072 -0.136 1
1 642 . 13 1 1 A 53 53 ILE HA H 187 3.648 3.705 -0.057 1
1 652 . 13 1 1 A 53 53 ILE C C 187 177.886 177.712 0.174 1
1 653 . 13 1 1 A 53 53 ILE CA C 187 64.366 64.999 -0.633 1
1 654 . 13 1 1 A 53 53 ILE CB C 187 36.478 37.435 -0.957 1
1 658 . 13 1 1 A 53 53 ILE N N 187 120.991 120.726 0.265 1
1 659 . 13 1 1 A 54 54 ALA H H 188 8.895 8.560 0.335 1
1 660 . 13 1 1 A 54 54 ALA HA H 188 3.629 3.805 -0.176 1
1 664 . 13 1 1 A 54 54 ALA C C 188 179.437 179.310 0.127 1
1 665 . 13 1 1 A 54 54 ALA CA C 188 55.974 55.700 0.274 1
1 666 . 13 1 1 A 54 54 ALA CB C 188 17.591 18.717 -1.126 1
1 667 . 13 1 1 A 54 54 ALA N N 188 125.308 122.274 3.034 1
1 668 . 13 1 1 A 55 55 LYS H H 189 8.049 7.778 0.271 1
1 669 . 13 1 1 A 55 55 LYS HA H 189 4.106 3.912 0.194 1
1 678 . 13 1 1 A 55 55 LYS C C 189 178.995 178.088 0.907 1
1 679 . 13 1 1 A 55 55 LYS CA C 189 59.312 59.163 0.149 1
1 680 . 13 1 1 A 55 55 LYS CB C 189 32.647 31.908 0.739 1
1 684 . 13 1 1 A 55 55 LYS N N 189 116.835 118.332 -1.497 1
1 685 . 13 1 1 A 56 56 LYS H H 190 7.215 8.053 -0.838 1
1 686 . 13 1 1 A 56 56 LYS HA H 190 4.172 4.270 -0.098 1
1 695 . 13 1 1 A 56 56 LYS C C 190 177.897 178.068 -0.171 1
1 696 . 13 1 1 A 56 56 LYS CA C 190 58.418 58.061 0.357 1
1 697 . 13 1 1 A 56 56 LYS CB C 190 34.652 33.409 1.243 1
1 701 . 13 1 1 A 56 56 LYS N N 190 117.170 118.237 -1.067 1
1 702 . 13 1 1 A 57 57 GLU H H 191 8.572 7.846 0.726 1
1 703 . 13 1 1 A 57 57 GLU HA H 191 4.643 4.367 0.276 1
1 708 . 13 1 1 A 57 57 GLU C C 191 177.903 176.143 1.760 1
1 709 . 13 1 1 A 57 57 GLU CA C 191 55.708 56.239 -0.531 1
1 710 . 13 1 1 A 57 57 GLU CB C 191 32.460 30.759 1.701 1
1 712 . 13 1 1 A 57 57 GLU N N 191 113.316 117.131 -3.815 1
1 713 . 13 1 1 A 58 58 SER H H 192 8.550 7.695 0.855 1
1 714 . 13 1 1 A 58 58 SER HA H 192 4.149 4.375 -0.226 1
1 717 . 13 1 1 A 58 58 SER C C 192 176.161 175.433 0.728 1
1 718 . 13 1 1 A 58 58 SER CA C 192 58.403 58.427 -0.024 1
1 719 . 13 1 1 A 58 58 SER CB C 192 64.392 64.162 0.230 1
1 720 . 13 1 1 A 58 58 SER N N 192 109.861 115.584 -5.723 1
1 721 . 13 1 1 A 59 59 MET H H 193 9.533 8.852 0.681 1
1 722 . 13 1 1 A 59 59 MET HA H 193 4.457 4.784 -0.327 1
1 730 . 13 1 1 A 59 59 MET C C 193 175.204 174.884 0.320 1
1 731 . 13 1 1 A 59 59 MET CA C 193 55.781 54.431 1.350 1
1 732 . 13 1 1 A 59 59 MET CB C 193 32.855 32.567 0.288 1
1 735 . 13 1 1 A 59 59 MET N N 193 124.493 123.663 0.830 1
1 736 . 13 1 1 A 60 60 ASP H H 194 7.514 7.788 -0.274 1
1 737 . 13 1 1 A 60 60 ASP HA H 194 4.886 4.838 0.048 1
1 740 . 13 1 1 A 60 60 ASP C C 194 175.517 176.503 -0.986 1
1 741 . 13 1 1 A 60 60 ASP CA C 194 52.286 52.906 -0.620 1
1 742 . 13 1 1 A 60 60 ASP CB C 194 40.222 41.742 -1.520 1
1 743 . 13 1 1 A 60 60 ASP N N 194 117.785 122.243 -4.458 1
1 744 . 13 1 1 A 61 61 THR H H 195 8.118 8.605 -0.487 1
1 745 . 13 1 1 A 61 61 THR HA H 195 3.918 3.959 -0.041 1
1 750 . 13 1 1 A 61 61 THR C C 195 176.269 177.143 -0.874 1
1 751 . 13 1 1 A 61 61 THR CA C 195 65.469 65.336 0.133 1
1 752 . 13 1 1 A 61 61 THR CB C 195 68.741 68.443 0.298 1
1 754 . 13 1 1 A 61 61 THR N N 195 120.765 118.720 2.045 1
1 755 . 13 1 1 A 62 62 GLY H H 196 8.399 8.473 -0.074 1
1 756 . 13 1 1 A 62 62 GLY HA2 H 196 3.932 3.846 0.086 1
1 757 . 13 1 1 A 62 62 GLY HA3 H 196 3.900 3.847 0.053 1
1 758 . 13 1 1 A 62 62 GLY C C 196 174.948 176.600 -1.652 1
1 759 . 13 1 1 A 62 62 GLY CA C 196 46.768 47.678 -0.910 1
1 760 . 13 1 1 A 62 62 GLY N N 196 108.183 111.429 -3.246 1
1 761 . 13 1 1 A 63 63 SER H H 197 7.265 8.169 -0.904 1
1 762 . 13 1 1 A 63 63 SER HA H 197 4.554 4.403 0.151 1
1 765 . 13 1 1 A 63 63 SER C C 197 177.630 176.010 1.620 1
1 766 . 13 1 1 A 63 63 SER CA C 197 59.550 62.559 -3.009 1
1 767 . 13 1 1 A 63 63 SER CB C 197 65.504 63.245 2.259 1
1 768 . 13 1 1 A 63 63 SER N N 197 111.815 119.387 -7.572 1
1 769 . 13 1 1 A 64 64 ALA H H 198 8.675 8.080 0.595 1
1 770 . 13 1 1 A 64 64 ALA HA H 198 3.801 3.964 -0.163 1
1 774 . 13 1 1 A 64 64 ALA C C 198 178.492 179.663 -1.171 1
1 775 . 13 1 1 A 64 64 ALA CA C 198 56.794 55.282 1.512 1
1 776 . 13 1 1 A 64 64 ALA CB C 198 18.951 18.088 0.863 1
1 777 . 13 1 1 A 64 64 ALA N N 198 131.710 123.525 8.185 1
1 778 . 13 1 1 A 65 65 LYS H H 199 7.666 8.144 -0.478 1
1 779 . 13 1 1 A 65 65 LYS HA H 199 4.175 4.090 0.085 1
1 788 . 13 1 1 A 65 65 LYS C C 199 177.159 177.195 -0.036 1
1 789 . 13 1 1 A 65 65 LYS CA C 199 57.735 58.436 -0.701 1
1 790 . 13 1 1 A 65 65 LYS CB C 199 31.948 32.114 -0.166 1
1 794 . 13 1 1 A 65 65 LYS N N 199 111.375 118.263 -6.888 1
1 795 . 13 1 1 A 66 66 LYS H H 200 7.545 7.445 0.100 1
1 796 . 13 1 1 A 66 66 LYS HA H 200 4.612 4.479 0.133 1
1 805 . 13 1 1 A 66 66 LYS C C 200 175.609 175.922 -0.313 1
1 806 . 13 1 1 A 66 66 LYS CA C 200 54.468 55.492 -1.024 1
1 807 . 13 1 1 A 66 66 LYS CB C 200 31.525 32.661 -1.136 1
1 811 . 13 1 1 A 66 66 LYS N N 200 121.421 118.910 2.511 1
1 812 . 13 1 1 A 67 67 ASP H H 201 7.630 8.208 -0.578 1
1 813 . 13 1 1 A 67 67 ASP HA H 201 4.306 4.358 -0.052 1
1 816 . 13 1 1 A 67 67 ASP C C 201 175.025 176.260 -1.235 1
1 817 . 13 1 1 A 67 67 ASP CA C 201 56.400 55.355 1.045 1
1 818 . 13 1 1 A 67 67 ASP CB C 201 38.315 39.066 -0.751 1
1 819 . 13 1 1 A 67 67 ASP N N 201 116.216 116.096 0.120 1
1 820 . 13 1 1 A 68 68 GLY H H 202 8.368 8.654 -0.286 1
1 821 . 13 1 1 A 68 68 GLY HA2 H 202 4.316 3.930 0.386 1
1 822 . 13 1 1 A 68 68 GLY HA3 H 202 3.731 3.991 -0.260 1
1 823 . 13 1 1 A 68 68 GLY C C 202 174.139 174.163 -0.024 1
1 824 . 13 1 1 A 68 68 GLY CA C 202 45.514 45.410 0.104 1
1 825 . 13 1 1 A 68 68 GLY N N 202 105.095 105.041 0.054 1
1 826 . 13 1 1 A 69 69 GLU H H 203 7.534 7.764 -0.230 1
1 827 . 13 1 1 A 69 69 GLU HA H 203 4.479 4.398 0.081 1
1 832 . 13 1 1 A 69 69 GLU C C 203 176.961 176.482 0.479 1
1 833 . 13 1 1 A 69 69 GLU CA C 203 58.549 56.378 2.171 1
1 834 . 13 1 1 A 69 69 GLU CB C 203 30.998 30.829 0.169 1
1 836 . 13 1 1 A 69 69 GLU N N 203 120.426 120.555 -0.129 1
1 837 . 13 1 1 A 70 70 LEU H H 204 8.962 8.975 -0.013 1
1 838 . 13 1 1 A 70 70 LEU HA H 204 4.438 4.651 -0.213 1
1 848 . 13 1 1 A 70 70 LEU C C 204 178.648 177.327 1.321 1
1 849 . 13 1 1 A 70 70 LEU CA C 204 53.977 54.814 -0.837 1
1 850 . 13 1 1 A 70 70 LEU CB C 204 43.612 43.795 -0.183 1
1 854 . 13 1 1 A 70 70 LEU N N 204 122.066 124.929 -2.863 1
1 855 . 13 1 1 A 71 71 GLY H H 205 8.104 7.694 0.410 1
1 856 . 13 1 1 A 71 71 GLY HA2 H 205 4.165 4.040 0.125 1
1 857 . 13 1 1 A 71 71 GLY HA3 H 205 3.552 4.130 -0.578 1
1 858 . 13 1 1 A 71 71 GLY C C 205 173.098 173.406 -0.308 1
1 859 . 13 1 1 A 71 71 GLY CA C 205 44.723 45.005 -0.282 1
1 860 . 13 1 1 A 71 71 GLY N N 205 110.168 106.851 3.317 1
1 861 . 13 1 1 A 72 72 TYR H H 206 8.457 8.675 -0.218 1
1 862 . 13 1 1 A 72 72 TYR HA H 206 4.184 4.708 -0.524 1
1 869 . 13 1 1 A 72 72 TYR C C 206 175.975 175.481 0.494 1
1 870 . 13 1 1 A 72 72 TYR CA C 206 59.722 58.924 0.798 1
1 871 . 13 1 1 A 72 72 TYR CB C 206 38.378 38.308 0.070 1
1 874 . 13 1 1 A 72 72 TYR N N 206 120.171 122.122 -1.951 1
1 875 . 13 1 1 A 73 73 VAL H H 207 8.782 9.131 -0.349 1
1 876 . 13 1 1 A 73 73 VAL HA H 207 4.056 4.388 -0.332 1
1 884 . 13 1 1 A 73 73 VAL C C 207 174.901 175.926 -1.025 1
1 885 . 13 1 1 A 73 73 VAL CA C 207 62.202 62.489 -0.287 1
1 886 . 13 1 1 A 73 73 VAL CB C 207 33.071 32.346 0.725 1
1 889 . 13 1 1 A 73 73 VAL N N 207 128.847 125.030 3.817 1
1 890 . 13 1 1 A 74 74 LEU H H 208 8.146 8.860 -0.714 1
1 891 . 13 1 1 A 74 74 LEU HA H 208 4.944 4.516 0.428 1
1 901 . 13 1 1 A 74 74 LEU C C 208 178.400 177.437 0.963 1
1 902 . 13 1 1 A 74 74 LEU CA C 208 53.520 54.318 -0.798 1
1 903 . 13 1 1 A 74 74 LEU CB C 208 43.499 42.297 1.202 1
1 907 . 13 1 1 A 74 74 LEU N N 208 127.599 129.525 -1.926 1
1 908 . 13 1 1 A 75 75 LYS H H 209 8.403 8.336 0.067 1
1 909 . 13 1 1 A 75 75 LYS HA H 209 3.771 3.846 -0.075 1
1 918 . 13 1 1 A 75 75 LYS C C 209 177.536 177.543 -0.007 1
1 919 . 13 1 1 A 75 75 LYS CA C 209 58.385 58.920 -0.535 1
1 920 . 13 1 1 A 75 75 LYS CB C 209 32.459 32.140 0.319 1
1 924 . 13 1 1 A 75 75 LYS N N 209 123.798 122.449 1.349 1
1 925 . 13 1 1 A 76 76 GLY H H 210 9.997 9.151 0.846 1
1 926 . 13 1 1 A 76 76 GLY HA2 H 210 4.255 3.999 0.256 1
1 927 . 13 1 1 A 76 76 GLY HA3 H 210 3.791 4.001 -0.210 1
1 928 . 13 1 1 A 76 76 GLY C C 210 175.091 175.419 -0.328 1
1 929 . 13 1 1 A 76 76 GLY CA C 210 45.465 45.723 -0.258 1
1 930 . 13 1 1 A 76 76 GLY N N 210 114.705 113.607 1.098 1
1 931 . 13 1 1 A 77 77 GLN H H 211 7.726 8.033 -0.307 1
1 932 . 13 1 1 A 77 77 GLN HA H 211 4.373 4.160 0.213 1
1 939 . 13 1 1 A 77 77 GLN C C 211 176.301 175.934 0.367 1
1 940 . 13 1 1 A 77 77 GLN CA C 211 57.074 57.791 -0.717 1
1 941 . 13 1 1 A 77 77 GLN CB C 211 30.798 29.269 1.529 1
1 943 . 13 1 1 A 77 77 GLN N N 211 118.702 118.800 -0.098 1
1 945 . 13 1 1 A 78 78 THR H H 212 8.225 7.511 0.714 1
1 946 . 13 1 1 A 78 78 THR HA H 212 4.620 4.508 0.112 1
1 951 . 13 1 1 A 78 78 THR C C 212 173.920 174.281 -0.361 1
1 952 . 13 1 1 A 78 78 THR CA C 212 60.087 59.736 0.351 1
1 953 . 13 1 1 A 78 78 THR CB C 212 71.412 70.787 0.625 1
1 955 . 13 1 1 A 78 78 THR N N 212 111.935 111.472 0.463 1
1 956 . 13 1 1 A 79 79 ASP H H 213 8.372 8.517 -0.145 1
1 957 . 13 1 1 A 79 79 ASP HA H 213 4.470 4.630 -0.160 1
1 960 . 13 1 1 A 79 79 ASP C C 213 176.759 177.809 -1.050 1
1 961 . 13 1 1 A 79 79 ASP CA C 213 54.927 54.343 0.584 1
1 962 . 13 1 1 A 79 79 ASP CB C 213 43.859 41.896 1.963 1
1 963 . 13 1 1 A 79 79 ASP N N 213 122.093 121.378 0.715 1
1 964 . 13 1 1 A 80 80 LYS H H 214 8.740 8.923 -0.183 1
1 965 . 13 1 1 A 80 80 LYS HA H 214 4.027 3.896 0.131 1
1 974 . 13 1 1 A 80 80 LYS C C 214 178.493 178.226 0.267 1
1 975 . 13 1 1 A 80 80 LYS CA C 214 59.802 59.885 -0.083 1
1 976 . 13 1 1 A 80 80 LYS CB C 214 32.374 32.152 0.222 1
1 980 . 13 1 1 A 80 80 LYS N N 214 124.685 122.913 1.772 1
1 981 . 13 1 1 A 81 81 ASP H H 215 8.556 8.207 0.349 1
1 982 . 13 1 1 A 81 81 ASP HA H 215 4.566 4.364 0.202 1
1 985 . 13 1 1 A 81 81 ASP C C 215 178.889 178.604 0.285 1
1 986 . 13 1 1 A 81 81 ASP CA C 215 58.046 57.353 0.693 1
1 987 . 13 1 1 A 81 81 ASP CB C 215 40.872 40.387 0.485 1
1 988 . 13 1 1 A 81 81 ASP N N 215 121.413 119.355 2.058 1
1 989 . 13 1 1 A 82 82 PHE H H 216 8.205 8.280 -0.075 1
1 990 . 13 1 1 A 82 82 PHE HA H 216 3.686 4.055 -0.369 1
1 998 . 13 1 1 A 82 82 PHE C C 216 175.919 177.366 -1.447 1
1 999 . 13 1 1 A 82 82 PHE CA C 216 61.648 60.662 0.986 1
1 1000 . 13 1 1 A 82 82 PHE CB C 216 39.743 39.028 0.715 1
1 1004 . 13 1 1 A 82 82 PHE N N 216 124.401 122.493 1.908 1
1 1005 . 13 1 1 A 83 83 GLU H H 217 8.887 8.822 0.065 1
1 1006 . 13 1 1 A 83 83 GLU HA H 217 3.704 4.175 -0.471 1
1 1011 . 13 1 1 A 83 83 GLU C C 217 177.788 179.480 -1.692 1
1 1012 . 13 1 1 A 83 83 GLU CA C 217 60.545 60.280 0.265 1
1 1013 . 13 1 1 A 83 83 GLU CB C 217 30.639 29.440 1.199 1
1 1015 . 13 1 1 A 83 83 GLU N N 217 119.421 119.029 0.392 1
1 1016 . 13 1 1 A 84 84 LYS H H 218 8.055 7.972 0.083 1
1 1017 . 13 1 1 A 84 84 LYS HA H 218 3.947 4.118 -0.171 1
1 1026 . 13 1 1 A 84 84 LYS C C 218 178.783 178.314 0.469 1
1 1027 . 13 1 1 A 84 84 LYS CA C 218 59.327 58.756 0.571 1
1 1028 . 13 1 1 A 84 84 LYS CB C 218 32.539 32.212 0.327 1
1 1032 . 13 1 1 A 84 84 LYS N N 218 117.821 118.755 -0.934 1
1 1033 . 13 1 1 A 85 85 ALA H H 219 7.059 7.722 -0.663 1
1 1034 . 13 1 1 A 85 85 ALA HA H 219 4.040 4.244 -0.204 1
1 1038 . 13 1 1 A 85 85 ALA C C 219 179.794 180.019 -0.225 1
1 1039 . 13 1 1 A 85 85 ALA CA C 219 54.407 54.549 -0.142 1
1 1040 . 13 1 1 A 85 85 ALA CB C 219 20.130 18.829 1.301 1
1 1041 . 13 1 1 A 85 85 ALA N N 219 118.905 122.809 -3.904 1
1 1042 . 13 1 1 A 86 86 LEU H H 220 8.157 8.403 -0.246 1
1 1043 . 13 1 1 A 86 86 LEU HA H 220 3.692 4.005 -0.313 1
1 1053 . 13 1 1 A 86 86 LEU C C 220 178.330 178.550 -0.220 1
1 1054 . 13 1 1 A 86 86 LEU CA C 220 57.752 58.111 -0.359 1
1 1055 . 13 1 1 A 86 86 LEU CB C 220 41.464 41.830 -0.366 1
1 1059 . 13 1 1 A 86 86 LEU N N 220 118.606 120.274 -1.668 1
1 1060 . 13 1 1 A 87 87 PHE H H 221 8.349 8.308 0.041 1
1 1061 . 13 1 1 A 87 87 PHE HA H 221 3.861 4.472 -0.611 1
1 1069 . 13 1 1 A 87 87 PHE C C 221 176.176 177.825 -1.649 1
1 1070 . 13 1 1 A 87 87 PHE CA C 221 61.780 61.508 0.272 1
1 1071 . 13 1 1 A 87 87 PHE CB C 221 37.549 37.930 -0.381 1
1 1075 . 13 1 1 A 87 87 PHE N N 221 112.449 116.765 -4.316 1
1 1076 . 13 1 1 A 88 88 LYS H H 222 7.061 7.820 -0.759 1
1 1077 . 13 1 1 A 88 88 LYS HA H 222 4.380 4.133 0.247 1
1 1086 . 13 1 1 A 88 88 LYS C C 222 177.089 177.149 -0.060 1
1 1087 . 13 1 1 A 88 88 LYS CA C 222 56.726 58.504 -1.778 1
1 1088 . 13 1 1 A 88 88 LYS CB C 222 33.738 32.376 1.362 1
1 1092 . 13 1 1 A 88 88 LYS N N 222 118.308 120.958 -2.650 1
1 1093 . 13 1 1 A 89 89 LEU H H 223 7.270 7.289 -0.019 1
1 1094 . 13 1 1 A 89 89 LEU HA H 223 4.168 4.221 -0.053 1
1 1104 . 13 1 1 A 89 89 LEU C C 223 177.528 177.007 0.521 1
1 1105 . 13 1 1 A 89 89 LEU CA C 223 55.279 54.370 0.909 1
1 1106 . 13 1 1 A 89 89 LEU CB C 223 43.240 42.602 0.638 1
1 1110 . 13 1 1 A 89 89 LEU N N 223 121.317 122.475 -1.158 1
1 1111 . 13 1 1 A 90 90 LYS H H 224 8.788 8.478 0.310 1
1 1112 . 13 1 1 A 90 90 LYS HA H 224 4.359 4.479 -0.120 1
1 1121 . 13 1 1 A 90 90 LYS C C 224 175.839 175.431 0.408 1
1 1122 . 13 1 1 A 90 90 LYS CA C 224 54.772 55.038 -0.266 1
1 1123 . 13 1 1 A 90 90 LYS CB C 224 33.232 33.238 -0.006 1
1 1127 . 13 1 1 A 90 90 LYS N N 224 123.558 122.323 1.235 1
1 1128 . 13 1 1 A 91 91 ASP H H 225 8.125 8.647 -0.522 1
1 1129 . 13 1 1 A 91 91 ASP HA H 225 3.958 4.367 -0.409 1
1 1132 . 13 1 1 A 91 91 ASP C C 225 177.452 176.593 0.859 1
1 1133 . 13 1 1 A 91 91 ASP CA C 225 56.642 55.513 1.129 1
1 1134 . 13 1 1 A 91 91 ASP CB C 225 40.269 40.181 0.088 1
1 1135 . 13 1 1 A 91 91 ASP N N 225 119.419 121.471 -2.052 1
1 1136 . 13 1 1 A 92 92 GLY H H 226 8.681 8.718 -0.037 1
1 1137 . 13 1 1 A 92 92 GLY HA2 H 226 4.131 3.871 0.260 1
1 1138 . 13 1 1 A 92 92 GLY HA3 H 226 3.579 3.895 -0.316 1
1 1139 . 13 1 1 A 92 92 GLY C C 226 173.614 173.899 -0.285 1
1 1140 . 13 1 1 A 92 92 GLY CA C 226 45.564 45.043 0.521 1
1 1141 . 13 1 1 A 92 92 GLY N N 226 113.802 112.029 1.773 1
1 1142 . 13 1 1 A 93 93 GLU H H 227 8.104 8.031 0.073 1
1 1143 . 13 1 1 A 93 93 GLU HA H 227 4.232 4.440 -0.208 1
1 1148 . 13 1 1 A 93 93 GLU C C 227 174.282 175.611 -1.329 1
1 1149 . 13 1 1 A 93 93 GLU CA C 227 56.651 55.927 0.724 1
1 1150 . 13 1 1 A 93 93 GLU CB C 227 32.190 31.072 1.118 1
1 1152 . 13 1 1 A 93 93 GLU N N 227 121.527 121.809 -0.282 1
1 1153 . 13 1 1 A 94 94 VAL H H 228 7.918 8.558 -0.640 1
1 1154 . 13 1 1 A 94 94 VAL HA H 228 4.857 4.729 0.128 1
1 1162 . 13 1 1 A 94 94 VAL C C 228 176.556 175.661 0.895 1
1 1163 . 13 1 1 A 94 94 VAL CA C 228 60.309 60.443 -0.134 1
1 1164 . 13 1 1 A 94 94 VAL CB C 228 33.847 35.403 -1.556 1
1 1167 . 13 1 1 A 94 94 VAL N N 228 119.768 125.886 -6.118 1
1 1168 . 13 1 1 A 95 95 SER H H 229 9.659 9.456 0.203 1
1 1169 . 13 1 1 A 95 95 SER HA H 229 4.313 4.708 -0.395 1
1 1172 . 13 1 1 A 95 95 SER C C 229 174.641 174.371 0.270 1
1 1173 . 13 1 1 A 95 95 SER CA C 229 59.208 57.925 1.283 1
1 1174 . 13 1 1 A 95 95 SER CB C 229 66.080 65.719 0.361 1
1 1175 . 13 1 1 A 95 95 SER N N 229 124.903 121.470 3.433 1
1 1176 . 13 1 1 A 96 96 GLU H H 230 8.014 8.595 -0.581 1
1 1177 . 13 1 1 A 96 96 GLU HA H 230 4.376 4.475 -0.099 1
1 1182 . 13 1 1 A 96 96 GLU C C 230 176.641 177.222 -0.581 1
1 1183 . 13 1 1 A 96 96 GLU CA C 230 56.236 56.314 -0.078 1
1 1184 . 13 1 1 A 96 96 GLU CB C 230 30.324 30.880 -0.556 1
1 1186 . 13 1 1 A 96 96 GLU N N 230 115.510 120.893 -5.383 1
1 1187 . 13 1 1 A 97 97 VAL H H 231 8.741 8.438 0.303 1
1 1188 . 13 1 1 A 97 97 VAL HA H 231 4.171 4.202 -0.031 1
1 1196 . 13 1 1 A 97 97 VAL C C 231 176.684 175.589 1.095 1
1 1197 . 13 1 1 A 97 97 VAL CA C 231 65.418 63.217 2.201 1
1 1198 . 13 1 1 A 97 97 VAL CB C 231 31.218 31.558 -0.340 1
1 1201 . 13 1 1 A 97 97 VAL N N 231 121.289 121.508 -0.219 1
1 1202 . 13 1 1 A 98 98 VAL H H 232 9.218 9.527 -0.309 1
1 1203 . 13 1 1 A 98 98 VAL HA H 232 4.405 4.644 -0.239 1
1 1211 . 13 1 1 A 98 98 VAL C C 232 174.258 174.387 -0.129 1
1 1212 . 13 1 1 A 98 98 VAL CA C 232 60.937 61.138 -0.201 1
1 1213 . 13 1 1 A 98 98 VAL CB C 232 35.825 34.041 1.784 1
1 1216 . 13 1 1 A 98 98 VAL N N 232 130.544 128.655 1.889 1
1 1217 . 13 1 1 A 99 99 LYS H H 233 8.800 8.942 -0.142 1
1 1218 . 13 1 1 A 99 99 LYS HA H 233 4.853 5.054 -0.201 1
1 1227 . 13 1 1 A 99 99 LYS C C 233 175.274 175.037 0.237 1
1 1228 . 13 1 1 A 99 99 LYS CA C 233 55.499 54.819 0.680 1
1 1229 . 13 1 1 A 99 99 LYS CB C 233 34.452 34.432 0.020 1
1 1233 . 13 1 1 A 99 99 LYS N N 233 130.477 128.014 2.463 1
1 1234 . 13 1 1 A 100 100 SER H H 234 9.585 8.744 0.841 1
1 1235 . 13 1 1 A 100 100 SER HA H 234 5.150 4.920 0.230 1
1 1238 . 13 1 1 A 100 100 SER C C 234 175.493 173.512 1.981 1
1 1239 . 13 1 1 A 100 100 SER CA C 234 56.927 56.164 0.763 1
1 1240 . 13 1 1 A 100 100 SER CB C 234 67.309 65.516 1.793 1
1 1241 . 13 1 1 A 100 100 SER N N 234 125.814 120.480 5.334 1
1 1242 . 13 1 1 A 101 101 SER H H 235 8.631 8.999 -0.368 1
1 1243 . 13 1 1 A 101 101 SER HA H 235 4.106 4.114 -0.008 1
1 1246 . 13 1 1 A 101 101 SER C C 235 175.385 175.519 -0.134 1
1 1247 . 13 1 1 A 101 101 SER CA C 235 61.123 61.742 -0.619 1
1 1248 . 13 1 1 A 101 101 SER CB C 235 62.818 62.644 0.174 1
1 1249 . 13 1 1 A 101 101 SER N N 235 115.089 118.872 -3.783 1
1 1250 . 13 1 1 A 102 102 PHE H H 236 8.957 7.741 1.216 1
1 1251 . 13 1 1 A 102 102 PHE HA H 236 4.610 4.585 0.025 1
1 1259 . 13 1 1 A 102 102 PHE C C 236 176.453 175.787 0.666 1
1 1260 . 13 1 1 A 102 102 PHE CA C 236 58.382 58.115 0.267 1
1 1261 . 13 1 1 A 102 102 PHE CB C 236 40.275 39.438 0.837 1
1 1263 . 13 1 1 A 102 102 PHE N N 236 119.917 117.932 1.985 1
1 1264 . 13 1 1 A 103 103 GLY H H 237 7.377 7.314 0.063 1
1 1265 . 13 1 1 A 103 103 GLY HA2 H 237 4.453 4.063 0.390 1
1 1266 . 13 1 1 A 103 103 GLY HA3 H 237 3.472 4.190 -0.718 1
1 1267 . 13 1 1 A 103 103 GLY C C 237 169.627 172.165 -2.538 1
1 1268 . 13 1 1 A 103 103 GLY CA C 237 45.384 44.903 0.481 1
1 1269 . 13 1 1 A 103 103 GLY N N 237 108.809 106.169 2.640 1
1 1270 . 13 1 1 A 104 104 TYR H H 238 8.632 8.489 0.143 1
1 1271 . 13 1 1 A 104 104 TYR HA H 238 5.322 5.686 -0.364 1
1 1278 . 13 1 1 A 104 104 TYR C C 238 175.043 175.232 -0.189 1
1 1279 . 13 1 1 A 104 104 TYR CA C 238 57.627 56.416 1.211 1
1 1280 . 13 1 1 A 104 104 TYR CB C 238 41.711 42.533 -0.822 1
1 1283 . 13 1 1 A 104 104 TYR N N 238 120.030 121.560 -1.530 1
1 1284 . 13 1 1 A 105 105 HIS H H 239 10.070 9.531 0.539 1
1 1285 . 13 1 1 A 105 105 HIS HA H 239 6.046 5.673 0.373 1
1 1290 . 13 1 1 A 105 105 HIS C C 239 175.734 174.916 0.818 1
1 1291 . 13 1 1 A 105 105 HIS CA C 239 53.945 54.112 -0.167 1
1 1292 . 13 1 1 A 105 105 HIS CB C 239 32.450 34.135 -1.685 1
1 1295 . 13 1 1 A 105 105 HIS N N 239 119.504 119.787 -0.283 1
1 1296 . 13 1 1 A 106 106 ILE H H 240 8.660 8.889 -0.229 1
1 1297 . 13 1 1 A 106 106 ILE HA H 240 4.120 4.915 -0.795 1
1 1307 . 13 1 1 A 106 106 ILE C C 240 174.758 175.383 -0.625 1
1 1308 . 13 1 1 A 106 106 ILE CA C 240 63.446 59.975 3.471 1
1 1309 . 13 1 1 A 106 106 ILE CB C 240 40.786 41.344 -0.558 1
1 1313 . 13 1 1 A 106 106 ILE N N 240 120.639 120.083 0.556 1
1 1314 . 13 1 1 A 107 107 ILE H H 241 9.033 9.083 -0.050 1
1 1315 . 13 1 1 A 107 107 ILE HA H 241 4.799 5.141 -0.342 1
1 1325 . 13 1 1 A 107 107 ILE C C 241 172.880 173.962 -1.082 1
1 1326 . 13 1 1 A 107 107 ILE CA C 241 60.563 59.632 0.931 1
1 1327 . 13 1 1 A 107 107 ILE CB C 241 41.652 40.922 0.730 1
1 1331 . 13 1 1 A 107 107 ILE N N 241 129.098 127.158 1.940 1
1 1332 . 13 1 1 A 108 108 LYS H H 242 8.692 9.030 -0.338 1
1 1333 . 13 1 1 A 108 108 LYS HA H 242 5.012 4.989 0.023 1
1 1342 . 13 1 1 A 108 108 LYS C C 242 174.484 175.566 -1.082 1
1 1343 . 13 1 1 A 108 108 LYS CA C 242 54.317 53.932 0.385 1
1 1344 . 13 1 1 A 108 108 LYS CB C 242 35.619 35.416 0.203 1
1 1348 . 13 1 1 A 108 108 LYS N N 242 127.179 128.293 -1.114 1
1 1349 . 13 1 1 A 109 109 ALA H H 243 7.816 9.105 -1.289 1
1 1350 . 13 1 1 A 109 109 ALA HA H 243 4.604 4.740 -0.136 1
1 1354 . 13 1 1 A 109 109 ALA C C 243 176.231 175.957 0.274 1
1 1355 . 13 1 1 A 109 109 ALA CA C 243 50.505 51.035 -0.530 1
1 1356 . 13 1 1 A 109 109 ALA CB C 243 19.584 19.971 -0.387 1
1 1357 . 13 1 1 A 109 109 ALA N N 243 129.619 128.216 1.403 1
1 1358 . 13 1 1 A 110 110 ASP H H 244 7.578 8.574 -0.996 1
1 1359 . 13 1 1 A 110 110 ASP HA H 244 4.424 5.080 -0.656 1
1 1362 . 13 1 1 A 110 110 ASP C C 244 175.259 175.932 -0.673 1
1 1363 . 13 1 1 A 110 110 ASP CA C 244 54.489 52.362 2.127 1
1 1364 . 13 1 1 A 110 110 ASP CB C 244 42.693 43.766 -1.073 1
1 1365 . 13 1 1 A 110 110 ASP N N 244 125.434 121.932 3.502 1
1 4 . 14 1 1 A 2 2 PRO HA H -4 4.403 4.663 -0.260 1
1 11 . 14 1 1 A 2 2 PRO C C -4 176.990 176.442 0.548 1
1 12 . 14 1 1 A 2 2 PRO CA C -4 63.131 62.815 0.316 1
1 13 . 14 1 1 A 2 2 PRO CB C -4 32.342 32.435 -0.093 1
1 16 . 14 1 1 A 3 3 LEU H H -3 8.483 8.596 -0.113 1
1 17 . 14 1 1 A 3 3 LEU HA H -3 4.333 4.560 -0.227 1
1 27 . 14 1 1 A 3 3 LEU C C -3 177.991 176.597 1.394 1
1 28 . 14 1 1 A 3 3 LEU CA C -3 55.314 54.568 0.746 1
1 29 . 14 1 1 A 3 3 LEU CB C -3 42.244 42.382 -0.138 1
1 33 . 14 1 1 A 3 3 LEU N N -3 122.986 117.875 5.111 1
1 34 . 14 1 1 A 4 4 GLY H H -2 8.397 7.714 0.683 1
1 35 . 14 1 1 A 4 4 GLY HA2 H -2 4.024 4.060 -0.036 1
1 36 . 14 1 1 A 4 4 GLY HA3 H -2 3.976 4.067 -0.091 1
1 37 . 14 1 1 A 4 4 GLY C C -2 174.360 174.403 -0.043 1
1 38 . 14 1 1 A 4 4 GLY CA C -2 45.434 44.218 1.216 1
1 39 . 14 1 1 A 4 4 GLY N N -2 110.666 109.306 1.360 1
1 56 . 14 1 1 A 7 7 SER H H 141 7.913 7.922 -0.009 1
1 57 . 14 1 1 A 7 7 SER HA H 141 5.657 5.343 0.314 1
1 60 . 14 1 1 A 7 7 SER C C 141 173.753 172.548 1.205 1
1 61 . 14 1 1 A 7 7 SER CA C 141 56.758 57.889 -1.131 1
1 62 . 14 1 1 A 7 7 SER CB C 141 66.774 65.526 1.248 1
1 63 . 14 1 1 A 7 7 SER N N 141 113.824 112.169 1.655 1
1 64 . 14 1 1 A 8 8 LYS H H 142 8.656 8.803 -0.147 1
1 65 . 14 1 1 A 8 8 LYS HA H 142 4.543 5.127 -0.584 1
1 74 . 14 1 1 A 8 8 LYS C C 142 174.403 174.135 0.268 1
1 75 . 14 1 1 A 8 8 LYS CA C 142 55.578 54.783 0.795 1
1 76 . 14 1 1 A 8 8 LYS CB C 142 36.561 35.989 0.572 1
1 80 . 14 1 1 A 8 8 LYS N N 142 123.076 119.253 3.823 1
1 81 . 14 1 1 A 9 9 LYS H H 143 8.623 8.160 0.463 1
1 82 . 14 1 1 A 9 9 LYS HA H 143 4.119 4.169 -0.050 1
1 91 . 14 1 1 A 9 9 LYS C C 143 176.144 175.445 0.699 1
1 92 . 14 1 1 A 9 9 LYS CA C 143 56.683 56.163 0.520 1
1 93 . 14 1 1 A 9 9 LYS CB C 143 32.580 32.713 -0.133 1
1 97 . 14 1 1 A 9 9 LYS N N 143 129.542 122.527 7.015 1
1 98 . 14 1 1 A 10 10 ALA H H 144 8.151 8.638 -0.487 1
1 99 . 14 1 1 A 10 10 ALA HA H 144 5.208 4.963 0.245 1
1 103 . 14 1 1 A 10 10 ALA C C 144 175.577 175.019 0.558 1
1 104 . 14 1 1 A 10 10 ALA CA C 144 51.226 51.075 0.151 1
1 105 . 14 1 1 A 10 10 ALA CB C 144 25.299 24.211 1.088 1
1 106 . 14 1 1 A 10 10 ALA N N 144 127.933 128.022 -0.089 1
1 107 . 14 1 1 A 11 11 SER H H 145 8.679 8.708 -0.029 1
1 108 . 14 1 1 A 11 11 SER HA H 145 5.431 5.769 -0.338 1
1 111 . 14 1 1 A 11 11 SER C C 145 173.072 173.270 -0.198 1
1 112 . 14 1 1 A 11 11 SER CA C 145 57.772 57.093 0.679 1
1 113 . 14 1 1 A 11 11 SER CB C 145 67.301 66.043 1.258 1
1 114 . 14 1 1 A 11 11 SER N N 145 116.245 115.173 1.072 1
1 115 . 14 1 1 A 12 12 HIS H H 146 9.962 9.587 0.375 1
1 116 . 14 1 1 A 12 12 HIS HA H 146 6.332 6.028 0.304 1
1 121 . 14 1 1 A 12 12 HIS C C 146 173.006 172.445 0.561 1
1 122 . 14 1 1 A 12 12 HIS CA C 146 55.020 54.316 0.704 1
1 123 . 14 1 1 A 12 12 HIS CB C 146 37.071 33.323 3.748 1
1 126 . 14 1 1 A 12 12 HIS N N 146 119.181 118.461 0.720 1
1 127 . 14 1 1 A 13 13 ILE H H 147 8.976 8.765 0.211 1
1 128 . 14 1 1 A 13 13 ILE HA H 147 3.528 4.579 -1.051 1
1 138 . 14 1 1 A 13 13 ILE C C 147 173.010 173.775 -0.765 1
1 139 . 14 1 1 A 13 13 ILE CA C 147 61.273 59.261 2.012 1
1 140 . 14 1 1 A 13 13 ILE CB C 147 41.773 41.681 0.092 1
1 144 . 14 1 1 A 13 13 ILE N N 147 121.873 119.237 2.636 1
1 145 . 14 1 1 A 14 14 LEU H H 148 7.627 8.880 -1.253 1
1 146 . 14 1 1 A 14 14 LEU HA H 148 4.814 5.091 -0.277 1
1 156 . 14 1 1 A 14 14 LEU C C 148 174.112 174.301 -0.189 1
1 157 . 14 1 1 A 14 14 LEU CA C 148 52.574 52.959 -0.385 1
1 158 . 14 1 1 A 14 14 LEU CB C 148 45.643 45.181 0.462 1
1 162 . 14 1 1 A 14 14 LEU N N 148 127.112 128.499 -1.387 1
1 163 . 14 1 1 A 15 15 ILE H H 149 9.524 9.204 0.320 1
1 164 . 14 1 1 A 15 15 ILE HA H 149 4.362 4.582 -0.220 1
1 174 . 14 1 1 A 15 15 ILE C C 149 175.452 175.645 -0.193 1
1 175 . 14 1 1 A 15 15 ILE CA C 149 58.516 60.681 -2.165 1
1 176 . 14 1 1 A 15 15 ILE CB C 149 36.560 38.722 -2.162 1
1 180 . 14 1 1 A 15 15 ILE N N 149 128.652 127.103 1.549 1
1 181 . 14 1 1 A 16 16 LYS H H 150 8.035 8.587 -0.552 1
1 182 . 14 1 1 A 16 16 LYS HA H 150 4.319 4.375 -0.056 1
1 191 . 14 1 1 A 16 16 LYS C C 150 175.038 176.376 -1.338 1
1 192 . 14 1 1 A 16 16 LYS CA C 150 57.817 56.731 1.086 1
1 193 . 14 1 1 A 16 16 LYS CB C 150 34.853 32.489 2.364 1
1 197 . 14 1 1 A 16 16 LYS N N 150 129.153 127.978 1.175 1
1 198 . 14 1 1 A 17 17 VAL H H 151 8.016 8.676 -0.660 1
1 199 . 14 1 1 A 17 17 VAL HA H 151 4.873 4.568 0.305 1
1 207 . 14 1 1 A 17 17 VAL C C 151 176.647 175.427 1.220 1
1 208 . 14 1 1 A 17 17 VAL CA C 151 60.088 61.629 -1.541 1
1 209 . 14 1 1 A 17 17 VAL CB C 151 34.082 32.784 1.298 1
1 212 . 14 1 1 A 17 17 VAL N N 151 121.288 124.993 -3.705 1
1 213 . 14 1 1 A 18 18 LYS H H 152 8.443 8.781 -0.338 1
1 214 . 14 1 1 A 18 18 LYS HA H 152 4.334 4.793 -0.459 1
1 223 . 14 1 1 A 18 18 LYS C C 152 176.345 177.191 -0.846 1
1 224 . 14 1 1 A 18 18 LYS CA C 152 57.016 54.530 2.486 1
1 225 . 14 1 1 A 18 18 LYS CB C 152 33.222 35.036 -1.814 1
1 229 . 14 1 1 A 18 18 LYS N N 152 128.408 126.999 1.409 1
1 230 . 14 1 1 A 19 19 SER H H 153 9.067 8.814 0.253 1
1 231 . 14 1 1 A 19 19 SER HA H 153 4.457 4.365 0.092 1
1 234 . 14 1 1 A 19 19 SER C C 153 174.236 174.291 -0.055 1
1 235 . 14 1 1 A 19 19 SER CA C 153 59.642 59.710 -0.068 1
1 236 . 14 1 1 A 19 19 SER CB C 153 64.347 63.699 0.648 1
1 237 . 14 1 1 A 19 19 SER N N 153 121.522 115.939 5.583 1
1 238 . 14 1 1 A 20 20 LYS H H 154 7.961 7.656 0.305 1
1 239 . 14 1 1 A 20 20 LYS HA H 154 4.558 4.720 -0.162 1
1 244 . 14 1 1 A 20 20 LYS C C 154 177.256 176.136 1.120 1
1 245 . 14 1 1 A 20 20 LYS CA C 154 55.249 55.803 -0.554 1
1 246 . 14 1 1 A 20 20 LYS CB C 154 34.531 35.877 -1.346 1
1 248 . 14 1 1 A 20 20 LYS N N 154 120.270 120.192 0.078 1
1 249 . 14 1 1 A 21 21 LYS HA H 155 4.003 4.076 -0.073 1
1 258 . 14 1 1 A 21 21 LYS C C 155 177.015 178.530 -1.515 1
1 259 . 14 1 1 A 21 21 LYS CA C 155 59.091 58.524 0.567 1
1 260 . 14 1 1 A 21 21 LYS CB C 155 32.394 32.018 0.376 1
1 264 . 14 1 1 A 22 22 SER H H 156 7.625 7.780 -0.155 1
1 265 . 14 1 1 A 22 22 SER HA H 156 4.293 4.385 -0.092 1
1 268 . 14 1 1 A 22 22 SER C C 156 174.843 174.420 0.423 1
1 269 . 14 1 1 A 22 22 SER CA C 156 57.966 60.978 -3.012 1
1 270 . 14 1 1 A 22 22 SER CB C 156 63.369 63.242 0.127 1
1 271 . 14 1 1 A 22 22 SER N N 156 109.549 115.188 -5.639 1
1 272 . 14 1 1 A 23 23 ASP H H 157 7.701 7.434 0.267 1
1 273 . 14 1 1 A 23 23 ASP HA H 157 4.548 4.639 -0.091 1
1 276 . 14 1 1 A 23 23 ASP C C 157 176.544 177.039 -0.495 1
1 277 . 14 1 1 A 23 23 ASP CA C 157 55.242 53.973 1.269 1
1 278 . 14 1 1 A 23 23 ASP CB C 157 41.103 42.019 -0.916 1
1 279 . 14 1 1 A 23 23 ASP N N 157 124.536 120.678 3.858 1
1 280 . 14 1 1 A 24 24 LYS H H 158 8.583 9.013 -0.430 1
1 281 . 14 1 1 A 24 24 LYS HA H 158 4.252 4.196 0.056 1
1 290 . 14 1 1 A 24 24 LYS C C 158 176.813 178.752 -1.939 1
1 291 . 14 1 1 A 24 24 LYS CA C 158 57.148 58.571 -1.423 1
1 292 . 14 1 1 A 24 24 LYS CB C 158 33.200 32.282 0.918 1
1 296 . 14 1 1 A 24 24 LYS N N 158 122.372 126.839 -4.467 1
1 297 . 14 1 1 A 25 25 GLU H H 159 8.001 7.886 0.115 1
1 298 . 14 1 1 A 25 25 GLU HA H 159 4.521 4.109 0.412 1
1 303 . 14 1 1 A 25 25 GLU C C 159 175.995 176.260 -0.265 1
1 304 . 14 1 1 A 25 25 GLU CA C 159 55.727 59.126 -3.399 1
1 305 . 14 1 1 A 25 25 GLU CB C 159 31.918 30.413 1.505 1
1 307 . 14 1 1 A 25 25 GLU N N 159 118.705 119.595 -0.890 1
1 308 . 14 1 1 A 26 26 GLY H H 160 8.458 7.538 0.920 1
1 309 . 14 1 1 A 26 26 GLY HA2 H 160 3.946 4.032 -0.086 1
1 310 . 14 1 1 A 26 26 GLY HA3 H 160 3.511 4.040 -0.529 1
1 311 . 14 1 1 A 26 26 GLY C C 160 172.201 171.843 0.358 1
1 312 . 14 1 1 A 26 26 GLY CA C 160 44.038 45.777 -1.739 1
1 313 . 14 1 1 A 26 26 GLY N N 160 107.642 106.773 0.869 1
1 314 . 14 1 1 A 27 27 LEU H H 161 8.259 8.240 0.019 1
1 315 . 14 1 1 A 27 27 LEU HA H 161 4.775 5.131 -0.356 1
1 325 . 14 1 1 A 27 27 LEU C C 161 177.422 175.157 2.265 1
1 326 . 14 1 1 A 27 27 LEU CA C 161 53.322 53.236 0.086 1
1 327 . 14 1 1 A 27 27 LEU CB C 161 45.576 45.506 0.070 1
1 331 . 14 1 1 A 27 27 LEU N N 161 119.856 122.208 -2.352 1
1 332 . 14 1 1 A 28 28 ASP H H 162 8.848 8.342 0.506 1
1 333 . 14 1 1 A 28 28 ASP HA H 162 4.644 4.503 0.141 1
1 336 . 14 1 1 A 28 28 ASP C C 162 176.630 177.108 -0.478 1
1 337 . 14 1 1 A 28 28 ASP CA C 162 55.195 54.629 0.566 1
1 338 . 14 1 1 A 28 28 ASP CB C 162 41.673 42.618 -0.945 1
1 339 . 14 1 1 A 28 28 ASP N N 162 122.434 122.501 -0.067 1
1 340 . 14 1 1 A 29 29 ASP H H 163 8.720 9.170 -0.450 1
1 341 . 14 1 1 A 29 29 ASP HA H 163 4.386 4.385 0.001 1
1 344 . 14 1 1 A 29 29 ASP C C 163 176.604 178.518 -1.914 1
1 345 . 14 1 1 A 29 29 ASP CA C 163 59.690 57.025 2.665 1
1 346 . 14 1 1 A 29 29 ASP CB C 163 42.964 39.869 3.095 1
1 347 . 14 1 1 A 29 29 ASP N N 163 121.460 124.899 -3.439 1
1 348 . 14 1 1 A 30 30 LYS H H 164 8.434 7.665 0.769 1
1 349 . 14 1 1 A 30 30 LYS HA H 164 3.901 3.974 -0.073 1
1 358 . 14 1 1 A 30 30 LYS C C 164 179.479 179.132 0.347 1
1 359 . 14 1 1 A 30 30 LYS CA C 164 60.047 59.563 0.484 1
1 360 . 14 1 1 A 30 30 LYS CB C 164 32.038 32.291 -0.253 1
1 364 . 14 1 1 A 30 30 LYS N N 164 116.627 119.790 -3.163 1
1 365 . 14 1 1 A 31 31 GLU H H 165 7.755 8.373 -0.618 1
1 366 . 14 1 1 A 31 31 GLU HA H 165 3.998 4.044 -0.046 1
1 371 . 14 1 1 A 31 31 GLU C C 165 179.031 179.314 -0.283 1
1 372 . 14 1 1 A 31 31 GLU CA C 165 59.335 59.130 0.205 1
1 373 . 14 1 1 A 31 31 GLU CB C 165 29.972 29.783 0.189 1
1 375 . 14 1 1 A 31 31 GLU N N 165 120.456 119.562 0.894 1
1 376 . 14 1 1 A 32 32 ALA H H 166 9.060 8.629 0.431 1
1 377 . 14 1 1 A 32 32 ALA HA H 166 3.871 4.057 -0.186 1
1 381 . 14 1 1 A 32 32 ALA C C 166 178.029 179.094 -1.065 1
1 382 . 14 1 1 A 32 32 ALA CA C 166 54.997 55.346 -0.349 1
1 383 . 14 1 1 A 32 32 ALA CB C 166 19.727 18.398 1.329 1
1 384 . 14 1 1 A 32 32 ALA N N 166 124.406 122.523 1.883 1
1 385 . 14 1 1 A 33 33 LYS H H 167 8.228 7.809 0.419 1
1 386 . 14 1 1 A 33 33 LYS HA H 167 2.595 3.177 -0.582 1
1 395 . 14 1 1 A 33 33 LYS C C 167 177.938 177.949 -0.011 1
1 396 . 14 1 1 A 33 33 LYS CA C 167 59.573 59.326 0.247 1
1 397 . 14 1 1 A 33 33 LYS CB C 167 32.098 32.194 -0.096 1
1 401 . 14 1 1 A 33 33 LYS N N 167 119.833 118.346 1.487 1
1 402 . 14 1 1 A 34 34 GLN H H 168 7.392 7.787 -0.395 1
1 403 . 14 1 1 A 34 34 GLN HA H 168 3.943 3.913 0.030 1
1 410 . 14 1 1 A 34 34 GLN C C 168 178.323 178.440 -0.117 1
1 411 . 14 1 1 A 34 34 GLN CA C 168 58.883 59.294 -0.411 1
1 412 . 14 1 1 A 34 34 GLN CB C 168 28.485 28.110 0.375 1
1 414 . 14 1 1 A 34 34 GLN N N 168 117.208 117.812 -0.604 1
1 416 . 14 1 1 A 35 35 LYS H H 169 7.994 7.987 0.007 1
1 417 . 14 1 1 A 35 35 LYS HA H 169 4.067 3.986 0.081 1
1 426 . 14 1 1 A 35 35 LYS C C 169 178.161 178.518 -0.357 1
1 427 . 14 1 1 A 35 35 LYS CA C 169 58.437 59.302 -0.865 1
1 428 . 14 1 1 A 35 35 LYS CB C 169 31.611 32.306 -0.695 1
1 432 . 14 1 1 A 35 35 LYS N N 169 120.898 119.788 1.110 1
1 433 . 14 1 1 A 36 36 ALA H H 170 8.431 8.220 0.211 1
1 434 . 14 1 1 A 36 36 ALA HA H 170 3.738 4.042 -0.304 1
1 438 . 14 1 1 A 36 36 ALA C C 170 178.862 179.707 -0.845 1
1 439 . 14 1 1 A 36 36 ALA CA C 170 55.351 55.072 0.279 1
1 440 . 14 1 1 A 36 36 ALA CB C 170 18.295 18.453 -0.158 1
1 441 . 14 1 1 A 36 36 ALA N N 170 120.641 119.906 0.735 1
1 442 . 14 1 1 A 37 37 GLU H H 171 8.412 8.244 0.168 1
1 443 . 14 1 1 A 37 37 GLU HA H 171 3.867 3.931 -0.064 1
1 448 . 14 1 1 A 37 37 GLU C C 171 179.255 178.887 0.368 1
1 449 . 14 1 1 A 37 37 GLU CA C 171 59.543 59.539 0.004 1
1 450 . 14 1 1 A 37 37 GLU CB C 171 29.569 29.624 -0.055 1
1 452 . 14 1 1 A 37 37 GLU N N 171 118.224 117.687 0.537 1
1 453 . 14 1 1 A 38 38 GLU H H 172 8.019 8.266 -0.247 1
1 454 . 14 1 1 A 38 38 GLU HA H 172 3.952 4.055 -0.103 1
1 459 . 14 1 1 A 38 38 GLU C C 172 180.250 178.537 1.713 1
1 460 . 14 1 1 A 38 38 GLU CA C 172 59.627 59.211 0.416 1
1 461 . 14 1 1 A 38 38 GLU CB C 172 29.368 29.077 0.291 1
1 463 . 14 1 1 A 38 38 GLU N N 172 121.250 118.544 2.706 1
1 464 . 14 1 1 A 39 39 ILE H H 173 8.174 7.548 0.626 1
1 465 . 14 1 1 A 39 39 ILE HA H 173 3.643 3.795 -0.152 1
1 475 . 14 1 1 A 39 39 ILE C C 173 177.568 177.887 -0.319 1
1 476 . 14 1 1 A 39 39 ILE CA C 173 64.869 63.734 1.135 1
1 477 . 14 1 1 A 39 39 ILE CB C 173 38.160 37.354 0.806 1
1 481 . 14 1 1 A 39 39 ILE N N 173 121.527 117.049 4.478 1
1 482 . 14 1 1 A 40 40 GLN H H 174 8.860 8.222 0.638 1
1 483 . 14 1 1 A 40 40 GLN HA H 174 3.533 4.005 -0.472 1
1 490 . 14 1 1 A 40 40 GLN C C 174 179.022 178.151 0.871 1
1 491 . 14 1 1 A 40 40 GLN CA C 174 61.316 59.093 2.223 1
1 492 . 14 1 1 A 40 40 GLN CB C 174 26.604 28.290 -1.686 1
1 494 . 14 1 1 A 40 40 GLN N N 174 121.956 121.140 0.816 1
1 496 . 14 1 1 A 41 41 LYS H H 175 7.879 7.817 0.062 1
1 497 . 14 1 1 A 41 41 LYS HA H 175 3.777 4.058 -0.281 1
1 506 . 14 1 1 A 41 41 LYS C C 175 178.779 179.595 -0.816 1
1 507 . 14 1 1 A 41 41 LYS CA C 175 59.701 59.544 0.157 1
1 508 . 14 1 1 A 41 41 LYS CB C 175 32.581 32.133 0.448 1
1 512 . 14 1 1 A 41 41 LYS N N 175 119.012 118.072 0.940 1
1 513 . 14 1 1 A 42 42 GLU H H 176 7.447 7.699 -0.252 1
1 514 . 14 1 1 A 42 42 GLU HA H 176 4.059 4.119 -0.060 1
1 519 . 14 1 1 A 42 42 GLU C C 176 180.058 178.820 1.238 1
1 520 . 14 1 1 A 42 42 GLU CA C 176 59.456 59.148 0.308 1
1 521 . 14 1 1 A 42 42 GLU CB C 176 29.923 29.367 0.556 1
1 523 . 14 1 1 A 42 42 GLU N N 176 120.054 120.011 0.043 1
1 524 . 14 1 1 A 43 43 VAL H H 177 8.618 7.993 0.625 1
1 525 . 14 1 1 A 43 43 VAL HA H 177 3.986 3.889 0.097 1
1 533 . 14 1 1 A 43 43 VAL C C 177 176.459 178.246 -1.787 1
1 534 . 14 1 1 A 43 43 VAL CA C 177 63.923 64.776 -0.853 1
1 535 . 14 1 1 A 43 43 VAL CB C 177 31.899 31.502 0.397 1
1 538 . 14 1 1 A 43 43 VAL N N 177 114.191 116.978 -2.787 1
1 539 . 14 1 1 A 44 44 SER H H 178 8.052 8.503 -0.451 1
1 540 . 14 1 1 A 44 44 SER HA H 178 4.098 4.277 -0.179 1
1 543 . 14 1 1 A 44 44 SER C C 178 176.548 176.220 0.328 1
1 544 . 14 1 1 A 44 44 SER CA C 178 61.160 61.789 -0.629 1
1 545 . 14 1 1 A 44 44 SER CB C 178 62.959 63.113 -0.154 1
1 546 . 14 1 1 A 44 44 SER N N 178 114.202 117.354 -3.152 1
1 547 . 14 1 1 A 45 45 LYS H H 179 7.083 7.697 -0.614 1
1 548 . 14 1 1 A 45 45 LYS HA H 179 4.140 4.211 -0.071 1
1 557 . 14 1 1 A 45 45 LYS C C 179 177.288 176.142 1.146 1
1 558 . 14 1 1 A 45 45 LYS CA C 179 58.469 57.949 0.520 1
1 559 . 14 1 1 A 45 45 LYS CB C 179 32.671 31.565 1.106 1
1 563 . 14 1 1 A 45 45 LYS N N 179 120.935 117.547 3.388 1
1 564 . 14 1 1 A 46 46 ASP H H 180 7.098 7.881 -0.783 1
1 565 . 14 1 1 A 46 46 ASP HA H 180 4.917 4.978 -0.061 1
1 568 . 14 1 1 A 46 46 ASP CA C 180 51.492 51.484 0.008 1
1 569 . 14 1 1 A 46 46 ASP CB C 180 40.595 41.523 -0.928 1
1 570 . 14 1 1 A 46 46 ASP N N 180 112.836 120.233 -7.397 1
1 571 . 14 1 1 A 47 47 PRO HA H 181 4.681 4.509 0.172 1
1 578 . 14 1 1 A 47 47 PRO C C 181 179.248 177.596 1.652 1
1 579 . 14 1 1 A 47 47 PRO CA C 181 64.718 64.275 0.443 1
1 580 . 14 1 1 A 47 47 PRO CB C 181 32.159 31.812 0.347 1
1 583 . 14 1 1 A 48 48 SER H H 182 8.248 7.974 0.274 1
1 584 . 14 1 1 A 48 48 SER HA H 182 4.378 4.336 0.042 1
1 587 . 14 1 1 A 48 48 SER C C 182 176.071 175.444 0.627 1
1 588 . 14 1 1 A 48 48 SER CA C 182 61.377 60.464 0.913 1
1 589 . 14 1 1 A 48 48 SER CB C 182 62.455 62.706 -0.251 1
1 590 . 14 1 1 A 48 48 SER N N 182 116.986 113.584 3.402 1
1 591 . 14 1 1 A 49 49 LYS H H 183 7.842 7.262 0.580 1
1 592 . 14 1 1 A 49 49 LYS HA H 183 4.482 4.329 0.153 1
1 601 . 14 1 1 A 49 49 LYS C C 183 175.605 177.545 -1.940 1
1 602 . 14 1 1 A 49 49 LYS CA C 183 55.824 56.526 -0.702 1
1 603 . 14 1 1 A 49 49 LYS CB C 183 32.834 32.905 -0.071 1
1 607 . 14 1 1 A 49 49 LYS N N 183 121.698 120.033 1.665 1
1 608 . 14 1 1 A 50 50 PHE H H 184 7.634 7.611 0.023 1
1 609 . 14 1 1 A 50 50 PHE HA H 184 3.510 4.235 -0.725 1
1 617 . 14 1 1 A 50 50 PHE C C 184 176.214 177.782 -1.568 1
1 618 . 14 1 1 A 50 50 PHE CA C 184 63.276 61.107 2.169 1
1 619 . 14 1 1 A 50 50 PHE CB C 184 40.948 38.949 1.999 1
1 623 . 14 1 1 A 50 50 PHE N N 184 120.120 121.695 -1.575 1
1 624 . 14 1 1 A 51 51 GLY H H 185 8.855 8.651 0.204 1
1 625 . 14 1 1 A 51 51 GLY HA2 H 185 3.993 3.945 0.048 1
1 626 . 14 1 1 A 51 51 GLY HA3 H 185 3.958 3.988 -0.030 1
1 627 . 14 1 1 A 51 51 GLY C C 185 175.169 175.816 -0.647 1
1 628 . 14 1 1 A 51 51 GLY CA C 185 47.475 47.031 0.444 1
1 629 . 14 1 1 A 51 51 GLY N N 185 105.550 106.112 -0.562 1
1 630 . 14 1 1 A 52 52 GLU H H 186 7.917 7.829 0.088 1
1 631 . 14 1 1 A 52 52 GLU HA H 186 4.006 4.223 -0.217 1
1 636 . 14 1 1 A 52 52 GLU C C 186 179.499 179.322 0.177 1
1 637 . 14 1 1 A 52 52 GLU CA C 186 58.904 59.230 -0.326 1
1 638 . 14 1 1 A 52 52 GLU CB C 186 29.700 29.708 -0.008 1
1 640 . 14 1 1 A 52 52 GLU N N 186 121.929 120.134 1.795 1
1 641 . 14 1 1 A 53 53 ILE H H 187 7.936 8.123 -0.187 1
1 642 . 14 1 1 A 53 53 ILE HA H 187 3.648 3.659 -0.011 1
1 652 . 14 1 1 A 53 53 ILE C C 187 177.886 177.697 0.189 1
1 653 . 14 1 1 A 53 53 ILE CA C 187 64.366 65.160 -0.794 1
1 654 . 14 1 1 A 53 53 ILE CB C 187 36.478 37.746 -1.268 1
1 658 . 14 1 1 A 53 53 ILE N N 187 120.991 121.874 -0.883 1
1 659 . 14 1 1 A 54 54 ALA H H 188 8.895 8.508 0.387 1
1 660 . 14 1 1 A 54 54 ALA HA H 188 3.629 3.723 -0.094 1
1 664 . 14 1 1 A 54 54 ALA C C 188 179.437 179.214 0.223 1
1 665 . 14 1 1 A 54 54 ALA CA C 188 55.974 55.467 0.507 1
1 666 . 14 1 1 A 54 54 ALA CB C 188 17.591 18.236 -0.645 1
1 667 . 14 1 1 A 54 54 ALA N N 188 125.308 122.038 3.270 1
1 668 . 14 1 1 A 55 55 LYS H H 189 8.049 7.852 0.197 1
1 669 . 14 1 1 A 55 55 LYS HA H 189 4.106 3.909 0.197 1
1 678 . 14 1 1 A 55 55 LYS C C 189 178.995 177.888 1.107 1
1 679 . 14 1 1 A 55 55 LYS CA C 189 59.312 59.144 0.168 1
1 680 . 14 1 1 A 55 55 LYS CB C 189 32.647 31.858 0.789 1
1 684 . 14 1 1 A 55 55 LYS N N 189 116.835 118.355 -1.520 1
1 685 . 14 1 1 A 56 56 LYS H H 190 7.215 7.785 -0.570 1
1 686 . 14 1 1 A 56 56 LYS HA H 190 4.172 4.326 -0.154 1
1 695 . 14 1 1 A 56 56 LYS C C 190 177.897 177.977 -0.080 1
1 696 . 14 1 1 A 56 56 LYS CA C 190 58.418 57.564 0.854 1
1 697 . 14 1 1 A 56 56 LYS CB C 190 34.652 33.531 1.121 1
1 701 . 14 1 1 A 56 56 LYS N N 190 117.170 118.038 -0.868 1
1 702 . 14 1 1 A 57 57 GLU H H 191 8.572 7.991 0.581 1
1 703 . 14 1 1 A 57 57 GLU HA H 191 4.643 4.357 0.286 1
1 708 . 14 1 1 A 57 57 GLU C C 191 177.903 176.205 1.698 1
1 709 . 14 1 1 A 57 57 GLU CA C 191 55.708 56.170 -0.462 1
1 710 . 14 1 1 A 57 57 GLU CB C 191 32.460 31.090 1.370 1
1 712 . 14 1 1 A 57 57 GLU N N 191 113.316 117.127 -3.811 1
1 713 . 14 1 1 A 58 58 SER H H 192 8.550 7.687 0.863 1
1 714 . 14 1 1 A 58 58 SER HA H 192 4.149 4.323 -0.174 1
1 717 . 14 1 1 A 58 58 SER C C 192 176.161 175.363 0.798 1
1 718 . 14 1 1 A 58 58 SER CA C 192 58.403 58.056 0.347 1
1 719 . 14 1 1 A 58 58 SER CB C 192 64.392 64.222 0.170 1
1 720 . 14 1 1 A 58 58 SER N N 192 109.861 115.895 -6.034 1
1 721 . 14 1 1 A 59 59 MET H H 193 9.533 8.838 0.695 1
1 722 . 14 1 1 A 59 59 MET HA H 193 4.457 4.650 -0.193 1
1 730 . 14 1 1 A 59 59 MET C C 193 175.204 175.513 -0.309 1
1 731 . 14 1 1 A 59 59 MET CA C 193 55.781 54.888 0.893 1
1 732 . 14 1 1 A 59 59 MET CB C 193 32.855 32.165 0.690 1
1 735 . 14 1 1 A 59 59 MET N N 193 124.493 124.315 0.178 1
1 736 . 14 1 1 A 60 60 ASP H H 194 7.514 7.753 -0.239 1
1 737 . 14 1 1 A 60 60 ASP HA H 194 4.886 4.627 0.259 1
1 740 . 14 1 1 A 60 60 ASP C C 194 175.517 176.818 -1.301 1
1 741 . 14 1 1 A 60 60 ASP CA C 194 52.286 53.197 -0.911 1
1 742 . 14 1 1 A 60 60 ASP CB C 194 40.222 41.469 -1.247 1
1 743 . 14 1 1 A 60 60 ASP N N 194 117.785 122.520 -4.735 1
1 744 . 14 1 1 A 61 61 THR H H 195 8.118 8.479 -0.361 1
1 745 . 14 1 1 A 61 61 THR HA H 195 3.918 3.946 -0.028 1
1 750 . 14 1 1 A 61 61 THR C C 195 176.269 177.233 -0.964 1
1 751 . 14 1 1 A 61 61 THR CA C 195 65.469 65.271 0.198 1
1 752 . 14 1 1 A 61 61 THR CB C 195 68.741 68.414 0.327 1
1 754 . 14 1 1 A 61 61 THR N N 195 120.765 118.751 2.014 1
1 755 . 14 1 1 A 62 62 GLY H H 196 8.399 8.542 -0.143 1
1 756 . 14 1 1 A 62 62 GLY HA2 H 196 3.932 3.862 0.070 1
1 757 . 14 1 1 A 62 62 GLY HA3 H 196 3.900 3.864 0.036 1
1 758 . 14 1 1 A 62 62 GLY C C 196 174.948 176.722 -1.774 1
1 759 . 14 1 1 A 62 62 GLY CA C 196 46.768 47.699 -0.931 1
1 760 . 14 1 1 A 62 62 GLY N N 196 108.183 111.261 -3.078 1
1 761 . 14 1 1 A 63 63 SER H H 197 7.265 8.174 -0.909 1
1 762 . 14 1 1 A 63 63 SER HA H 197 4.554 4.404 0.150 1
1 765 . 14 1 1 A 63 63 SER C C 197 177.630 176.098 1.532 1
1 766 . 14 1 1 A 63 63 SER CA C 197 59.550 62.333 -2.783 1
1 767 . 14 1 1 A 63 63 SER CB C 197 65.504 63.230 2.274 1
1 768 . 14 1 1 A 63 63 SER N N 197 111.815 119.400 -7.585 1
1 769 . 14 1 1 A 64 64 ALA H H 198 8.675 8.176 0.499 1
1 770 . 14 1 1 A 64 64 ALA HA H 198 3.801 3.983 -0.182 1
1 774 . 14 1 1 A 64 64 ALA C C 198 178.492 179.547 -1.055 1
1 775 . 14 1 1 A 64 64 ALA CA C 198 56.794 55.318 1.476 1
1 776 . 14 1 1 A 64 64 ALA CB C 198 18.951 18.460 0.491 1
1 777 . 14 1 1 A 64 64 ALA N N 198 131.710 123.540 8.170 1
1 778 . 14 1 1 A 65 65 LYS H H 199 7.666 7.741 -0.075 1
1 779 . 14 1 1 A 65 65 LYS HA H 199 4.175 4.062 0.113 1
1 788 . 14 1 1 A 65 65 LYS C C 199 177.159 178.086 -0.927 1
1 789 . 14 1 1 A 65 65 LYS CA C 199 57.735 58.899 -1.164 1
1 790 . 14 1 1 A 65 65 LYS CB C 199 31.948 31.925 0.023 1
1 794 . 14 1 1 A 65 65 LYS N N 199 111.375 118.478 -7.103 1
1 795 . 14 1 1 A 66 66 LYS H H 200 7.545 7.613 -0.068 1
1 796 . 14 1 1 A 66 66 LYS HA H 200 4.612 4.477 0.135 1
1 805 . 14 1 1 A 66 66 LYS C C 200 175.609 175.780 -0.171 1
1 806 . 14 1 1 A 66 66 LYS CA C 200 54.468 55.641 -1.173 1
1 807 . 14 1 1 A 66 66 LYS CB C 200 31.525 32.616 -1.091 1
1 811 . 14 1 1 A 66 66 LYS N N 200 121.421 118.722 2.699 1
1 812 . 14 1 1 A 67 67 ASP H H 201 7.630 8.170 -0.540 1
1 813 . 14 1 1 A 67 67 ASP HA H 201 4.306 4.359 -0.053 1
1 816 . 14 1 1 A 67 67 ASP C C 201 175.025 176.308 -1.283 1
1 817 . 14 1 1 A 67 67 ASP CA C 201 56.400 55.389 1.011 1
1 818 . 14 1 1 A 67 67 ASP CB C 201 38.315 39.038 -0.723 1
1 819 . 14 1 1 A 67 67 ASP N N 201 116.216 116.730 -0.514 1
1 820 . 14 1 1 A 68 68 GLY H H 202 8.368 8.709 -0.341 1
1 821 . 14 1 1 A 68 68 GLY HA2 H 202 4.316 3.960 0.356 1
1 822 . 14 1 1 A 68 68 GLY HA3 H 202 3.731 4.063 -0.332 1
1 823 . 14 1 1 A 68 68 GLY C C 202 174.139 174.541 -0.402 1
1 824 . 14 1 1 A 68 68 GLY CA C 202 45.514 45.464 0.050 1
1 825 . 14 1 1 A 68 68 GLY N N 202 105.095 104.960 0.135 1
1 826 . 14 1 1 A 69 69 GLU H H 203 7.534 7.761 -0.227 1
1 827 . 14 1 1 A 69 69 GLU HA H 203 4.479 4.487 -0.008 1
1 832 . 14 1 1 A 69 69 GLU C C 203 176.961 176.684 0.277 1
1 833 . 14 1 1 A 69 69 GLU CA C 203 58.549 57.061 1.488 1
1 834 . 14 1 1 A 69 69 GLU CB C 203 30.998 30.543 0.455 1
1 836 . 14 1 1 A 69 69 GLU N N 203 120.426 120.883 -0.457 1
1 837 . 14 1 1 A 70 70 LEU H H 204 8.962 8.950 0.012 1
1 838 . 14 1 1 A 70 70 LEU HA H 204 4.438 4.629 -0.191 1
1 848 . 14 1 1 A 70 70 LEU C C 204 178.648 177.133 1.515 1
1 849 . 14 1 1 A 70 70 LEU CA C 204 53.977 54.767 -0.790 1
1 850 . 14 1 1 A 70 70 LEU CB C 204 43.612 43.427 0.185 1
1 854 . 14 1 1 A 70 70 LEU N N 204 122.066 125.650 -3.584 1
1 855 . 14 1 1 A 71 71 GLY H H 205 8.104 7.449 0.655 1
1 856 . 14 1 1 A 71 71 GLY HA2 H 205 4.165 4.110 0.055 1
1 857 . 14 1 1 A 71 71 GLY HA3 H 205 3.552 4.171 -0.619 1
1 858 . 14 1 1 A 71 71 GLY C C 205 173.098 173.371 -0.273 1
1 859 . 14 1 1 A 71 71 GLY CA C 205 44.723 45.188 -0.465 1
1 860 . 14 1 1 A 71 71 GLY N N 205 110.168 106.839 3.329 1
1 861 . 14 1 1 A 72 72 TYR H H 206 8.457 8.621 -0.164 1
1 862 . 14 1 1 A 72 72 TYR HA H 206 4.184 4.851 -0.667 1
1 869 . 14 1 1 A 72 72 TYR C C 206 175.975 175.485 0.490 1
1 870 . 14 1 1 A 72 72 TYR CA C 206 59.722 58.841 0.881 1
1 871 . 14 1 1 A 72 72 TYR CB C 206 38.378 38.595 -0.217 1
1 874 . 14 1 1 A 72 72 TYR N N 206 120.171 122.093 -1.922 1
1 875 . 14 1 1 A 73 73 VAL H H 207 8.782 9.236 -0.454 1
1 876 . 14 1 1 A 73 73 VAL HA H 207 4.056 4.686 -0.630 1
1 884 . 14 1 1 A 73 73 VAL C C 207 174.901 175.129 -0.228 1
1 885 . 14 1 1 A 73 73 VAL CA C 207 62.202 61.595 0.607 1
1 886 . 14 1 1 A 73 73 VAL CB C 207 33.071 33.553 -0.482 1
1 889 . 14 1 1 A 73 73 VAL N N 207 128.847 123.729 5.118 1
1 890 . 14 1 1 A 74 74 LEU H H 208 8.146 8.971 -0.825 1
1 891 . 14 1 1 A 74 74 LEU HA H 208 4.944 5.331 -0.387 1
1 901 . 14 1 1 A 74 74 LEU C C 208 178.400 176.642 1.758 1
1 902 . 14 1 1 A 74 74 LEU CA C 208 53.520 53.554 -0.034 1
1 903 . 14 1 1 A 74 74 LEU CB C 208 43.499 45.196 -1.697 1
1 907 . 14 1 1 A 74 74 LEU N N 208 127.599 127.162 0.437 1
1 908 . 14 1 1 A 75 75 LYS H H 209 8.403 8.646 -0.243 1
1 909 . 14 1 1 A 75 75 LYS HA H 209 3.771 3.843 -0.072 1
1 918 . 14 1 1 A 75 75 LYS C C 209 177.536 177.360 0.176 1
1 919 . 14 1 1 A 75 75 LYS CA C 209 58.385 58.850 -0.465 1
1 920 . 14 1 1 A 75 75 LYS CB C 209 32.459 31.908 0.551 1
1 924 . 14 1 1 A 75 75 LYS N N 209 123.798 122.936 0.862 1
1 925 . 14 1 1 A 76 76 GLY H H 210 9.997 9.442 0.555 1
1 926 . 14 1 1 A 76 76 GLY HA2 H 210 4.255 3.993 0.262 1
1 927 . 14 1 1 A 76 76 GLY HA3 H 210 3.791 3.997 -0.206 1
1 928 . 14 1 1 A 76 76 GLY C C 210 175.091 175.793 -0.702 1
1 929 . 14 1 1 A 76 76 GLY CA C 210 45.465 45.343 0.122 1
1 930 . 14 1 1 A 76 76 GLY N N 210 114.705 113.242 1.463 1
1 931 . 14 1 1 A 77 77 GLN H H 211 7.726 8.156 -0.430 1
1 932 . 14 1 1 A 77 77 GLN HA H 211 4.373 4.244 0.129 1
1 939 . 14 1 1 A 77 77 GLN C C 211 176.301 175.958 0.343 1
1 940 . 14 1 1 A 77 77 GLN CA C 211 57.074 57.256 -0.182 1
1 941 . 14 1 1 A 77 77 GLN CB C 211 30.798 29.351 1.447 1
1 943 . 14 1 1 A 77 77 GLN N N 211 118.702 117.785 0.917 1
1 945 . 14 1 1 A 78 78 THR H H 212 8.225 7.552 0.673 1
1 946 . 14 1 1 A 78 78 THR HA H 212 4.620 4.665 -0.045 1
1 951 . 14 1 1 A 78 78 THR C C 212 173.920 174.191 -0.271 1
1 952 . 14 1 1 A 78 78 THR CA C 212 60.087 59.413 0.674 1
1 953 . 14 1 1 A 78 78 THR CB C 212 71.412 70.997 0.415 1
1 955 . 14 1 1 A 78 78 THR N N 212 111.935 111.110 0.825 1
1 956 . 14 1 1 A 79 79 ASP H H 213 8.372 8.508 -0.136 1
1 957 . 14 1 1 A 79 79 ASP HA H 213 4.470 4.581 -0.111 1
1 960 . 14 1 1 A 79 79 ASP C C 213 176.759 177.726 -0.967 1
1 961 . 14 1 1 A 79 79 ASP CA C 213 54.927 54.342 0.585 1
1 962 . 14 1 1 A 79 79 ASP CB C 213 43.859 41.642 2.217 1
1 963 . 14 1 1 A 79 79 ASP N N 213 122.093 121.370 0.723 1
1 964 . 14 1 1 A 80 80 LYS H H 214 8.740 8.958 -0.218 1
1 965 . 14 1 1 A 80 80 LYS HA H 214 4.027 3.930 0.097 1
1 974 . 14 1 1 A 80 80 LYS C C 214 178.493 178.294 0.199 1
1 975 . 14 1 1 A 80 80 LYS CA C 214 59.802 59.970 -0.168 1
1 976 . 14 1 1 A 80 80 LYS CB C 214 32.374 32.172 0.202 1
1 980 . 14 1 1 A 80 80 LYS N N 214 124.685 122.910 1.775 1
1 981 . 14 1 1 A 81 81 ASP H H 215 8.556 8.230 0.326 1
1 982 . 14 1 1 A 81 81 ASP HA H 215 4.566 4.385 0.181 1
1 985 . 14 1 1 A 81 81 ASP C C 215 178.889 178.719 0.170 1
1 986 . 14 1 1 A 81 81 ASP CA C 215 58.046 57.364 0.682 1
1 987 . 14 1 1 A 81 81 ASP CB C 215 40.872 40.490 0.382 1
1 988 . 14 1 1 A 81 81 ASP N N 215 121.413 119.515 1.898 1
1 989 . 14 1 1 A 82 82 PHE H H 216 8.205 8.336 -0.131 1
1 990 . 14 1 1 A 82 82 PHE HA H 216 3.686 4.068 -0.382 1
1 998 . 14 1 1 A 82 82 PHE C C 216 175.919 177.375 -1.456 1
1 999 . 14 1 1 A 82 82 PHE CA C 216 61.648 60.845 0.803 1
1 1000 . 14 1 1 A 82 82 PHE CB C 216 39.743 39.156 0.587 1
1 1004 . 14 1 1 A 82 82 PHE N N 216 124.401 122.771 1.630 1
1 1005 . 14 1 1 A 83 83 GLU H H 217 8.887 8.966 -0.079 1
1 1006 . 14 1 1 A 83 83 GLU HA H 217 3.704 4.215 -0.511 1
1 1011 . 14 1 1 A 83 83 GLU C C 217 177.788 179.044 -1.256 1
1 1012 . 14 1 1 A 83 83 GLU CA C 217 60.545 60.279 0.266 1
1 1013 . 14 1 1 A 83 83 GLU CB C 217 30.639 29.460 1.179 1
1 1015 . 14 1 1 A 83 83 GLU N N 217 119.421 119.054 0.367 1
1 1016 . 14 1 1 A 84 84 LYS H H 218 8.055 7.951 0.104 1
1 1017 . 14 1 1 A 84 84 LYS HA H 218 3.947 4.149 -0.202 1
1 1026 . 14 1 1 A 84 84 LYS C C 218 178.783 178.481 0.302 1
1 1027 . 14 1 1 A 84 84 LYS CA C 218 59.327 58.826 0.501 1
1 1028 . 14 1 1 A 84 84 LYS CB C 218 32.539 32.210 0.329 1
1 1032 . 14 1 1 A 84 84 LYS N N 218 117.821 119.717 -1.896 1
1 1033 . 14 1 1 A 85 85 ALA H H 219 7.059 7.660 -0.601 1
1 1034 . 14 1 1 A 85 85 ALA HA H 219 4.040 4.075 -0.035 1
1 1038 . 14 1 1 A 85 85 ALA C C 219 179.794 179.870 -0.076 1
1 1039 . 14 1 1 A 85 85 ALA CA C 219 54.407 54.794 -0.387 1
1 1040 . 14 1 1 A 85 85 ALA CB C 219 20.130 18.236 1.894 1
1 1041 . 14 1 1 A 85 85 ALA N N 219 118.905 121.676 -2.771 1
1 1042 . 14 1 1 A 86 86 LEU H H 220 8.157 8.277 -0.120 1
1 1043 . 14 1 1 A 86 86 LEU HA H 220 3.692 3.906 -0.214 1
1 1053 . 14 1 1 A 86 86 LEU C C 220 178.330 178.458 -0.128 1
1 1054 . 14 1 1 A 86 86 LEU CA C 220 57.752 57.847 -0.095 1
1 1055 . 14 1 1 A 86 86 LEU CB C 220 41.464 41.884 -0.420 1
1 1059 . 14 1 1 A 86 86 LEU N N 220 118.606 120.284 -1.678 1
1 1060 . 14 1 1 A 87 87 PHE H H 221 8.349 8.165 0.184 1
1 1061 . 14 1 1 A 87 87 PHE HA H 221 3.861 4.535 -0.674 1
1 1069 . 14 1 1 A 87 87 PHE C C 221 176.176 177.621 -1.445 1
1 1070 . 14 1 1 A 87 87 PHE CA C 221 61.780 61.259 0.521 1
1 1071 . 14 1 1 A 87 87 PHE CB C 221 37.549 37.866 -0.317 1
1 1075 . 14 1 1 A 87 87 PHE N N 221 112.449 116.820 -4.371 1
1 1076 . 14 1 1 A 88 88 LYS H H 222 7.061 8.095 -1.034 1
1 1077 . 14 1 1 A 88 88 LYS HA H 222 4.380 4.124 0.256 1
1 1086 . 14 1 1 A 88 88 LYS C C 222 177.089 177.234 -0.145 1
1 1087 . 14 1 1 A 88 88 LYS CA C 222 56.726 58.482 -1.756 1
1 1088 . 14 1 1 A 88 88 LYS CB C 222 33.738 32.356 1.382 1
1 1092 . 14 1 1 A 88 88 LYS N N 222 118.308 121.258 -2.950 1
1 1093 . 14 1 1 A 89 89 LEU H H 223 7.270 7.179 0.091 1
1 1094 . 14 1 1 A 89 89 LEU HA H 223 4.168 4.160 0.008 1
1 1104 . 14 1 1 A 89 89 LEU C C 223 177.528 177.118 0.410 1
1 1105 . 14 1 1 A 89 89 LEU CA C 223 55.279 54.989 0.290 1
1 1106 . 14 1 1 A 89 89 LEU CB C 223 43.240 42.243 0.997 1
1 1110 . 14 1 1 A 89 89 LEU N N 223 121.317 122.001 -0.684 1
1 1111 . 14 1 1 A 90 90 LYS H H 224 8.788 8.481 0.307 1
1 1112 . 14 1 1 A 90 90 LYS HA H 224 4.359 4.328 0.031 1
1 1121 . 14 1 1 A 90 90 LYS C C 224 175.839 175.555 0.284 1
1 1122 . 14 1 1 A 90 90 LYS CA C 224 54.772 55.955 -1.183 1
1 1123 . 14 1 1 A 90 90 LYS CB C 224 33.232 33.123 0.109 1
1 1127 . 14 1 1 A 90 90 LYS N N 224 123.558 122.613 0.945 1
1 1128 . 14 1 1 A 91 91 ASP H H 225 8.125 8.647 -0.522 1
1 1129 . 14 1 1 A 91 91 ASP HA H 225 3.958 4.370 -0.412 1
1 1132 . 14 1 1 A 91 91 ASP C C 225 177.452 176.604 0.848 1
1 1133 . 14 1 1 A 91 91 ASP CA C 225 56.642 55.519 1.123 1
1 1134 . 14 1 1 A 91 91 ASP CB C 225 40.269 40.219 0.050 1
1 1135 . 14 1 1 A 91 91 ASP N N 225 119.419 121.405 -1.986 1
1 1136 . 14 1 1 A 92 92 GLY H H 226 8.681 8.716 -0.035 1
1 1137 . 14 1 1 A 92 92 GLY HA2 H 226 4.131 3.879 0.252 1
1 1138 . 14 1 1 A 92 92 GLY HA3 H 226 3.579 3.905 -0.326 1
1 1139 . 14 1 1 A 92 92 GLY C C 226 173.614 173.971 -0.357 1
1 1140 . 14 1 1 A 92 92 GLY CA C 226 45.564 45.058 0.506 1
1 1141 . 14 1 1 A 92 92 GLY N N 226 113.802 112.017 1.785 1
1 1142 . 14 1 1 A 93 93 GLU H H 227 8.104 8.015 0.089 1
1 1143 . 14 1 1 A 93 93 GLU HA H 227 4.232 4.419 -0.187 1
1 1148 . 14 1 1 A 93 93 GLU C C 227 174.282 175.637 -1.355 1
1 1149 . 14 1 1 A 93 93 GLU CA C 227 56.651 56.163 0.488 1
1 1150 . 14 1 1 A 93 93 GLU CB C 227 32.190 31.066 1.124 1
1 1152 . 14 1 1 A 93 93 GLU N N 227 121.527 121.915 -0.388 1
1 1153 . 14 1 1 A 94 94 VAL H H 228 7.918 8.413 -0.495 1
1 1154 . 14 1 1 A 94 94 VAL HA H 228 4.857 4.699 0.158 1
1 1162 . 14 1 1 A 94 94 VAL C C 228 176.556 175.619 0.937 1
1 1163 . 14 1 1 A 94 94 VAL CA C 228 60.309 60.284 0.025 1
1 1164 . 14 1 1 A 94 94 VAL CB C 228 33.847 35.233 -1.386 1
1 1167 . 14 1 1 A 94 94 VAL N N 228 119.768 126.036 -6.268 1
1 1168 . 14 1 1 A 95 95 SER H H 229 9.659 9.435 0.224 1
1 1169 . 14 1 1 A 95 95 SER HA H 229 4.313 4.614 -0.301 1
1 1172 . 14 1 1 A 95 95 SER C C 229 174.641 174.519 0.122 1
1 1173 . 14 1 1 A 95 95 SER CA C 229 59.208 57.787 1.421 1
1 1174 . 14 1 1 A 95 95 SER CB C 229 66.080 65.556 0.524 1
1 1175 . 14 1 1 A 95 95 SER N N 229 124.903 121.408 3.495 1
1 1176 . 14 1 1 A 96 96 GLU H H 230 8.014 8.608 -0.594 1
1 1177 . 14 1 1 A 96 96 GLU HA H 230 4.376 4.369 0.007 1
1 1182 . 14 1 1 A 96 96 GLU C C 230 176.641 177.203 -0.562 1
1 1183 . 14 1 1 A 96 96 GLU CA C 230 56.236 56.717 -0.481 1
1 1184 . 14 1 1 A 96 96 GLU CB C 230 30.324 30.586 -0.262 1
1 1186 . 14 1 1 A 96 96 GLU N N 230 115.510 121.155 -5.645 1
1 1187 . 14 1 1 A 97 97 VAL H H 231 8.741 8.298 0.443 1
1 1188 . 14 1 1 A 97 97 VAL HA H 231 4.171 4.153 0.018 1
1 1196 . 14 1 1 A 97 97 VAL C C 231 176.684 175.690 0.994 1
1 1197 . 14 1 1 A 97 97 VAL CA C 231 65.418 63.163 2.255 1
1 1198 . 14 1 1 A 97 97 VAL CB C 231 31.218 31.566 -0.348 1
1 1201 . 14 1 1 A 97 97 VAL N N 231 121.289 121.555 -0.266 1
1 1202 . 14 1 1 A 98 98 VAL H H 232 9.218 9.689 -0.471 1
1 1203 . 14 1 1 A 98 98 VAL HA H 232 4.405 4.598 -0.193 1
1 1211 . 14 1 1 A 98 98 VAL C C 232 174.258 174.505 -0.247 1
1 1212 . 14 1 1 A 98 98 VAL CA C 232 60.937 61.309 -0.372 1
1 1213 . 14 1 1 A 98 98 VAL CB C 232 35.825 33.530 2.295 1
1 1216 . 14 1 1 A 98 98 VAL N N 232 130.544 128.965 1.579 1
1 1217 . 14 1 1 A 99 99 LYS H H 233 8.800 9.031 -0.231 1
1 1218 . 14 1 1 A 99 99 LYS HA H 233 4.853 4.987 -0.134 1
1 1227 . 14 1 1 A 99 99 LYS C C 233 175.274 175.198 0.076 1
1 1228 . 14 1 1 A 99 99 LYS CA C 233 55.499 55.220 0.279 1
1 1229 . 14 1 1 A 99 99 LYS CB C 233 34.452 33.810 0.642 1
1 1233 . 14 1 1 A 99 99 LYS N N 233 130.477 128.862 1.615 1
1 1234 . 14 1 1 A 100 100 SER H H 234 9.585 8.978 0.607 1
1 1235 . 14 1 1 A 100 100 SER HA H 234 5.150 4.970 0.180 1
1 1238 . 14 1 1 A 100 100 SER C C 234 175.493 174.256 1.237 1
1 1239 . 14 1 1 A 100 100 SER CA C 234 56.927 57.362 -0.435 1
1 1240 . 14 1 1 A 100 100 SER CB C 234 67.309 67.332 -0.023 1
1 1241 . 14 1 1 A 100 100 SER N N 234 125.814 123.864 1.950 1
1 1242 . 14 1 1 A 101 101 SER H H 235 8.631 8.767 -0.136 1
1 1243 . 14 1 1 A 101 101 SER HA H 235 4.106 4.057 0.049 1
1 1246 . 14 1 1 A 101 101 SER C C 235 175.385 175.372 0.013 1
1 1247 . 14 1 1 A 101 101 SER CA C 235 61.123 61.699 -0.576 1
1 1248 . 14 1 1 A 101 101 SER CB C 235 62.818 62.399 0.419 1
1 1249 . 14 1 1 A 101 101 SER N N 235 115.089 117.195 -2.106 1
1 1250 . 14 1 1 A 102 102 PHE H H 236 8.957 7.538 1.419 1
1 1251 . 14 1 1 A 102 102 PHE HA H 236 4.610 4.618 -0.008 1
1 1259 . 14 1 1 A 102 102 PHE C C 236 176.453 175.700 0.753 1
1 1260 . 14 1 1 A 102 102 PHE CA C 236 58.382 58.118 0.264 1
1 1261 . 14 1 1 A 102 102 PHE CB C 236 40.275 39.663 0.612 1
1 1263 . 14 1 1 A 102 102 PHE N N 236 119.917 117.283 2.634 1
1 1264 . 14 1 1 A 103 103 GLY H H 237 7.377 7.289 0.088 1
1 1265 . 14 1 1 A 103 103 GLY HA2 H 237 4.453 3.889 0.564 1
1 1266 . 14 1 1 A 103 103 GLY HA3 H 237 3.472 4.066 -0.594 1
1 1267 . 14 1 1 A 103 103 GLY C C 237 169.627 172.378 -2.751 1
1 1268 . 14 1 1 A 103 103 GLY CA C 237 45.384 44.269 1.115 1
1 1269 . 14 1 1 A 103 103 GLY N N 237 108.809 106.247 2.562 1
1 1270 . 14 1 1 A 104 104 TYR H H 238 8.632 8.314 0.318 1
1 1271 . 14 1 1 A 104 104 TYR HA H 238 5.322 5.329 -0.007 1
1 1278 . 14 1 1 A 104 104 TYR C C 238 175.043 174.985 0.058 1
1 1279 . 14 1 1 A 104 104 TYR CA C 238 57.627 57.039 0.588 1
1 1280 . 14 1 1 A 104 104 TYR CB C 238 41.711 41.156 0.555 1
1 1283 . 14 1 1 A 104 104 TYR N N 238 120.030 121.771 -1.741 1
1 1284 . 14 1 1 A 105 105 HIS H H 239 10.070 9.571 0.499 1
1 1285 . 14 1 1 A 105 105 HIS HA H 239 6.046 5.576 0.470 1
1 1290 . 14 1 1 A 105 105 HIS C C 239 175.734 174.856 0.878 1
1 1291 . 14 1 1 A 105 105 HIS CA C 239 53.945 54.176 -0.231 1
1 1292 . 14 1 1 A 105 105 HIS CB C 239 32.450 34.135 -1.685 1
1 1295 . 14 1 1 A 105 105 HIS N N 239 119.504 119.911 -0.407 1
1 1296 . 14 1 1 A 106 106 ILE H H 240 8.660 8.628 0.032 1
1 1297 . 14 1 1 A 106 106 ILE HA H 240 4.120 4.885 -0.765 1
1 1307 . 14 1 1 A 106 106 ILE C C 240 174.758 175.337 -0.579 1
1 1308 . 14 1 1 A 106 106 ILE CA C 240 63.446 59.962 3.484 1
1 1309 . 14 1 1 A 106 106 ILE CB C 240 40.786 41.416 -0.630 1
1 1313 . 14 1 1 A 106 106 ILE N N 240 120.639 120.153 0.486 1
1 1314 . 14 1 1 A 107 107 ILE H H 241 9.033 8.980 0.053 1
1 1315 . 14 1 1 A 107 107 ILE HA H 241 4.799 5.038 -0.239 1
1 1325 . 14 1 1 A 107 107 ILE C C 241 172.880 173.915 -1.035 1
1 1326 . 14 1 1 A 107 107 ILE CA C 241 60.563 59.858 0.705 1
1 1327 . 14 1 1 A 107 107 ILE CB C 241 41.652 41.136 0.516 1
1 1331 . 14 1 1 A 107 107 ILE N N 241 129.098 127.179 1.919 1
1 1332 . 14 1 1 A 108 108 LYS H H 242 8.692 8.992 -0.300 1
1 1333 . 14 1 1 A 108 108 LYS HA H 242 5.012 4.917 0.095 1
1 1342 . 14 1 1 A 108 108 LYS C C 242 174.484 175.679 -1.195 1
1 1343 . 14 1 1 A 108 108 LYS CA C 242 54.317 53.918 0.399 1
1 1344 . 14 1 1 A 108 108 LYS CB C 242 35.619 35.426 0.193 1
1 1348 . 14 1 1 A 108 108 LYS N N 242 127.179 128.167 -0.988 1
1 1349 . 14 1 1 A 109 109 ALA H H 243 7.816 9.050 -1.234 1
1 1350 . 14 1 1 A 109 109 ALA HA H 243 4.604 4.775 -0.171 1
1 1354 . 14 1 1 A 109 109 ALA C C 243 176.231 176.313 -0.082 1
1 1355 . 14 1 1 A 109 109 ALA CA C 243 50.505 50.817 -0.312 1
1 1356 . 14 1 1 A 109 109 ALA CB C 243 19.584 20.582 -0.998 1
1 1357 . 14 1 1 A 109 109 ALA N N 243 129.619 127.768 1.851 1
1 1358 . 14 1 1 A 110 110 ASP H H 244 7.578 8.793 -1.215 1
1 1359 . 14 1 1 A 110 110 ASP HA H 244 4.424 4.943 -0.519 1
1 1362 . 14 1 1 A 110 110 ASP C C 244 175.259 176.015 -0.756 1
1 1363 . 14 1 1 A 110 110 ASP CA C 244 54.489 53.120 1.369 1
1 1364 . 14 1 1 A 110 110 ASP CB C 244 42.693 44.147 -1.454 1
1 1365 . 14 1 1 A 110 110 ASP N N 244 125.434 121.389 4.045 1
1 4 . 15 1 1 A 2 2 PRO HA H -4 4.403 4.566 -0.163 1
1 11 . 15 1 1 A 2 2 PRO C C -4 176.990 176.584 0.406 1
1 12 . 15 1 1 A 2 2 PRO CA C -4 63.131 62.781 0.350 1
1 13 . 15 1 1 A 2 2 PRO CB C -4 32.342 32.320 0.022 1
1 16 . 15 1 1 A 3 3 LEU H H -3 8.483 8.345 0.138 1
1 17 . 15 1 1 A 3 3 LEU HA H -3 4.333 4.505 -0.172 1
1 27 . 15 1 1 A 3 3 LEU C C -3 177.991 177.134 0.857 1
1 28 . 15 1 1 A 3 3 LEU CA C -3 55.314 53.549 1.765 1
1 29 . 15 1 1 A 3 3 LEU CB C -3 42.244 43.125 -0.881 1
1 33 . 15 1 1 A 3 3 LEU N N -3 122.986 119.330 3.656 1
1 34 . 15 1 1 A 4 4 GLY H H -2 8.397 8.458 -0.061 1
1 35 . 15 1 1 A 4 4 GLY HA2 H -2 4.024 4.154 -0.130 1
1 36 . 15 1 1 A 4 4 GLY HA3 H -2 3.976 4.165 -0.189 1
1 37 . 15 1 1 A 4 4 GLY C C -2 174.360 174.030 0.330 1
1 38 . 15 1 1 A 4 4 GLY CA C -2 45.434 44.507 0.927 1
1 39 . 15 1 1 A 4 4 GLY N N -2 110.666 107.308 3.358 1
1 56 . 15 1 1 A 7 7 SER H H 141 7.913 7.993 -0.080 1
1 57 . 15 1 1 A 7 7 SER HA H 141 5.657 5.540 0.117 1
1 60 . 15 1 1 A 7 7 SER C C 141 173.753 172.709 1.044 1
1 61 . 15 1 1 A 7 7 SER CA C 141 56.758 57.323 -0.565 1
1 62 . 15 1 1 A 7 7 SER CB C 141 66.774 66.423 0.351 1
1 63 . 15 1 1 A 7 7 SER N N 141 113.824 112.466 1.358 1
1 64 . 15 1 1 A 8 8 LYS H H 142 8.656 8.541 0.115 1
1 65 . 15 1 1 A 8 8 LYS HA H 142 4.543 5.019 -0.476 1
1 74 . 15 1 1 A 8 8 LYS C C 142 174.403 174.809 -0.406 1
1 75 . 15 1 1 A 8 8 LYS CA C 142 55.578 54.438 1.140 1
1 76 . 15 1 1 A 8 8 LYS CB C 142 36.561 35.946 0.615 1
1 80 . 15 1 1 A 8 8 LYS N N 142 123.076 121.189 1.887 1
1 81 . 15 1 1 A 9 9 LYS H H 143 8.623 8.629 -0.006 1
1 82 . 15 1 1 A 9 9 LYS HA H 143 4.119 4.523 -0.404 1
1 91 . 15 1 1 A 9 9 LYS C C 143 176.144 175.613 0.531 1
1 92 . 15 1 1 A 9 9 LYS CA C 143 56.683 56.158 0.525 1
1 93 . 15 1 1 A 9 9 LYS CB C 143 32.580 32.707 -0.127 1
1 97 . 15 1 1 A 9 9 LYS N N 143 129.542 124.014 5.528 1
1 98 . 15 1 1 A 10 10 ALA H H 144 8.151 8.760 -0.609 1
1 99 . 15 1 1 A 10 10 ALA HA H 144 5.208 4.894 0.314 1
1 103 . 15 1 1 A 10 10 ALA C C 144 175.577 175.102 0.475 1
1 104 . 15 1 1 A 10 10 ALA CA C 144 51.226 51.232 -0.006 1
1 105 . 15 1 1 A 10 10 ALA CB C 144 25.299 24.195 1.104 1
1 106 . 15 1 1 A 10 10 ALA N N 144 127.933 127.908 0.025 1
1 107 . 15 1 1 A 11 11 SER H H 145 8.679 8.878 -0.199 1
1 108 . 15 1 1 A 11 11 SER HA H 145 5.431 5.872 -0.441 1
1 111 . 15 1 1 A 11 11 SER C C 145 173.072 173.261 -0.189 1
1 112 . 15 1 1 A 11 11 SER CA C 145 57.772 56.993 0.779 1
1 113 . 15 1 1 A 11 11 SER CB C 145 67.301 66.249 1.052 1
1 114 . 15 1 1 A 11 11 SER N N 145 116.245 115.559 0.686 1
1 115 . 15 1 1 A 12 12 HIS H H 146 9.962 9.595 0.367 1
1 116 . 15 1 1 A 12 12 HIS HA H 146 6.332 6.114 0.218 1
1 121 . 15 1 1 A 12 12 HIS C C 146 173.006 172.317 0.689 1
1 122 . 15 1 1 A 12 12 HIS CA C 146 55.020 54.266 0.754 1
1 123 . 15 1 1 A 12 12 HIS CB C 146 37.071 33.944 3.127 1
1 126 . 15 1 1 A 12 12 HIS N N 146 119.181 118.689 0.492 1
1 127 . 15 1 1 A 13 13 ILE H H 147 8.976 9.035 -0.059 1
1 128 . 15 1 1 A 13 13 ILE HA H 147 3.528 4.519 -0.991 1
1 138 . 15 1 1 A 13 13 ILE C C 147 173.010 173.787 -0.777 1
1 139 . 15 1 1 A 13 13 ILE CA C 147 61.273 59.699 1.574 1
1 140 . 15 1 1 A 13 13 ILE CB C 147 41.773 41.560 0.213 1
1 144 . 15 1 1 A 13 13 ILE N N 147 121.873 119.338 2.535 1
1 145 . 15 1 1 A 14 14 LEU H H 148 7.627 8.888 -1.261 1
1 146 . 15 1 1 A 14 14 LEU HA H 148 4.814 4.866 -0.052 1
1 156 . 15 1 1 A 14 14 LEU C C 148 174.112 174.317 -0.205 1
1 157 . 15 1 1 A 14 14 LEU CA C 148 52.574 53.052 -0.478 1
1 158 . 15 1 1 A 14 14 LEU CB C 148 45.643 44.953 0.690 1
1 162 . 15 1 1 A 14 14 LEU N N 148 127.112 129.759 -2.647 1
1 163 . 15 1 1 A 15 15 ILE H H 149 9.524 9.349 0.175 1
1 164 . 15 1 1 A 15 15 ILE HA H 149 4.362 4.605 -0.243 1
1 174 . 15 1 1 A 15 15 ILE C C 149 175.452 175.545 -0.093 1
1 175 . 15 1 1 A 15 15 ILE CA C 149 58.516 60.698 -2.182 1
1 176 . 15 1 1 A 15 15 ILE CB C 149 36.560 39.421 -2.861 1
1 180 . 15 1 1 A 15 15 ILE N N 149 128.652 127.319 1.333 1
1 181 . 15 1 1 A 16 16 LYS H H 150 8.035 8.597 -0.562 1
1 182 . 15 1 1 A 16 16 LYS HA H 150 4.319 4.374 -0.055 1
1 191 . 15 1 1 A 16 16 LYS C C 150 175.038 176.318 -1.280 1
1 192 . 15 1 1 A 16 16 LYS CA C 150 57.817 56.836 0.981 1
1 193 . 15 1 1 A 16 16 LYS CB C 150 34.853 32.729 2.124 1
1 197 . 15 1 1 A 16 16 LYS N N 150 129.153 127.974 1.179 1
1 198 . 15 1 1 A 17 17 VAL H H 151 8.016 8.604 -0.588 1
1 199 . 15 1 1 A 17 17 VAL HA H 151 4.873 4.584 0.289 1
1 207 . 15 1 1 A 17 17 VAL C C 151 176.647 175.931 0.716 1
1 208 . 15 1 1 A 17 17 VAL CA C 151 60.088 61.447 -1.359 1
1 209 . 15 1 1 A 17 17 VAL CB C 151 34.082 33.140 0.942 1
1 212 . 15 1 1 A 17 17 VAL N N 151 121.288 124.431 -3.143 1
1 213 . 15 1 1 A 18 18 LYS H H 152 8.443 8.799 -0.356 1
1 214 . 15 1 1 A 18 18 LYS HA H 152 4.334 4.294 0.040 1
1 223 . 15 1 1 A 18 18 LYS C C 152 176.345 178.446 -2.101 1
1 224 . 15 1 1 A 18 18 LYS CA C 152 57.016 56.967 0.049 1
1 225 . 15 1 1 A 18 18 LYS CB C 152 33.222 32.691 0.531 1
1 229 . 15 1 1 A 18 18 LYS N N 152 128.408 127.139 1.269 1
1 230 . 15 1 1 A 19 19 SER H H 153 9.067 8.993 0.074 1
1 231 . 15 1 1 A 19 19 SER HA H 153 4.457 4.422 0.035 1
1 234 . 15 1 1 A 19 19 SER C C 153 174.236 174.328 -0.092 1
1 235 . 15 1 1 A 19 19 SER CA C 153 59.642 59.061 0.581 1
1 236 . 15 1 1 A 19 19 SER CB C 153 64.347 63.871 0.476 1
1 237 . 15 1 1 A 19 19 SER N N 153 121.522 117.879 3.643 1
1 238 . 15 1 1 A 20 20 LYS H H 154 7.961 7.662 0.299 1
1 239 . 15 1 1 A 20 20 LYS HA H 154 4.558 4.753 -0.195 1
1 244 . 15 1 1 A 20 20 LYS C C 154 177.256 175.921 1.335 1
1 245 . 15 1 1 A 20 20 LYS CA C 154 55.249 55.752 -0.503 1
1 246 . 15 1 1 A 20 20 LYS CB C 154 34.531 35.602 -1.071 1
1 248 . 15 1 1 A 20 20 LYS N N 154 120.270 120.589 -0.319 1
1 249 . 15 1 1 A 21 21 LYS HA H 155 4.003 4.020 -0.017 1
1 258 . 15 1 1 A 21 21 LYS C C 155 177.015 178.191 -1.176 1
1 259 . 15 1 1 A 21 21 LYS CA C 155 59.091 59.350 -0.259 1
1 260 . 15 1 1 A 21 21 LYS CB C 155 32.394 32.157 0.237 1
1 264 . 15 1 1 A 22 22 SER H H 156 7.625 7.736 -0.111 1
1 265 . 15 1 1 A 22 22 SER HA H 156 4.293 4.528 -0.235 1
1 268 . 15 1 1 A 22 22 SER C C 156 174.843 173.915 0.928 1
1 269 . 15 1 1 A 22 22 SER CA C 156 57.966 58.755 -0.789 1
1 270 . 15 1 1 A 22 22 SER CB C 156 63.369 63.616 -0.247 1
1 271 . 15 1 1 A 22 22 SER N N 156 109.549 112.775 -3.226 1
1 272 . 15 1 1 A 23 23 ASP H H 157 7.701 7.632 0.069 1
1 273 . 15 1 1 A 23 23 ASP HA H 157 4.548 4.607 -0.059 1
1 276 . 15 1 1 A 23 23 ASP C C 157 176.544 175.518 1.026 1
1 277 . 15 1 1 A 23 23 ASP CA C 157 55.242 54.360 0.882 1
1 278 . 15 1 1 A 23 23 ASP CB C 157 41.103 42.044 -0.941 1
1 279 . 15 1 1 A 23 23 ASP N N 157 124.536 122.681 1.855 1
1 280 . 15 1 1 A 24 24 LYS H H 158 8.583 8.729 -0.146 1
1 281 . 15 1 1 A 24 24 LYS HA H 158 4.252 4.543 -0.291 1
1 290 . 15 1 1 A 24 24 LYS C C 158 176.813 177.961 -1.148 1
1 291 . 15 1 1 A 24 24 LYS CA C 158 57.148 56.098 1.050 1
1 292 . 15 1 1 A 24 24 LYS CB C 158 33.200 34.416 -1.216 1
1 296 . 15 1 1 A 24 24 LYS N N 158 122.372 124.063 -1.691 1
1 297 . 15 1 1 A 25 25 GLU H H 159 8.001 8.408 -0.407 1
1 298 . 15 1 1 A 25 25 GLU HA H 159 4.521 4.223 0.298 1
1 303 . 15 1 1 A 25 25 GLU C C 159 175.995 176.709 -0.714 1
1 304 . 15 1 1 A 25 25 GLU CA C 159 55.727 58.017 -2.290 1
1 305 . 15 1 1 A 25 25 GLU CB C 159 31.918 30.290 1.628 1
1 307 . 15 1 1 A 25 25 GLU N N 159 118.705 118.413 0.292 1
1 308 . 15 1 1 A 26 26 GLY H H 160 8.458 7.778 0.680 1
1 309 . 15 1 1 A 26 26 GLY HA2 H 160 3.946 4.063 -0.117 1
1 310 . 15 1 1 A 26 26 GLY HA3 H 160 3.511 4.073 -0.562 1
1 311 . 15 1 1 A 26 26 GLY C C 160 172.201 172.583 -0.382 1
1 312 . 15 1 1 A 26 26 GLY CA C 160 44.038 45.231 -1.193 1
1 313 . 15 1 1 A 26 26 GLY N N 160 107.642 105.616 2.026 1
1 314 . 15 1 1 A 27 27 LEU H H 161 8.259 8.689 -0.430 1
1 315 . 15 1 1 A 27 27 LEU HA H 161 4.775 5.059 -0.284 1
1 325 . 15 1 1 A 27 27 LEU C C 161 177.422 176.466 0.956 1
1 326 . 15 1 1 A 27 27 LEU CA C 161 53.322 53.313 0.009 1
1 327 . 15 1 1 A 27 27 LEU CB C 161 45.576 43.972 1.604 1
1 331 . 15 1 1 A 27 27 LEU N N 161 119.856 122.223 -2.367 1
1 332 . 15 1 1 A 28 28 ASP H H 162 8.848 8.785 0.063 1
1 333 . 15 1 1 A 28 28 ASP HA H 162 4.644 4.656 -0.012 1
1 336 . 15 1 1 A 28 28 ASP C C 162 176.630 177.565 -0.935 1
1 337 . 15 1 1 A 28 28 ASP CA C 162 55.195 54.534 0.661 1
1 338 . 15 1 1 A 28 28 ASP CB C 162 41.673 41.651 0.022 1
1 339 . 15 1 1 A 28 28 ASP N N 162 122.434 121.276 1.158 1
1 340 . 15 1 1 A 29 29 ASP H H 163 8.720 9.171 -0.451 1
1 341 . 15 1 1 A 29 29 ASP HA H 163 4.386 4.395 -0.009 1
1 344 . 15 1 1 A 29 29 ASP C C 163 176.604 178.493 -1.889 1
1 345 . 15 1 1 A 29 29 ASP CA C 163 59.690 57.035 2.655 1
1 346 . 15 1 1 A 29 29 ASP CB C 163 42.964 39.948 3.016 1
1 347 . 15 1 1 A 29 29 ASP N N 163 121.460 122.707 -1.247 1
1 348 . 15 1 1 A 30 30 LYS H H 164 8.434 8.007 0.427 1
1 349 . 15 1 1 A 30 30 LYS HA H 164 3.901 3.981 -0.080 1
1 358 . 15 1 1 A 30 30 LYS C C 164 179.479 179.163 0.316 1
1 359 . 15 1 1 A 30 30 LYS CA C 164 60.047 59.448 0.599 1
1 360 . 15 1 1 A 30 30 LYS CB C 164 32.038 32.277 -0.239 1
1 364 . 15 1 1 A 30 30 LYS N N 164 116.627 119.746 -3.119 1
1 365 . 15 1 1 A 31 31 GLU H H 165 7.755 8.074 -0.319 1
1 366 . 15 1 1 A 31 31 GLU HA H 165 3.998 3.997 0.001 1
1 371 . 15 1 1 A 31 31 GLU C C 165 179.031 179.340 -0.309 1
1 372 . 15 1 1 A 31 31 GLU CA C 165 59.335 59.324 0.011 1
1 373 . 15 1 1 A 31 31 GLU CB C 165 29.972 29.205 0.767 1
1 375 . 15 1 1 A 31 31 GLU N N 165 120.456 119.860 0.596 1
1 376 . 15 1 1 A 32 32 ALA H H 166 9.060 8.693 0.367 1
1 377 . 15 1 1 A 32 32 ALA HA H 166 3.871 4.084 -0.213 1
1 381 . 15 1 1 A 32 32 ALA C C 166 178.029 179.029 -1.000 1
1 382 . 15 1 1 A 32 32 ALA CA C 166 54.997 55.423 -0.426 1
1 383 . 15 1 1 A 32 32 ALA CB C 166 19.727 18.563 1.164 1
1 384 . 15 1 1 A 32 32 ALA N N 166 124.406 122.466 1.940 1
1 385 . 15 1 1 A 33 33 LYS H H 167 8.228 7.655 0.573 1
1 386 . 15 1 1 A 33 33 LYS HA H 167 2.595 3.092 -0.497 1
1 395 . 15 1 1 A 33 33 LYS C C 167 177.938 177.955 -0.017 1
1 396 . 15 1 1 A 33 33 LYS CA C 167 59.573 59.292 0.281 1
1 397 . 15 1 1 A 33 33 LYS CB C 167 32.098 32.175 -0.077 1
1 401 . 15 1 1 A 33 33 LYS N N 167 119.833 118.294 1.539 1
1 402 . 15 1 1 A 34 34 GLN H H 168 7.392 7.793 -0.401 1
1 403 . 15 1 1 A 34 34 GLN HA H 168 3.943 3.914 0.029 1
1 410 . 15 1 1 A 34 34 GLN C C 168 178.323 178.394 -0.071 1
1 411 . 15 1 1 A 34 34 GLN CA C 168 58.883 59.304 -0.421 1
1 412 . 15 1 1 A 34 34 GLN CB C 168 28.485 28.104 0.381 1
1 414 . 15 1 1 A 34 34 GLN N N 168 117.208 117.786 -0.578 1
1 416 . 15 1 1 A 35 35 LYS H H 169 7.994 8.044 -0.050 1
1 417 . 15 1 1 A 35 35 LYS HA H 169 4.067 4.002 0.065 1
1 426 . 15 1 1 A 35 35 LYS C C 169 178.161 178.446 -0.285 1
1 427 . 15 1 1 A 35 35 LYS CA C 169 58.437 59.374 -0.937 1
1 428 . 15 1 1 A 35 35 LYS CB C 169 31.611 32.273 -0.662 1
1 432 . 15 1 1 A 35 35 LYS N N 169 120.898 119.869 1.029 1
1 433 . 15 1 1 A 36 36 ALA H H 170 8.431 8.226 0.205 1
1 434 . 15 1 1 A 36 36 ALA HA H 170 3.738 4.039 -0.301 1
1 438 . 15 1 1 A 36 36 ALA C C 170 178.862 179.619 -0.757 1
1 439 . 15 1 1 A 36 36 ALA CA C 170 55.351 54.957 0.394 1
1 440 . 15 1 1 A 36 36 ALA CB C 170 18.295 18.441 -0.146 1
1 441 . 15 1 1 A 36 36 ALA N N 170 120.641 120.118 0.523 1
1 442 . 15 1 1 A 37 37 GLU H H 171 8.412 8.132 0.280 1
1 443 . 15 1 1 A 37 37 GLU HA H 171 3.867 3.927 -0.060 1
1 448 . 15 1 1 A 37 37 GLU C C 171 179.255 179.241 0.014 1
1 449 . 15 1 1 A 37 37 GLU CA C 171 59.543 59.614 -0.071 1
1 450 . 15 1 1 A 37 37 GLU CB C 171 29.569 29.435 0.134 1
1 452 . 15 1 1 A 37 37 GLU N N 171 118.224 117.809 0.415 1
1 453 . 15 1 1 A 38 38 GLU H H 172 8.019 8.405 -0.386 1
1 454 . 15 1 1 A 38 38 GLU HA H 172 3.952 4.069 -0.117 1
1 459 . 15 1 1 A 38 38 GLU C C 172 180.250 178.419 1.831 1
1 460 . 15 1 1 A 38 38 GLU CA C 172 59.627 59.142 0.485 1
1 461 . 15 1 1 A 38 38 GLU CB C 172 29.368 28.715 0.653 1
1 463 . 15 1 1 A 38 38 GLU N N 172 121.250 118.308 2.942 1
1 464 . 15 1 1 A 39 39 ILE H H 173 8.174 7.601 0.573 1
1 465 . 15 1 1 A 39 39 ILE HA H 173 3.643 3.803 -0.160 1
1 475 . 15 1 1 A 39 39 ILE C C 173 177.568 177.977 -0.409 1
1 476 . 15 1 1 A 39 39 ILE CA C 173 64.869 63.814 1.055 1
1 477 . 15 1 1 A 39 39 ILE CB C 173 38.160 37.452 0.708 1
1 481 . 15 1 1 A 39 39 ILE N N 173 121.527 117.582 3.945 1
1 482 . 15 1 1 A 40 40 GLN H H 174 8.860 8.275 0.585 1
1 483 . 15 1 1 A 40 40 GLN HA H 174 3.533 4.014 -0.481 1
1 490 . 15 1 1 A 40 40 GLN C C 174 179.022 179.107 -0.085 1
1 491 . 15 1 1 A 40 40 GLN CA C 174 61.316 59.273 2.043 1
1 492 . 15 1 1 A 40 40 GLN CB C 174 26.604 28.401 -1.797 1
1 494 . 15 1 1 A 40 40 GLN N N 174 121.956 121.265 0.691 1
1 496 . 15 1 1 A 41 41 LYS H H 175 7.879 8.062 -0.183 1
1 497 . 15 1 1 A 41 41 LYS HA H 175 3.777 4.123 -0.346 1
1 506 . 15 1 1 A 41 41 LYS C C 175 178.779 178.563 0.216 1
1 507 . 15 1 1 A 41 41 LYS CA C 175 59.701 58.658 1.043 1
1 508 . 15 1 1 A 41 41 LYS CB C 175 32.581 32.303 0.278 1
1 512 . 15 1 1 A 41 41 LYS N N 175 119.012 118.196 0.816 1
1 513 . 15 1 1 A 42 42 GLU H H 176 7.447 7.856 -0.409 1
1 514 . 15 1 1 A 42 42 GLU HA H 176 4.059 4.241 -0.182 1
1 519 . 15 1 1 A 42 42 GLU C C 176 180.058 178.785 1.273 1
1 520 . 15 1 1 A 42 42 GLU CA C 176 59.456 58.555 0.901 1
1 521 . 15 1 1 A 42 42 GLU CB C 176 29.923 30.288 -0.365 1
1 523 . 15 1 1 A 42 42 GLU N N 176 120.054 118.699 1.355 1
1 524 . 15 1 1 A 43 43 VAL H H 177 8.618 8.131 0.487 1
1 525 . 15 1 1 A 43 43 VAL HA H 177 3.986 3.942 0.044 1
1 533 . 15 1 1 A 43 43 VAL C C 177 176.459 177.588 -1.129 1
1 534 . 15 1 1 A 43 43 VAL CA C 177 63.923 64.779 -0.856 1
1 535 . 15 1 1 A 43 43 VAL CB C 177 31.899 31.300 0.599 1
1 538 . 15 1 1 A 43 43 VAL N N 177 114.191 116.457 -2.266 1
1 539 . 15 1 1 A 44 44 SER H H 178 8.052 8.336 -0.284 1
1 540 . 15 1 1 A 44 44 SER HA H 178 4.098 4.276 -0.178 1
1 543 . 15 1 1 A 44 44 SER C C 178 176.548 175.960 0.588 1
1 544 . 15 1 1 A 44 44 SER CA C 178 61.160 61.356 -0.196 1
1 545 . 15 1 1 A 44 44 SER CB C 178 62.959 62.604 0.355 1
1 546 . 15 1 1 A 44 44 SER N N 178 114.202 115.822 -1.620 1
1 547 . 15 1 1 A 45 45 LYS H H 179 7.083 8.222 -1.139 1
1 548 . 15 1 1 A 45 45 LYS HA H 179 4.140 4.252 -0.112 1
1 557 . 15 1 1 A 45 45 LYS C C 179 177.288 175.936 1.352 1
1 558 . 15 1 1 A 45 45 LYS CA C 179 58.469 57.931 0.538 1
1 559 . 15 1 1 A 45 45 LYS CB C 179 32.671 32.282 0.389 1
1 563 . 15 1 1 A 45 45 LYS N N 179 120.935 117.651 3.284 1
1 564 . 15 1 1 A 46 46 ASP H H 180 7.098 7.414 -0.316 1
1 565 . 15 1 1 A 46 46 ASP HA H 180 4.917 5.046 -0.129 1
1 568 . 15 1 1 A 46 46 ASP CA C 180 51.492 51.455 0.037 1
1 569 . 15 1 1 A 46 46 ASP CB C 180 40.595 41.241 -0.646 1
1 570 . 15 1 1 A 46 46 ASP N N 180 112.836 120.642 -7.806 1
1 571 . 15 1 1 A 47 47 PRO HA H 181 4.681 4.529 0.152 1
1 578 . 15 1 1 A 47 47 PRO C C 181 179.248 177.928 1.320 1
1 579 . 15 1 1 A 47 47 PRO CA C 181 64.718 64.478 0.240 1
1 580 . 15 1 1 A 47 47 PRO CB C 181 32.159 31.954 0.205 1
1 583 . 15 1 1 A 48 48 SER H H 182 8.248 8.277 -0.029 1
1 584 . 15 1 1 A 48 48 SER HA H 182 4.378 4.269 0.109 1
1 587 . 15 1 1 A 48 48 SER C C 182 176.071 175.244 0.827 1
1 588 . 15 1 1 A 48 48 SER CA C 182 61.377 60.893 0.484 1
1 589 . 15 1 1 A 48 48 SER CB C 182 62.455 63.151 -0.696 1
1 590 . 15 1 1 A 48 48 SER N N 182 116.986 112.991 3.995 1
1 591 . 15 1 1 A 49 49 LYS H H 183 7.842 7.360 0.482 1
1 592 . 15 1 1 A 49 49 LYS HA H 183 4.482 4.439 0.043 1
1 601 . 15 1 1 A 49 49 LYS C C 183 175.605 177.252 -1.647 1
1 602 . 15 1 1 A 49 49 LYS CA C 183 55.824 55.992 -0.168 1
1 603 . 15 1 1 A 49 49 LYS CB C 183 32.834 32.805 0.029 1
1 607 . 15 1 1 A 49 49 LYS N N 183 121.698 117.948 3.750 1
1 608 . 15 1 1 A 50 50 PHE H H 184 7.634 7.760 -0.126 1
1 609 . 15 1 1 A 50 50 PHE HA H 184 3.510 4.233 -0.723 1
1 617 . 15 1 1 A 50 50 PHE C C 184 176.214 177.522 -1.308 1
1 618 . 15 1 1 A 50 50 PHE CA C 184 63.276 61.052 2.224 1
1 619 . 15 1 1 A 50 50 PHE CB C 184 40.948 39.066 1.882 1
1 623 . 15 1 1 A 50 50 PHE N N 184 120.120 121.383 -1.263 1
1 624 . 15 1 1 A 51 51 GLY H H 185 8.855 8.582 0.273 1
1 625 . 15 1 1 A 51 51 GLY HA2 H 185 3.993 3.841 0.152 1
1 626 . 15 1 1 A 51 51 GLY HA3 H 185 3.958 3.878 0.080 1
1 627 . 15 1 1 A 51 51 GLY C C 185 175.169 176.163 -0.994 1
1 628 . 15 1 1 A 51 51 GLY CA C 185 47.475 47.649 -0.174 1
1 629 . 15 1 1 A 51 51 GLY N N 185 105.550 106.182 -0.632 1
1 630 . 15 1 1 A 52 52 GLU H H 186 7.917 7.976 -0.059 1
1 631 . 15 1 1 A 52 52 GLU HA H 186 4.006 4.027 -0.021 1
1 636 . 15 1 1 A 52 52 GLU C C 186 179.499 179.559 -0.060 1
1 637 . 15 1 1 A 52 52 GLU CA C 186 58.904 59.146 -0.242 1
1 638 . 15 1 1 A 52 52 GLU CB C 186 29.700 29.744 -0.044 1
1 640 . 15 1 1 A 52 52 GLU N N 186 121.929 121.750 0.179 1
1 641 . 15 1 1 A 53 53 ILE H H 187 7.936 8.048 -0.112 1
1 642 . 15 1 1 A 53 53 ILE HA H 187 3.648 3.800 -0.152 1
1 652 . 15 1 1 A 53 53 ILE C C 187 177.886 177.956 -0.070 1
1 653 . 15 1 1 A 53 53 ILE CA C 187 64.366 64.091 0.275 1
1 654 . 15 1 1 A 53 53 ILE CB C 187 36.478 36.915 -0.437 1
1 658 . 15 1 1 A 53 53 ILE N N 187 120.991 120.852 0.139 1
1 659 . 15 1 1 A 54 54 ALA H H 188 8.895 8.500 0.395 1
1 660 . 15 1 1 A 54 54 ALA HA H 188 3.629 3.790 -0.161 1
1 664 . 15 1 1 A 54 54 ALA C C 188 179.437 179.335 0.102 1
1 665 . 15 1 1 A 54 54 ALA CA C 188 55.974 55.586 0.388 1
1 666 . 15 1 1 A 54 54 ALA CB C 188 17.591 18.609 -1.018 1
1 667 . 15 1 1 A 54 54 ALA N N 188 125.308 121.907 3.401 1
1 668 . 15 1 1 A 55 55 LYS H H 189 8.049 7.643 0.406 1
1 669 . 15 1 1 A 55 55 LYS HA H 189 4.106 3.929 0.177 1
1 678 . 15 1 1 A 55 55 LYS C C 189 178.995 178.336 0.659 1
1 679 . 15 1 1 A 55 55 LYS CA C 189 59.312 59.035 0.277 1
1 680 . 15 1 1 A 55 55 LYS CB C 189 32.647 31.825 0.822 1
1 684 . 15 1 1 A 55 55 LYS N N 189 116.835 118.439 -1.604 1
1 685 . 15 1 1 A 56 56 LYS H H 190 7.215 8.033 -0.818 1
1 686 . 15 1 1 A 56 56 LYS HA H 190 4.172 4.265 -0.093 1
1 695 . 15 1 1 A 56 56 LYS C C 190 177.897 177.932 -0.035 1
1 696 . 15 1 1 A 56 56 LYS CA C 190 58.418 58.036 0.382 1
1 697 . 15 1 1 A 56 56 LYS CB C 190 34.652 33.245 1.407 1
1 701 . 15 1 1 A 56 56 LYS N N 190 117.170 117.805 -0.635 1
1 702 . 15 1 1 A 57 57 GLU H H 191 8.572 7.957 0.615 1
1 703 . 15 1 1 A 57 57 GLU HA H 191 4.643 4.385 0.258 1
1 708 . 15 1 1 A 57 57 GLU C C 191 177.903 176.014 1.889 1
1 709 . 15 1 1 A 57 57 GLU CA C 191 55.708 55.978 -0.270 1
1 710 . 15 1 1 A 57 57 GLU CB C 191 32.460 31.166 1.294 1
1 712 . 15 1 1 A 57 57 GLU N N 191 113.316 116.676 -3.360 1
1 713 . 15 1 1 A 58 58 SER H H 192 8.550 7.590 0.960 1
1 714 . 15 1 1 A 58 58 SER HA H 192 4.149 4.355 -0.206 1
1 717 . 15 1 1 A 58 58 SER C C 192 176.161 175.205 0.956 1
1 718 . 15 1 1 A 58 58 SER CA C 192 58.403 58.174 0.229 1
1 719 . 15 1 1 A 58 58 SER CB C 192 64.392 64.346 0.046 1
1 720 . 15 1 1 A 58 58 SER N N 192 109.861 115.950 -6.089 1
1 721 . 15 1 1 A 59 59 MET H H 193 9.533 8.884 0.649 1
1 722 . 15 1 1 A 59 59 MET HA H 193 4.457 4.491 -0.034 1
1 730 . 15 1 1 A 59 59 MET C C 193 175.204 175.619 -0.415 1
1 731 . 15 1 1 A 59 59 MET CA C 193 55.781 56.176 -0.395 1
1 732 . 15 1 1 A 59 59 MET CB C 193 32.855 33.285 -0.430 1
1 735 . 15 1 1 A 59 59 MET N N 193 124.493 123.694 0.799 1
1 736 . 15 1 1 A 60 60 ASP H H 194 7.514 7.445 0.069 1
1 737 . 15 1 1 A 60 60 ASP HA H 194 4.886 4.581 0.305 1
1 740 . 15 1 1 A 60 60 ASP C C 194 175.517 176.583 -1.066 1
1 741 . 15 1 1 A 60 60 ASP CA C 194 52.286 53.343 -1.057 1
1 742 . 15 1 1 A 60 60 ASP CB C 194 40.222 40.659 -0.437 1
1 743 . 15 1 1 A 60 60 ASP N N 194 117.785 120.534 -2.749 1
1 744 . 15 1 1 A 61 61 THR H H 195 8.118 8.231 -0.113 1
1 745 . 15 1 1 A 61 61 THR HA H 195 3.918 3.826 0.092 1
1 750 . 15 1 1 A 61 61 THR C C 195 176.269 176.842 -0.573 1
1 751 . 15 1 1 A 61 61 THR CA C 195 65.469 66.545 -1.076 1
1 752 . 15 1 1 A 61 61 THR CB C 195 68.741 68.270 0.471 1
1 754 . 15 1 1 A 61 61 THR N N 195 120.765 118.555 2.210 1
1 755 . 15 1 1 A 62 62 GLY H H 196 8.399 8.496 -0.097 1
1 756 . 15 1 1 A 62 62 GLY HA2 H 196 3.932 3.861 0.071 1
1 757 . 15 1 1 A 62 62 GLY HA3 H 196 3.900 3.864 0.036 1
1 758 . 15 1 1 A 62 62 GLY C C 196 174.948 176.637 -1.689 1
1 759 . 15 1 1 A 62 62 GLY CA C 196 46.768 47.631 -0.863 1
1 760 . 15 1 1 A 62 62 GLY N N 196 108.183 108.508 -0.325 1
1 761 . 15 1 1 A 63 63 SER H H 197 7.265 8.154 -0.889 1
1 762 . 15 1 1 A 63 63 SER HA H 197 4.554 4.402 0.152 1
1 765 . 15 1 1 A 63 63 SER C C 197 177.630 176.371 1.259 1
1 766 . 15 1 1 A 63 63 SER CA C 197 59.550 62.570 -3.020 1
1 767 . 15 1 1 A 63 63 SER CB C 197 65.504 63.124 2.380 1
1 768 . 15 1 1 A 63 63 SER N N 197 111.815 119.294 -7.479 1
1 769 . 15 1 1 A 64 64 ALA H H 198 8.675 8.476 0.199 1
1 770 . 15 1 1 A 64 64 ALA HA H 198 3.801 4.020 -0.219 1
1 774 . 15 1 1 A 64 64 ALA C C 198 178.492 180.063 -1.571 1
1 775 . 15 1 1 A 64 64 ALA CA C 198 56.794 55.468 1.326 1
1 776 . 15 1 1 A 64 64 ALA CB C 198 18.951 18.163 0.788 1
1 777 . 15 1 1 A 64 64 ALA N N 198 131.710 123.442 8.268 1
1 778 . 15 1 1 A 65 65 LYS H H 199 7.666 8.086 -0.420 1
1 779 . 15 1 1 A 65 65 LYS HA H 199 4.175 4.043 0.132 1
1 788 . 15 1 1 A 65 65 LYS C C 199 177.159 177.668 -0.509 1
1 789 . 15 1 1 A 65 65 LYS CA C 199 57.735 58.540 -0.805 1
1 790 . 15 1 1 A 65 65 LYS CB C 199 31.948 31.755 0.193 1
1 794 . 15 1 1 A 65 65 LYS N N 199 111.375 117.687 -6.312 1
1 795 . 15 1 1 A 66 66 LYS H H 200 7.545 7.630 -0.085 1
1 796 . 15 1 1 A 66 66 LYS HA H 200 4.612 4.458 0.154 1
1 805 . 15 1 1 A 66 66 LYS C C 200 175.609 175.800 -0.191 1
1 806 . 15 1 1 A 66 66 LYS CA C 200 54.468 56.349 -1.881 1
1 807 . 15 1 1 A 66 66 LYS CB C 200 31.525 33.176 -1.651 1
1 811 . 15 1 1 A 66 66 LYS N N 200 121.421 118.425 2.996 1
1 812 . 15 1 1 A 67 67 ASP H H 201 7.630 8.379 -0.749 1
1 813 . 15 1 1 A 67 67 ASP HA H 201 4.306 4.388 -0.082 1
1 816 . 15 1 1 A 67 67 ASP C C 201 175.025 176.438 -1.413 1
1 817 . 15 1 1 A 67 67 ASP CA C 201 56.400 55.368 1.032 1
1 818 . 15 1 1 A 67 67 ASP CB C 201 38.315 39.047 -0.732 1
1 819 . 15 1 1 A 67 67 ASP N N 201 116.216 117.457 -1.241 1
1 820 . 15 1 1 A 68 68 GLY H H 202 8.368 8.648 -0.280 1
1 821 . 15 1 1 A 68 68 GLY HA2 H 202 4.316 3.935 0.381 1
1 822 . 15 1 1 A 68 68 GLY HA3 H 202 3.731 4.011 -0.280 1
1 823 . 15 1 1 A 68 68 GLY C C 202 174.139 174.696 -0.557 1
1 824 . 15 1 1 A 68 68 GLY CA C 202 45.514 45.299 0.215 1
1 825 . 15 1 1 A 68 68 GLY N N 202 105.095 104.667 0.428 1
1 826 . 15 1 1 A 69 69 GLU H H 203 7.534 8.082 -0.548 1
1 827 . 15 1 1 A 69 69 GLU HA H 203 4.479 4.380 0.099 1
1 832 . 15 1 1 A 69 69 GLU C C 203 176.961 176.102 0.859 1
1 833 . 15 1 1 A 69 69 GLU CA C 203 58.549 56.741 1.808 1
1 834 . 15 1 1 A 69 69 GLU CB C 203 30.998 30.100 0.898 1
1 836 . 15 1 1 A 69 69 GLU N N 203 120.426 120.162 0.264 1
1 837 . 15 1 1 A 70 70 LEU H H 204 8.962 9.134 -0.172 1
1 838 . 15 1 1 A 70 70 LEU HA H 204 4.438 4.548 -0.110 1
1 848 . 15 1 1 A 70 70 LEU C C 204 178.648 177.263 1.385 1
1 849 . 15 1 1 A 70 70 LEU CA C 204 53.977 55.498 -1.521 1
1 850 . 15 1 1 A 70 70 LEU CB C 204 43.612 43.431 0.181 1
1 854 . 15 1 1 A 70 70 LEU N N 204 122.066 124.155 -2.089 1
1 855 . 15 1 1 A 71 71 GLY H H 205 8.104 7.595 0.509 1
1 856 . 15 1 1 A 71 71 GLY HA2 H 205 4.165 3.988 0.177 1
1 857 . 15 1 1 A 71 71 GLY HA3 H 205 3.552 4.104 -0.552 1
1 858 . 15 1 1 A 71 71 GLY C C 205 173.098 173.445 -0.347 1
1 859 . 15 1 1 A 71 71 GLY CA C 205 44.723 44.955 -0.232 1
1 860 . 15 1 1 A 71 71 GLY N N 205 110.168 106.599 3.569 1
1 861 . 15 1 1 A 72 72 TYR H H 206 8.457 8.619 -0.162 1
1 862 . 15 1 1 A 72 72 TYR HA H 206 4.184 4.720 -0.536 1
1 869 . 15 1 1 A 72 72 TYR C C 206 175.975 175.602 0.373 1
1 870 . 15 1 1 A 72 72 TYR CA C 206 59.722 58.933 0.789 1
1 871 . 15 1 1 A 72 72 TYR CB C 206 38.378 38.313 0.065 1
1 874 . 15 1 1 A 72 72 TYR N N 206 120.171 122.045 -1.874 1
1 875 . 15 1 1 A 73 73 VAL H H 207 8.782 9.206 -0.424 1
1 876 . 15 1 1 A 73 73 VAL HA H 207 4.056 4.468 -0.412 1
1 884 . 15 1 1 A 73 73 VAL C C 207 174.901 175.703 -0.802 1
1 885 . 15 1 1 A 73 73 VAL CA C 207 62.202 62.409 -0.207 1
1 886 . 15 1 1 A 73 73 VAL CB C 207 33.071 32.381 0.690 1
1 889 . 15 1 1 A 73 73 VAL N N 207 128.847 125.004 3.843 1
1 890 . 15 1 1 A 74 74 LEU H H 208 8.146 8.884 -0.738 1
1 891 . 15 1 1 A 74 74 LEU HA H 208 4.944 4.961 -0.017 1
1 901 . 15 1 1 A 74 74 LEU C C 208 178.400 177.441 0.959 1
1 902 . 15 1 1 A 74 74 LEU CA C 208 53.520 53.475 0.045 1
1 903 . 15 1 1 A 74 74 LEU CB C 208 43.499 43.421 0.078 1
1 907 . 15 1 1 A 74 74 LEU N N 208 127.599 129.109 -1.510 1
1 908 . 15 1 1 A 75 75 LYS H H 209 8.403 8.357 0.046 1
1 909 . 15 1 1 A 75 75 LYS HA H 209 3.771 3.751 0.020 1
1 918 . 15 1 1 A 75 75 LYS C C 209 177.536 177.375 0.161 1
1 919 . 15 1 1 A 75 75 LYS CA C 209 58.385 58.903 -0.518 1
1 920 . 15 1 1 A 75 75 LYS CB C 209 32.459 31.990 0.469 1
1 924 . 15 1 1 A 75 75 LYS N N 209 123.798 123.045 0.753 1
1 925 . 15 1 1 A 76 76 GLY H H 210 9.997 9.366 0.631 1
1 926 . 15 1 1 A 76 76 GLY HA2 H 210 4.255 3.982 0.273 1
1 927 . 15 1 1 A 76 76 GLY HA3 H 210 3.791 3.985 -0.194 1
1 928 . 15 1 1 A 76 76 GLY C C 210 175.091 175.715 -0.624 1
1 929 . 15 1 1 A 76 76 GLY CA C 210 45.465 45.393 0.072 1
1 930 . 15 1 1 A 76 76 GLY N N 210 114.705 113.306 1.399 1
1 931 . 15 1 1 A 77 77 GLN H H 211 7.726 8.085 -0.359 1
1 932 . 15 1 1 A 77 77 GLN HA H 211 4.373 4.191 0.182 1
1 939 . 15 1 1 A 77 77 GLN C C 211 176.301 176.133 0.168 1
1 940 . 15 1 1 A 77 77 GLN CA C 211 57.074 57.478 -0.404 1
1 941 . 15 1 1 A 77 77 GLN CB C 211 30.798 29.328 1.470 1
1 943 . 15 1 1 A 77 77 GLN N N 211 118.702 118.005 0.697 1
1 945 . 15 1 1 A 78 78 THR H H 212 8.225 7.470 0.755 1
1 946 . 15 1 1 A 78 78 THR HA H 212 4.620 4.615 0.005 1
1 951 . 15 1 1 A 78 78 THR C C 212 173.920 174.049 -0.129 1
1 952 . 15 1 1 A 78 78 THR CA C 212 60.087 59.722 0.365 1
1 953 . 15 1 1 A 78 78 THR CB C 212 71.412 70.883 0.529 1
1 955 . 15 1 1 A 78 78 THR N N 212 111.935 110.735 1.200 1
1 956 . 15 1 1 A 79 79 ASP H H 213 8.372 8.500 -0.128 1
1 957 . 15 1 1 A 79 79 ASP HA H 213 4.470 4.525 -0.055 1
1 960 . 15 1 1 A 79 79 ASP C C 213 176.759 177.618 -0.859 1
1 961 . 15 1 1 A 79 79 ASP CA C 213 54.927 54.442 0.485 1
1 962 . 15 1 1 A 79 79 ASP CB C 213 43.859 41.365 2.494 1
1 963 . 15 1 1 A 79 79 ASP N N 213 122.093 121.544 0.549 1
1 964 . 15 1 1 A 80 80 LYS H H 214 8.740 8.899 -0.159 1
1 965 . 15 1 1 A 80 80 LYS HA H 214 4.027 4.013 0.014 1
1 974 . 15 1 1 A 80 80 LYS C C 214 178.493 178.610 -0.117 1
1 975 . 15 1 1 A 80 80 LYS CA C 214 59.802 59.211 0.591 1
1 976 . 15 1 1 A 80 80 LYS CB C 214 32.374 31.873 0.501 1
1 980 . 15 1 1 A 80 80 LYS N N 214 124.685 123.089 1.596 1
1 981 . 15 1 1 A 81 81 ASP H H 215 8.556 8.116 0.440 1
1 982 . 15 1 1 A 81 81 ASP HA H 215 4.566 4.408 0.158 1
1 985 . 15 1 1 A 81 81 ASP C C 215 178.889 178.676 0.213 1
1 986 . 15 1 1 A 81 81 ASP CA C 215 58.046 57.232 0.814 1
1 987 . 15 1 1 A 81 81 ASP CB C 215 40.872 40.394 0.478 1
1 988 . 15 1 1 A 81 81 ASP N N 215 121.413 119.668 1.745 1
1 989 . 15 1 1 A 82 82 PHE H H 216 8.205 8.240 -0.035 1
1 990 . 15 1 1 A 82 82 PHE HA H 216 3.686 4.079 -0.393 1
1 998 . 15 1 1 A 82 82 PHE C C 216 175.919 177.363 -1.444 1
1 999 . 15 1 1 A 82 82 PHE CA C 216 61.648 61.000 0.648 1
1 1000 . 15 1 1 A 82 82 PHE CB C 216 39.743 39.217 0.526 1
1 1004 . 15 1 1 A 82 82 PHE N N 216 124.401 121.593 2.808 1
1 1005 . 15 1 1 A 83 83 GLU H H 217 8.887 8.821 0.066 1
1 1006 . 15 1 1 A 83 83 GLU HA H 217 3.704 4.183 -0.479 1
1 1011 . 15 1 1 A 83 83 GLU C C 217 177.788 178.869 -1.081 1
1 1012 . 15 1 1 A 83 83 GLU CA C 217 60.545 60.224 0.321 1
1 1013 . 15 1 1 A 83 83 GLU CB C 217 30.639 29.456 1.183 1
1 1015 . 15 1 1 A 83 83 GLU N N 217 119.421 119.013 0.408 1
1 1016 . 15 1 1 A 84 84 LYS H H 218 8.055 8.045 0.010 1
1 1017 . 15 1 1 A 84 84 LYS HA H 218 3.947 4.098 -0.151 1
1 1026 . 15 1 1 A 84 84 LYS C C 218 178.783 178.816 -0.033 1
1 1027 . 15 1 1 A 84 84 LYS CA C 218 59.327 59.093 0.234 1
1 1028 . 15 1 1 A 84 84 LYS CB C 218 32.539 32.202 0.337 1
1 1032 . 15 1 1 A 84 84 LYS N N 218 117.821 119.570 -1.749 1
1 1033 . 15 1 1 A 85 85 ALA H H 219 7.059 7.799 -0.740 1
1 1034 . 15 1 1 A 85 85 ALA HA H 219 4.040 4.057 -0.017 1
1 1038 . 15 1 1 A 85 85 ALA C C 219 179.794 179.987 -0.193 1
1 1039 . 15 1 1 A 85 85 ALA CA C 219 54.407 54.830 -0.423 1
1 1040 . 15 1 1 A 85 85 ALA CB C 219 20.130 18.117 2.013 1
1 1041 . 15 1 1 A 85 85 ALA N N 219 118.905 121.253 -2.348 1
1 1042 . 15 1 1 A 86 86 LEU H H 220 8.157 8.287 -0.130 1
1 1043 . 15 1 1 A 86 86 LEU HA H 220 3.692 3.983 -0.291 1
1 1053 . 15 1 1 A 86 86 LEU C C 220 178.330 178.594 -0.264 1
1 1054 . 15 1 1 A 86 86 LEU CA C 220 57.752 57.968 -0.216 1
1 1055 . 15 1 1 A 86 86 LEU CB C 220 41.464 41.963 -0.499 1
1 1059 . 15 1 1 A 86 86 LEU N N 220 118.606 120.241 -1.635 1
1 1060 . 15 1 1 A 87 87 PHE H H 221 8.349 8.342 0.007 1
1 1061 . 15 1 1 A 87 87 PHE HA H 221 3.861 4.494 -0.633 1
1 1069 . 15 1 1 A 87 87 PHE C C 221 176.176 177.849 -1.673 1
1 1070 . 15 1 1 A 87 87 PHE CA C 221 61.780 61.324 0.456 1
1 1071 . 15 1 1 A 87 87 PHE CB C 221 37.549 37.858 -0.309 1
1 1075 . 15 1 1 A 87 87 PHE N N 221 112.449 116.879 -4.430 1
1 1076 . 15 1 1 A 88 88 LYS H H 222 7.061 8.187 -1.126 1
1 1077 . 15 1 1 A 88 88 LYS HA H 222 4.380 4.110 0.270 1
1 1086 . 15 1 1 A 88 88 LYS C C 222 177.089 177.228 -0.139 1
1 1087 . 15 1 1 A 88 88 LYS CA C 222 56.726 58.431 -1.705 1
1 1088 . 15 1 1 A 88 88 LYS CB C 222 33.738 32.432 1.306 1
1 1092 . 15 1 1 A 88 88 LYS N N 222 118.308 120.876 -2.568 1
1 1093 . 15 1 1 A 89 89 LEU H H 223 7.270 7.419 -0.149 1
1 1094 . 15 1 1 A 89 89 LEU HA H 223 4.168 4.277 -0.109 1
1 1104 . 15 1 1 A 89 89 LEU C C 223 177.528 176.865 0.663 1
1 1105 . 15 1 1 A 89 89 LEU CA C 223 55.279 54.748 0.531 1
1 1106 . 15 1 1 A 89 89 LEU CB C 223 43.240 42.316 0.924 1
1 1110 . 15 1 1 A 89 89 LEU N N 223 121.317 122.340 -1.023 1
1 1111 . 15 1 1 A 90 90 LYS H H 224 8.788 8.527 0.261 1
1 1112 . 15 1 1 A 90 90 LYS HA H 224 4.359 4.213 0.146 1
1 1121 . 15 1 1 A 90 90 LYS C C 224 175.839 176.631 -0.792 1
1 1122 . 15 1 1 A 90 90 LYS CA C 224 54.772 56.210 -1.438 1
1 1123 . 15 1 1 A 90 90 LYS CB C 224 33.232 33.270 -0.038 1
1 1127 . 15 1 1 A 90 90 LYS N N 224 123.558 123.436 0.122 1
1 1128 . 15 1 1 A 91 91 ASP H H 225 8.125 8.784 -0.659 1
1 1129 . 15 1 1 A 91 91 ASP HA H 225 3.958 4.153 -0.195 1
1 1132 . 15 1 1 A 91 91 ASP C C 225 177.452 177.085 0.367 1
1 1133 . 15 1 1 A 91 91 ASP CA C 225 56.642 56.220 0.422 1
1 1134 . 15 1 1 A 91 91 ASP CB C 225 40.269 40.106 0.163 1
1 1135 . 15 1 1 A 91 91 ASP N N 225 119.419 122.775 -3.356 1
1 1136 . 15 1 1 A 92 92 GLY H H 226 8.681 8.913 -0.232 1
1 1137 . 15 1 1 A 92 92 GLY HA2 H 226 4.131 3.836 0.295 1
1 1138 . 15 1 1 A 92 92 GLY HA3 H 226 3.579 3.863 -0.284 1
1 1139 . 15 1 1 A 92 92 GLY C C 226 173.614 174.154 -0.540 1
1 1140 . 15 1 1 A 92 92 GLY CA C 226 45.564 44.873 0.691 1
1 1141 . 15 1 1 A 92 92 GLY N N 226 113.802 111.732 2.070 1
1 1142 . 15 1 1 A 93 93 GLU H H 227 8.104 8.076 0.028 1
1 1143 . 15 1 1 A 93 93 GLU HA H 227 4.232 4.399 -0.167 1
1 1148 . 15 1 1 A 93 93 GLU C C 227 174.282 175.584 -1.302 1
1 1149 . 15 1 1 A 93 93 GLU CA C 227 56.651 56.206 0.445 1
1 1150 . 15 1 1 A 93 93 GLU CB C 227 32.190 31.209 0.981 1
1 1152 . 15 1 1 A 93 93 GLU N N 227 121.527 121.972 -0.445 1
1 1153 . 15 1 1 A 94 94 VAL H H 228 7.918 8.473 -0.555 1
1 1154 . 15 1 1 A 94 94 VAL HA H 228 4.857 4.732 0.125 1
1 1162 . 15 1 1 A 94 94 VAL C C 228 176.556 175.649 0.907 1
1 1163 . 15 1 1 A 94 94 VAL CA C 228 60.309 60.283 0.026 1
1 1164 . 15 1 1 A 94 94 VAL CB C 228 33.847 35.443 -1.596 1
1 1167 . 15 1 1 A 94 94 VAL N N 228 119.768 125.840 -6.072 1
1 1168 . 15 1 1 A 95 95 SER H H 229 9.659 9.376 0.283 1
1 1169 . 15 1 1 A 95 95 SER HA H 229 4.313 4.710 -0.397 1
1 1172 . 15 1 1 A 95 95 SER C C 229 174.641 174.605 0.036 1
1 1173 . 15 1 1 A 95 95 SER CA C 229 59.208 57.709 1.499 1
1 1174 . 15 1 1 A 95 95 SER CB C 229 66.080 65.798 0.282 1
1 1175 . 15 1 1 A 95 95 SER N N 229 124.903 120.741 4.162 1
1 1176 . 15 1 1 A 96 96 GLU H H 230 8.014 8.397 -0.383 1
1 1177 . 15 1 1 A 96 96 GLU HA H 230 4.376 4.293 0.083 1
1 1182 . 15 1 1 A 96 96 GLU C C 230 176.641 175.883 0.758 1
1 1183 . 15 1 1 A 96 96 GLU CA C 230 56.236 56.124 0.112 1
1 1184 . 15 1 1 A 96 96 GLU CB C 230 30.324 30.315 0.009 1
1 1186 . 15 1 1 A 96 96 GLU N N 230 115.510 119.371 -3.861 1
1 1187 . 15 1 1 A 97 97 VAL H H 231 8.741 8.338 0.403 1
1 1188 . 15 1 1 A 97 97 VAL HA H 231 4.171 4.127 0.044 1
1 1196 . 15 1 1 A 97 97 VAL C C 231 176.684 175.834 0.850 1
1 1197 . 15 1 1 A 97 97 VAL CA C 231 65.418 63.266 2.152 1
1 1198 . 15 1 1 A 97 97 VAL CB C 231 31.218 31.421 -0.203 1
1 1201 . 15 1 1 A 97 97 VAL N N 231 121.289 120.537 0.752 1
1 1202 . 15 1 1 A 98 98 VAL H H 232 9.218 9.367 -0.149 1
1 1203 . 15 1 1 A 98 98 VAL HA H 232 4.405 4.591 -0.186 1
1 1211 . 15 1 1 A 98 98 VAL C C 232 174.258 174.496 -0.238 1
1 1212 . 15 1 1 A 98 98 VAL CA C 232 60.937 61.507 -0.570 1
1 1213 . 15 1 1 A 98 98 VAL CB C 232 35.825 33.700 2.125 1
1 1216 . 15 1 1 A 98 98 VAL N N 232 130.544 128.900 1.644 1
1 1217 . 15 1 1 A 99 99 LYS H H 233 8.800 8.786 0.014 1
1 1218 . 15 1 1 A 99 99 LYS HA H 233 4.853 5.278 -0.425 1
1 1227 . 15 1 1 A 99 99 LYS C C 233 175.274 175.064 0.210 1
1 1228 . 15 1 1 A 99 99 LYS CA C 233 55.499 54.751 0.748 1
1 1229 . 15 1 1 A 99 99 LYS CB C 233 34.452 35.023 -0.571 1
1 1233 . 15 1 1 A 99 99 LYS N N 233 130.477 128.026 2.451 1
1 1234 . 15 1 1 A 100 100 SER H H 234 9.585 9.158 0.427 1
1 1235 . 15 1 1 A 100 100 SER HA H 234 5.150 4.872 0.278 1
1 1238 . 15 1 1 A 100 100 SER C C 234 175.493 173.987 1.506 1
1 1239 . 15 1 1 A 100 100 SER CA C 234 56.927 57.559 -0.632 1
1 1240 . 15 1 1 A 100 100 SER CB C 234 67.309 67.443 -0.134 1
1 1241 . 15 1 1 A 100 100 SER N N 234 125.814 122.930 2.884 1
1 1242 . 15 1 1 A 101 101 SER H H 235 8.631 8.759 -0.128 1
1 1243 . 15 1 1 A 101 101 SER HA H 235 4.106 4.055 0.051 1
1 1246 . 15 1 1 A 101 101 SER C C 235 175.385 175.092 0.293 1
1 1247 . 15 1 1 A 101 101 SER CA C 235 61.123 61.314 -0.191 1
1 1248 . 15 1 1 A 101 101 SER CB C 235 62.818 62.597 0.221 1
1 1249 . 15 1 1 A 101 101 SER N N 235 115.089 117.410 -2.321 1
1 1250 . 15 1 1 A 102 102 PHE H H 236 8.957 7.449 1.508 1
1 1251 . 15 1 1 A 102 102 PHE HA H 236 4.610 4.630 -0.020 1
1 1259 . 15 1 1 A 102 102 PHE C C 236 176.453 175.674 0.779 1
1 1260 . 15 1 1 A 102 102 PHE CA C 236 58.382 58.045 0.337 1
1 1261 . 15 1 1 A 102 102 PHE CB C 236 40.275 39.629 0.646 1
1 1263 . 15 1 1 A 102 102 PHE N N 236 119.917 117.254 2.663 1
1 1264 . 15 1 1 A 103 103 GLY H H 237 7.377 7.245 0.132 1
1 1265 . 15 1 1 A 103 103 GLY HA2 H 237 4.453 3.940 0.513 1
1 1266 . 15 1 1 A 103 103 GLY HA3 H 237 3.472 4.113 -0.641 1
1 1267 . 15 1 1 A 103 103 GLY C C 237 169.627 172.442 -2.815 1
1 1268 . 15 1 1 A 103 103 GLY CA C 237 45.384 44.524 0.860 1
1 1269 . 15 1 1 A 103 103 GLY N N 237 108.809 106.363 2.446 1
1 1270 . 15 1 1 A 104 104 TYR H H 238 8.632 8.487 0.145 1
1 1271 . 15 1 1 A 104 104 TYR HA H 238 5.322 5.511 -0.189 1
1 1278 . 15 1 1 A 104 104 TYR C C 238 175.043 175.150 -0.107 1
1 1279 . 15 1 1 A 104 104 TYR CA C 238 57.627 57.172 0.455 1
1 1280 . 15 1 1 A 104 104 TYR CB C 238 41.711 41.678 0.033 1
1 1283 . 15 1 1 A 104 104 TYR N N 238 120.030 121.823 -1.793 1
1 1284 . 15 1 1 A 105 105 HIS H H 239 10.070 9.385 0.685 1
1 1285 . 15 1 1 A 105 105 HIS HA H 239 6.046 5.653 0.393 1
1 1290 . 15 1 1 A 105 105 HIS C C 239 175.734 174.768 0.966 1
1 1291 . 15 1 1 A 105 105 HIS CA C 239 53.945 54.413 -0.468 1
1 1292 . 15 1 1 A 105 105 HIS CB C 239 32.450 34.472 -2.022 1
1 1295 . 15 1 1 A 105 105 HIS N N 239 119.504 118.531 0.973 1
1 1296 . 15 1 1 A 106 106 ILE H H 240 8.660 8.998 -0.338 1
1 1297 . 15 1 1 A 106 106 ILE HA H 240 4.120 4.907 -0.787 1
1 1307 . 15 1 1 A 106 106 ILE C C 240 174.758 175.374 -0.616 1
1 1308 . 15 1 1 A 106 106 ILE CA C 240 63.446 60.016 3.430 1
1 1309 . 15 1 1 A 106 106 ILE CB C 240 40.786 41.520 -0.734 1
1 1313 . 15 1 1 A 106 106 ILE N N 240 120.639 119.728 0.911 1
1 1314 . 15 1 1 A 107 107 ILE H H 241 9.033 9.239 -0.206 1
1 1315 . 15 1 1 A 107 107 ILE HA H 241 4.799 5.099 -0.300 1
1 1325 . 15 1 1 A 107 107 ILE C C 241 172.880 174.111 -1.231 1
1 1326 . 15 1 1 A 107 107 ILE CA C 241 60.563 59.554 1.009 1
1 1327 . 15 1 1 A 107 107 ILE CB C 241 41.652 40.492 1.160 1
1 1331 . 15 1 1 A 107 107 ILE N N 241 129.098 127.241 1.857 1
1 1332 . 15 1 1 A 108 108 LYS H H 242 8.692 9.012 -0.320 1
1 1333 . 15 1 1 A 108 108 LYS HA H 242 5.012 4.989 0.023 1
1 1342 . 15 1 1 A 108 108 LYS C C 242 174.484 175.552 -1.068 1
1 1343 . 15 1 1 A 108 108 LYS CA C 242 54.317 53.956 0.361 1
1 1344 . 15 1 1 A 108 108 LYS CB C 242 35.619 35.424 0.195 1
1 1348 . 15 1 1 A 108 108 LYS N N 242 127.179 126.754 0.425 1
1 1349 . 15 1 1 A 109 109 ALA H H 243 7.816 8.812 -0.996 1
1 1350 . 15 1 1 A 109 109 ALA HA H 243 4.604 4.536 0.068 1
1 1354 . 15 1 1 A 109 109 ALA C C 243 176.231 176.561 -0.330 1
1 1355 . 15 1 1 A 109 109 ALA CA C 243 50.505 51.282 -0.777 1
1 1356 . 15 1 1 A 109 109 ALA CB C 243 19.584 19.418 0.166 1
1 1357 . 15 1 1 A 109 109 ALA N N 243 129.619 127.934 1.685 1
1 1358 . 15 1 1 A 110 110 ASP H H 244 7.578 8.839 -1.261 1
1 1359 . 15 1 1 A 110 110 ASP HA H 244 4.424 4.679 -0.255 1
1 1362 . 15 1 1 A 110 110 ASP C C 244 175.259 175.283 -0.024 1
1 1363 . 15 1 1 A 110 110 ASP CA C 244 54.489 53.590 0.899 1
1 1364 . 15 1 1 A 110 110 ASP CB C 244 42.693 41.904 0.789 1
1 1365 . 15 1 1 A 110 110 ASP N N 244 125.434 121.402 4.032 1
1 4 . 16 1 1 A 2 2 PRO HA H -4 4.403 4.527 -0.124 1
1 11 . 16 1 1 A 2 2 PRO C C -4 176.990 177.481 -0.491 1
1 12 . 16 1 1 A 2 2 PRO CA C -4 63.131 63.071 0.060 1
1 13 . 16 1 1 A 2 2 PRO CB C -4 32.342 32.399 -0.057 1
1 16 . 16 1 1 A 3 3 LEU H H -3 8.483 8.802 -0.319 1
1 17 . 16 1 1 A 3 3 LEU HA H -3 4.333 4.196 0.137 1
1 27 . 16 1 1 A 3 3 LEU C C -3 177.991 176.720 1.271 1
1 28 . 16 1 1 A 3 3 LEU CA C -3 55.314 56.370 -1.056 1
1 29 . 16 1 1 A 3 3 LEU CB C -3 42.244 43.645 -1.401 1
1 33 . 16 1 1 A 3 3 LEU N N -3 122.986 123.202 -0.216 1
1 34 . 16 1 1 A 4 4 GLY H H -2 8.397 7.852 0.545 1
1 35 . 16 1 1 A 4 4 GLY HA2 H -2 4.024 4.099 -0.075 1
1 36 . 16 1 1 A 4 4 GLY HA3 H -2 3.976 4.105 -0.129 1
1 37 . 16 1 1 A 4 4 GLY C C -2 174.360 173.004 1.356 1
1 38 . 16 1 1 A 4 4 GLY CA C -2 45.434 44.648 0.786 1
1 39 . 16 1 1 A 4 4 GLY N N -2 110.666 106.757 3.909 1
1 56 . 16 1 1 A 7 7 SER H H 141 7.913 7.835 0.078 1
1 57 . 16 1 1 A 7 7 SER HA H 141 5.657 5.107 0.550 1
1 60 . 16 1 1 A 7 7 SER C C 141 173.753 172.338 1.415 1
1 61 . 16 1 1 A 7 7 SER CA C 141 56.758 57.727 -0.969 1
1 62 . 16 1 1 A 7 7 SER CB C 141 66.774 65.789 0.985 1
1 63 . 16 1 1 A 7 7 SER N N 141 113.824 112.640 1.184 1
1 64 . 16 1 1 A 8 8 LYS H H 142 8.656 8.262 0.394 1
1 65 . 16 1 1 A 8 8 LYS HA H 142 4.543 5.083 -0.540 1
1 74 . 16 1 1 A 8 8 LYS C C 142 174.403 174.468 -0.065 1
1 75 . 16 1 1 A 8 8 LYS CA C 142 55.578 54.372 1.206 1
1 76 . 16 1 1 A 8 8 LYS CB C 142 36.561 36.038 0.523 1
1 80 . 16 1 1 A 8 8 LYS N N 142 123.076 119.308 3.768 1
1 81 . 16 1 1 A 9 9 LYS H H 143 8.623 8.198 0.425 1
1 82 . 16 1 1 A 9 9 LYS HA H 143 4.119 4.303 -0.184 1
1 91 . 16 1 1 A 9 9 LYS C C 143 176.144 175.499 0.645 1
1 92 . 16 1 1 A 9 9 LYS CA C 143 56.683 56.024 0.659 1
1 93 . 16 1 1 A 9 9 LYS CB C 143 32.580 32.581 -0.001 1
1 97 . 16 1 1 A 9 9 LYS N N 143 129.542 122.781 6.761 1
1 98 . 16 1 1 A 10 10 ALA H H 144 8.151 8.523 -0.372 1
1 99 . 16 1 1 A 10 10 ALA HA H 144 5.208 4.968 0.240 1
1 103 . 16 1 1 A 10 10 ALA C C 144 175.577 175.044 0.533 1
1 104 . 16 1 1 A 10 10 ALA CA C 144 51.226 51.156 0.070 1
1 105 . 16 1 1 A 10 10 ALA CB C 144 25.299 24.202 1.097 1
1 106 . 16 1 1 A 10 10 ALA N N 144 127.933 128.085 -0.152 1
1 107 . 16 1 1 A 11 11 SER H H 145 8.679 8.789 -0.110 1
1 108 . 16 1 1 A 11 11 SER HA H 145 5.431 5.720 -0.289 1
1 111 . 16 1 1 A 11 11 SER C C 145 173.072 173.212 -0.140 1
1 112 . 16 1 1 A 11 11 SER CA C 145 57.772 57.144 0.628 1
1 113 . 16 1 1 A 11 11 SER CB C 145 67.301 66.240 1.061 1
1 114 . 16 1 1 A 11 11 SER N N 145 116.245 115.180 1.065 1
1 115 . 16 1 1 A 12 12 HIS H H 146 9.962 9.530 0.432 1
1 116 . 16 1 1 A 12 12 HIS HA H 146 6.332 6.023 0.309 1
1 121 . 16 1 1 A 12 12 HIS C C 146 173.006 172.372 0.634 1
1 122 . 16 1 1 A 12 12 HIS CA C 146 55.020 54.342 0.678 1
1 123 . 16 1 1 A 12 12 HIS CB C 146 37.071 33.129 3.942 1
1 126 . 16 1 1 A 12 12 HIS N N 146 119.181 118.473 0.708 1
1 127 . 16 1 1 A 13 13 ILE H H 147 8.976 8.914 0.062 1
1 128 . 16 1 1 A 13 13 ILE HA H 147 3.528 4.535 -1.007 1
1 138 . 16 1 1 A 13 13 ILE C C 147 173.010 173.875 -0.865 1
1 139 . 16 1 1 A 13 13 ILE CA C 147 61.273 59.813 1.460 1
1 140 . 16 1 1 A 13 13 ILE CB C 147 41.773 42.146 -0.373 1
1 144 . 16 1 1 A 13 13 ILE N N 147 121.873 119.270 2.603 1
1 145 . 16 1 1 A 14 14 LEU H H 148 7.627 8.797 -1.170 1
1 146 . 16 1 1 A 14 14 LEU HA H 148 4.814 4.794 0.020 1
1 156 . 16 1 1 A 14 14 LEU C C 148 174.112 174.347 -0.235 1
1 157 . 16 1 1 A 14 14 LEU CA C 148 52.574 53.156 -0.582 1
1 158 . 16 1 1 A 14 14 LEU CB C 148 45.643 44.830 0.813 1
1 162 . 16 1 1 A 14 14 LEU N N 148 127.112 129.774 -2.662 1
1 163 . 16 1 1 A 15 15 ILE H H 149 9.524 9.335 0.189 1
1 164 . 16 1 1 A 15 15 ILE HA H 149 4.362 4.681 -0.319 1
1 174 . 16 1 1 A 15 15 ILE C C 149 175.452 175.387 0.065 1
1 175 . 16 1 1 A 15 15 ILE CA C 149 58.516 60.363 -1.847 1
1 176 . 16 1 1 A 15 15 ILE CB C 149 36.560 40.215 -3.655 1
1 180 . 16 1 1 A 15 15 ILE N N 149 128.652 126.724 1.928 1
1 181 . 16 1 1 A 16 16 LYS H H 150 8.035 8.306 -0.271 1
1 182 . 16 1 1 A 16 16 LYS HA H 150 4.319 4.457 -0.138 1
1 191 . 16 1 1 A 16 16 LYS C C 150 175.038 176.386 -1.348 1
1 192 . 16 1 1 A 16 16 LYS CA C 150 57.817 56.448 1.369 1
1 193 . 16 1 1 A 16 16 LYS CB C 150 34.853 32.913 1.940 1
1 197 . 16 1 1 A 16 16 LYS N N 150 129.153 127.899 1.254 1
1 198 . 16 1 1 A 17 17 VAL H H 151 8.016 8.897 -0.881 1
1 199 . 16 1 1 A 17 17 VAL HA H 151 4.873 4.876 -0.003 1
1 207 . 16 1 1 A 17 17 VAL C C 151 176.647 175.378 1.269 1
1 208 . 16 1 1 A 17 17 VAL CA C 151 60.088 61.330 -1.242 1
1 209 . 16 1 1 A 17 17 VAL CB C 151 34.082 33.130 0.952 1
1 212 . 16 1 1 A 17 17 VAL N N 151 121.288 125.148 -3.860 1
1 213 . 16 1 1 A 18 18 LYS H H 152 8.443 8.928 -0.485 1
1 214 . 16 1 1 A 18 18 LYS HA H 152 4.334 4.881 -0.547 1
1 223 . 16 1 1 A 18 18 LYS C C 152 176.345 176.094 0.251 1
1 224 . 16 1 1 A 18 18 LYS CA C 152 57.016 54.568 2.448 1
1 225 . 16 1 1 A 18 18 LYS CB C 152 33.222 35.968 -2.746 1
1 229 . 16 1 1 A 18 18 LYS N N 152 128.408 127.433 0.975 1
1 230 . 16 1 1 A 19 19 SER H H 153 9.067 8.481 0.586 1
1 231 . 16 1 1 A 19 19 SER HA H 153 4.457 4.496 -0.039 1
1 234 . 16 1 1 A 19 19 SER C C 153 174.236 174.799 -0.563 1
1 235 . 16 1 1 A 19 19 SER CA C 153 59.642 58.708 0.934 1
1 236 . 16 1 1 A 19 19 SER CB C 153 64.347 64.111 0.236 1
1 237 . 16 1 1 A 19 19 SER N N 153 121.522 116.107 5.415 1
1 238 . 16 1 1 A 20 20 LYS H H 154 7.961 7.599 0.362 1
1 239 . 16 1 1 A 20 20 LYS HA H 154 4.558 4.411 0.147 1
1 244 . 16 1 1 A 20 20 LYS C C 154 177.256 177.495 -0.239 1
1 245 . 16 1 1 A 20 20 LYS CA C 154 55.249 55.299 -0.050 1
1 246 . 16 1 1 A 20 20 LYS CB C 154 34.531 33.306 1.225 1
1 248 . 16 1 1 A 20 20 LYS N N 154 120.270 122.377 -2.107 1
1 249 . 16 1 1 A 21 21 LYS HA H 155 4.003 4.103 -0.100 1
1 258 . 16 1 1 A 21 21 LYS C C 155 177.015 177.478 -0.463 1
1 259 . 16 1 1 A 21 21 LYS CA C 155 59.091 58.823 0.268 1
1 260 . 16 1 1 A 21 21 LYS CB C 155 32.394 32.241 0.153 1
1 264 . 16 1 1 A 22 22 SER H H 156 7.625 7.776 -0.151 1
1 265 . 16 1 1 A 22 22 SER HA H 156 4.293 4.395 -0.102 1
1 268 . 16 1 1 A 22 22 SER C C 156 174.843 174.419 0.424 1
1 269 . 16 1 1 A 22 22 SER CA C 156 57.966 58.235 -0.269 1
1 270 . 16 1 1 A 22 22 SER CB C 156 63.369 63.739 -0.370 1
1 271 . 16 1 1 A 22 22 SER N N 156 109.549 111.106 -1.557 1
1 272 . 16 1 1 A 23 23 ASP H H 157 7.701 7.590 0.111 1
1 273 . 16 1 1 A 23 23 ASP HA H 157 4.548 4.510 0.038 1
1 276 . 16 1 1 A 23 23 ASP C C 157 176.544 176.098 0.446 1
1 277 . 16 1 1 A 23 23 ASP CA C 157 55.242 54.580 0.662 1
1 278 . 16 1 1 A 23 23 ASP CB C 157 41.103 40.936 0.167 1
1 279 . 16 1 1 A 23 23 ASP N N 157 124.536 123.418 1.118 1
1 280 . 16 1 1 A 24 24 LYS H H 158 8.583 8.745 -0.162 1
1 281 . 16 1 1 A 24 24 LYS HA H 158 4.252 4.611 -0.359 1
1 290 . 16 1 1 A 24 24 LYS C C 158 176.813 176.910 -0.097 1
1 291 . 16 1 1 A 24 24 LYS CA C 158 57.148 55.595 1.553 1
1 292 . 16 1 1 A 24 24 LYS CB C 158 33.200 33.256 -0.056 1
1 296 . 16 1 1 A 24 24 LYS N N 158 122.372 120.205 2.167 1
1 297 . 16 1 1 A 25 25 GLU H H 159 8.001 8.641 -0.640 1
1 298 . 16 1 1 A 25 25 GLU HA H 159 4.521 4.453 0.068 1
1 303 . 16 1 1 A 25 25 GLU C C 159 175.995 176.244 -0.249 1
1 304 . 16 1 1 A 25 25 GLU CA C 159 55.727 57.155 -1.428 1
1 305 . 16 1 1 A 25 25 GLU CB C 159 31.918 31.496 0.422 1
1 307 . 16 1 1 A 25 25 GLU N N 159 118.705 120.107 -1.402 1
1 308 . 16 1 1 A 26 26 GLY H H 160 8.458 7.892 0.566 1
1 309 . 16 1 1 A 26 26 GLY HA2 H 160 3.946 4.057 -0.111 1
1 310 . 16 1 1 A 26 26 GLY HA3 H 160 3.511 4.065 -0.554 1
1 311 . 16 1 1 A 26 26 GLY C C 160 172.201 172.111 0.090 1
1 312 . 16 1 1 A 26 26 GLY CA C 160 44.038 45.249 -1.211 1
1 313 . 16 1 1 A 26 26 GLY N N 160 107.642 106.840 0.802 1
1 314 . 16 1 1 A 27 27 LEU H H 161 8.259 8.425 -0.166 1
1 315 . 16 1 1 A 27 27 LEU HA H 161 4.775 5.186 -0.411 1
1 325 . 16 1 1 A 27 27 LEU C C 161 177.422 175.238 2.184 1
1 326 . 16 1 1 A 27 27 LEU CA C 161 53.322 53.266 0.056 1
1 327 . 16 1 1 A 27 27 LEU CB C 161 45.576 45.459 0.117 1
1 331 . 16 1 1 A 27 27 LEU N N 161 119.856 121.947 -2.091 1
1 332 . 16 1 1 A 28 28 ASP H H 162 8.848 8.748 0.100 1
1 333 . 16 1 1 A 28 28 ASP HA H 162 4.644 4.546 0.098 1
1 336 . 16 1 1 A 28 28 ASP C C 162 176.630 177.104 -0.474 1
1 337 . 16 1 1 A 28 28 ASP CA C 162 55.195 54.578 0.617 1
1 338 . 16 1 1 A 28 28 ASP CB C 162 41.673 42.771 -1.098 1
1 339 . 16 1 1 A 28 28 ASP N N 162 122.434 122.129 0.305 1
1 340 . 16 1 1 A 29 29 ASP H H 163 8.720 8.917 -0.197 1
1 341 . 16 1 1 A 29 29 ASP HA H 163 4.386 4.439 -0.053 1
1 344 . 16 1 1 A 29 29 ASP C C 163 176.604 178.609 -2.005 1
1 345 . 16 1 1 A 29 29 ASP CA C 163 59.690 57.944 1.746 1
1 346 . 16 1 1 A 29 29 ASP CB C 163 42.964 40.473 2.491 1
1 347 . 16 1 1 A 29 29 ASP N N 163 121.460 124.690 -3.230 1
1 348 . 16 1 1 A 30 30 LYS H H 164 8.434 7.768 0.666 1
1 349 . 16 1 1 A 30 30 LYS HA H 164 3.901 4.006 -0.105 1
1 358 . 16 1 1 A 30 30 LYS C C 164 179.479 179.201 0.278 1
1 359 . 16 1 1 A 30 30 LYS CA C 164 60.047 59.457 0.590 1
1 360 . 16 1 1 A 30 30 LYS CB C 164 32.038 32.260 -0.222 1
1 364 . 16 1 1 A 30 30 LYS N N 164 116.627 120.501 -3.874 1
1 365 . 16 1 1 A 31 31 GLU H H 165 7.755 8.271 -0.516 1
1 366 . 16 1 1 A 31 31 GLU HA H 165 3.998 4.006 -0.008 1
1 371 . 16 1 1 A 31 31 GLU C C 165 179.031 179.288 -0.257 1
1 372 . 16 1 1 A 31 31 GLU CA C 165 59.335 59.310 0.025 1
1 373 . 16 1 1 A 31 31 GLU CB C 165 29.972 29.324 0.648 1
1 375 . 16 1 1 A 31 31 GLU N N 165 120.456 119.887 0.569 1
1 376 . 16 1 1 A 32 32 ALA H H 166 9.060 8.654 0.406 1
1 377 . 16 1 1 A 32 32 ALA HA H 166 3.871 4.039 -0.168 1
1 381 . 16 1 1 A 32 32 ALA C C 166 178.029 179.096 -1.067 1
1 382 . 16 1 1 A 32 32 ALA CA C 166 54.997 55.507 -0.510 1
1 383 . 16 1 1 A 32 32 ALA CB C 166 19.727 18.417 1.310 1
1 384 . 16 1 1 A 32 32 ALA N N 166 124.406 122.339 2.067 1
1 385 . 16 1 1 A 33 33 LYS H H 167 8.228 7.883 0.345 1
1 386 . 16 1 1 A 33 33 LYS HA H 167 2.595 3.238 -0.643 1
1 395 . 16 1 1 A 33 33 LYS C C 167 177.938 178.047 -0.109 1
1 396 . 16 1 1 A 33 33 LYS CA C 167 59.573 59.364 0.209 1
1 397 . 16 1 1 A 33 33 LYS CB C 167 32.098 32.281 -0.183 1
1 401 . 16 1 1 A 33 33 LYS N N 167 119.833 118.496 1.337 1
1 402 . 16 1 1 A 34 34 GLN H H 168 7.392 7.867 -0.475 1
1 403 . 16 1 1 A 34 34 GLN HA H 168 3.943 3.923 0.020 1
1 410 . 16 1 1 A 34 34 GLN C C 168 178.323 178.478 -0.155 1
1 411 . 16 1 1 A 34 34 GLN CA C 168 58.883 59.366 -0.483 1
1 412 . 16 1 1 A 34 34 GLN CB C 168 28.485 28.145 0.340 1
1 414 . 16 1 1 A 34 34 GLN N N 168 117.208 117.869 -0.661 1
1 416 . 16 1 1 A 35 35 LYS H H 169 7.994 7.952 0.042 1
1 417 . 16 1 1 A 35 35 LYS HA H 169 4.067 4.016 0.051 1
1 426 . 16 1 1 A 35 35 LYS C C 169 178.161 178.582 -0.421 1
1 427 . 16 1 1 A 35 35 LYS CA C 169 58.437 59.182 -0.745 1
1 428 . 16 1 1 A 35 35 LYS CB C 169 31.611 32.181 -0.570 1
1 432 . 16 1 1 A 35 35 LYS N N 169 120.898 119.970 0.928 1
1 433 . 16 1 1 A 36 36 ALA H H 170 8.431 8.322 0.109 1
1 434 . 16 1 1 A 36 36 ALA HA H 170 3.738 4.028 -0.290 1
1 438 . 16 1 1 A 36 36 ALA C C 170 178.862 179.663 -0.801 1
1 439 . 16 1 1 A 36 36 ALA CA C 170 55.351 55.009 0.342 1
1 440 . 16 1 1 A 36 36 ALA CB C 170 18.295 18.377 -0.082 1
1 441 . 16 1 1 A 36 36 ALA N N 170 120.641 120.419 0.222 1
1 442 . 16 1 1 A 37 37 GLU H H 171 8.412 8.220 0.192 1
1 443 . 16 1 1 A 37 37 GLU HA H 171 3.867 3.935 -0.068 1
1 448 . 16 1 1 A 37 37 GLU C C 171 179.255 178.930 0.325 1
1 449 . 16 1 1 A 37 37 GLU CA C 171 59.543 59.641 -0.098 1
1 450 . 16 1 1 A 37 37 GLU CB C 171 29.569 29.495 0.074 1
1 452 . 16 1 1 A 37 37 GLU N N 171 118.224 117.832 0.392 1
1 453 . 16 1 1 A 38 38 GLU H H 172 8.019 8.201 -0.182 1
1 454 . 16 1 1 A 38 38 GLU HA H 172 3.952 4.067 -0.115 1
1 459 . 16 1 1 A 38 38 GLU C C 172 180.250 178.309 1.941 1
1 460 . 16 1 1 A 38 38 GLU CA C 172 59.627 59.209 0.418 1
1 461 . 16 1 1 A 38 38 GLU CB C 172 29.368 28.823 0.545 1
1 463 . 16 1 1 A 38 38 GLU N N 172 121.250 118.488 2.762 1
1 464 . 16 1 1 A 39 39 ILE H H 173 8.174 7.534 0.640 1
1 465 . 16 1 1 A 39 39 ILE HA H 173 3.643 3.795 -0.152 1
1 475 . 16 1 1 A 39 39 ILE C C 173 177.568 177.937 -0.369 1
1 476 . 16 1 1 A 39 39 ILE CA C 173 64.869 63.736 1.133 1
1 477 . 16 1 1 A 39 39 ILE CB C 173 38.160 37.370 0.790 1
1 481 . 16 1 1 A 39 39 ILE N N 173 121.527 117.455 4.072 1
1 482 . 16 1 1 A 40 40 GLN H H 174 8.860 8.277 0.583 1
1 483 . 16 1 1 A 40 40 GLN HA H 174 3.533 3.977 -0.444 1
1 490 . 16 1 1 A 40 40 GLN C C 174 179.022 178.556 0.466 1
1 491 . 16 1 1 A 40 40 GLN CA C 174 61.316 59.411 1.905 1
1 492 . 16 1 1 A 40 40 GLN CB C 174 26.604 28.418 -1.814 1
1 494 . 16 1 1 A 40 40 GLN N N 174 121.956 121.082 0.874 1
1 496 . 16 1 1 A 41 41 LYS H H 175 7.879 7.972 -0.093 1
1 497 . 16 1 1 A 41 41 LYS HA H 175 3.777 4.188 -0.411 1
1 506 . 16 1 1 A 41 41 LYS C C 175 178.779 177.545 1.234 1
1 507 . 16 1 1 A 41 41 LYS CA C 175 59.701 58.145 1.556 1
1 508 . 16 1 1 A 41 41 LYS CB C 175 32.581 31.937 0.644 1
1 512 . 16 1 1 A 41 41 LYS N N 175 119.012 118.386 0.626 1
1 513 . 16 1 1 A 42 42 GLU H H 176 7.447 7.871 -0.424 1
1 514 . 16 1 1 A 42 42 GLU HA H 176 4.059 4.317 -0.258 1
1 519 . 16 1 1 A 42 42 GLU C C 176 180.058 178.837 1.221 1
1 520 . 16 1 1 A 42 42 GLU CA C 176 59.456 58.266 1.190 1
1 521 . 16 1 1 A 42 42 GLU CB C 176 29.923 30.563 -0.640 1
1 523 . 16 1 1 A 42 42 GLU N N 176 120.054 118.578 1.476 1
1 524 . 16 1 1 A 43 43 VAL H H 177 8.618 8.206 0.412 1
1 525 . 16 1 1 A 43 43 VAL HA H 177 3.986 3.924 0.062 1
1 533 . 16 1 1 A 43 43 VAL C C 177 176.459 177.561 -1.102 1
1 534 . 16 1 1 A 43 43 VAL CA C 177 63.923 64.783 -0.860 1
1 535 . 16 1 1 A 43 43 VAL CB C 177 31.899 31.199 0.700 1
1 538 . 16 1 1 A 43 43 VAL N N 177 114.191 116.509 -2.318 1
1 539 . 16 1 1 A 44 44 SER H H 178 8.052 8.233 -0.181 1
1 540 . 16 1 1 A 44 44 SER HA H 178 4.098 4.309 -0.211 1
1 543 . 16 1 1 A 44 44 SER C C 178 176.548 176.046 0.502 1
1 544 . 16 1 1 A 44 44 SER CA C 178 61.160 61.183 -0.023 1
1 545 . 16 1 1 A 44 44 SER CB C 178 62.959 62.783 0.176 1
1 546 . 16 1 1 A 44 44 SER N N 178 114.202 115.977 -1.775 1
1 547 . 16 1 1 A 45 45 LYS H H 179 7.083 8.270 -1.187 1
1 548 . 16 1 1 A 45 45 LYS HA H 179 4.140 4.179 -0.039 1
1 557 . 16 1 1 A 45 45 LYS C C 179 177.288 176.411 0.877 1
1 558 . 16 1 1 A 45 45 LYS CA C 179 58.469 58.047 0.422 1
1 559 . 16 1 1 A 45 45 LYS CB C 179 32.671 31.718 0.953 1
1 563 . 16 1 1 A 45 45 LYS N N 179 120.935 117.651 3.284 1
1 564 . 16 1 1 A 46 46 ASP H H 180 7.098 7.326 -0.228 1
1 565 . 16 1 1 A 46 46 ASP HA H 180 4.917 5.095 -0.178 1
1 568 . 16 1 1 A 46 46 ASP CA C 180 51.492 51.273 0.219 1
1 569 . 16 1 1 A 46 46 ASP CB C 180 40.595 41.449 -0.854 1
1 570 . 16 1 1 A 46 46 ASP N N 180 112.836 120.106 -7.270 1
1 571 . 16 1 1 A 47 47 PRO HA H 181 4.681 4.494 0.187 1
1 578 . 16 1 1 A 47 47 PRO C C 181 179.248 177.946 1.302 1
1 579 . 16 1 1 A 47 47 PRO CA C 181 64.718 64.664 0.054 1
1 580 . 16 1 1 A 47 47 PRO CB C 181 32.159 32.041 0.118 1
1 583 . 16 1 1 A 48 48 SER H H 182 8.248 8.334 -0.086 1
1 584 . 16 1 1 A 48 48 SER HA H 182 4.378 4.266 0.112 1
1 587 . 16 1 1 A 48 48 SER C C 182 176.071 175.298 0.773 1
1 588 . 16 1 1 A 48 48 SER CA C 182 61.377 60.902 0.475 1
1 589 . 16 1 1 A 48 48 SER CB C 182 62.455 63.139 -0.684 1
1 590 . 16 1 1 A 48 48 SER N N 182 116.986 113.235 3.751 1
1 591 . 16 1 1 A 49 49 LYS H H 183 7.842 7.554 0.288 1
1 592 . 16 1 1 A 49 49 LYS HA H 183 4.482 4.380 0.102 1
1 601 . 16 1 1 A 49 49 LYS C C 183 175.605 177.553 -1.948 1
1 602 . 16 1 1 A 49 49 LYS CA C 183 55.824 55.797 0.027 1
1 603 . 16 1 1 A 49 49 LYS CB C 183 32.834 32.900 -0.066 1
1 607 . 16 1 1 A 49 49 LYS N N 183 121.698 118.265 3.433 1
1 608 . 16 1 1 A 50 50 PHE H H 184 7.634 7.648 -0.014 1
1 609 . 16 1 1 A 50 50 PHE HA H 184 3.510 4.189 -0.679 1
1 617 . 16 1 1 A 50 50 PHE C C 184 176.214 177.609 -1.395 1
1 618 . 16 1 1 A 50 50 PHE CA C 184 63.276 61.017 2.259 1
1 619 . 16 1 1 A 50 50 PHE CB C 184 40.948 39.023 1.925 1
1 623 . 16 1 1 A 50 50 PHE N N 184 120.120 121.551 -1.431 1
1 624 . 16 1 1 A 51 51 GLY H H 185 8.855 8.569 0.286 1
1 625 . 16 1 1 A 51 51 GLY HA2 H 185 3.993 3.879 0.114 1
1 626 . 16 1 1 A 51 51 GLY HA3 H 185 3.958 3.917 0.041 1
1 627 . 16 1 1 A 51 51 GLY C C 185 175.169 176.160 -0.991 1
1 628 . 16 1 1 A 51 51 GLY CA C 185 47.475 47.533 -0.058 1
1 629 . 16 1 1 A 51 51 GLY N N 185 105.550 106.331 -0.781 1
1 630 . 16 1 1 A 52 52 GLU H H 186 7.917 8.002 -0.085 1
1 631 . 16 1 1 A 52 52 GLU HA H 186 4.006 4.039 -0.033 1
1 636 . 16 1 1 A 52 52 GLU C C 186 179.499 179.556 -0.057 1
1 637 . 16 1 1 A 52 52 GLU CA C 186 58.904 59.220 -0.316 1
1 638 . 16 1 1 A 52 52 GLU CB C 186 29.700 29.894 -0.194 1
1 640 . 16 1 1 A 52 52 GLU N N 186 121.929 121.758 0.171 1
1 641 . 16 1 1 A 53 53 ILE H H 187 7.936 7.952 -0.016 1
1 642 . 16 1 1 A 53 53 ILE HA H 187 3.648 3.772 -0.124 1
1 652 . 16 1 1 A 53 53 ILE C C 187 177.886 177.947 -0.061 1
1 653 . 16 1 1 A 53 53 ILE CA C 187 64.366 64.229 0.137 1
1 654 . 16 1 1 A 53 53 ILE CB C 187 36.478 36.852 -0.374 1
1 658 . 16 1 1 A 53 53 ILE N N 187 120.991 121.175 -0.184 1
1 659 . 16 1 1 A 54 54 ALA H H 188 8.895 8.477 0.418 1
1 660 . 16 1 1 A 54 54 ALA HA H 188 3.629 3.790 -0.161 1
1 664 . 16 1 1 A 54 54 ALA C C 188 179.437 179.138 0.299 1
1 665 . 16 1 1 A 54 54 ALA CA C 188 55.974 55.542 0.432 1
1 666 . 16 1 1 A 54 54 ALA CB C 188 17.591 18.340 -0.749 1
1 667 . 16 1 1 A 54 54 ALA N N 188 125.308 121.886 3.422 1
1 668 . 16 1 1 A 55 55 LYS H H 189 8.049 7.668 0.381 1
1 669 . 16 1 1 A 55 55 LYS HA H 189 4.106 3.878 0.228 1
1 678 . 16 1 1 A 55 55 LYS C C 189 178.995 178.388 0.607 1
1 679 . 16 1 1 A 55 55 LYS CA C 189 59.312 59.282 0.030 1
1 680 . 16 1 1 A 55 55 LYS CB C 189 32.647 31.973 0.674 1
1 684 . 16 1 1 A 55 55 LYS N N 189 116.835 118.349 -1.514 1
1 685 . 16 1 1 A 56 56 LYS H H 190 7.215 7.829 -0.614 1
1 686 . 16 1 1 A 56 56 LYS HA H 190 4.172 4.231 -0.059 1
1 695 . 16 1 1 A 56 56 LYS C C 190 177.897 177.927 -0.030 1
1 696 . 16 1 1 A 56 56 LYS CA C 190 58.418 58.485 -0.067 1
1 697 . 16 1 1 A 56 56 LYS CB C 190 34.652 33.260 1.392 1
1 701 . 16 1 1 A 56 56 LYS N N 190 117.170 118.143 -0.973 1
1 702 . 16 1 1 A 57 57 GLU H H 191 8.572 7.928 0.644 1
1 703 . 16 1 1 A 57 57 GLU HA H 191 4.643 4.383 0.260 1
1 708 . 16 1 1 A 57 57 GLU C C 191 177.903 176.078 1.825 1
1 709 . 16 1 1 A 57 57 GLU CA C 191 55.708 55.830 -0.122 1
1 710 . 16 1 1 A 57 57 GLU CB C 191 32.460 31.011 1.449 1
1 712 . 16 1 1 A 57 57 GLU N N 191 113.316 116.692 -3.376 1
1 713 . 16 1 1 A 58 58 SER H H 192 8.550 7.745 0.805 1
1 714 . 16 1 1 A 58 58 SER HA H 192 4.149 4.387 -0.238 1
1 717 . 16 1 1 A 58 58 SER C C 192 176.161 175.247 0.914 1
1 718 . 16 1 1 A 58 58 SER CA C 192 58.403 58.207 0.196 1
1 719 . 16 1 1 A 58 58 SER CB C 192 64.392 64.283 0.109 1
1 720 . 16 1 1 A 58 58 SER N N 192 109.861 116.115 -6.254 1
1 721 . 16 1 1 A 59 59 MET H H 193 9.533 8.880 0.653 1
1 722 . 16 1 1 A 59 59 MET HA H 193 4.457 4.643 -0.186 1
1 730 . 16 1 1 A 59 59 MET C C 193 175.204 175.554 -0.350 1
1 731 . 16 1 1 A 59 59 MET CA C 193 55.781 54.639 1.142 1
1 732 . 16 1 1 A 59 59 MET CB C 193 32.855 32.209 0.646 1
1 735 . 16 1 1 A 59 59 MET N N 193 124.493 123.944 0.549 1
1 736 . 16 1 1 A 60 60 ASP H H 194 7.514 7.255 0.259 1
1 737 . 16 1 1 A 60 60 ASP HA H 194 4.886 4.628 0.258 1
1 740 . 16 1 1 A 60 60 ASP C C 194 175.517 176.793 -1.276 1
1 741 . 16 1 1 A 60 60 ASP CA C 194 52.286 52.953 -0.667 1
1 742 . 16 1 1 A 60 60 ASP CB C 194 40.222 41.429 -1.207 1
1 743 . 16 1 1 A 60 60 ASP N N 194 117.785 122.266 -4.481 1
1 744 . 16 1 1 A 61 61 THR H H 195 8.118 8.441 -0.323 1
1 745 . 16 1 1 A 61 61 THR HA H 195 3.918 3.941 -0.023 1
1 750 . 16 1 1 A 61 61 THR C C 195 176.269 177.055 -0.786 1
1 751 . 16 1 1 A 61 61 THR CA C 195 65.469 65.074 0.395 1
1 752 . 16 1 1 A 61 61 THR CB C 195 68.741 68.368 0.373 1
1 754 . 16 1 1 A 61 61 THR N N 195 120.765 118.400 2.365 1
1 755 . 16 1 1 A 62 62 GLY H H 196 8.399 8.494 -0.095 1
1 756 . 16 1 1 A 62 62 GLY HA2 H 196 3.932 3.822 0.110 1
1 757 . 16 1 1 A 62 62 GLY HA3 H 196 3.900 3.822 0.078 1
1 758 . 16 1 1 A 62 62 GLY C C 196 174.948 176.543 -1.595 1
1 759 . 16 1 1 A 62 62 GLY CA C 196 46.768 47.629 -0.861 1
1 760 . 16 1 1 A 62 62 GLY N N 196 108.183 111.307 -3.124 1
1 761 . 16 1 1 A 63 63 SER H H 197 7.265 8.237 -0.972 1
1 762 . 16 1 1 A 63 63 SER HA H 197 4.554 4.399 0.155 1
1 765 . 16 1 1 A 63 63 SER C C 197 177.630 175.932 1.698 1
1 766 . 16 1 1 A 63 63 SER CA C 197 59.550 62.390 -2.840 1
1 767 . 16 1 1 A 63 63 SER CB C 197 65.504 63.405 2.099 1
1 768 . 16 1 1 A 63 63 SER N N 197 111.815 119.285 -7.470 1
1 769 . 16 1 1 A 64 64 ALA H H 198 8.675 8.363 0.312 1
1 770 . 16 1 1 A 64 64 ALA HA H 198 3.801 3.961 -0.160 1
1 774 . 16 1 1 A 64 64 ALA C C 198 178.492 179.452 -0.960 1
1 775 . 16 1 1 A 64 64 ALA CA C 198 56.794 55.373 1.421 1
1 776 . 16 1 1 A 64 64 ALA CB C 198 18.951 18.638 0.313 1
1 777 . 16 1 1 A 64 64 ALA N N 198 131.710 123.547 8.163 1
1 778 . 16 1 1 A 65 65 LYS H H 199 7.666 7.592 0.074 1
1 779 . 16 1 1 A 65 65 LYS HA H 199 4.175 4.009 0.166 1
1 788 . 16 1 1 A 65 65 LYS C C 199 177.159 177.890 -0.731 1
1 789 . 16 1 1 A 65 65 LYS CA C 199 57.735 58.964 -1.229 1
1 790 . 16 1 1 A 65 65 LYS CB C 199 31.948 31.846 0.102 1
1 794 . 16 1 1 A 65 65 LYS N N 199 111.375 118.300 -6.925 1
1 795 . 16 1 1 A 66 66 LYS H H 200 7.545 7.357 0.188 1
1 796 . 16 1 1 A 66 66 LYS HA H 200 4.612 4.414 0.198 1
1 805 . 16 1 1 A 66 66 LYS C C 200 175.609 175.222 0.387 1
1 806 . 16 1 1 A 66 66 LYS CA C 200 54.468 56.180 -1.712 1
1 807 . 16 1 1 A 66 66 LYS CB C 200 31.525 32.298 -0.773 1
1 811 . 16 1 1 A 66 66 LYS N N 200 121.421 116.201 5.220 1
1 812 . 16 1 1 A 67 67 ASP H H 201 7.630 8.240 -0.610 1
1 813 . 16 1 1 A 67 67 ASP HA H 201 4.306 4.367 -0.061 1
1 816 . 16 1 1 A 67 67 ASP C C 201 175.025 176.318 -1.293 1
1 817 . 16 1 1 A 67 67 ASP CA C 201 56.400 55.356 1.044 1
1 818 . 16 1 1 A 67 67 ASP CB C 201 38.315 39.056 -0.741 1
1 819 . 16 1 1 A 67 67 ASP N N 201 116.216 117.001 -0.785 1
1 820 . 16 1 1 A 68 68 GLY H H 202 8.368 8.521 -0.153 1
1 821 . 16 1 1 A 68 68 GLY HA2 H 202 4.316 3.921 0.395 1
1 822 . 16 1 1 A 68 68 GLY HA3 H 202 3.731 3.994 -0.263 1
1 823 . 16 1 1 A 68 68 GLY C C 202 174.139 174.620 -0.481 1
1 824 . 16 1 1 A 68 68 GLY CA C 202 45.514 45.257 0.257 1
1 825 . 16 1 1 A 68 68 GLY N N 202 105.095 104.854 0.241 1
1 826 . 16 1 1 A 69 69 GLU H H 203 7.534 8.055 -0.521 1
1 827 . 16 1 1 A 69 69 GLU HA H 203 4.479 4.451 0.028 1
1 832 . 16 1 1 A 69 69 GLU C C 203 176.961 176.272 0.689 1
1 833 . 16 1 1 A 69 69 GLU CA C 203 58.549 56.366 2.183 1
1 834 . 16 1 1 A 69 69 GLU CB C 203 30.998 30.630 0.368 1
1 836 . 16 1 1 A 69 69 GLU N N 203 120.426 120.163 0.263 1
1 837 . 16 1 1 A 70 70 LEU H H 204 8.962 9.106 -0.144 1
1 838 . 16 1 1 A 70 70 LEU HA H 204 4.438 4.655 -0.217 1
1 848 . 16 1 1 A 70 70 LEU C C 204 178.648 177.254 1.394 1
1 849 . 16 1 1 A 70 70 LEU CA C 204 53.977 54.763 -0.786 1
1 850 . 16 1 1 A 70 70 LEU CB C 204 43.612 43.648 -0.036 1
1 854 . 16 1 1 A 70 70 LEU N N 204 122.066 123.851 -1.785 1
1 855 . 16 1 1 A 71 71 GLY H H 205 8.104 7.490 0.614 1
1 856 . 16 1 1 A 71 71 GLY HA2 H 205 4.165 4.074 0.091 1
1 857 . 16 1 1 A 71 71 GLY HA3 H 205 3.552 4.144 -0.592 1
1 858 . 16 1 1 A 71 71 GLY C C 205 173.098 173.317 -0.219 1
1 859 . 16 1 1 A 71 71 GLY CA C 205 44.723 44.922 -0.199 1
1 860 . 16 1 1 A 71 71 GLY N N 205 110.168 106.709 3.459 1
1 861 . 16 1 1 A 72 72 TYR H H 206 8.457 8.615 -0.158 1
1 862 . 16 1 1 A 72 72 TYR HA H 206 4.184 4.847 -0.663 1
1 869 . 16 1 1 A 72 72 TYR C C 206 175.975 175.520 0.455 1
1 870 . 16 1 1 A 72 72 TYR CA C 206 59.722 58.964 0.758 1
1 871 . 16 1 1 A 72 72 TYR CB C 206 38.378 38.574 -0.196 1
1 874 . 16 1 1 A 72 72 TYR N N 206 120.171 122.046 -1.875 1
1 875 . 16 1 1 A 73 73 VAL H H 207 8.782 9.100 -0.318 1
1 876 . 16 1 1 A 73 73 VAL HA H 207 4.056 4.564 -0.508 1
1 884 . 16 1 1 A 73 73 VAL C C 207 174.901 175.535 -0.634 1
1 885 . 16 1 1 A 73 73 VAL CA C 207 62.202 62.173 0.029 1
1 886 . 16 1 1 A 73 73 VAL CB C 207 33.071 32.673 0.398 1
1 889 . 16 1 1 A 73 73 VAL N N 207 128.847 124.370 4.477 1
1 890 . 16 1 1 A 74 74 LEU H H 208 8.146 8.921 -0.775 1
1 891 . 16 1 1 A 74 74 LEU HA H 208 4.944 4.690 0.254 1
1 901 . 16 1 1 A 74 74 LEU C C 208 178.400 177.516 0.884 1
1 902 . 16 1 1 A 74 74 LEU CA C 208 53.520 54.194 -0.674 1
1 903 . 16 1 1 A 74 74 LEU CB C 208 43.499 42.319 1.180 1
1 907 . 16 1 1 A 74 74 LEU N N 208 127.599 129.334 -1.735 1
1 908 . 16 1 1 A 75 75 LYS H H 209 8.403 8.761 -0.358 1
1 909 . 16 1 1 A 75 75 LYS HA H 209 3.771 3.805 -0.034 1
1 918 . 16 1 1 A 75 75 LYS C C 209 177.536 177.462 0.074 1
1 919 . 16 1 1 A 75 75 LYS CA C 209 58.385 58.818 -0.433 1
1 920 . 16 1 1 A 75 75 LYS CB C 209 32.459 32.065 0.394 1
1 924 . 16 1 1 A 75 75 LYS N N 209 123.798 122.407 1.391 1
1 925 . 16 1 1 A 76 76 GLY H H 210 9.997 9.432 0.565 1
1 926 . 16 1 1 A 76 76 GLY HA2 H 210 4.255 4.001 0.254 1
1 927 . 16 1 1 A 76 76 GLY HA3 H 210 3.791 4.005 -0.214 1
1 928 . 16 1 1 A 76 76 GLY C C 210 175.091 175.473 -0.382 1
1 929 . 16 1 1 A 76 76 GLY CA C 210 45.465 45.563 -0.098 1
1 930 . 16 1 1 A 76 76 GLY N N 210 114.705 113.240 1.465 1
1 931 . 16 1 1 A 77 77 GLN H H 211 7.726 7.938 -0.212 1
1 932 . 16 1 1 A 77 77 GLN HA H 211 4.373 4.213 0.160 1
1 939 . 16 1 1 A 77 77 GLN C C 211 176.301 176.040 0.261 1
1 940 . 16 1 1 A 77 77 GLN CA C 211 57.074 57.107 -0.033 1
1 941 . 16 1 1 A 77 77 GLN CB C 211 30.798 29.272 1.526 1
1 943 . 16 1 1 A 77 77 GLN N N 211 118.702 118.142 0.560 1
1 945 . 16 1 1 A 78 78 THR H H 212 8.225 7.479 0.746 1
1 946 . 16 1 1 A 78 78 THR HA H 212 4.620 4.642 -0.022 1
1 951 . 16 1 1 A 78 78 THR C C 212 173.920 173.907 0.013 1
1 952 . 16 1 1 A 78 78 THR CA C 212 60.087 59.261 0.826 1
1 953 . 16 1 1 A 78 78 THR CB C 212 71.412 71.079 0.333 1
1 955 . 16 1 1 A 78 78 THR N N 212 111.935 110.221 1.714 1
1 956 . 16 1 1 A 79 79 ASP H H 213 8.372 8.438 -0.066 1
1 957 . 16 1 1 A 79 79 ASP HA H 213 4.470 4.519 -0.049 1
1 960 . 16 1 1 A 79 79 ASP C C 213 176.759 177.694 -0.935 1
1 961 . 16 1 1 A 79 79 ASP CA C 213 54.927 54.282 0.645 1
1 962 . 16 1 1 A 79 79 ASP CB C 213 43.859 41.437 2.422 1
1 963 . 16 1 1 A 79 79 ASP N N 213 122.093 121.336 0.757 1
1 964 . 16 1 1 A 80 80 LYS H H 214 8.740 8.937 -0.197 1
1 965 . 16 1 1 A 80 80 LYS HA H 214 4.027 3.905 0.122 1
1 974 . 16 1 1 A 80 80 LYS C C 214 178.493 178.271 0.222 1
1 975 . 16 1 1 A 80 80 LYS CA C 214 59.802 59.870 -0.068 1
1 976 . 16 1 1 A 80 80 LYS CB C 214 32.374 32.250 0.124 1
1 980 . 16 1 1 A 80 80 LYS N N 214 124.685 123.275 1.410 1
1 981 . 16 1 1 A 81 81 ASP H H 215 8.556 8.293 0.263 1
1 982 . 16 1 1 A 81 81 ASP HA H 215 4.566 4.384 0.182 1
1 985 . 16 1 1 A 81 81 ASP C C 215 178.889 178.818 0.071 1
1 986 . 16 1 1 A 81 81 ASP CA C 215 58.046 57.410 0.636 1
1 987 . 16 1 1 A 81 81 ASP CB C 215 40.872 40.391 0.481 1
1 988 . 16 1 1 A 81 81 ASP N N 215 121.413 119.716 1.697 1
1 989 . 16 1 1 A 82 82 PHE H H 216 8.205 8.350 -0.145 1
1 990 . 16 1 1 A 82 82 PHE HA H 216 3.686 4.069 -0.383 1
1 998 . 16 1 1 A 82 82 PHE C C 216 175.919 177.322 -1.403 1
1 999 . 16 1 1 A 82 82 PHE CA C 216 61.648 61.010 0.638 1
1 1000 . 16 1 1 A 82 82 PHE CB C 216 39.743 39.219 0.524 1
1 1004 . 16 1 1 A 82 82 PHE N N 216 124.401 122.800 1.601 1
1 1005 . 16 1 1 A 83 83 GLU H H 217 8.887 8.830 0.057 1
1 1006 . 16 1 1 A 83 83 GLU HA H 217 3.704 4.202 -0.498 1
1 1011 . 16 1 1 A 83 83 GLU C C 217 177.788 179.307 -1.519 1
1 1012 . 16 1 1 A 83 83 GLU CA C 217 60.545 60.231 0.314 1
1 1013 . 16 1 1 A 83 83 GLU CB C 217 30.639 29.505 1.134 1
1 1015 . 16 1 1 A 83 83 GLU N N 217 119.421 118.974 0.447 1
1 1016 . 16 1 1 A 84 84 LYS H H 218 8.055 7.940 0.115 1
1 1017 . 16 1 1 A 84 84 LYS HA H 218 3.947 4.149 -0.202 1
1 1026 . 16 1 1 A 84 84 LYS C C 218 178.783 178.367 0.416 1
1 1027 . 16 1 1 A 84 84 LYS CA C 218 59.327 58.546 0.781 1
1 1028 . 16 1 1 A 84 84 LYS CB C 218 32.539 32.205 0.334 1
1 1032 . 16 1 1 A 84 84 LYS N N 218 117.821 119.442 -1.621 1
1 1033 . 16 1 1 A 85 85 ALA H H 219 7.059 7.684 -0.625 1
1 1034 . 16 1 1 A 85 85 ALA HA H 219 4.040 4.103 -0.063 1
1 1038 . 16 1 1 A 85 85 ALA C C 219 179.794 179.956 -0.162 1
1 1039 . 16 1 1 A 85 85 ALA CA C 219 54.407 54.945 -0.538 1
1 1040 . 16 1 1 A 85 85 ALA CB C 219 20.130 18.480 1.650 1
1 1041 . 16 1 1 A 85 85 ALA N N 219 118.905 122.293 -3.388 1
1 1042 . 16 1 1 A 86 86 LEU H H 220 8.157 8.314 -0.157 1
1 1043 . 16 1 1 A 86 86 LEU HA H 220 3.692 3.987 -0.295 1
1 1053 . 16 1 1 A 86 86 LEU C C 220 178.330 178.534 -0.204 1
1 1054 . 16 1 1 A 86 86 LEU CA C 220 57.752 58.125 -0.373 1
1 1055 . 16 1 1 A 86 86 LEU CB C 220 41.464 41.721 -0.257 1
1 1059 . 16 1 1 A 86 86 LEU N N 220 118.606 120.233 -1.627 1
1 1060 . 16 1 1 A 87 87 PHE H H 221 8.349 8.172 0.177 1
1 1061 . 16 1 1 A 87 87 PHE HA H 221 3.861 4.387 -0.526 1
1 1069 . 16 1 1 A 87 87 PHE C C 221 176.176 178.006 -1.830 1
1 1070 . 16 1 1 A 87 87 PHE CA C 221 61.780 61.804 -0.024 1
1 1071 . 16 1 1 A 87 87 PHE CB C 221 37.549 37.936 -0.387 1
1 1075 . 16 1 1 A 87 87 PHE N N 221 112.449 116.581 -4.132 1
1 1076 . 16 1 1 A 88 88 LYS H H 222 7.061 7.842 -0.781 1
1 1077 . 16 1 1 A 88 88 LYS HA H 222 4.380 4.127 0.253 1
1 1086 . 16 1 1 A 88 88 LYS C C 222 177.089 177.228 -0.139 1
1 1087 . 16 1 1 A 88 88 LYS CA C 222 56.726 58.472 -1.746 1
1 1088 . 16 1 1 A 88 88 LYS CB C 222 33.738 32.286 1.452 1
1 1092 . 16 1 1 A 88 88 LYS N N 222 118.308 120.714 -2.406 1
1 1093 . 16 1 1 A 89 89 LEU H H 223 7.270 7.079 0.191 1
1 1094 . 16 1 1 A 89 89 LEU HA H 223 4.168 4.101 0.067 1
1 1104 . 16 1 1 A 89 89 LEU C C 223 177.528 177.172 0.356 1
1 1105 . 16 1 1 A 89 89 LEU CA C 223 55.279 55.330 -0.051 1
1 1106 . 16 1 1 A 89 89 LEU CB C 223 43.240 42.105 1.135 1
1 1110 . 16 1 1 A 89 89 LEU N N 223 121.317 122.124 -0.807 1
1 1111 . 16 1 1 A 90 90 LYS H H 224 8.788 8.512 0.276 1
1 1112 . 16 1 1 A 90 90 LYS HA H 224 4.359 4.277 0.082 1
1 1121 . 16 1 1 A 90 90 LYS C C 224 175.839 175.612 0.227 1
1 1122 . 16 1 1 A 90 90 LYS CA C 224 54.772 55.964 -1.192 1
1 1123 . 16 1 1 A 90 90 LYS CB C 224 33.232 33.175 0.057 1
1 1127 . 16 1 1 A 90 90 LYS N N 224 123.558 122.750 0.808 1
1 1128 . 16 1 1 A 91 91 ASP H H 225 8.125 8.614 -0.489 1
1 1129 . 16 1 1 A 91 91 ASP HA H 225 3.958 4.382 -0.424 1
1 1132 . 16 1 1 A 91 91 ASP C C 225 177.452 176.636 0.816 1
1 1133 . 16 1 1 A 91 91 ASP CA C 225 56.642 55.521 1.121 1
1 1134 . 16 1 1 A 91 91 ASP CB C 225 40.269 40.197 0.072 1
1 1135 . 16 1 1 A 91 91 ASP N N 225 119.419 121.368 -1.949 1
1 1136 . 16 1 1 A 92 92 GLY H H 226 8.681 8.282 0.399 1
1 1137 . 16 1 1 A 92 92 GLY HA2 H 226 4.131 3.872 0.259 1
1 1138 . 16 1 1 A 92 92 GLY HA3 H 226 3.579 3.899 -0.320 1
1 1139 . 16 1 1 A 92 92 GLY C C 226 173.614 173.848 -0.234 1
1 1140 . 16 1 1 A 92 92 GLY CA C 226 45.564 45.256 0.308 1
1 1141 . 16 1 1 A 92 92 GLY N N 226 113.802 111.948 1.854 1
1 1142 . 16 1 1 A 93 93 GLU H H 227 8.104 7.982 0.122 1
1 1143 . 16 1 1 A 93 93 GLU HA H 227 4.232 4.416 -0.184 1
1 1148 . 16 1 1 A 93 93 GLU C C 227 174.282 175.664 -1.382 1
1 1149 . 16 1 1 A 93 93 GLU CA C 227 56.651 56.163 0.488 1
1 1150 . 16 1 1 A 93 93 GLU CB C 227 32.190 30.977 1.213 1
1 1152 . 16 1 1 A 93 93 GLU N N 227 121.527 121.840 -0.313 1
1 1153 . 16 1 1 A 94 94 VAL H H 228 7.918 8.476 -0.558 1
1 1154 . 16 1 1 A 94 94 VAL HA H 228 4.857 4.753 0.104 1
1 1162 . 16 1 1 A 94 94 VAL C C 228 176.556 175.693 0.863 1
1 1163 . 16 1 1 A 94 94 VAL CA C 228 60.309 60.400 -0.091 1
1 1164 . 16 1 1 A 94 94 VAL CB C 228 33.847 35.182 -1.335 1
1 1167 . 16 1 1 A 94 94 VAL N N 228 119.768 125.955 -6.187 1
1 1168 . 16 1 1 A 95 95 SER H H 229 9.659 9.401 0.258 1
1 1169 . 16 1 1 A 95 95 SER HA H 229 4.313 4.703 -0.390 1
1 1172 . 16 1 1 A 95 95 SER C C 229 174.641 174.392 0.249 1
1 1173 . 16 1 1 A 95 95 SER CA C 229 59.208 57.911 1.297 1
1 1174 . 16 1 1 A 95 95 SER CB C 229 66.080 65.700 0.380 1
1 1175 . 16 1 1 A 95 95 SER N N 229 124.903 121.431 3.472 1
1 1176 . 16 1 1 A 96 96 GLU H H 230 8.014 8.583 -0.569 1
1 1177 . 16 1 1 A 96 96 GLU HA H 230 4.376 4.468 -0.092 1
1 1182 . 16 1 1 A 96 96 GLU C C 230 176.641 177.203 -0.562 1
1 1183 . 16 1 1 A 96 96 GLU CA C 230 56.236 56.254 -0.018 1
1 1184 . 16 1 1 A 96 96 GLU CB C 230 30.324 30.853 -0.529 1
1 1186 . 16 1 1 A 96 96 GLU N N 230 115.510 120.894 -5.384 1
1 1187 . 16 1 1 A 97 97 VAL H H 231 8.741 8.419 0.322 1
1 1188 . 16 1 1 A 97 97 VAL HA H 231 4.171 4.178 -0.007 1
1 1196 . 16 1 1 A 97 97 VAL C C 231 176.684 175.571 1.113 1
1 1197 . 16 1 1 A 97 97 VAL CA C 231 65.418 63.155 2.263 1
1 1198 . 16 1 1 A 97 97 VAL CB C 231 31.218 31.476 -0.258 1
1 1201 . 16 1 1 A 97 97 VAL N N 231 121.289 121.497 -0.208 1
1 1202 . 16 1 1 A 98 98 VAL H H 232 9.218 9.503 -0.285 1
1 1203 . 16 1 1 A 98 98 VAL HA H 232 4.405 4.644 -0.239 1
1 1211 . 16 1 1 A 98 98 VAL C C 232 174.258 174.461 -0.203 1
1 1212 . 16 1 1 A 98 98 VAL CA C 232 60.937 61.237 -0.300 1
1 1213 . 16 1 1 A 98 98 VAL CB C 232 35.825 33.931 1.894 1
1 1216 . 16 1 1 A 98 98 VAL N N 232 130.544 129.123 1.421 1
1 1217 . 16 1 1 A 99 99 LYS H H 233 8.800 9.017 -0.217 1
1 1218 . 16 1 1 A 99 99 LYS HA H 233 4.853 5.120 -0.267 1
1 1227 . 16 1 1 A 99 99 LYS C C 233 175.274 175.215 0.059 1
1 1228 . 16 1 1 A 99 99 LYS CA C 233 55.499 55.441 0.058 1
1 1229 . 16 1 1 A 99 99 LYS CB C 233 34.452 33.731 0.721 1
1 1233 . 16 1 1 A 99 99 LYS N N 233 130.477 128.694 1.783 1
1 1234 . 16 1 1 A 100 100 SER H H 234 9.585 9.036 0.549 1
1 1235 . 16 1 1 A 100 100 SER HA H 234 5.150 4.899 0.251 1
1 1238 . 16 1 1 A 100 100 SER C C 234 175.493 174.157 1.336 1
1 1239 . 16 1 1 A 100 100 SER CA C 234 56.927 57.341 -0.414 1
1 1240 . 16 1 1 A 100 100 SER CB C 234 67.309 67.167 0.142 1
1 1241 . 16 1 1 A 100 100 SER N N 234 125.814 123.279 2.535 1
1 1242 . 16 1 1 A 101 101 SER H H 235 8.631 8.723 -0.092 1
1 1243 . 16 1 1 A 101 101 SER HA H 235 4.106 4.078 0.028 1
1 1246 . 16 1 1 A 101 101 SER C C 235 175.385 174.968 0.417 1
1 1247 . 16 1 1 A 101 101 SER CA C 235 61.123 61.510 -0.387 1
1 1248 . 16 1 1 A 101 101 SER CB C 235 62.818 62.552 0.266 1
1 1249 . 16 1 1 A 101 101 SER N N 235 115.089 116.856 -1.767 1
1 1250 . 16 1 1 A 102 102 PHE H H 236 8.957 7.709 1.248 1
1 1251 . 16 1 1 A 102 102 PHE HA H 236 4.610 4.639 -0.029 1
1 1259 . 16 1 1 A 102 102 PHE C C 236 176.453 175.613 0.840 1
1 1260 . 16 1 1 A 102 102 PHE CA C 236 58.382 57.993 0.389 1
1 1261 . 16 1 1 A 102 102 PHE CB C 236 40.275 39.797 0.478 1
1 1263 . 16 1 1 A 102 102 PHE N N 236 119.917 116.951 2.966 1
1 1264 . 16 1 1 A 103 103 GLY H H 237 7.377 7.214 0.163 1
1 1265 . 16 1 1 A 103 103 GLY HA2 H 237 4.453 3.897 0.556 1
1 1266 . 16 1 1 A 103 103 GLY HA3 H 237 3.472 4.063 -0.591 1
1 1267 . 16 1 1 A 103 103 GLY C C 237 169.627 172.429 -2.802 1
1 1268 . 16 1 1 A 103 103 GLY CA C 237 45.384 44.565 0.819 1
1 1269 . 16 1 1 A 103 103 GLY N N 237 108.809 106.739 2.070 1
1 1270 . 16 1 1 A 104 104 TYR H H 238 8.632 8.419 0.213 1
1 1271 . 16 1 1 A 104 104 TYR HA H 238 5.322 5.434 -0.112 1
1 1278 . 16 1 1 A 104 104 TYR C C 238 175.043 175.191 -0.148 1
1 1279 . 16 1 1 A 104 104 TYR CA C 238 57.627 57.109 0.518 1
1 1280 . 16 1 1 A 104 104 TYR CB C 238 41.711 41.615 0.096 1
1 1283 . 16 1 1 A 104 104 TYR N N 238 120.030 121.907 -1.877 1
1 1284 . 16 1 1 A 105 105 HIS H H 239 10.070 9.488 0.582 1
1 1285 . 16 1 1 A 105 105 HIS HA H 239 6.046 5.616 0.430 1
1 1290 . 16 1 1 A 105 105 HIS C C 239 175.734 174.711 1.023 1
1 1291 . 16 1 1 A 105 105 HIS CA C 239 53.945 54.543 -0.598 1
1 1292 . 16 1 1 A 105 105 HIS CB C 239 32.450 34.137 -1.687 1
1 1295 . 16 1 1 A 105 105 HIS N N 239 119.504 118.530 0.974 1
1 1296 . 16 1 1 A 106 106 ILE H H 240 8.660 9.037 -0.377 1
1 1297 . 16 1 1 A 106 106 ILE HA H 240 4.120 4.889 -0.769 1
1 1307 . 16 1 1 A 106 106 ILE C C 240 174.758 175.278 -0.520 1
1 1308 . 16 1 1 A 106 106 ILE CA C 240 63.446 59.897 3.549 1
1 1309 . 16 1 1 A 106 106 ILE CB C 240 40.786 41.248 -0.462 1
1 1313 . 16 1 1 A 106 106 ILE N N 240 120.639 120.687 -0.048 1
1 1314 . 16 1 1 A 107 107 ILE H H 241 9.033 9.229 -0.196 1
1 1315 . 16 1 1 A 107 107 ILE HA H 241 4.799 5.121 -0.322 1
1 1325 . 16 1 1 A 107 107 ILE C C 241 172.880 173.933 -1.053 1
1 1326 . 16 1 1 A 107 107 ILE CA C 241 60.563 59.615 0.948 1
1 1327 . 16 1 1 A 107 107 ILE CB C 241 41.652 40.786 0.866 1
1 1331 . 16 1 1 A 107 107 ILE N N 241 129.098 127.185 1.913 1
1 1332 . 16 1 1 A 108 108 LYS H H 242 8.692 9.080 -0.388 1
1 1333 . 16 1 1 A 108 108 LYS HA H 242 5.012 4.954 0.058 1
1 1342 . 16 1 1 A 108 108 LYS C C 242 174.484 175.837 -1.353 1
1 1343 . 16 1 1 A 108 108 LYS CA C 242 54.317 53.951 0.366 1
1 1344 . 16 1 1 A 108 108 LYS CB C 242 35.619 35.326 0.293 1
1 1348 . 16 1 1 A 108 108 LYS N N 242 127.179 128.038 -0.859 1
1 1349 . 16 1 1 A 109 109 ALA H H 243 7.816 9.138 -1.322 1
1 1350 . 16 1 1 A 109 109 ALA HA H 243 4.604 4.638 -0.034 1
1 1354 . 16 1 1 A 109 109 ALA C C 243 176.231 176.455 -0.224 1
1 1355 . 16 1 1 A 109 109 ALA CA C 243 50.505 50.918 -0.413 1
1 1356 . 16 1 1 A 109 109 ALA CB C 243 19.584 20.099 -0.515 1
1 1357 . 16 1 1 A 109 109 ALA N N 243 129.619 128.777 0.842 1
1 1358 . 16 1 1 A 110 110 ASP H H 244 7.578 8.617 -1.039 1
1 1359 . 16 1 1 A 110 110 ASP HA H 244 4.424 4.877 -0.453 1
1 1362 . 16 1 1 A 110 110 ASP C C 244 175.259 174.901 0.358 1
1 1363 . 16 1 1 A 110 110 ASP CA C 244 54.489 51.736 2.753 1
1 1364 . 16 1 1 A 110 110 ASP CB C 244 42.693 43.449 -0.756 1
1 1365 . 16 1 1 A 110 110 ASP N N 244 125.434 121.465 3.969 1
1 4 . 17 1 1 A 2 2 PRO HA H -4 4.403 4.333 0.070 1
1 11 . 17 1 1 A 2 2 PRO C C -4 176.990 177.933 -0.943 1
1 12 . 17 1 1 A 2 2 PRO CA C -4 63.131 65.204 -2.073 1
1 13 . 17 1 1 A 2 2 PRO CB C -4 32.342 31.565 0.777 1
1 16 . 17 1 1 A 3 3 LEU H H -3 8.483 8.159 0.324 1
1 17 . 17 1 1 A 3 3 LEU HA H -3 4.333 4.327 0.006 1
1 27 . 17 1 1 A 3 3 LEU C C -3 177.991 177.229 0.762 1
1 28 . 17 1 1 A 3 3 LEU CA C -3 55.314 55.361 -0.047 1
1 29 . 17 1 1 A 3 3 LEU CB C -3 42.244 41.786 0.458 1
1 33 . 17 1 1 A 3 3 LEU N N -3 122.986 116.871 6.115 1
1 34 . 17 1 1 A 4 4 GLY H H -2 8.397 7.871 0.526 1
1 35 . 17 1 1 A 4 4 GLY HA2 H -2 4.024 4.071 -0.047 1
1 36 . 17 1 1 A 4 4 GLY HA3 H -2 3.976 4.072 -0.096 1
1 37 . 17 1 1 A 4 4 GLY C C -2 174.360 173.955 0.405 1
1 38 . 17 1 1 A 4 4 GLY CA C -2 45.434 44.031 1.403 1
1 39 . 17 1 1 A 4 4 GLY N N -2 110.666 108.280 2.386 1
1 56 . 17 1 1 A 7 7 SER H H 141 7.913 7.936 -0.023 1
1 57 . 17 1 1 A 7 7 SER HA H 141 5.657 5.374 0.283 1
1 60 . 17 1 1 A 7 7 SER C C 141 173.753 172.313 1.440 1
1 61 . 17 1 1 A 7 7 SER CA C 141 56.758 57.653 -0.895 1
1 62 . 17 1 1 A 7 7 SER CB C 141 66.774 66.197 0.577 1
1 63 . 17 1 1 A 7 7 SER N N 141 113.824 112.690 1.134 1
1 64 . 17 1 1 A 8 8 LYS H H 142 8.656 8.445 0.211 1
1 65 . 17 1 1 A 8 8 LYS HA H 142 4.543 4.946 -0.403 1
1 74 . 17 1 1 A 8 8 LYS C C 142 174.403 174.967 -0.564 1
1 75 . 17 1 1 A 8 8 LYS CA C 142 55.578 54.360 1.218 1
1 76 . 17 1 1 A 8 8 LYS CB C 142 36.561 35.774 0.787 1
1 80 . 17 1 1 A 8 8 LYS N N 142 123.076 120.080 2.996 1
1 81 . 17 1 1 A 9 9 LYS H H 143 8.623 8.432 0.191 1
1 82 . 17 1 1 A 9 9 LYS HA H 143 4.119 4.323 -0.204 1
1 91 . 17 1 1 A 9 9 LYS C C 143 176.144 175.578 0.566 1
1 92 . 17 1 1 A 9 9 LYS CA C 143 56.683 56.042 0.641 1
1 93 . 17 1 1 A 9 9 LYS CB C 143 32.580 32.450 0.130 1
1 97 . 17 1 1 A 9 9 LYS N N 143 129.542 123.624 5.918 1
1 98 . 17 1 1 A 10 10 ALA H H 144 8.151 8.687 -0.536 1
1 99 . 17 1 1 A 10 10 ALA HA H 144 5.208 4.909 0.299 1
1 103 . 17 1 1 A 10 10 ALA C C 144 175.577 175.071 0.506 1
1 104 . 17 1 1 A 10 10 ALA CA C 144 51.226 51.185 0.041 1
1 105 . 17 1 1 A 10 10 ALA CB C 144 25.299 24.146 1.153 1
1 106 . 17 1 1 A 10 10 ALA N N 144 127.933 127.852 0.081 1
1 107 . 17 1 1 A 11 11 SER H H 145 8.679 8.876 -0.197 1
1 108 . 17 1 1 A 11 11 SER HA H 145 5.431 5.818 -0.387 1
1 111 . 17 1 1 A 11 11 SER C C 145 173.072 173.181 -0.109 1
1 112 . 17 1 1 A 11 11 SER CA C 145 57.772 56.929 0.843 1
1 113 . 17 1 1 A 11 11 SER CB C 145 67.301 66.135 1.166 1
1 114 . 17 1 1 A 11 11 SER N N 145 116.245 115.476 0.769 1
1 115 . 17 1 1 A 12 12 HIS H H 146 9.962 9.566 0.396 1
1 116 . 17 1 1 A 12 12 HIS HA H 146 6.332 6.085 0.247 1
1 121 . 17 1 1 A 12 12 HIS C C 146 173.006 172.338 0.668 1
1 122 . 17 1 1 A 12 12 HIS CA C 146 55.020 54.257 0.763 1
1 123 . 17 1 1 A 12 12 HIS CB C 146 37.071 33.325 3.746 1
1 126 . 17 1 1 A 12 12 HIS N N 146 119.181 118.636 0.545 1
1 127 . 17 1 1 A 13 13 ILE H H 147 8.976 8.994 -0.018 1
1 128 . 17 1 1 A 13 13 ILE HA H 147 3.528 4.564 -1.036 1
1 138 . 17 1 1 A 13 13 ILE C C 147 173.010 173.975 -0.965 1
1 139 . 17 1 1 A 13 13 ILE CA C 147 61.273 59.702 1.571 1
1 140 . 17 1 1 A 13 13 ILE CB C 147 41.773 41.093 0.680 1
1 144 . 17 1 1 A 13 13 ILE N N 147 121.873 119.287 2.586 1
1 145 . 17 1 1 A 14 14 LEU H H 148 7.627 8.990 -1.363 1
1 146 . 17 1 1 A 14 14 LEU HA H 148 4.814 4.893 -0.079 1
1 156 . 17 1 1 A 14 14 LEU C C 148 174.112 174.306 -0.194 1
1 157 . 17 1 1 A 14 14 LEU CA C 148 52.574 53.076 -0.502 1
1 158 . 17 1 1 A 14 14 LEU CB C 148 45.643 45.020 0.623 1
1 162 . 17 1 1 A 14 14 LEU N N 148 127.112 129.655 -2.543 1
1 163 . 17 1 1 A 15 15 ILE H H 149 9.524 9.380 0.144 1
1 164 . 17 1 1 A 15 15 ILE HA H 149 4.362 4.697 -0.335 1
1 174 . 17 1 1 A 15 15 ILE C C 149 175.452 175.473 -0.021 1
1 175 . 17 1 1 A 15 15 ILE CA C 149 58.516 60.574 -2.058 1
1 176 . 17 1 1 A 15 15 ILE CB C 149 36.560 39.899 -3.339 1
1 180 . 17 1 1 A 15 15 ILE N N 149 128.652 126.916 1.736 1
1 181 . 17 1 1 A 16 16 LYS H H 150 8.035 8.398 -0.363 1
1 182 . 17 1 1 A 16 16 LYS HA H 150 4.319 4.484 -0.165 1
1 191 . 17 1 1 A 16 16 LYS C C 150 175.038 176.340 -1.302 1
1 192 . 17 1 1 A 16 16 LYS CA C 150 57.817 56.568 1.249 1
1 193 . 17 1 1 A 16 16 LYS CB C 150 34.853 32.873 1.980 1
1 197 . 17 1 1 A 16 16 LYS N N 150 129.153 128.043 1.110 1
1 198 . 17 1 1 A 17 17 VAL H H 151 8.016 8.883 -0.867 1
1 199 . 17 1 1 A 17 17 VAL HA H 151 4.873 4.875 -0.002 1
1 207 . 17 1 1 A 17 17 VAL C C 151 176.647 175.689 0.958 1
1 208 . 17 1 1 A 17 17 VAL CA C 151 60.088 61.454 -1.366 1
1 209 . 17 1 1 A 17 17 VAL CB C 151 34.082 32.935 1.147 1
1 212 . 17 1 1 A 17 17 VAL N N 151 121.288 124.558 -3.270 1
1 213 . 17 1 1 A 18 18 LYS H H 152 8.443 8.597 -0.154 1
1 214 . 17 1 1 A 18 18 LYS HA H 152 4.334 4.855 -0.521 1
1 223 . 17 1 1 A 18 18 LYS C C 152 176.345 176.954 -0.609 1
1 224 . 17 1 1 A 18 18 LYS CA C 152 57.016 54.193 2.823 1
1 225 . 17 1 1 A 18 18 LYS CB C 152 33.222 35.816 -2.594 1
1 229 . 17 1 1 A 18 18 LYS N N 152 128.408 127.265 1.143 1
1 230 . 17 1 1 A 19 19 SER H H 153 9.067 8.653 0.414 1
1 231 . 17 1 1 A 19 19 SER HA H 153 4.457 4.272 0.185 1
1 234 . 17 1 1 A 19 19 SER C C 153 174.236 175.456 -1.220 1
1 235 . 17 1 1 A 19 19 SER CA C 153 59.642 59.655 -0.013 1
1 236 . 17 1 1 A 19 19 SER CB C 153 64.347 64.311 0.036 1
1 237 . 17 1 1 A 19 19 SER N N 153 121.522 116.987 4.535 1
1 238 . 17 1 1 A 20 20 LYS H H 154 7.961 8.088 -0.127 1
1 239 . 17 1 1 A 20 20 LYS HA H 154 4.558 4.313 0.245 1
1 244 . 17 1 1 A 20 20 LYS C C 154 177.256 176.163 1.093 1
1 245 . 17 1 1 A 20 20 LYS CA C 154 55.249 57.545 -2.296 1
1 246 . 17 1 1 A 20 20 LYS CB C 154 34.531 30.230 4.301 1
1 248 . 17 1 1 A 20 20 LYS N N 154 120.270 120.604 -0.334 1
1 249 . 17 1 1 A 21 21 LYS HA H 155 4.003 4.181 -0.178 1
1 258 . 17 1 1 A 21 21 LYS C C 155 177.015 178.385 -1.370 1
1 259 . 17 1 1 A 21 21 LYS CA C 155 59.091 58.771 0.320 1
1 260 . 17 1 1 A 21 21 LYS CB C 155 32.394 33.132 -0.738 1
1 264 . 17 1 1 A 22 22 SER H H 156 7.625 7.780 -0.155 1
1 265 . 17 1 1 A 22 22 SER HA H 156 4.293 4.467 -0.174 1
1 268 . 17 1 1 A 22 22 SER C C 156 174.843 173.666 1.177 1
1 269 . 17 1 1 A 22 22 SER CA C 156 57.966 58.894 -0.928 1
1 270 . 17 1 1 A 22 22 SER CB C 156 63.369 63.995 -0.626 1
1 271 . 17 1 1 A 22 22 SER N N 156 109.549 111.220 -1.671 1
1 272 . 17 1 1 A 23 23 ASP H H 157 7.701 7.826 -0.125 1
1 273 . 17 1 1 A 23 23 ASP HA H 157 4.548 5.057 -0.509 1
1 276 . 17 1 1 A 23 23 ASP C C 157 176.544 174.733 1.811 1
1 277 . 17 1 1 A 23 23 ASP CA C 157 55.242 53.254 1.988 1
1 278 . 17 1 1 A 23 23 ASP CB C 157 41.103 44.500 -3.397 1
1 279 . 17 1 1 A 23 23 ASP N N 157 124.536 121.038 3.498 1
1 280 . 17 1 1 A 24 24 LYS H H 158 8.583 8.847 -0.264 1
1 281 . 17 1 1 A 24 24 LYS HA H 158 4.252 4.529 -0.277 1
1 290 . 17 1 1 A 24 24 LYS C C 158 176.813 176.709 0.104 1
1 291 . 17 1 1 A 24 24 LYS CA C 158 57.148 56.076 1.072 1
1 292 . 17 1 1 A 24 24 LYS CB C 158 33.200 32.851 0.349 1
1 296 . 17 1 1 A 24 24 LYS N N 158 122.372 124.330 -1.958 1
1 297 . 17 1 1 A 25 25 GLU H H 159 8.001 8.278 -0.277 1
1 298 . 17 1 1 A 25 25 GLU HA H 159 4.521 4.156 0.365 1
1 303 . 17 1 1 A 25 25 GLU C C 159 175.995 176.996 -1.001 1
1 304 . 17 1 1 A 25 25 GLU CA C 159 55.727 59.262 -3.535 1
1 305 . 17 1 1 A 25 25 GLU CB C 159 31.918 30.081 1.837 1
1 307 . 17 1 1 A 25 25 GLU N N 159 118.705 120.341 -1.636 1
1 308 . 17 1 1 A 26 26 GLY H H 160 8.458 7.744 0.714 1
1 309 . 17 1 1 A 26 26 GLY HA2 H 160 3.946 4.044 -0.098 1
1 310 . 17 1 1 A 26 26 GLY HA3 H 160 3.511 4.052 -0.541 1
1 311 . 17 1 1 A 26 26 GLY C C 160 172.201 173.131 -0.930 1
1 312 . 17 1 1 A 26 26 GLY CA C 160 44.038 44.567 -0.529 1
1 313 . 17 1 1 A 26 26 GLY N N 160 107.642 109.114 -1.472 1
1 314 . 17 1 1 A 27 27 LEU H H 161 8.259 8.617 -0.358 1
1 315 . 17 1 1 A 27 27 LEU HA H 161 4.775 4.974 -0.199 1
1 325 . 17 1 1 A 27 27 LEU C C 161 177.422 175.372 2.050 1
1 326 . 17 1 1 A 27 27 LEU CA C 161 53.322 53.297 0.025 1
1 327 . 17 1 1 A 27 27 LEU CB C 161 45.576 43.720 1.856 1
1 331 . 17 1 1 A 27 27 LEU N N 161 119.856 121.356 -1.500 1
1 332 . 17 1 1 A 28 28 ASP H H 162 8.848 8.302 0.546 1
1 333 . 17 1 1 A 28 28 ASP HA H 162 4.644 4.584 0.060 1
1 336 . 17 1 1 A 28 28 ASP C C 162 176.630 176.847 -0.217 1
1 337 . 17 1 1 A 28 28 ASP CA C 162 55.195 54.613 0.582 1
1 338 . 17 1 1 A 28 28 ASP CB C 162 41.673 42.804 -1.131 1
1 339 . 17 1 1 A 28 28 ASP N N 162 122.434 121.644 0.790 1
1 340 . 17 1 1 A 29 29 ASP H H 163 8.720 9.073 -0.353 1
1 341 . 17 1 1 A 29 29 ASP HA H 163 4.386 4.483 -0.097 1
1 344 . 17 1 1 A 29 29 ASP C C 163 176.604 178.642 -2.038 1
1 345 . 17 1 1 A 29 29 ASP CA C 163 59.690 56.630 3.060 1
1 346 . 17 1 1 A 29 29 ASP CB C 163 42.964 40.062 2.902 1
1 347 . 17 1 1 A 29 29 ASP N N 163 121.460 125.114 -3.654 1
1 348 . 17 1 1 A 30 30 LYS H H 164 8.434 7.723 0.711 1
1 349 . 17 1 1 A 30 30 LYS HA H 164 3.901 3.965 -0.064 1
1 358 . 17 1 1 A 30 30 LYS C C 164 179.479 179.085 0.394 1
1 359 . 17 1 1 A 30 30 LYS CA C 164 60.047 59.390 0.657 1
1 360 . 17 1 1 A 30 30 LYS CB C 164 32.038 32.245 -0.207 1
1 364 . 17 1 1 A 30 30 LYS N N 164 116.627 119.596 -2.969 1
1 365 . 17 1 1 A 31 31 GLU H H 165 7.755 8.358 -0.603 1
1 366 . 17 1 1 A 31 31 GLU HA H 165 3.998 3.998 0.000 1
1 371 . 17 1 1 A 31 31 GLU C C 165 179.031 179.141 -0.110 1
1 372 . 17 1 1 A 31 31 GLU CA C 165 59.335 59.123 0.212 1
1 373 . 17 1 1 A 31 31 GLU CB C 165 29.972 29.453 0.519 1
1 375 . 17 1 1 A 31 31 GLU N N 165 120.456 119.858 0.598 1
1 376 . 17 1 1 A 32 32 ALA H H 166 9.060 8.447 0.613 1
1 377 . 17 1 1 A 32 32 ALA HA H 166 3.871 3.999 -0.128 1
1 381 . 17 1 1 A 32 32 ALA C C 166 178.029 179.007 -0.978 1
1 382 . 17 1 1 A 32 32 ALA CA C 166 54.997 55.418 -0.421 1
1 383 . 17 1 1 A 32 32 ALA CB C 166 19.727 18.384 1.343 1
1 384 . 17 1 1 A 32 32 ALA N N 166 124.406 122.162 2.244 1
1 385 . 17 1 1 A 33 33 LYS H H 167 8.228 7.707 0.521 1
1 386 . 17 1 1 A 33 33 LYS HA H 167 2.595 2.981 -0.386 1
1 395 . 17 1 1 A 33 33 LYS C C 167 177.938 178.166 -0.228 1
1 396 . 17 1 1 A 33 33 LYS CA C 167 59.573 59.255 0.318 1
1 397 . 17 1 1 A 33 33 LYS CB C 167 32.098 32.187 -0.089 1
1 401 . 17 1 1 A 33 33 LYS N N 167 119.833 118.146 1.687 1
1 402 . 17 1 1 A 34 34 GLN H H 168 7.392 7.647 -0.255 1
1 403 . 17 1 1 A 34 34 GLN HA H 168 3.943 3.931 0.012 1
1 410 . 17 1 1 A 34 34 GLN C C 168 178.323 178.451 -0.128 1
1 411 . 17 1 1 A 34 34 GLN CA C 168 58.883 59.271 -0.388 1
1 412 . 17 1 1 A 34 34 GLN CB C 168 28.485 28.097 0.388 1
1 414 . 17 1 1 A 34 34 GLN N N 168 117.208 118.070 -0.862 1
1 416 . 17 1 1 A 35 35 LYS H H 169 7.994 7.966 0.028 1
1 417 . 17 1 1 A 35 35 LYS HA H 169 4.067 3.981 0.086 1
1 426 . 17 1 1 A 35 35 LYS C C 169 178.161 178.520 -0.359 1
1 427 . 17 1 1 A 35 35 LYS CA C 169 58.437 59.249 -0.812 1
1 428 . 17 1 1 A 35 35 LYS CB C 169 31.611 32.254 -0.643 1
1 432 . 17 1 1 A 35 35 LYS N N 169 120.898 119.827 1.071 1
1 433 . 17 1 1 A 36 36 ALA H H 170 8.431 8.286 0.145 1
1 434 . 17 1 1 A 36 36 ALA HA H 170 3.738 4.046 -0.308 1
1 438 . 17 1 1 A 36 36 ALA C C 170 178.862 179.878 -1.016 1
1 439 . 17 1 1 A 36 36 ALA CA C 170 55.351 54.980 0.371 1
1 440 . 17 1 1 A 36 36 ALA CB C 170 18.295 18.502 -0.207 1
1 441 . 17 1 1 A 36 36 ALA N N 170 120.641 119.307 1.334 1
1 442 . 17 1 1 A 37 37 GLU H H 171 8.412 8.053 0.359 1
1 443 . 17 1 1 A 37 37 GLU HA H 171 3.867 3.991 -0.124 1
1 448 . 17 1 1 A 37 37 GLU C C 171 179.255 179.115 0.140 1
1 449 . 17 1 1 A 37 37 GLU CA C 171 59.543 59.453 0.090 1
1 450 . 17 1 1 A 37 37 GLU CB C 171 29.569 29.390 0.179 1
1 452 . 17 1 1 A 37 37 GLU N N 171 118.224 117.849 0.375 1
1 453 . 17 1 1 A 38 38 GLU H H 172 8.019 8.286 -0.267 1
1 454 . 17 1 1 A 38 38 GLU HA H 172 3.952 4.085 -0.133 1
1 459 . 17 1 1 A 38 38 GLU C C 172 180.250 178.270 1.980 1
1 460 . 17 1 1 A 38 38 GLU CA C 172 59.627 59.141 0.486 1
1 461 . 17 1 1 A 38 38 GLU CB C 172 29.368 28.633 0.735 1
1 463 . 17 1 1 A 38 38 GLU N N 172 121.250 118.653 2.597 1
1 464 . 17 1 1 A 39 39 ILE H H 173 8.174 7.405 0.769 1
1 465 . 17 1 1 A 39 39 ILE HA H 173 3.643 3.800 -0.157 1
1 475 . 17 1 1 A 39 39 ILE C C 173 177.568 178.047 -0.479 1
1 476 . 17 1 1 A 39 39 ILE CA C 173 64.869 64.030 0.839 1
1 477 . 17 1 1 A 39 39 ILE CB C 173 38.160 37.465 0.695 1
1 481 . 17 1 1 A 39 39 ILE N N 173 121.527 117.993 3.534 1
1 482 . 17 1 1 A 40 40 GLN H H 174 8.860 8.322 0.538 1
1 483 . 17 1 1 A 40 40 GLN HA H 174 3.533 3.983 -0.450 1
1 490 . 17 1 1 A 40 40 GLN C C 174 179.022 178.536 0.486 1
1 491 . 17 1 1 A 40 40 GLN CA C 174 61.316 59.277 2.039 1
1 492 . 17 1 1 A 40 40 GLN CB C 174 26.604 28.331 -1.727 1
1 494 . 17 1 1 A 40 40 GLN N N 174 121.956 121.105 0.851 1
1 496 . 17 1 1 A 41 41 LYS H H 175 7.879 7.930 -0.051 1
1 497 . 17 1 1 A 41 41 LYS HA H 175 3.777 4.119 -0.342 1
1 506 . 17 1 1 A 41 41 LYS C C 175 178.779 178.398 0.381 1
1 507 . 17 1 1 A 41 41 LYS CA C 175 59.701 58.776 0.925 1
1 508 . 17 1 1 A 41 41 LYS CB C 175 32.581 31.660 0.921 1
1 512 . 17 1 1 A 41 41 LYS N N 175 119.012 118.292 0.720 1
1 513 . 17 1 1 A 42 42 GLU H H 176 7.447 7.908 -0.461 1
1 514 . 17 1 1 A 42 42 GLU HA H 176 4.059 4.246 -0.187 1
1 519 . 17 1 1 A 42 42 GLU C C 176 180.058 178.623 1.435 1
1 520 . 17 1 1 A 42 42 GLU CA C 176 59.456 58.865 0.591 1
1 521 . 17 1 1 A 42 42 GLU CB C 176 29.923 30.120 -0.197 1
1 523 . 17 1 1 A 42 42 GLU N N 176 120.054 118.906 1.148 1
1 524 . 17 1 1 A 43 43 VAL H H 177 8.618 8.049 0.569 1
1 525 . 17 1 1 A 43 43 VAL HA H 177 3.986 3.909 0.077 1
1 533 . 17 1 1 A 43 43 VAL C C 177 176.459 177.525 -1.066 1
1 534 . 17 1 1 A 43 43 VAL CA C 177 63.923 64.938 -1.015 1
1 535 . 17 1 1 A 43 43 VAL CB C 177 31.899 31.224 0.675 1
1 538 . 17 1 1 A 43 43 VAL N N 177 114.191 117.114 -2.923 1
1 539 . 17 1 1 A 44 44 SER H H 178 8.052 8.215 -0.163 1
1 540 . 17 1 1 A 44 44 SER HA H 178 4.098 4.289 -0.191 1
1 543 . 17 1 1 A 44 44 SER C C 178 176.548 176.395 0.153 1
1 544 . 17 1 1 A 44 44 SER CA C 178 61.160 61.393 -0.233 1
1 545 . 17 1 1 A 44 44 SER CB C 178 62.959 62.638 0.321 1
1 546 . 17 1 1 A 44 44 SER N N 178 114.202 116.089 -1.887 1
1 547 . 17 1 1 A 45 45 LYS H H 179 7.083 8.478 -1.395 1
1 548 . 17 1 1 A 45 45 LYS HA H 179 4.140 4.170 -0.030 1
1 557 . 17 1 1 A 45 45 LYS C C 179 177.288 176.457 0.831 1
1 558 . 17 1 1 A 45 45 LYS CA C 179 58.469 58.068 0.401 1
1 559 . 17 1 1 A 45 45 LYS CB C 179 32.671 31.577 1.094 1
1 563 . 17 1 1 A 45 45 LYS N N 179 120.935 118.329 2.606 1
1 564 . 17 1 1 A 46 46 ASP H H 180 7.098 7.883 -0.785 1
1 565 . 17 1 1 A 46 46 ASP HA H 180 4.917 5.125 -0.208 1
1 568 . 17 1 1 A 46 46 ASP CA C 180 51.492 51.286 0.206 1
1 569 . 17 1 1 A 46 46 ASP CB C 180 40.595 41.132 -0.537 1
1 570 . 17 1 1 A 46 46 ASP N N 180 112.836 120.679 -7.843 1
1 571 . 17 1 1 A 47 47 PRO HA H 181 4.681 4.431 0.250 1
1 578 . 17 1 1 A 47 47 PRO C C 181 179.248 178.037 1.211 1
1 579 . 17 1 1 A 47 47 PRO CA C 181 64.718 64.648 0.070 1
1 580 . 17 1 1 A 47 47 PRO CB C 181 32.159 32.031 0.128 1
1 583 . 17 1 1 A 48 48 SER H H 182 8.248 8.211 0.037 1
1 584 . 17 1 1 A 48 48 SER HA H 182 4.378 4.286 0.092 1
1 587 . 17 1 1 A 48 48 SER C C 182 176.071 175.532 0.539 1
1 588 . 17 1 1 A 48 48 SER CA C 182 61.377 60.791 0.586 1
1 589 . 17 1 1 A 48 48 SER CB C 182 62.455 62.585 -0.130 1
1 590 . 17 1 1 A 48 48 SER N N 182 116.986 112.366 4.620 1
1 591 . 17 1 1 A 49 49 LYS H H 183 7.842 7.642 0.200 1
1 592 . 17 1 1 A 49 49 LYS HA H 183 4.482 4.320 0.162 1
1 601 . 17 1 1 A 49 49 LYS C C 183 175.605 177.442 -1.837 1
1 602 . 17 1 1 A 49 49 LYS CA C 183 55.824 56.640 -0.816 1
1 603 . 17 1 1 A 49 49 LYS CB C 183 32.834 32.690 0.144 1
1 607 . 17 1 1 A 49 49 LYS N N 183 121.698 120.234 1.464 1
1 608 . 17 1 1 A 50 50 PHE H H 184 7.634 7.947 -0.313 1
1 609 . 17 1 1 A 50 50 PHE HA H 184 3.510 4.190 -0.680 1
1 617 . 17 1 1 A 50 50 PHE C C 184 176.214 177.629 -1.415 1
1 618 . 17 1 1 A 50 50 PHE CA C 184 63.276 61.013 2.263 1
1 619 . 17 1 1 A 50 50 PHE CB C 184 40.948 39.019 1.929 1
1 623 . 17 1 1 A 50 50 PHE N N 184 120.120 121.608 -1.488 1
1 624 . 17 1 1 A 51 51 GLY H H 185 8.855 8.560 0.295 1
1 625 . 17 1 1 A 51 51 GLY HA2 H 185 3.993 3.840 0.153 1
1 626 . 17 1 1 A 51 51 GLY HA3 H 185 3.958 3.880 0.078 1
1 627 . 17 1 1 A 51 51 GLY C C 185 175.169 176.273 -1.104 1
1 628 . 17 1 1 A 51 51 GLY CA C 185 47.475 47.712 -0.237 1
1 629 . 17 1 1 A 51 51 GLY N N 185 105.550 106.300 -0.750 1
1 630 . 17 1 1 A 52 52 GLU H H 186 7.917 7.992 -0.075 1
1 631 . 17 1 1 A 52 52 GLU HA H 186 4.006 4.026 -0.020 1
1 636 . 17 1 1 A 52 52 GLU C C 186 179.499 179.207 0.292 1
1 637 . 17 1 1 A 52 52 GLU CA C 186 58.904 59.123 -0.219 1
1 638 . 17 1 1 A 52 52 GLU CB C 186 29.700 29.580 0.120 1
1 640 . 17 1 1 A 52 52 GLU N N 186 121.929 121.715 0.214 1
1 641 . 17 1 1 A 53 53 ILE H H 187 7.936 7.744 0.192 1
1 642 . 17 1 1 A 53 53 ILE HA H 187 3.648 3.758 -0.110 1
1 652 . 17 1 1 A 53 53 ILE C C 187 177.886 177.954 -0.068 1
1 653 . 17 1 1 A 53 53 ILE CA C 187 64.366 64.428 -0.062 1
1 654 . 17 1 1 A 53 53 ILE CB C 187 36.478 37.225 -0.747 1
1 658 . 17 1 1 A 53 53 ILE N N 187 120.991 122.010 -1.019 1
1 659 . 17 1 1 A 54 54 ALA H H 188 8.895 8.540 0.355 1
1 660 . 17 1 1 A 54 54 ALA HA H 188 3.629 3.777 -0.148 1
1 664 . 17 1 1 A 54 54 ALA C C 188 179.437 179.463 -0.026 1
1 665 . 17 1 1 A 54 54 ALA CA C 188 55.974 55.500 0.474 1
1 666 . 17 1 1 A 54 54 ALA CB C 188 17.591 18.311 -0.720 1
1 667 . 17 1 1 A 54 54 ALA N N 188 125.308 122.311 2.997 1
1 668 . 17 1 1 A 55 55 LYS H H 189 8.049 7.785 0.264 1
1 669 . 17 1 1 A 55 55 LYS HA H 189 4.106 3.896 0.210 1
1 678 . 17 1 1 A 55 55 LYS C C 189 178.995 177.739 1.256 1
1 679 . 17 1 1 A 55 55 LYS CA C 189 59.312 59.253 0.059 1
1 680 . 17 1 1 A 55 55 LYS CB C 189 32.647 31.860 0.787 1
1 684 . 17 1 1 A 55 55 LYS N N 189 116.835 118.294 -1.459 1
1 685 . 17 1 1 A 56 56 LYS H H 190 7.215 7.785 -0.570 1
1 686 . 17 1 1 A 56 56 LYS HA H 190 4.172 4.355 -0.183 1
1 695 . 17 1 1 A 56 56 LYS C C 190 177.897 178.110 -0.213 1
1 696 . 17 1 1 A 56 56 LYS CA C 190 58.418 57.480 0.938 1
1 697 . 17 1 1 A 56 56 LYS CB C 190 34.652 33.571 1.081 1
1 701 . 17 1 1 A 56 56 LYS N N 190 117.170 117.797 -0.627 1
1 702 . 17 1 1 A 57 57 GLU H H 191 8.572 7.896 0.676 1
1 703 . 17 1 1 A 57 57 GLU HA H 191 4.643 4.355 0.288 1
1 708 . 17 1 1 A 57 57 GLU C C 191 177.903 176.039 1.864 1
1 709 . 17 1 1 A 57 57 GLU CA C 191 55.708 56.487 -0.779 1
1 710 . 17 1 1 A 57 57 GLU CB C 191 32.460 30.969 1.491 1
1 712 . 17 1 1 A 57 57 GLU N N 191 113.316 116.928 -3.612 1
1 713 . 17 1 1 A 58 58 SER H H 192 8.550 7.730 0.820 1
1 714 . 17 1 1 A 58 58 SER HA H 192 4.149 4.429 -0.280 1
1 717 . 17 1 1 A 58 58 SER C C 192 176.161 175.042 1.119 1
1 718 . 17 1 1 A 58 58 SER CA C 192 58.403 57.872 0.531 1
1 719 . 17 1 1 A 58 58 SER CB C 192 64.392 64.268 0.124 1
1 720 . 17 1 1 A 58 58 SER N N 192 109.861 115.654 -5.793 1
1 721 . 17 1 1 A 59 59 MET H H 193 9.533 8.916 0.617 1
1 722 . 17 1 1 A 59 59 MET HA H 193 4.457 4.654 -0.197 1
1 730 . 17 1 1 A 59 59 MET C C 193 175.204 175.577 -0.373 1
1 731 . 17 1 1 A 59 59 MET CA C 193 55.781 54.840 0.941 1
1 732 . 17 1 1 A 59 59 MET CB C 193 32.855 32.256 0.599 1
1 735 . 17 1 1 A 59 59 MET N N 193 124.493 123.400 1.093 1
1 736 . 17 1 1 A 60 60 ASP H H 194 7.514 7.313 0.201 1
1 737 . 17 1 1 A 60 60 ASP HA H 194 4.886 4.629 0.257 1
1 740 . 17 1 1 A 60 60 ASP C C 194 175.517 176.726 -1.209 1
1 741 . 17 1 1 A 60 60 ASP CA C 194 52.286 53.127 -0.841 1
1 742 . 17 1 1 A 60 60 ASP CB C 194 40.222 40.797 -0.575 1
1 743 . 17 1 1 A 60 60 ASP N N 194 117.785 122.355 -4.570 1
1 744 . 17 1 1 A 61 61 THR H H 195 8.118 8.447 -0.329 1
1 745 . 17 1 1 A 61 61 THR HA H 195 3.918 3.955 -0.037 1
1 750 . 17 1 1 A 61 61 THR C C 195 176.269 177.239 -0.970 1
1 751 . 17 1 1 A 61 61 THR CA C 195 65.469 65.273 0.196 1
1 752 . 17 1 1 A 61 61 THR CB C 195 68.741 68.414 0.327 1
1 754 . 17 1 1 A 61 61 THR N N 195 120.765 118.543 2.222 1
1 755 . 17 1 1 A 62 62 GLY H H 196 8.399 8.543 -0.144 1
1 756 . 17 1 1 A 62 62 GLY HA2 H 196 3.932 3.849 0.083 1
1 757 . 17 1 1 A 62 62 GLY HA3 H 196 3.900 3.851 0.049 1
1 758 . 17 1 1 A 62 62 GLY C C 196 174.948 176.762 -1.814 1
1 759 . 17 1 1 A 62 62 GLY CA C 196 46.768 47.337 -0.569 1
1 760 . 17 1 1 A 62 62 GLY N N 196 108.183 111.409 -3.226 1
1 761 . 17 1 1 A 63 63 SER H H 197 7.265 8.178 -0.913 1
1 762 . 17 1 1 A 63 63 SER HA H 197 4.554 4.424 0.130 1
1 765 . 17 1 1 A 63 63 SER C C 197 177.630 176.034 1.596 1
1 766 . 17 1 1 A 63 63 SER CA C 197 59.550 62.441 -2.891 1
1 767 . 17 1 1 A 63 63 SER CB C 197 65.504 63.667 1.837 1
1 768 . 17 1 1 A 63 63 SER N N 197 111.815 119.281 -7.466 1
1 769 . 17 1 1 A 64 64 ALA H H 198 8.675 8.469 0.206 1
1 770 . 17 1 1 A 64 64 ALA HA H 198 3.801 3.987 -0.186 1
1 774 . 17 1 1 A 64 64 ALA C C 198 178.492 179.838 -1.346 1
1 775 . 17 1 1 A 64 64 ALA CA C 198 56.794 55.450 1.344 1
1 776 . 17 1 1 A 64 64 ALA CB C 198 18.951 18.250 0.701 1
1 777 . 17 1 1 A 64 64 ALA N N 198 131.710 123.574 8.136 1
1 778 . 17 1 1 A 65 65 LYS H H 199 7.666 7.652 0.014 1
1 779 . 17 1 1 A 65 65 LYS HA H 199 4.175 4.162 0.013 1
1 788 . 17 1 1 A 65 65 LYS C C 199 177.159 177.357 -0.198 1
1 789 . 17 1 1 A 65 65 LYS CA C 199 57.735 58.213 -0.478 1
1 790 . 17 1 1 A 65 65 LYS CB C 199 31.948 31.949 -0.001 1
1 794 . 17 1 1 A 65 65 LYS N N 199 111.375 117.825 -6.450 1
1 795 . 17 1 1 A 66 66 LYS H H 200 7.545 7.400 0.145 1
1 796 . 17 1 1 A 66 66 LYS HA H 200 4.612 4.472 0.140 1
1 805 . 17 1 1 A 66 66 LYS C C 200 175.609 175.835 -0.226 1
1 806 . 17 1 1 A 66 66 LYS CA C 200 54.468 55.766 -1.298 1
1 807 . 17 1 1 A 66 66 LYS CB C 200 31.525 32.942 -1.417 1
1 811 . 17 1 1 A 66 66 LYS N N 200 121.421 118.504 2.917 1
1 812 . 17 1 1 A 67 67 ASP H H 201 7.630 8.249 -0.619 1
1 813 . 17 1 1 A 67 67 ASP HA H 201 4.306 4.417 -0.111 1
1 816 . 17 1 1 A 67 67 ASP C C 201 175.025 176.431 -1.406 1
1 817 . 17 1 1 A 67 67 ASP CA C 201 56.400 55.361 1.039 1
1 818 . 17 1 1 A 67 67 ASP CB C 201 38.315 39.085 -0.770 1
1 819 . 17 1 1 A 67 67 ASP N N 201 116.216 117.235 -1.019 1
1 820 . 17 1 1 A 68 68 GLY H H 202 8.368 8.665 -0.297 1
1 821 . 17 1 1 A 68 68 GLY HA2 H 202 4.316 3.951 0.365 1
1 822 . 17 1 1 A 68 68 GLY HA3 H 202 3.731 4.033 -0.302 1
1 823 . 17 1 1 A 68 68 GLY C C 202 174.139 174.605 -0.466 1
1 824 . 17 1 1 A 68 68 GLY CA C 202 45.514 45.337 0.177 1
1 825 . 17 1 1 A 68 68 GLY N N 202 105.095 104.925 0.170 1
1 826 . 17 1 1 A 69 69 GLU H H 203 7.534 8.052 -0.518 1
1 827 . 17 1 1 A 69 69 GLU HA H 203 4.479 4.396 0.083 1
1 832 . 17 1 1 A 69 69 GLU C C 203 176.961 175.994 0.967 1
1 833 . 17 1 1 A 69 69 GLU CA C 203 58.549 56.651 1.898 1
1 834 . 17 1 1 A 69 69 GLU CB C 203 30.998 30.518 0.480 1
1 836 . 17 1 1 A 69 69 GLU N N 203 120.426 120.138 0.288 1
1 837 . 17 1 1 A 70 70 LEU H H 204 8.962 9.057 -0.095 1
1 838 . 17 1 1 A 70 70 LEU HA H 204 4.438 4.631 -0.193 1
1 848 . 17 1 1 A 70 70 LEU C C 204 178.648 177.180 1.468 1
1 849 . 17 1 1 A 70 70 LEU CA C 204 53.977 55.059 -1.082 1
1 850 . 17 1 1 A 70 70 LEU CB C 204 43.612 43.652 -0.040 1
1 854 . 17 1 1 A 70 70 LEU N N 204 122.066 123.776 -1.710 1
1 855 . 17 1 1 A 71 71 GLY H H 205 8.104 7.482 0.622 1
1 856 . 17 1 1 A 71 71 GLY HA2 H 205 4.165 4.031 0.134 1
1 857 . 17 1 1 A 71 71 GLY HA3 H 205 3.552 4.125 -0.573 1
1 858 . 17 1 1 A 71 71 GLY C C 205 173.098 173.320 -0.222 1
1 859 . 17 1 1 A 71 71 GLY CA C 205 44.723 44.974 -0.251 1
1 860 . 17 1 1 A 71 71 GLY N N 205 110.168 106.588 3.580 1
1 861 . 17 1 1 A 72 72 TYR H H 206 8.457 8.582 -0.125 1
1 862 . 17 1 1 A 72 72 TYR HA H 206 4.184 4.855 -0.671 1
1 869 . 17 1 1 A 72 72 TYR C C 206 175.975 175.382 0.593 1
1 870 . 17 1 1 A 72 72 TYR CA C 206 59.722 59.020 0.702 1
1 871 . 17 1 1 A 72 72 TYR CB C 206 38.378 38.494 -0.116 1
1 874 . 17 1 1 A 72 72 TYR N N 206 120.171 122.034 -1.863 1
1 875 . 17 1 1 A 73 73 VAL H H 207 8.782 9.146 -0.364 1
1 876 . 17 1 1 A 73 73 VAL HA H 207 4.056 4.574 -0.518 1
1 884 . 17 1 1 A 73 73 VAL C C 207 174.901 175.542 -0.641 1
1 885 . 17 1 1 A 73 73 VAL CA C 207 62.202 61.842 0.360 1
1 886 . 17 1 1 A 73 73 VAL CB C 207 33.071 32.813 0.258 1
1 889 . 17 1 1 A 73 73 VAL N N 207 128.847 124.148 4.699 1
1 890 . 17 1 1 A 74 74 LEU H H 208 8.146 8.996 -0.850 1
1 891 . 17 1 1 A 74 74 LEU HA H 208 4.944 5.158 -0.214 1
1 901 . 17 1 1 A 74 74 LEU C C 208 178.400 176.755 1.645 1
1 902 . 17 1 1 A 74 74 LEU CA C 208 53.520 53.233 0.287 1
1 903 . 17 1 1 A 74 74 LEU CB C 208 43.499 44.303 -0.804 1
1 907 . 17 1 1 A 74 74 LEU N N 208 127.599 127.985 -0.386 1
1 908 . 17 1 1 A 75 75 LYS H H 209 8.403 8.281 0.122 1
1 909 . 17 1 1 A 75 75 LYS HA H 209 3.771 3.820 -0.049 1
1 918 . 17 1 1 A 75 75 LYS C C 209 177.536 177.448 0.088 1
1 919 . 17 1 1 A 75 75 LYS CA C 209 58.385 58.883 -0.498 1
1 920 . 17 1 1 A 75 75 LYS CB C 209 32.459 32.029 0.430 1
1 924 . 17 1 1 A 75 75 LYS N N 209 123.798 122.469 1.329 1
1 925 . 17 1 1 A 76 76 GLY H H 210 9.997 9.402 0.595 1
1 926 . 17 1 1 A 76 76 GLY HA2 H 210 4.255 4.012 0.243 1
1 927 . 17 1 1 A 76 76 GLY HA3 H 210 3.791 4.012 -0.221 1
1 928 . 17 1 1 A 76 76 GLY C C 210 175.091 175.521 -0.430 1
1 929 . 17 1 1 A 76 76 GLY CA C 210 45.465 45.472 -0.007 1
1 930 . 17 1 1 A 76 76 GLY N N 210 114.705 113.347 1.358 1
1 931 . 17 1 1 A 77 77 GLN H H 211 7.726 7.990 -0.264 1
1 932 . 17 1 1 A 77 77 GLN HA H 211 4.373 4.302 0.071 1
1 939 . 17 1 1 A 77 77 GLN C C 211 176.301 175.798 0.503 1
1 940 . 17 1 1 A 77 77 GLN CA C 211 57.074 56.450 0.624 1
1 941 . 17 1 1 A 77 77 GLN CB C 211 30.798 29.391 1.407 1
1 943 . 17 1 1 A 77 77 GLN N N 211 118.702 117.915 0.787 1
1 945 . 17 1 1 A 78 78 THR H H 212 8.225 7.300 0.925 1
1 946 . 17 1 1 A 78 78 THR HA H 212 4.620 4.759 -0.139 1
1 951 . 17 1 1 A 78 78 THR C C 212 173.920 173.009 0.911 1
1 952 . 17 1 1 A 78 78 THR CA C 212 60.087 59.228 0.859 1
1 953 . 17 1 1 A 78 78 THR CB C 212 71.412 71.810 -0.398 1
1 955 . 17 1 1 A 78 78 THR N N 212 111.935 109.767 2.168 1
1 956 . 17 1 1 A 79 79 ASP H H 213 8.372 8.406 -0.034 1
1 957 . 17 1 1 A 79 79 ASP HA H 213 4.470 4.430 0.040 1
1 960 . 17 1 1 A 79 79 ASP C C 213 176.759 177.714 -0.955 1
1 961 . 17 1 1 A 79 79 ASP CA C 213 54.927 54.793 0.134 1
1 962 . 17 1 1 A 79 79 ASP CB C 213 43.859 42.573 1.286 1
1 963 . 17 1 1 A 79 79 ASP N N 213 122.093 122.694 -0.601 1
1 964 . 17 1 1 A 80 80 LYS H H 214 8.740 8.772 -0.032 1
1 965 . 17 1 1 A 80 80 LYS HA H 214 4.027 4.075 -0.048 1
1 974 . 17 1 1 A 80 80 LYS C C 214 178.493 178.307 0.186 1
1 975 . 17 1 1 A 80 80 LYS CA C 214 59.802 58.858 0.944 1
1 976 . 17 1 1 A 80 80 LYS CB C 214 32.374 31.961 0.413 1
1 980 . 17 1 1 A 80 80 LYS N N 214 124.685 123.751 0.934 1
1 981 . 17 1 1 A 81 81 ASP H H 215 8.556 8.110 0.446 1
1 982 . 17 1 1 A 81 81 ASP HA H 215 4.566 4.443 0.123 1
1 985 . 17 1 1 A 81 81 ASP C C 215 178.889 178.707 0.182 1
1 986 . 17 1 1 A 81 81 ASP CA C 215 58.046 56.929 1.117 1
1 987 . 17 1 1 A 81 81 ASP CB C 215 40.872 40.606 0.266 1
1 988 . 17 1 1 A 81 81 ASP N N 215 121.413 120.217 1.196 1
1 989 . 17 1 1 A 82 82 PHE H H 216 8.205 8.200 0.005 1
1 990 . 17 1 1 A 82 82 PHE HA H 216 3.686 4.129 -0.443 1
1 998 . 17 1 1 A 82 82 PHE C C 216 175.919 177.443 -1.524 1
1 999 . 17 1 1 A 82 82 PHE CA C 216 61.648 60.990 0.658 1
1 1000 . 17 1 1 A 82 82 PHE CB C 216 39.743 39.192 0.551 1
1 1004 . 17 1 1 A 82 82 PHE N N 216 124.401 120.249 4.152 1
1 1005 . 17 1 1 A 83 83 GLU H H 217 8.887 8.790 0.097 1
1 1006 . 17 1 1 A 83 83 GLU HA H 217 3.704 4.242 -0.538 1
1 1011 . 17 1 1 A 83 83 GLU C C 217 177.788 179.052 -1.264 1
1 1012 . 17 1 1 A 83 83 GLU CA C 217 60.545 60.195 0.350 1
1 1013 . 17 1 1 A 83 83 GLU CB C 217 30.639 29.220 1.419 1
1 1015 . 17 1 1 A 83 83 GLU N N 217 119.421 118.585 0.836 1
1 1016 . 17 1 1 A 84 84 LYS H H 218 8.055 7.719 0.336 1
1 1017 . 17 1 1 A 84 84 LYS HA H 218 3.947 4.133 -0.186 1
1 1026 . 17 1 1 A 84 84 LYS C C 218 178.783 178.450 0.333 1
1 1027 . 17 1 1 A 84 84 LYS CA C 218 59.327 58.812 0.515 1
1 1028 . 17 1 1 A 84 84 LYS CB C 218 32.539 32.194 0.345 1
1 1032 . 17 1 1 A 84 84 LYS N N 218 117.821 119.754 -1.933 1
1 1033 . 17 1 1 A 85 85 ALA H H 219 7.059 7.905 -0.846 1
1 1034 . 17 1 1 A 85 85 ALA HA H 219 4.040 4.098 -0.058 1
1 1038 . 17 1 1 A 85 85 ALA C C 219 179.794 179.410 0.384 1
1 1039 . 17 1 1 A 85 85 ALA CA C 219 54.407 54.233 0.174 1
1 1040 . 17 1 1 A 85 85 ALA CB C 219 20.130 18.197 1.933 1
1 1041 . 17 1 1 A 85 85 ALA N N 219 118.905 121.014 -2.109 1
1 1042 . 17 1 1 A 86 86 LEU H H 220 8.157 7.997 0.160 1
1 1043 . 17 1 1 A 86 86 LEU HA H 220 3.692 4.028 -0.336 1
1 1053 . 17 1 1 A 86 86 LEU C C 220 178.330 178.520 -0.190 1
1 1054 . 17 1 1 A 86 86 LEU CA C 220 57.752 57.527 0.225 1
1 1055 . 17 1 1 A 86 86 LEU CB C 220 41.464 41.852 -0.388 1
1 1059 . 17 1 1 A 86 86 LEU N N 220 118.606 120.387 -1.781 1
1 1060 . 17 1 1 A 87 87 PHE H H 221 8.349 8.529 -0.180 1
1 1061 . 17 1 1 A 87 87 PHE HA H 221 3.861 4.433 -0.572 1
1 1069 . 17 1 1 A 87 87 PHE C C 221 176.176 177.170 -0.994 1
1 1070 . 17 1 1 A 87 87 PHE CA C 221 61.780 61.814 -0.034 1
1 1071 . 17 1 1 A 87 87 PHE CB C 221 37.549 37.876 -0.327 1
1 1075 . 17 1 1 A 87 87 PHE N N 221 112.449 116.975 -4.526 1
1 1076 . 17 1 1 A 88 88 LYS H H 222 7.061 8.150 -1.089 1
1 1077 . 17 1 1 A 88 88 LYS HA H 222 4.380 4.372 0.008 1
1 1086 . 17 1 1 A 88 88 LYS C C 222 177.089 176.796 0.293 1
1 1087 . 17 1 1 A 88 88 LYS CA C 222 56.726 58.108 -1.382 1
1 1088 . 17 1 1 A 88 88 LYS CB C 222 33.738 32.108 1.630 1
1 1092 . 17 1 1 A 88 88 LYS N N 222 118.308 113.575 4.733 1
1 1093 . 17 1 1 A 89 89 LEU H H 223 7.270 7.321 -0.051 1
1 1094 . 17 1 1 A 89 89 LEU HA H 223 4.168 4.187 -0.019 1
1 1104 . 17 1 1 A 89 89 LEU C C 223 177.528 176.817 0.711 1
1 1105 . 17 1 1 A 89 89 LEU CA C 223 55.279 54.697 0.582 1
1 1106 . 17 1 1 A 89 89 LEU CB C 223 43.240 42.254 0.986 1
1 1110 . 17 1 1 A 89 89 LEU N N 223 121.317 121.813 -0.496 1
1 1111 . 17 1 1 A 90 90 LYS H H 224 8.788 8.451 0.337 1
1 1112 . 17 1 1 A 90 90 LYS HA H 224 4.359 4.294 0.065 1
1 1121 . 17 1 1 A 90 90 LYS C C 224 175.839 175.652 0.187 1
1 1122 . 17 1 1 A 90 90 LYS CA C 224 54.772 55.978 -1.206 1
1 1123 . 17 1 1 A 90 90 LYS CB C 224 33.232 33.123 0.109 1
1 1127 . 17 1 1 A 90 90 LYS N N 224 123.558 122.691 0.867 1
1 1128 . 17 1 1 A 91 91 ASP H H 225 8.125 8.662 -0.537 1
1 1129 . 17 1 1 A 91 91 ASP HA H 225 3.958 4.359 -0.401 1
1 1132 . 17 1 1 A 91 91 ASP C C 225 177.452 176.570 0.882 1
1 1133 . 17 1 1 A 91 91 ASP CA C 225 56.642 55.525 1.117 1
1 1134 . 17 1 1 A 91 91 ASP CB C 225 40.269 40.177 0.092 1
1 1135 . 17 1 1 A 91 91 ASP N N 225 119.419 121.812 -2.393 1
1 1136 . 17 1 1 A 92 92 GLY H H 226 8.681 8.893 -0.212 1
1 1137 . 17 1 1 A 92 92 GLY HA2 H 226 4.131 3.878 0.253 1
1 1138 . 17 1 1 A 92 92 GLY HA3 H 226 3.579 3.903 -0.324 1
1 1139 . 17 1 1 A 92 92 GLY C C 226 173.614 174.117 -0.503 1
1 1140 . 17 1 1 A 92 92 GLY CA C 226 45.564 44.905 0.659 1
1 1141 . 17 1 1 A 92 92 GLY N N 226 113.802 112.077 1.725 1
1 1142 . 17 1 1 A 93 93 GLU H H 227 8.104 8.123 -0.019 1
1 1143 . 17 1 1 A 93 93 GLU HA H 227 4.232 4.430 -0.198 1
1 1148 . 17 1 1 A 93 93 GLU C C 227 174.282 175.616 -1.334 1
1 1149 . 17 1 1 A 93 93 GLU CA C 227 56.651 56.115 0.536 1
1 1150 . 17 1 1 A 93 93 GLU CB C 227 32.190 31.024 1.166 1
1 1152 . 17 1 1 A 93 93 GLU N N 227 121.527 121.913 -0.386 1
1 1153 . 17 1 1 A 94 94 VAL H H 228 7.918 8.555 -0.637 1
1 1154 . 17 1 1 A 94 94 VAL HA H 228 4.857 4.769 0.088 1
1 1162 . 17 1 1 A 94 94 VAL C C 228 176.556 175.689 0.867 1
1 1163 . 17 1 1 A 94 94 VAL CA C 228 60.309 60.425 -0.116 1
1 1164 . 17 1 1 A 94 94 VAL CB C 228 33.847 35.190 -1.343 1
1 1167 . 17 1 1 A 94 94 VAL N N 228 119.768 126.105 -6.337 1
1 1168 . 17 1 1 A 95 95 SER H H 229 9.659 9.462 0.197 1
1 1169 . 17 1 1 A 95 95 SER HA H 229 4.313 4.709 -0.396 1
1 1172 . 17 1 1 A 95 95 SER C C 229 174.641 174.479 0.162 1
1 1173 . 17 1 1 A 95 95 SER CA C 229 59.208 57.817 1.391 1
1 1174 . 17 1 1 A 95 95 SER CB C 229 66.080 65.762 0.318 1
1 1175 . 17 1 1 A 95 95 SER N N 229 124.903 121.019 3.884 1
1 1176 . 17 1 1 A 96 96 GLU H H 230 8.014 8.609 -0.595 1
1 1177 . 17 1 1 A 96 96 GLU HA H 230 4.376 4.435 -0.059 1
1 1182 . 17 1 1 A 96 96 GLU C C 230 176.641 177.197 -0.556 1
1 1183 . 17 1 1 A 96 96 GLU CA C 230 56.236 56.409 -0.173 1
1 1184 . 17 1 1 A 96 96 GLU CB C 230 30.324 30.972 -0.648 1
1 1186 . 17 1 1 A 96 96 GLU N N 230 115.510 121.000 -5.490 1
1 1187 . 17 1 1 A 97 97 VAL H H 231 8.741 8.300 0.441 1
1 1188 . 17 1 1 A 97 97 VAL HA H 231 4.171 4.146 0.025 1
1 1196 . 17 1 1 A 97 97 VAL C C 231 176.684 175.761 0.923 1
1 1197 . 17 1 1 A 97 97 VAL CA C 231 65.418 63.014 2.404 1
1 1198 . 17 1 1 A 97 97 VAL CB C 231 31.218 31.842 -0.624 1
1 1201 . 17 1 1 A 97 97 VAL N N 231 121.289 121.496 -0.207 1
1 1202 . 17 1 1 A 98 98 VAL H H 232 9.218 9.390 -0.172 1
1 1203 . 17 1 1 A 98 98 VAL HA H 232 4.405 4.684 -0.279 1
1 1211 . 17 1 1 A 98 98 VAL C C 232 174.258 174.173 0.085 1
1 1212 . 17 1 1 A 98 98 VAL CA C 232 60.937 61.184 -0.247 1
1 1213 . 17 1 1 A 98 98 VAL CB C 232 35.825 34.064 1.761 1
1 1216 . 17 1 1 A 98 98 VAL N N 232 130.544 128.294 2.250 1
1 1217 . 17 1 1 A 99 99 LYS H H 233 8.800 8.807 -0.007 1
1 1218 . 17 1 1 A 99 99 LYS HA H 233 4.853 5.234 -0.381 1
1 1227 . 17 1 1 A 99 99 LYS C C 233 175.274 175.088 0.186 1
1 1228 . 17 1 1 A 99 99 LYS CA C 233 55.499 54.516 0.983 1
1 1229 . 17 1 1 A 99 99 LYS CB C 233 34.452 35.361 -0.909 1
1 1233 . 17 1 1 A 99 99 LYS N N 233 130.477 127.408 3.069 1
1 1234 . 17 1 1 A 100 100 SER H H 234 9.585 9.097 0.488 1
1 1235 . 17 1 1 A 100 100 SER HA H 234 5.150 4.965 0.185 1
1 1238 . 17 1 1 A 100 100 SER C C 234 175.493 174.216 1.277 1
1 1239 . 17 1 1 A 100 100 SER CA C 234 56.927 57.441 -0.514 1
1 1240 . 17 1 1 A 100 100 SER CB C 234 67.309 67.475 -0.166 1
1 1241 . 17 1 1 A 100 100 SER N N 234 125.814 123.304 2.510 1
1 1242 . 17 1 1 A 101 101 SER H H 235 8.631 8.624 0.007 1
1 1243 . 17 1 1 A 101 101 SER HA H 235 4.106 4.018 0.088 1
1 1246 . 17 1 1 A 101 101 SER C C 235 175.385 175.566 -0.181 1
1 1247 . 17 1 1 A 101 101 SER CA C 235 61.123 61.706 -0.583 1
1 1248 . 17 1 1 A 101 101 SER CB C 235 62.818 62.438 0.380 1
1 1249 . 17 1 1 A 101 101 SER N N 235 115.089 117.308 -2.219 1
1 1250 . 17 1 1 A 102 102 PHE H H 236 8.957 7.558 1.399 1
1 1251 . 17 1 1 A 102 102 PHE HA H 236 4.610 4.620 -0.010 1
1 1259 . 17 1 1 A 102 102 PHE C C 236 176.453 175.788 0.665 1
1 1260 . 17 1 1 A 102 102 PHE CA C 236 58.382 58.150 0.232 1
1 1261 . 17 1 1 A 102 102 PHE CB C 236 40.275 39.423 0.852 1
1 1263 . 17 1 1 A 102 102 PHE N N 236 119.917 117.913 2.004 1
1 1264 . 17 1 1 A 103 103 GLY H H 237 7.377 7.395 -0.018 1
1 1265 . 17 1 1 A 103 103 GLY HA2 H 237 4.453 4.022 0.431 1
1 1266 . 17 1 1 A 103 103 GLY HA3 H 237 3.472 4.170 -0.698 1
1 1267 . 17 1 1 A 103 103 GLY C C 237 169.627 172.446 -2.819 1
1 1268 . 17 1 1 A 103 103 GLY CA C 237 45.384 44.652 0.732 1
1 1269 . 17 1 1 A 103 103 GLY N N 237 108.809 106.295 2.514 1
1 1270 . 17 1 1 A 104 104 TYR H H 238 8.632 8.614 0.018 1
1 1271 . 17 1 1 A 104 104 TYR HA H 238 5.322 5.526 -0.204 1
1 1278 . 17 1 1 A 104 104 TYR C C 238 175.043 175.127 -0.084 1
1 1279 . 17 1 1 A 104 104 TYR CA C 238 57.627 57.173 0.454 1
1 1280 . 17 1 1 A 104 104 TYR CB C 238 41.711 41.674 0.037 1
1 1283 . 17 1 1 A 104 104 TYR N N 238 120.030 121.763 -1.733 1
1 1284 . 17 1 1 A 105 105 HIS H H 239 10.070 9.352 0.718 1
1 1285 . 17 1 1 A 105 105 HIS HA H 239 6.046 5.584 0.462 1
1 1290 . 17 1 1 A 105 105 HIS C C 239 175.734 174.595 1.139 1
1 1291 . 17 1 1 A 105 105 HIS CA C 239 53.945 54.654 -0.709 1
1 1292 . 17 1 1 A 105 105 HIS CB C 239 32.450 34.326 -1.876 1
1 1295 . 17 1 1 A 105 105 HIS N N 239 119.504 118.168 1.336 1
1 1296 . 17 1 1 A 106 106 ILE H H 240 8.660 8.616 0.044 1
1 1297 . 17 1 1 A 106 106 ILE HA H 240 4.120 4.888 -0.768 1
1 1307 . 17 1 1 A 106 106 ILE C C 240 174.758 175.546 -0.788 1
1 1308 . 17 1 1 A 106 106 ILE CA C 240 63.446 59.770 3.676 1
1 1309 . 17 1 1 A 106 106 ILE CB C 240 40.786 41.787 -1.001 1
1 1313 . 17 1 1 A 106 106 ILE N N 240 120.639 119.240 1.399 1
1 1314 . 17 1 1 A 107 107 ILE H H 241 9.033 9.177 -0.144 1
1 1315 . 17 1 1 A 107 107 ILE HA H 241 4.799 5.094 -0.295 1
1 1325 . 17 1 1 A 107 107 ILE C C 241 172.880 174.247 -1.367 1
1 1326 . 17 1 1 A 107 107 ILE CA C 241 60.563 59.532 1.031 1
1 1327 . 17 1 1 A 107 107 ILE CB C 241 41.652 40.546 1.106 1
1 1331 . 17 1 1 A 107 107 ILE N N 241 129.098 127.250 1.848 1
1 1332 . 17 1 1 A 108 108 LYS H H 242 8.692 8.988 -0.296 1
1 1333 . 17 1 1 A 108 108 LYS HA H 242 5.012 5.128 -0.116 1
1 1342 . 17 1 1 A 108 108 LYS C C 242 174.484 175.310 -0.826 1
1 1343 . 17 1 1 A 108 108 LYS CA C 242 54.317 54.003 0.314 1
1 1344 . 17 1 1 A 108 108 LYS CB C 242 35.619 35.560 0.059 1
1 1348 . 17 1 1 A 108 108 LYS N N 242 127.179 126.611 0.568 1
1 1349 . 17 1 1 A 109 109 ALA H H 243 7.816 8.990 -1.174 1
1 1350 . 17 1 1 A 109 109 ALA HA H 243 4.604 4.700 -0.096 1
1 1354 . 17 1 1 A 109 109 ALA C C 243 176.231 175.962 0.269 1
1 1355 . 17 1 1 A 109 109 ALA CA C 243 50.505 50.969 -0.464 1
1 1356 . 17 1 1 A 109 109 ALA CB C 243 19.584 19.923 -0.339 1
1 1357 . 17 1 1 A 109 109 ALA N N 243 129.619 128.009 1.610 1
1 1358 . 17 1 1 A 110 110 ASP H H 244 7.578 8.580 -1.002 1
1 1359 . 17 1 1 A 110 110 ASP HA H 244 4.424 4.942 -0.518 1
1 1362 . 17 1 1 A 110 110 ASP C C 244 175.259 175.705 -0.446 1
1 1363 . 17 1 1 A 110 110 ASP CA C 244 54.489 52.653 1.836 1
1 1364 . 17 1 1 A 110 110 ASP CB C 244 42.693 43.040 -0.347 1
1 1365 . 17 1 1 A 110 110 ASP N N 244 125.434 122.270 3.164 1
1 4 . 18 1 1 A 2 2 PRO HA H -4 4.403 4.696 -0.293 1
1 11 . 18 1 1 A 2 2 PRO C C -4 176.990 175.584 1.406 1
1 12 . 18 1 1 A 2 2 PRO CA C -4 63.131 62.749 0.382 1
1 13 . 18 1 1 A 2 2 PRO CB C -4 32.342 33.129 -0.787 1
1 16 . 18 1 1 A 3 3 LEU H H -3 8.483 8.628 -0.145 1
1 17 . 18 1 1 A 3 3 LEU HA H -3 4.333 4.803 -0.470 1
1 27 . 18 1 1 A 3 3 LEU C C -3 177.991 175.398 2.593 1
1 28 . 18 1 1 A 3 3 LEU CA C -3 55.314 54.165 1.149 1
1 29 . 18 1 1 A 3 3 LEU CB C -3 42.244 45.994 -3.750 1
1 33 . 18 1 1 A 3 3 LEU N N -3 122.986 121.655 1.331 1
1 34 . 18 1 1 A 4 4 GLY H H -2 8.397 8.755 -0.358 1
1 35 . 18 1 1 A 4 4 GLY HA2 H -2 4.024 3.967 0.057 1
1 36 . 18 1 1 A 4 4 GLY HA3 H -2 3.976 3.974 0.002 1
1 37 . 18 1 1 A 4 4 GLY C C -2 174.360 174.558 -0.198 1
1 38 . 18 1 1 A 4 4 GLY CA C -2 45.434 45.565 -0.131 1
1 39 . 18 1 1 A 4 4 GLY N N -2 110.666 114.600 -3.934 1
1 56 . 18 1 1 A 7 7 SER H H 141 7.913 7.608 0.305 1
1 57 . 18 1 1 A 7 7 SER HA H 141 5.657 5.490 0.167 1
1 60 . 18 1 1 A 7 7 SER C C 141 173.753 172.574 1.179 1
1 61 . 18 1 1 A 7 7 SER CA C 141 56.758 57.652 -0.894 1
1 62 . 18 1 1 A 7 7 SER CB C 141 66.774 66.349 0.425 1
1 63 . 18 1 1 A 7 7 SER N N 141 113.824 112.209 1.615 1
1 64 . 18 1 1 A 8 8 LYS H H 142 8.656 8.899 -0.243 1
1 65 . 18 1 1 A 8 8 LYS HA H 142 4.543 5.154 -0.611 1
1 74 . 18 1 1 A 8 8 LYS C C 142 174.403 174.093 0.310 1
1 75 . 18 1 1 A 8 8 LYS CA C 142 55.578 54.798 0.780 1
1 76 . 18 1 1 A 8 8 LYS CB C 142 36.561 36.022 0.539 1
1 80 . 18 1 1 A 8 8 LYS N N 142 123.076 119.149 3.927 1
1 81 . 18 1 1 A 9 9 LYS H H 143 8.623 8.204 0.419 1
1 82 . 18 1 1 A 9 9 LYS HA H 143 4.119 4.282 -0.163 1
1 91 . 18 1 1 A 9 9 LYS C C 143 176.144 175.487 0.657 1
1 92 . 18 1 1 A 9 9 LYS CA C 143 56.683 55.950 0.733 1
1 93 . 18 1 1 A 9 9 LYS CB C 143 32.580 32.591 -0.011 1
1 97 . 18 1 1 A 9 9 LYS N N 143 129.542 122.708 6.834 1
1 98 . 18 1 1 A 10 10 ALA H H 144 8.151 8.703 -0.552 1
1 99 . 18 1 1 A 10 10 ALA HA H 144 5.208 4.884 0.324 1
1 103 . 18 1 1 A 10 10 ALA C C 144 175.577 175.033 0.544 1
1 104 . 18 1 1 A 10 10 ALA CA C 144 51.226 51.181 0.045 1
1 105 . 18 1 1 A 10 10 ALA CB C 144 25.299 24.073 1.226 1
1 106 . 18 1 1 A 10 10 ALA N N 144 127.933 127.802 0.131 1
1 107 . 18 1 1 A 11 11 SER H H 145 8.679 8.752 -0.073 1
1 108 . 18 1 1 A 11 11 SER HA H 145 5.431 5.608 -0.177 1
1 111 . 18 1 1 A 11 11 SER C C 145 173.072 173.129 -0.057 1
1 112 . 18 1 1 A 11 11 SER CA C 145 57.772 57.089 0.683 1
1 113 . 18 1 1 A 11 11 SER CB C 145 67.301 65.977 1.324 1
1 114 . 18 1 1 A 11 11 SER N N 145 116.245 115.228 1.017 1
1 115 . 18 1 1 A 12 12 HIS H H 146 9.962 9.449 0.513 1
1 116 . 18 1 1 A 12 12 HIS HA H 146 6.332 6.003 0.329 1
1 121 . 18 1 1 A 12 12 HIS C C 146 173.006 172.521 0.485 1
1 122 . 18 1 1 A 12 12 HIS CA C 146 55.020 54.264 0.756 1
1 123 . 18 1 1 A 12 12 HIS CB C 146 37.071 33.387 3.684 1
1 126 . 18 1 1 A 12 12 HIS N N 146 119.181 118.452 0.729 1
1 127 . 18 1 1 A 13 13 ILE H H 147 8.976 8.964 0.012 1
1 128 . 18 1 1 A 13 13 ILE HA H 147 3.528 4.538 -1.010 1
1 138 . 18 1 1 A 13 13 ILE C C 147 173.010 173.765 -0.755 1
1 139 . 18 1 1 A 13 13 ILE CA C 147 61.273 59.684 1.589 1
1 140 . 18 1 1 A 13 13 ILE CB C 147 41.773 41.874 -0.101 1
1 144 . 18 1 1 A 13 13 ILE N N 147 121.873 119.560 2.313 1
1 145 . 18 1 1 A 14 14 LEU H H 148 7.627 8.983 -1.356 1
1 146 . 18 1 1 A 14 14 LEU HA H 148 4.814 4.969 -0.155 1
1 156 . 18 1 1 A 14 14 LEU C C 148 174.112 174.334 -0.222 1
1 157 . 18 1 1 A 14 14 LEU CA C 148 52.574 53.100 -0.526 1
1 158 . 18 1 1 A 14 14 LEU CB C 148 45.643 45.022 0.621 1
1 162 . 18 1 1 A 14 14 LEU N N 148 127.112 129.739 -2.627 1
1 163 . 18 1 1 A 15 15 ILE H H 149 9.524 9.351 0.173 1
1 164 . 18 1 1 A 15 15 ILE HA H 149 4.362 4.739 -0.377 1
1 174 . 18 1 1 A 15 15 ILE C C 149 175.452 175.283 0.169 1
1 175 . 18 1 1 A 15 15 ILE CA C 149 58.516 60.509 -1.993 1
1 176 . 18 1 1 A 15 15 ILE CB C 149 36.560 40.012 -3.452 1
1 180 . 18 1 1 A 15 15 ILE N N 149 128.652 126.903 1.749 1
1 181 . 18 1 1 A 16 16 LYS H H 150 8.035 8.523 -0.488 1
1 182 . 18 1 1 A 16 16 LYS HA H 150 4.319 4.608 -0.289 1
1 191 . 18 1 1 A 16 16 LYS C C 150 175.038 176.203 -1.165 1
1 192 . 18 1 1 A 16 16 LYS CA C 150 57.817 56.403 1.414 1
1 193 . 18 1 1 A 16 16 LYS CB C 150 34.853 33.092 1.761 1
1 197 . 18 1 1 A 16 16 LYS N N 150 129.153 127.641 1.512 1
1 198 . 18 1 1 A 17 17 VAL H H 151 8.016 8.975 -0.959 1
1 199 . 18 1 1 A 17 17 VAL HA H 151 4.873 4.857 0.016 1
1 207 . 18 1 1 A 17 17 VAL C C 151 176.647 175.321 1.326 1
1 208 . 18 1 1 A 17 17 VAL CA C 151 60.088 61.475 -1.387 1
1 209 . 18 1 1 A 17 17 VAL CB C 151 34.082 32.957 1.125 1
1 212 . 18 1 1 A 17 17 VAL N N 151 121.288 124.354 -3.066 1
1 213 . 18 1 1 A 18 18 LYS H H 152 8.443 8.914 -0.471 1
1 214 . 18 1 1 A 18 18 LYS HA H 152 4.334 4.792 -0.458 1
1 223 . 18 1 1 A 18 18 LYS C C 152 176.345 177.078 -0.733 1
1 224 . 18 1 1 A 18 18 LYS CA C 152 57.016 54.411 2.605 1
1 225 . 18 1 1 A 18 18 LYS CB C 152 33.222 35.013 -1.791 1
1 229 . 18 1 1 A 18 18 LYS N N 152 128.408 126.840 1.568 1
1 230 . 18 1 1 A 19 19 SER H H 153 9.067 8.836 0.231 1
1 231 . 18 1 1 A 19 19 SER HA H 153 4.457 4.512 -0.055 1
1 234 . 18 1 1 A 19 19 SER C C 153 174.236 174.358 -0.122 1
1 235 . 18 1 1 A 19 19 SER CA C 153 59.642 59.589 0.053 1
1 236 . 18 1 1 A 19 19 SER CB C 153 64.347 64.177 0.170 1
1 237 . 18 1 1 A 19 19 SER N N 153 121.522 115.859 5.663 1
1 238 . 18 1 1 A 20 20 LYS H H 154 7.961 7.665 0.296 1
1 239 . 18 1 1 A 20 20 LYS HA H 154 4.558 4.760 -0.202 1
1 244 . 18 1 1 A 20 20 LYS C C 154 177.256 176.154 1.102 1
1 245 . 18 1 1 A 20 20 LYS CA C 154 55.249 55.654 -0.405 1
1 246 . 18 1 1 A 20 20 LYS CB C 154 34.531 35.789 -1.258 1
1 248 . 18 1 1 A 20 20 LYS N N 154 120.270 119.987 0.283 1
1 249 . 18 1 1 A 21 21 LYS HA H 155 4.003 4.067 -0.064 1
1 258 . 18 1 1 A 21 21 LYS C C 155 177.015 178.354 -1.339 1
1 259 . 18 1 1 A 21 21 LYS CA C 155 59.091 58.607 0.484 1
1 260 . 18 1 1 A 21 21 LYS CB C 155 32.394 31.998 0.396 1
1 264 . 18 1 1 A 22 22 SER H H 156 7.625 7.770 -0.145 1
1 265 . 18 1 1 A 22 22 SER HA H 156 4.293 4.398 -0.105 1
1 268 . 18 1 1 A 22 22 SER C C 156 174.843 174.036 0.807 1
1 269 . 18 1 1 A 22 22 SER CA C 156 57.966 60.503 -2.537 1
1 270 . 18 1 1 A 22 22 SER CB C 156 63.369 63.433 -0.064 1
1 271 . 18 1 1 A 22 22 SER N N 156 109.549 114.756 -5.207 1
1 272 . 18 1 1 A 23 23 ASP H H 157 7.701 7.501 0.200 1
1 273 . 18 1 1 A 23 23 ASP HA H 157 4.548 4.606 -0.058 1
1 276 . 18 1 1 A 23 23 ASP C C 157 176.544 176.554 -0.010 1
1 277 . 18 1 1 A 23 23 ASP CA C 157 55.242 54.659 0.583 1
1 278 . 18 1 1 A 23 23 ASP CB C 157 41.103 41.985 -0.882 1
1 279 . 18 1 1 A 23 23 ASP N N 157 124.536 120.951 3.585 1
1 280 . 18 1 1 A 24 24 LYS H H 158 8.583 8.959 -0.376 1
1 281 . 18 1 1 A 24 24 LYS HA H 158 4.252 4.445 -0.193 1
1 290 . 18 1 1 A 24 24 LYS C C 158 176.813 177.616 -0.803 1
1 291 . 18 1 1 A 24 24 LYS CA C 158 57.148 56.545 0.603 1
1 292 . 18 1 1 A 24 24 LYS CB C 158 33.200 32.650 0.550 1
1 296 . 18 1 1 A 24 24 LYS N N 158 122.372 126.807 -4.435 1
1 297 . 18 1 1 A 25 25 GLU H H 159 8.001 8.210 -0.209 1
1 298 . 18 1 1 A 25 25 GLU HA H 159 4.521 4.137 0.384 1
1 303 . 18 1 1 A 25 25 GLU C C 159 175.995 176.452 -0.457 1
1 304 . 18 1 1 A 25 25 GLU CA C 159 55.727 58.976 -3.249 1
1 305 . 18 1 1 A 25 25 GLU CB C 159 31.918 30.688 1.230 1
1 307 . 18 1 1 A 25 25 GLU N N 159 118.705 119.452 -0.747 1
1 308 . 18 1 1 A 26 26 GLY H H 160 8.458 7.694 0.764 1
1 309 . 18 1 1 A 26 26 GLY HA2 H 160 3.946 4.067 -0.121 1
1 310 . 18 1 1 A 26 26 GLY HA3 H 160 3.511 4.078 -0.567 1
1 311 . 18 1 1 A 26 26 GLY C C 160 172.201 172.487 -0.286 1
1 312 . 18 1 1 A 26 26 GLY CA C 160 44.038 45.209 -1.171 1
1 313 . 18 1 1 A 26 26 GLY N N 160 107.642 106.983 0.659 1
1 314 . 18 1 1 A 27 27 LEU H H 161 8.259 8.471 -0.212 1
1 315 . 18 1 1 A 27 27 LEU HA H 161 4.775 5.173 -0.398 1
1 325 . 18 1 1 A 27 27 LEU C C 161 177.422 175.103 2.319 1
1 326 . 18 1 1 A 27 27 LEU CA C 161 53.322 53.245 0.077 1
1 327 . 18 1 1 A 27 27 LEU CB C 161 45.576 45.431 0.145 1
1 331 . 18 1 1 A 27 27 LEU N N 161 119.856 122.011 -2.155 1
1 332 . 18 1 1 A 28 28 ASP H H 162 8.848 8.669 0.179 1
1 333 . 18 1 1 A 28 28 ASP HA H 162 4.644 4.509 0.135 1
1 336 . 18 1 1 A 28 28 ASP C C 162 176.630 177.121 -0.491 1
1 337 . 18 1 1 A 28 28 ASP CA C 162 55.195 54.640 0.555 1
1 338 . 18 1 1 A 28 28 ASP CB C 162 41.673 42.776 -1.103 1
1 339 . 18 1 1 A 28 28 ASP N N 162 122.434 122.283 0.151 1
1 340 . 18 1 1 A 29 29 ASP H H 163 8.720 9.175 -0.455 1
1 341 . 18 1 1 A 29 29 ASP HA H 163 4.386 4.357 0.029 1
1 344 . 18 1 1 A 29 29 ASP C C 163 176.604 177.917 -1.313 1
1 345 . 18 1 1 A 29 29 ASP CA C 163 59.690 58.395 1.295 1
1 346 . 18 1 1 A 29 29 ASP CB C 163 42.964 41.241 1.723 1
1 347 . 18 1 1 A 29 29 ASP N N 163 121.460 126.657 -5.197 1
1 348 . 18 1 1 A 30 30 LYS H H 164 8.434 7.643 0.791 1
1 349 . 18 1 1 A 30 30 LYS HA H 164 3.901 3.957 -0.056 1
1 358 . 18 1 1 A 30 30 LYS C C 164 179.479 179.200 0.279 1
1 359 . 18 1 1 A 30 30 LYS CA C 164 60.047 59.470 0.577 1
1 360 . 18 1 1 A 30 30 LYS CB C 164 32.038 32.249 -0.211 1
1 364 . 18 1 1 A 30 30 LYS N N 164 116.627 119.469 -2.842 1
1 365 . 18 1 1 A 31 31 GLU H H 165 7.755 8.313 -0.558 1
1 366 . 18 1 1 A 31 31 GLU HA H 165 3.998 3.991 0.007 1
1 371 . 18 1 1 A 31 31 GLU C C 165 179.031 179.316 -0.285 1
1 372 . 18 1 1 A 31 31 GLU CA C 165 59.335 59.304 0.031 1
1 373 . 18 1 1 A 31 31 GLU CB C 165 29.972 29.278 0.694 1
1 375 . 18 1 1 A 31 31 GLU N N 165 120.456 119.878 0.578 1
1 376 . 18 1 1 A 32 32 ALA H H 166 9.060 8.591 0.469 1
1 377 . 18 1 1 A 32 32 ALA HA H 166 3.871 4.026 -0.155 1
1 381 . 18 1 1 A 32 32 ALA C C 166 178.029 178.963 -0.934 1
1 382 . 18 1 1 A 32 32 ALA CA C 166 54.997 55.441 -0.444 1
1 383 . 18 1 1 A 32 32 ALA CB C 166 19.727 18.407 1.320 1
1 384 . 18 1 1 A 32 32 ALA N N 166 124.406 122.360 2.046 1
1 385 . 18 1 1 A 33 33 LYS H H 167 8.228 7.783 0.445 1
1 386 . 18 1 1 A 33 33 LYS HA H 167 2.595 3.075 -0.480 1
1 395 . 18 1 1 A 33 33 LYS C C 167 177.938 178.024 -0.086 1
1 396 . 18 1 1 A 33 33 LYS CA C 167 59.573 59.332 0.241 1
1 397 . 18 1 1 A 33 33 LYS CB C 167 32.098 32.187 -0.089 1
1 401 . 18 1 1 A 33 33 LYS N N 167 119.833 118.294 1.539 1
1 402 . 18 1 1 A 34 34 GLN H H 168 7.392 7.771 -0.379 1
1 403 . 18 1 1 A 34 34 GLN HA H 168 3.943 3.894 0.049 1
1 410 . 18 1 1 A 34 34 GLN C C 168 178.323 178.537 -0.214 1
1 411 . 18 1 1 A 34 34 GLN CA C 168 58.883 59.337 -0.454 1
1 412 . 18 1 1 A 34 34 GLN CB C 168 28.485 28.117 0.368 1
1 414 . 18 1 1 A 34 34 GLN N N 168 117.208 117.862 -0.654 1
1 416 . 18 1 1 A 35 35 LYS H H 169 7.994 7.987 0.007 1
1 417 . 18 1 1 A 35 35 LYS HA H 169 4.067 3.989 0.078 1
1 426 . 18 1 1 A 35 35 LYS C C 169 178.161 178.549 -0.388 1
1 427 . 18 1 1 A 35 35 LYS CA C 169 58.437 59.256 -0.819 1
1 428 . 18 1 1 A 35 35 LYS CB C 169 31.611 32.265 -0.654 1
1 432 . 18 1 1 A 35 35 LYS N N 169 120.898 119.925 0.973 1
1 433 . 18 1 1 A 36 36 ALA H H 170 8.431 8.289 0.142 1
1 434 . 18 1 1 A 36 36 ALA HA H 170 3.738 4.022 -0.284 1
1 438 . 18 1 1 A 36 36 ALA C C 170 178.862 179.814 -0.952 1
1 439 . 18 1 1 A 36 36 ALA CA C 170 55.351 54.957 0.394 1
1 440 . 18 1 1 A 36 36 ALA CB C 170 18.295 18.595 -0.300 1
1 441 . 18 1 1 A 36 36 ALA N N 170 120.641 119.367 1.274 1
1 442 . 18 1 1 A 37 37 GLU H H 171 8.412 8.119 0.293 1
1 443 . 18 1 1 A 37 37 GLU HA H 171 3.867 3.933 -0.066 1
1 448 . 18 1 1 A 37 37 GLU C C 171 179.255 179.313 -0.058 1
1 449 . 18 1 1 A 37 37 GLU CA C 171 59.543 59.491 0.052 1
1 450 . 18 1 1 A 37 37 GLU CB C 171 29.569 29.668 -0.099 1
1 452 . 18 1 1 A 37 37 GLU N N 171 118.224 117.765 0.459 1
1 453 . 18 1 1 A 38 38 GLU H H 172 8.019 8.390 -0.371 1
1 454 . 18 1 1 A 38 38 GLU HA H 172 3.952 4.059 -0.107 1
1 459 . 18 1 1 A 38 38 GLU C C 172 180.250 178.464 1.786 1
1 460 . 18 1 1 A 38 38 GLU CA C 172 59.627 59.178 0.449 1
1 461 . 18 1 1 A 38 38 GLU CB C 172 29.368 28.819 0.549 1
1 463 . 18 1 1 A 38 38 GLU N N 172 121.250 118.530 2.720 1
1 464 . 18 1 1 A 39 39 ILE H H 173 8.174 7.593 0.581 1
1 465 . 18 1 1 A 39 39 ILE HA H 173 3.643 3.789 -0.146 1
1 475 . 18 1 1 A 39 39 ILE C C 173 177.568 177.910 -0.342 1
1 476 . 18 1 1 A 39 39 ILE CA C 173 64.869 63.678 1.191 1
1 477 . 18 1 1 A 39 39 ILE CB C 173 38.160 37.310 0.850 1
1 481 . 18 1 1 A 39 39 ILE N N 173 121.527 117.361 4.166 1
1 482 . 18 1 1 A 40 40 GLN H H 174 8.860 8.174 0.686 1
1 483 . 18 1 1 A 40 40 GLN HA H 174 3.533 3.995 -0.462 1
1 490 . 18 1 1 A 40 40 GLN C C 174 179.022 178.933 0.089 1
1 491 . 18 1 1 A 40 40 GLN CA C 174 61.316 59.172 2.144 1
1 492 . 18 1 1 A 40 40 GLN CB C 174 26.604 28.284 -1.680 1
1 494 . 18 1 1 A 40 40 GLN N N 174 121.956 121.024 0.932 1
1 496 . 18 1 1 A 41 41 LYS H H 175 7.879 7.953 -0.074 1
1 497 . 18 1 1 A 41 41 LYS HA H 175 3.777 4.144 -0.367 1
1 506 . 18 1 1 A 41 41 LYS C C 175 178.779 179.108 -0.329 1
1 507 . 18 1 1 A 41 41 LYS CA C 175 59.701 58.882 0.819 1
1 508 . 18 1 1 A 41 41 LYS CB C 175 32.581 32.434 0.147 1
1 512 . 18 1 1 A 41 41 LYS N N 175 119.012 118.134 0.878 1
1 513 . 18 1 1 A 42 42 GLU H H 176 7.447 7.760 -0.313 1
1 514 . 18 1 1 A 42 42 GLU HA H 176 4.059 4.170 -0.111 1
1 519 . 18 1 1 A 42 42 GLU C C 176 180.058 178.832 1.226 1
1 520 . 18 1 1 A 42 42 GLU CA C 176 59.456 58.955 0.501 1
1 521 . 18 1 1 A 42 42 GLU CB C 176 29.923 30.234 -0.311 1
1 523 . 18 1 1 A 42 42 GLU N N 176 120.054 119.110 0.944 1
1 524 . 18 1 1 A 43 43 VAL H H 177 8.618 7.951 0.667 1
1 525 . 18 1 1 A 43 43 VAL HA H 177 3.986 3.898 0.088 1
1 533 . 18 1 1 A 43 43 VAL C C 177 176.459 177.681 -1.222 1
1 534 . 18 1 1 A 43 43 VAL CA C 177 63.923 64.838 -0.915 1
1 535 . 18 1 1 A 43 43 VAL CB C 177 31.899 31.439 0.460 1
1 538 . 18 1 1 A 43 43 VAL N N 177 114.191 117.023 -2.832 1
1 539 . 18 1 1 A 44 44 SER H H 178 8.052 8.454 -0.402 1
1 540 . 18 1 1 A 44 44 SER HA H 178 4.098 4.228 -0.130 1
1 543 . 18 1 1 A 44 44 SER C C 178 176.548 175.968 0.580 1
1 544 . 18 1 1 A 44 44 SER CA C 178 61.160 61.620 -0.460 1
1 545 . 18 1 1 A 44 44 SER CB C 178 62.959 62.574 0.385 1
1 546 . 18 1 1 A 44 44 SER N N 178 114.202 115.893 -1.691 1
1 547 . 18 1 1 A 45 45 LYS H H 179 7.083 8.135 -1.052 1
1 548 . 18 1 1 A 45 45 LYS HA H 179 4.140 4.221 -0.081 1
1 557 . 18 1 1 A 45 45 LYS C C 179 177.288 176.143 1.145 1
1 558 . 18 1 1 A 45 45 LYS CA C 179 58.469 57.969 0.500 1
1 559 . 18 1 1 A 45 45 LYS CB C 179 32.671 31.984 0.687 1
1 563 . 18 1 1 A 45 45 LYS N N 179 120.935 117.484 3.451 1
1 564 . 18 1 1 A 46 46 ASP H H 180 7.098 7.865 -0.767 1
1 565 . 18 1 1 A 46 46 ASP HA H 180 4.917 4.987 -0.070 1
1 568 . 18 1 1 A 46 46 ASP CA C 180 51.492 51.682 -0.190 1
1 569 . 18 1 1 A 46 46 ASP CB C 180 40.595 41.248 -0.653 1
1 570 . 18 1 1 A 46 46 ASP N N 180 112.836 120.387 -7.551 1
1 571 . 18 1 1 A 47 47 PRO HA H 181 4.681 4.394 0.287 1
1 578 . 18 1 1 A 47 47 PRO C C 181 179.248 177.784 1.464 1
1 579 . 18 1 1 A 47 47 PRO CA C 181 64.718 64.528 0.190 1
1 580 . 18 1 1 A 47 47 PRO CB C 181 32.159 32.007 0.152 1
1 583 . 18 1 1 A 48 48 SER H H 182 8.248 7.975 0.273 1
1 584 . 18 1 1 A 48 48 SER HA H 182 4.378 4.313 0.065 1
1 587 . 18 1 1 A 48 48 SER C C 182 176.071 175.711 0.360 1
1 588 . 18 1 1 A 48 48 SER CA C 182 61.377 60.739 0.638 1
1 589 . 18 1 1 A 48 48 SER CB C 182 62.455 63.023 -0.568 1
1 590 . 18 1 1 A 48 48 SER N N 182 116.986 113.297 3.689 1
1 591 . 18 1 1 A 49 49 LYS H H 183 7.842 7.519 0.323 1
1 592 . 18 1 1 A 49 49 LYS HA H 183 4.482 4.276 0.206 1
1 601 . 18 1 1 A 49 49 LYS C C 183 175.605 177.945 -2.340 1
1 602 . 18 1 1 A 49 49 LYS CA C 183 55.824 57.386 -1.562 1
1 603 . 18 1 1 A 49 49 LYS CB C 183 32.834 32.694 0.140 1
1 607 . 18 1 1 A 49 49 LYS N N 183 121.698 120.120 1.578 1
1 608 . 18 1 1 A 50 50 PHE H H 184 7.634 7.974 -0.340 1
1 609 . 18 1 1 A 50 50 PHE HA H 184 3.510 4.263 -0.753 1
1 617 . 18 1 1 A 50 50 PHE C C 184 176.214 177.966 -1.752 1
1 618 . 18 1 1 A 50 50 PHE CA C 184 63.276 61.077 2.199 1
1 619 . 18 1 1 A 50 50 PHE CB C 184 40.948 38.883 2.065 1
1 623 . 18 1 1 A 50 50 PHE N N 184 120.120 121.857 -1.737 1
1 624 . 18 1 1 A 51 51 GLY H H 185 8.855 8.678 0.177 1
1 625 . 18 1 1 A 51 51 GLY HA2 H 185 3.993 3.948 0.045 1
1 626 . 18 1 1 A 51 51 GLY HA3 H 185 3.958 4.000 -0.042 1
1 627 . 18 1 1 A 51 51 GLY C C 185 175.169 175.725 -0.556 1
1 628 . 18 1 1 A 51 51 GLY CA C 185 47.475 46.867 0.608 1
1 629 . 18 1 1 A 51 51 GLY N N 185 105.550 106.131 -0.581 1
1 630 . 18 1 1 A 52 52 GLU H H 186 7.917 7.823 0.094 1
1 631 . 18 1 1 A 52 52 GLU HA H 186 4.006 4.209 -0.203 1
1 636 . 18 1 1 A 52 52 GLU C C 186 179.499 179.154 0.345 1
1 637 . 18 1 1 A 52 52 GLU CA C 186 58.904 59.144 -0.240 1
1 638 . 18 1 1 A 52 52 GLU CB C 186 29.700 29.484 0.216 1
1 640 . 18 1 1 A 52 52 GLU N N 186 121.929 120.074 1.855 1
1 641 . 18 1 1 A 53 53 ILE H H 187 7.936 8.025 -0.089 1
1 642 . 18 1 1 A 53 53 ILE HA H 187 3.648 3.712 -0.064 1
1 652 . 18 1 1 A 53 53 ILE C C 187 177.886 177.958 -0.072 1
1 653 . 18 1 1 A 53 53 ILE CA C 187 64.366 64.834 -0.468 1
1 654 . 18 1 1 A 53 53 ILE CB C 187 36.478 37.594 -1.116 1
1 658 . 18 1 1 A 53 53 ILE N N 187 120.991 122.180 -1.189 1
1 659 . 18 1 1 A 54 54 ALA H H 188 8.895 8.583 0.312 1
1 660 . 18 1 1 A 54 54 ALA HA H 188 3.629 3.758 -0.129 1
1 664 . 18 1 1 A 54 54 ALA C C 188 179.437 179.387 0.050 1
1 665 . 18 1 1 A 54 54 ALA CA C 188 55.974 55.512 0.462 1
1 666 . 18 1 1 A 54 54 ALA CB C 188 17.591 18.397 -0.806 1
1 667 . 18 1 1 A 54 54 ALA N N 188 125.308 122.425 2.883 1
1 668 . 18 1 1 A 55 55 LYS H H 189 8.049 7.855 0.194 1
1 669 . 18 1 1 A 55 55 LYS HA H 189 4.106 3.903 0.203 1
1 678 . 18 1 1 A 55 55 LYS C C 189 178.995 177.977 1.018 1
1 679 . 18 1 1 A 55 55 LYS CA C 189 59.312 59.208 0.104 1
1 680 . 18 1 1 A 55 55 LYS CB C 189 32.647 31.886 0.761 1
1 684 . 18 1 1 A 55 55 LYS N N 189 116.835 118.359 -1.524 1
1 685 . 18 1 1 A 56 56 LYS H H 190 7.215 7.767 -0.552 1
1 686 . 18 1 1 A 56 56 LYS HA H 190 4.172 4.373 -0.201 1
1 695 . 18 1 1 A 56 56 LYS C C 190 177.897 177.993 -0.096 1
1 696 . 18 1 1 A 56 56 LYS CA C 190 58.418 57.309 1.109 1
1 697 . 18 1 1 A 56 56 LYS CB C 190 34.652 33.531 1.121 1
1 701 . 18 1 1 A 56 56 LYS N N 190 117.170 117.991 -0.821 1
1 702 . 18 1 1 A 57 57 GLU H H 191 8.572 8.018 0.554 1
1 703 . 18 1 1 A 57 57 GLU HA H 191 4.643 4.359 0.284 1
1 708 . 18 1 1 A 57 57 GLU C C 191 177.903 176.059 1.844 1
1 709 . 18 1 1 A 57 57 GLU CA C 191 55.708 56.321 -0.613 1
1 710 . 18 1 1 A 57 57 GLU CB C 191 32.460 30.814 1.646 1
1 712 . 18 1 1 A 57 57 GLU N N 191 113.316 117.137 -3.821 1
1 713 . 18 1 1 A 58 58 SER H H 192 8.550 7.629 0.921 1
1 714 . 18 1 1 A 58 58 SER HA H 192 4.149 4.384 -0.235 1
1 717 . 18 1 1 A 58 58 SER C C 192 176.161 175.105 1.056 1
1 718 . 18 1 1 A 58 58 SER CA C 192 58.403 58.171 0.232 1
1 719 . 18 1 1 A 58 58 SER CB C 192 64.392 64.326 0.066 1
1 720 . 18 1 1 A 58 58 SER N N 192 109.861 115.656 -5.795 1
1 721 . 18 1 1 A 59 59 MET H H 193 9.533 8.938 0.595 1
1 722 . 18 1 1 A 59 59 MET HA H 193 4.457 4.602 -0.145 1
1 730 . 18 1 1 A 59 59 MET C C 193 175.204 175.512 -0.308 1
1 731 . 18 1 1 A 59 59 MET CA C 193 55.781 54.927 0.854 1
1 732 . 18 1 1 A 59 59 MET CB C 193 32.855 32.488 0.367 1
1 735 . 18 1 1 A 59 59 MET N N 193 124.493 123.294 1.199 1
1 736 . 18 1 1 A 60 60 ASP H H 194 7.514 7.433 0.081 1
1 737 . 18 1 1 A 60 60 ASP HA H 194 4.886 4.585 0.301 1
1 740 . 18 1 1 A 60 60 ASP C C 194 175.517 176.665 -1.148 1
1 741 . 18 1 1 A 60 60 ASP CA C 194 52.286 53.194 -0.908 1
1 742 . 18 1 1 A 60 60 ASP CB C 194 40.222 40.495 -0.273 1
1 743 . 18 1 1 A 60 60 ASP N N 194 117.785 122.090 -4.305 1
1 744 . 18 1 1 A 61 61 THR H H 195 8.118 8.381 -0.263 1
1 745 . 18 1 1 A 61 61 THR HA H 195 3.918 3.948 -0.030 1
1 750 . 18 1 1 A 61 61 THR C C 195 176.269 177.223 -0.954 1
1 751 . 18 1 1 A 61 61 THR CA C 195 65.469 65.364 0.105 1
1 752 . 18 1 1 A 61 61 THR CB C 195 68.741 68.320 0.421 1
1 754 . 18 1 1 A 61 61 THR N N 195 120.765 118.719 2.046 1
1 755 . 18 1 1 A 62 62 GLY H H 196 8.399 8.571 -0.172 1
1 756 . 18 1 1 A 62 62 GLY HA2 H 196 3.932 3.861 0.071 1
1 757 . 18 1 1 A 62 62 GLY HA3 H 196 3.900 3.863 0.037 1
1 758 . 18 1 1 A 62 62 GLY C C 196 174.948 176.789 -1.841 1
1 759 . 18 1 1 A 62 62 GLY CA C 196 46.768 47.319 -0.551 1
1 760 . 18 1 1 A 62 62 GLY N N 196 108.183 111.295 -3.112 1
1 761 . 18 1 1 A 63 63 SER H H 197 7.265 8.216 -0.951 1
1 762 . 18 1 1 A 63 63 SER HA H 197 4.554 4.453 0.101 1
1 765 . 18 1 1 A 63 63 SER C C 197 177.630 176.102 1.528 1
1 766 . 18 1 1 A 63 63 SER CA C 197 59.550 62.203 -2.653 1
1 767 . 18 1 1 A 63 63 SER CB C 197 65.504 63.473 2.031 1
1 768 . 18 1 1 A 63 63 SER N N 197 111.815 119.404 -7.589 1
1 769 . 18 1 1 A 64 64 ALA H H 198 8.675 8.400 0.275 1
1 770 . 18 1 1 A 64 64 ALA HA H 198 3.801 3.993 -0.192 1
1 774 . 18 1 1 A 64 64 ALA C C 198 178.492 179.523 -1.031 1
1 775 . 18 1 1 A 64 64 ALA CA C 198 56.794 55.345 1.449 1
1 776 . 18 1 1 A 64 64 ALA CB C 198 18.951 18.498 0.453 1
1 777 . 18 1 1 A 64 64 ALA N N 198 131.710 123.410 8.300 1
1 778 . 18 1 1 A 65 65 LYS H H 199 7.666 7.994 -0.328 1
1 779 . 18 1 1 A 65 65 LYS HA H 199 4.175 4.117 0.058 1
1 788 . 18 1 1 A 65 65 LYS C C 199 177.159 177.455 -0.296 1
1 789 . 18 1 1 A 65 65 LYS CA C 199 57.735 58.881 -1.146 1
1 790 . 18 1 1 A 65 65 LYS CB C 199 31.948 31.566 0.382 1
1 794 . 18 1 1 A 65 65 LYS N N 199 111.375 115.832 -4.457 1
1 795 . 18 1 1 A 66 66 LYS H H 200 7.545 7.430 0.115 1
1 796 . 18 1 1 A 66 66 LYS HA H 200 4.612 4.481 0.131 1
1 805 . 18 1 1 A 66 66 LYS C C 200 175.609 175.774 -0.165 1
1 806 . 18 1 1 A 66 66 LYS CA C 200 54.468 55.761 -1.293 1
1 807 . 18 1 1 A 66 66 LYS CB C 200 31.525 32.929 -1.404 1
1 811 . 18 1 1 A 66 66 LYS N N 200 121.421 120.009 1.412 1
1 812 . 18 1 1 A 67 67 ASP H H 201 7.630 8.244 -0.614 1
1 813 . 18 1 1 A 67 67 ASP HA H 201 4.306 4.413 -0.107 1
1 816 . 18 1 1 A 67 67 ASP C C 201 175.025 176.327 -1.302 1
1 817 . 18 1 1 A 67 67 ASP CA C 201 56.400 55.377 1.023 1
1 818 . 18 1 1 A 67 67 ASP CB C 201 38.315 39.010 -0.695 1
1 819 . 18 1 1 A 67 67 ASP N N 201 116.216 117.230 -1.014 1
1 820 . 18 1 1 A 68 68 GLY H H 202 8.368 8.616 -0.248 1
1 821 . 18 1 1 A 68 68 GLY HA2 H 202 4.316 3.951 0.365 1
1 822 . 18 1 1 A 68 68 GLY HA3 H 202 3.731 4.019 -0.288 1
1 823 . 18 1 1 A 68 68 GLY C C 202 174.139 174.634 -0.495 1
1 824 . 18 1 1 A 68 68 GLY CA C 202 45.514 45.290 0.224 1
1 825 . 18 1 1 A 68 68 GLY N N 202 105.095 105.136 -0.041 1
1 826 . 18 1 1 A 69 69 GLU H H 203 7.534 8.037 -0.503 1
1 827 . 18 1 1 A 69 69 GLU HA H 203 4.479 4.457 0.022 1
1 832 . 18 1 1 A 69 69 GLU C C 203 176.961 176.071 0.890 1
1 833 . 18 1 1 A 69 69 GLU CA C 203 58.549 56.332 2.217 1
1 834 . 18 1 1 A 69 69 GLU CB C 203 30.998 30.598 0.400 1
1 836 . 18 1 1 A 69 69 GLU N N 203 120.426 119.848 0.578 1
1 837 . 18 1 1 A 70 70 LEU H H 204 8.962 9.169 -0.207 1
1 838 . 18 1 1 A 70 70 LEU HA H 204 4.438 4.607 -0.169 1
1 848 . 18 1 1 A 70 70 LEU C C 204 178.648 177.173 1.475 1
1 849 . 18 1 1 A 70 70 LEU CA C 204 53.977 55.151 -1.174 1
1 850 . 18 1 1 A 70 70 LEU CB C 204 43.612 43.538 0.074 1
1 854 . 18 1 1 A 70 70 LEU N N 204 122.066 123.883 -1.817 1
1 855 . 18 1 1 A 71 71 GLY H H 205 8.104 7.529 0.575 1
1 856 . 18 1 1 A 71 71 GLY HA2 H 205 4.165 4.075 0.090 1
1 857 . 18 1 1 A 71 71 GLY HA3 H 205 3.552 4.141 -0.589 1
1 858 . 18 1 1 A 71 71 GLY C C 205 173.098 173.357 -0.259 1
1 859 . 18 1 1 A 71 71 GLY CA C 205 44.723 44.952 -0.229 1
1 860 . 18 1 1 A 71 71 GLY N N 205 110.168 106.537 3.631 1
1 861 . 18 1 1 A 72 72 TYR H H 206 8.457 8.569 -0.112 1
1 862 . 18 1 1 A 72 72 TYR HA H 206 4.184 4.882 -0.698 1
1 869 . 18 1 1 A 72 72 TYR C C 206 175.975 175.553 0.422 1
1 870 . 18 1 1 A 72 72 TYR CA C 206 59.722 59.062 0.660 1
1 871 . 18 1 1 A 72 72 TYR CB C 206 38.378 38.364 0.014 1
1 874 . 18 1 1 A 72 72 TYR N N 206 120.171 122.027 -1.856 1
1 875 . 18 1 1 A 73 73 VAL H H 207 8.782 9.047 -0.265 1
1 876 . 18 1 1 A 73 73 VAL HA H 207 4.056 4.488 -0.432 1
1 884 . 18 1 1 A 73 73 VAL C C 207 174.901 175.566 -0.665 1
1 885 . 18 1 1 A 73 73 VAL CA C 207 62.202 62.157 0.045 1
1 886 . 18 1 1 A 73 73 VAL CB C 207 33.071 32.479 0.592 1
1 889 . 18 1 1 A 73 73 VAL N N 207 128.847 124.605 4.242 1
1 890 . 18 1 1 A 74 74 LEU H H 208 8.146 8.957 -0.811 1
1 891 . 18 1 1 A 74 74 LEU HA H 208 4.944 5.129 -0.185 1
1 901 . 18 1 1 A 74 74 LEU C C 208 178.400 177.085 1.315 1
1 902 . 18 1 1 A 74 74 LEU CA C 208 53.520 53.296 0.224 1
1 903 . 18 1 1 A 74 74 LEU CB C 208 43.499 44.320 -0.821 1
1 907 . 18 1 1 A 74 74 LEU N N 208 127.599 128.427 -0.828 1
1 908 . 18 1 1 A 75 75 LYS H H 209 8.403 8.560 -0.157 1
1 909 . 18 1 1 A 75 75 LYS HA H 209 3.771 3.784 -0.013 1
1 918 . 18 1 1 A 75 75 LYS C C 209 177.536 177.328 0.208 1
1 919 . 18 1 1 A 75 75 LYS CA C 209 58.385 58.821 -0.436 1
1 920 . 18 1 1 A 75 75 LYS CB C 209 32.459 31.923 0.536 1
1 924 . 18 1 1 A 75 75 LYS N N 209 123.798 122.854 0.944 1
1 925 . 18 1 1 A 76 76 GLY H H 210 9.997 9.421 0.576 1
1 926 . 18 1 1 A 76 76 GLY HA2 H 210 4.255 3.984 0.271 1
1 927 . 18 1 1 A 76 76 GLY HA3 H 210 3.791 3.985 -0.194 1
1 928 . 18 1 1 A 76 76 GLY C C 210 175.091 175.730 -0.639 1
1 929 . 18 1 1 A 76 76 GLY CA C 210 45.465 45.403 0.062 1
1 930 . 18 1 1 A 76 76 GLY N N 210 114.705 113.127 1.578 1
1 931 . 18 1 1 A 77 77 GLN H H 211 7.726 8.104 -0.378 1
1 932 . 18 1 1 A 77 77 GLN HA H 211 4.373 4.208 0.165 1
1 939 . 18 1 1 A 77 77 GLN C C 211 176.301 175.935 0.366 1
1 940 . 18 1 1 A 77 77 GLN CA C 211 57.074 57.123 -0.049 1
1 941 . 18 1 1 A 77 77 GLN CB C 211 30.798 29.337 1.461 1
1 943 . 18 1 1 A 77 77 GLN N N 211 118.702 117.925 0.777 1
1 945 . 18 1 1 A 78 78 THR H H 212 8.225 7.498 0.727 1
1 946 . 18 1 1 A 78 78 THR HA H 212 4.620 4.639 -0.019 1
1 951 . 18 1 1 A 78 78 THR C C 212 173.920 174.249 -0.329 1
1 952 . 18 1 1 A 78 78 THR CA C 212 60.087 59.441 0.646 1
1 953 . 18 1 1 A 78 78 THR CB C 212 71.412 70.915 0.497 1
1 955 . 18 1 1 A 78 78 THR N N 212 111.935 110.904 1.031 1
1 956 . 18 1 1 A 79 79 ASP H H 213 8.372 8.507 -0.135 1
1 957 . 18 1 1 A 79 79 ASP HA H 213 4.470 4.613 -0.143 1
1 960 . 18 1 1 A 79 79 ASP C C 213 176.759 177.763 -1.004 1
1 961 . 18 1 1 A 79 79 ASP CA C 213 54.927 54.371 0.556 1
1 962 . 18 1 1 A 79 79 ASP CB C 213 43.859 41.725 2.134 1
1 963 . 18 1 1 A 79 79 ASP N N 213 122.093 121.278 0.815 1
1 964 . 18 1 1 A 80 80 LYS H H 214 8.740 8.905 -0.165 1
1 965 . 18 1 1 A 80 80 LYS HA H 214 4.027 3.912 0.115 1
1 974 . 18 1 1 A 80 80 LYS C C 214 178.493 178.055 0.438 1
1 975 . 18 1 1 A 80 80 LYS CA C 214 59.802 59.702 0.100 1
1 976 . 18 1 1 A 80 80 LYS CB C 214 32.374 32.342 0.032 1
1 980 . 18 1 1 A 80 80 LYS N N 214 124.685 122.837 1.848 1
1 981 . 18 1 1 A 81 81 ASP H H 215 8.556 8.003 0.553 1
1 982 . 18 1 1 A 81 81 ASP HA H 215 4.566 4.499 0.067 1
1 985 . 18 1 1 A 81 81 ASP C C 215 178.889 178.454 0.435 1
1 986 . 18 1 1 A 81 81 ASP CA C 215 58.046 56.778 1.268 1
1 987 . 18 1 1 A 81 81 ASP CB C 215 40.872 40.566 0.306 1
1 988 . 18 1 1 A 81 81 ASP N N 215 121.413 119.097 2.316 1
1 989 . 18 1 1 A 82 82 PHE H H 216 8.205 8.229 -0.024 1
1 990 . 18 1 1 A 82 82 PHE HA H 216 3.686 4.109 -0.423 1
1 998 . 18 1 1 A 82 82 PHE C C 216 175.919 177.389 -1.470 1
1 999 . 18 1 1 A 82 82 PHE CA C 216 61.648 60.729 0.919 1
1 1000 . 18 1 1 A 82 82 PHE CB C 216 39.743 39.148 0.595 1
1 1004 . 18 1 1 A 82 82 PHE N N 216 124.401 122.955 1.446 1
1 1005 . 18 1 1 A 83 83 GLU H H 217 8.887 8.896 -0.009 1
1 1006 . 18 1 1 A 83 83 GLU HA H 217 3.704 4.205 -0.501 1
1 1011 . 18 1 1 A 83 83 GLU C C 217 177.788 178.870 -1.082 1
1 1012 . 18 1 1 A 83 83 GLU CA C 217 60.545 60.331 0.214 1
1 1013 . 18 1 1 A 83 83 GLU CB C 217 30.639 29.524 1.115 1
1 1015 . 18 1 1 A 83 83 GLU N N 217 119.421 119.255 0.166 1
1 1016 . 18 1 1 A 84 84 LYS H H 218 8.055 7.810 0.245 1
1 1017 . 18 1 1 A 84 84 LYS HA H 218 3.947 4.086 -0.139 1
1 1026 . 18 1 1 A 84 84 LYS C C 218 178.783 178.813 -0.030 1
1 1027 . 18 1 1 A 84 84 LYS CA C 218 59.327 59.041 0.286 1
1 1028 . 18 1 1 A 84 84 LYS CB C 218 32.539 32.289 0.250 1
1 1032 . 18 1 1 A 84 84 LYS N N 218 117.821 119.590 -1.769 1
1 1033 . 18 1 1 A 85 85 ALA H H 219 7.059 7.665 -0.606 1
1 1034 . 18 1 1 A 85 85 ALA HA H 219 4.040 4.034 0.006 1
1 1038 . 18 1 1 A 85 85 ALA C C 219 179.794 180.003 -0.209 1
1 1039 . 18 1 1 A 85 85 ALA CA C 219 54.407 54.904 -0.497 1
1 1040 . 18 1 1 A 85 85 ALA CB C 219 20.130 18.347 1.783 1
1 1041 . 18 1 1 A 85 85 ALA N N 219 118.905 121.510 -2.605 1
1 1042 . 18 1 1 A 86 86 LEU H H 220 8.157 8.355 -0.198 1
1 1043 . 18 1 1 A 86 86 LEU HA H 220 3.692 3.966 -0.274 1
1 1053 . 18 1 1 A 86 86 LEU C C 220 178.330 178.528 -0.198 1
1 1054 . 18 1 1 A 86 86 LEU CA C 220 57.752 58.051 -0.299 1
1 1055 . 18 1 1 A 86 86 LEU CB C 220 41.464 41.787 -0.323 1
1 1059 . 18 1 1 A 86 86 LEU N N 220 118.606 120.177 -1.571 1
1 1060 . 18 1 1 A 87 87 PHE H H 221 8.349 8.135 0.214 1
1 1061 . 18 1 1 A 87 87 PHE HA H 221 3.861 4.531 -0.670 1
1 1069 . 18 1 1 A 87 87 PHE C C 221 176.176 177.766 -1.590 1
1 1070 . 18 1 1 A 87 87 PHE CA C 221 61.780 61.360 0.420 1
1 1071 . 18 1 1 A 87 87 PHE CB C 221 37.549 37.907 -0.358 1
1 1075 . 18 1 1 A 87 87 PHE N N 221 112.449 116.728 -4.279 1
1 1076 . 18 1 1 A 88 88 LYS H H 222 7.061 7.762 -0.701 1
1 1077 . 18 1 1 A 88 88 LYS HA H 222 4.380 4.171 0.209 1
1 1086 . 18 1 1 A 88 88 LYS C C 222 177.089 177.204 -0.115 1
1 1087 . 18 1 1 A 88 88 LYS CA C 222 56.726 58.412 -1.686 1
1 1088 . 18 1 1 A 88 88 LYS CB C 222 33.738 32.319 1.419 1
1 1092 . 18 1 1 A 88 88 LYS N N 222 118.308 121.036 -2.728 1
1 1093 . 18 1 1 A 89 89 LEU H H 223 7.270 7.144 0.126 1
1 1094 . 18 1 1 A 89 89 LEU HA H 223 4.168 4.144 0.024 1
1 1104 . 18 1 1 A 89 89 LEU C C 223 177.528 177.057 0.471 1
1 1105 . 18 1 1 A 89 89 LEU CA C 223 55.279 55.189 0.090 1
1 1106 . 18 1 1 A 89 89 LEU CB C 223 43.240 42.224 1.016 1
1 1110 . 18 1 1 A 89 89 LEU N N 223 121.317 122.299 -0.982 1
1 1111 . 18 1 1 A 90 90 LYS H H 224 8.788 8.438 0.350 1
1 1112 . 18 1 1 A 90 90 LYS HA H 224 4.359 4.317 0.042 1
1 1121 . 18 1 1 A 90 90 LYS C C 224 175.839 176.716 -0.877 1
1 1122 . 18 1 1 A 90 90 LYS CA C 224 54.772 55.890 -1.118 1
1 1123 . 18 1 1 A 90 90 LYS CB C 224 33.232 33.206 0.026 1
1 1127 . 18 1 1 A 90 90 LYS N N 224 123.558 122.434 1.124 1
1 1128 . 18 1 1 A 91 91 ASP H H 225 8.125 8.827 -0.702 1
1 1129 . 18 1 1 A 91 91 ASP HA H 225 3.958 4.146 -0.188 1
1 1132 . 18 1 1 A 91 91 ASP C C 225 177.452 177.028 0.424 1
1 1133 . 18 1 1 A 91 91 ASP CA C 225 56.642 56.234 0.408 1
1 1134 . 18 1 1 A 91 91 ASP CB C 225 40.269 40.203 0.066 1
1 1135 . 18 1 1 A 91 91 ASP N N 225 119.419 122.510 -3.091 1
1 1136 . 18 1 1 A 92 92 GLY H H 226 8.681 8.844 -0.163 1
1 1137 . 18 1 1 A 92 92 GLY HA2 H 226 4.131 3.865 0.266 1
1 1138 . 18 1 1 A 92 92 GLY HA3 H 226 3.579 3.891 -0.312 1
1 1139 . 18 1 1 A 92 92 GLY C C 226 173.614 173.917 -0.303 1
1 1140 . 18 1 1 A 92 92 GLY CA C 226 45.564 44.971 0.593 1
1 1141 . 18 1 1 A 92 92 GLY N N 226 113.802 111.702 2.100 1
1 1142 . 18 1 1 A 93 93 GLU H H 227 8.104 8.037 0.067 1
1 1143 . 18 1 1 A 93 93 GLU HA H 227 4.232 4.438 -0.206 1
1 1148 . 18 1 1 A 93 93 GLU C C 227 174.282 175.477 -1.195 1
1 1149 . 18 1 1 A 93 93 GLU CA C 227 56.651 55.919 0.732 1
1 1150 . 18 1 1 A 93 93 GLU CB C 227 32.190 31.069 1.121 1
1 1152 . 18 1 1 A 93 93 GLU N N 227 121.527 121.824 -0.297 1
1 1153 . 18 1 1 A 94 94 VAL H H 228 7.918 8.499 -0.581 1
1 1154 . 18 1 1 A 94 94 VAL HA H 228 4.857 4.723 0.134 1
1 1162 . 18 1 1 A 94 94 VAL C C 228 176.556 175.688 0.868 1
1 1163 . 18 1 1 A 94 94 VAL CA C 228 60.309 60.406 -0.097 1
1 1164 . 18 1 1 A 94 94 VAL CB C 228 33.847 35.190 -1.343 1
1 1167 . 18 1 1 A 94 94 VAL N N 228 119.768 126.049 -6.281 1
1 1168 . 18 1 1 A 95 95 SER H H 229 9.659 9.445 0.214 1
1 1169 . 18 1 1 A 95 95 SER HA H 229 4.313 4.660 -0.347 1
1 1172 . 18 1 1 A 95 95 SER C C 229 174.641 174.365 0.276 1
1 1173 . 18 1 1 A 95 95 SER CA C 229 59.208 57.941 1.267 1
1 1174 . 18 1 1 A 95 95 SER CB C 229 66.080 65.647 0.433 1
1 1175 . 18 1 1 A 95 95 SER N N 229 124.903 121.485 3.418 1
1 1176 . 18 1 1 A 96 96 GLU H H 230 8.014 8.594 -0.580 1
1 1177 . 18 1 1 A 96 96 GLU HA H 230 4.376 4.464 -0.088 1
1 1182 . 18 1 1 A 96 96 GLU C C 230 176.641 177.192 -0.551 1
1 1183 . 18 1 1 A 96 96 GLU CA C 230 56.236 56.272 -0.036 1
1 1184 . 18 1 1 A 96 96 GLU CB C 230 30.324 30.936 -0.612 1
1 1186 . 18 1 1 A 96 96 GLU N N 230 115.510 121.013 -5.503 1
1 1187 . 18 1 1 A 97 97 VAL H H 231 8.741 8.405 0.336 1
1 1188 . 18 1 1 A 97 97 VAL HA H 231 4.171 4.185 -0.014 1
1 1196 . 18 1 1 A 97 97 VAL C C 231 176.684 175.764 0.920 1
1 1197 . 18 1 1 A 97 97 VAL CA C 231 65.418 63.154 2.264 1
1 1198 . 18 1 1 A 97 97 VAL CB C 231 31.218 31.546 -0.328 1
1 1201 . 18 1 1 A 97 97 VAL N N 231 121.289 121.405 -0.116 1
1 1202 . 18 1 1 A 98 98 VAL H H 232 9.218 9.407 -0.189 1
1 1203 . 18 1 1 A 98 98 VAL HA H 232 4.405 4.643 -0.238 1
1 1211 . 18 1 1 A 98 98 VAL C C 232 174.258 174.642 -0.384 1
1 1212 . 18 1 1 A 98 98 VAL CA C 232 60.937 61.307 -0.370 1
1 1213 . 18 1 1 A 98 98 VAL CB C 232 35.825 33.519 2.306 1
1 1216 . 18 1 1 A 98 98 VAL N N 232 130.544 128.901 1.643 1
1 1217 . 18 1 1 A 99 99 LYS H H 233 8.800 8.905 -0.105 1
1 1218 . 18 1 1 A 99 99 LYS HA H 233 4.853 5.127 -0.274 1
1 1227 . 18 1 1 A 99 99 LYS C C 233 175.274 175.077 0.197 1
1 1228 . 18 1 1 A 99 99 LYS CA C 233 55.499 54.968 0.531 1
1 1229 . 18 1 1 A 99 99 LYS CB C 233 34.452 34.711 -0.259 1
1 1233 . 18 1 1 A 99 99 LYS N N 233 130.477 128.481 1.996 1
1 1234 . 18 1 1 A 100 100 SER H H 234 9.585 8.977 0.608 1
1 1235 . 18 1 1 A 100 100 SER HA H 234 5.150 4.819 0.331 1
1 1238 . 18 1 1 A 100 100 SER C C 234 175.493 174.056 1.437 1
1 1239 . 18 1 1 A 100 100 SER CA C 234 56.927 57.526 -0.599 1
1 1240 . 18 1 1 A 100 100 SER CB C 234 67.309 67.333 -0.024 1
1 1241 . 18 1 1 A 100 100 SER N N 234 125.814 122.813 3.001 1
1 1242 . 18 1 1 A 101 101 SER H H 235 8.631 8.820 -0.189 1
1 1243 . 18 1 1 A 101 101 SER HA H 235 4.106 4.026 0.080 1
1 1246 . 18 1 1 A 101 101 SER C C 235 175.385 175.494 -0.109 1
1 1247 . 18 1 1 A 101 101 SER CA C 235 61.123 61.877 -0.754 1
1 1248 . 18 1 1 A 101 101 SER CB C 235 62.818 62.431 0.387 1
1 1249 . 18 1 1 A 101 101 SER N N 235 115.089 117.226 -2.137 1
1 1250 . 18 1 1 A 102 102 PHE H H 236 8.957 7.677 1.280 1
1 1251 . 18 1 1 A 102 102 PHE HA H 236 4.610 4.628 -0.018 1
1 1259 . 18 1 1 A 102 102 PHE C C 236 176.453 175.801 0.652 1
1 1260 . 18 1 1 A 102 102 PHE CA C 236 58.382 58.142 0.240 1
1 1261 . 18 1 1 A 102 102 PHE CB C 236 40.275 39.666 0.609 1
1 1263 . 18 1 1 A 102 102 PHE N N 236 119.917 117.716 2.201 1
1 1264 . 18 1 1 A 103 103 GLY H H 237 7.377 7.368 0.009 1
1 1265 . 18 1 1 A 103 103 GLY HA2 H 237 4.453 3.944 0.509 1
1 1266 . 18 1 1 A 103 103 GLY HA3 H 237 3.472 4.116 -0.644 1
1 1267 . 18 1 1 A 103 103 GLY C C 237 169.627 172.416 -2.789 1
1 1268 . 18 1 1 A 103 103 GLY CA C 237 45.384 44.624 0.760 1
1 1269 . 18 1 1 A 103 103 GLY N N 237 108.809 106.305 2.504 1
1 1270 . 18 1 1 A 104 104 TYR H H 238 8.632 8.584 0.048 1
1 1271 . 18 1 1 A 104 104 TYR HA H 238 5.322 5.531 -0.209 1
1 1278 . 18 1 1 A 104 104 TYR C C 238 175.043 175.162 -0.119 1
1 1279 . 18 1 1 A 104 104 TYR CA C 238 57.627 57.013 0.614 1
1 1280 . 18 1 1 A 104 104 TYR CB C 238 41.711 41.711 0.000 1
1 1283 . 18 1 1 A 104 104 TYR N N 238 120.030 121.771 -1.741 1
1 1284 . 18 1 1 A 105 105 HIS H H 239 10.070 9.405 0.665 1
1 1285 . 18 1 1 A 105 105 HIS HA H 239 6.046 5.562 0.484 1
1 1290 . 18 1 1 A 105 105 HIS C C 239 175.734 174.677 1.057 1
1 1291 . 18 1 1 A 105 105 HIS CA C 239 53.945 54.557 -0.612 1
1 1292 . 18 1 1 A 105 105 HIS CB C 239 32.450 34.093 -1.643 1
1 1295 . 18 1 1 A 105 105 HIS N N 239 119.504 118.409 1.095 1
1 1296 . 18 1 1 A 106 106 ILE H H 240 8.660 8.804 -0.144 1
1 1297 . 18 1 1 A 106 106 ILE HA H 240 4.120 4.884 -0.764 1
1 1307 . 18 1 1 A 106 106 ILE C C 240 174.758 175.327 -0.569 1
1 1308 . 18 1 1 A 106 106 ILE CA C 240 63.446 59.969 3.477 1
1 1309 . 18 1 1 A 106 106 ILE CB C 240 40.786 41.720 -0.934 1
1 1313 . 18 1 1 A 106 106 ILE N N 240 120.639 120.561 0.078 1
1 1314 . 18 1 1 A 107 107 ILE H H 241 9.033 9.071 -0.038 1
1 1315 . 18 1 1 A 107 107 ILE HA H 241 4.799 5.077 -0.278 1
1 1325 . 18 1 1 A 107 107 ILE C C 241 172.880 174.103 -1.223 1
1 1326 . 18 1 1 A 107 107 ILE CA C 241 60.563 59.597 0.966 1
1 1327 . 18 1 1 A 107 107 ILE CB C 241 41.652 41.119 0.533 1
1 1331 . 18 1 1 A 107 107 ILE N N 241 129.098 127.063 2.035 1
1 1332 . 18 1 1 A 108 108 LYS H H 242 8.692 9.069 -0.377 1
1 1333 . 18 1 1 A 108 108 LYS HA H 242 5.012 5.018 -0.006 1
1 1342 . 18 1 1 A 108 108 LYS C C 242 174.484 175.529 -1.045 1
1 1343 . 18 1 1 A 108 108 LYS CA C 242 54.317 53.992 0.325 1
1 1344 . 18 1 1 A 108 108 LYS CB C 242 35.619 35.496 0.123 1
1 1348 . 18 1 1 A 108 108 LYS N N 242 127.179 128.052 -0.873 1
1 1349 . 18 1 1 A 109 109 ALA H H 243 7.816 8.969 -1.153 1
1 1350 . 18 1 1 A 109 109 ALA HA H 243 4.604 4.641 -0.037 1
1 1354 . 18 1 1 A 109 109 ALA C C 243 176.231 176.189 0.042 1
1 1355 . 18 1 1 A 109 109 ALA CA C 243 50.505 51.251 -0.746 1
1 1356 . 18 1 1 A 109 109 ALA CB C 243 19.584 19.631 -0.047 1
1 1357 . 18 1 1 A 109 109 ALA N N 243 129.619 128.080 1.539 1
1 1358 . 18 1 1 A 110 110 ASP H H 244 7.578 8.564 -0.986 1
1 1359 . 18 1 1 A 110 110 ASP HA H 244 4.424 5.029 -0.605 1
1 1362 . 18 1 1 A 110 110 ASP C C 244 175.259 175.617 -0.358 1
1 1363 . 18 1 1 A 110 110 ASP CA C 244 54.489 52.310 2.179 1
1 1364 . 18 1 1 A 110 110 ASP CB C 244 42.693 43.542 -0.849 1
1 1365 . 18 1 1 A 110 110 ASP N N 244 125.434 122.351 3.083 1
1 4 . 19 1 1 A 2 2 PRO HA H -4 4.403 4.597 -0.194 1
1 11 . 19 1 1 A 2 2 PRO C C -4 176.990 177.034 -0.044 1
1 12 . 19 1 1 A 2 2 PRO CA C -4 63.131 62.588 0.543 1
1 13 . 19 1 1 A 2 2 PRO CB C -4 32.342 32.497 -0.155 1
1 16 . 19 1 1 A 3 3 LEU H H -3 8.483 8.512 -0.029 1
1 17 . 19 1 1 A 3 3 LEU HA H -3 4.333 3.990 0.343 1
1 27 . 19 1 1 A 3 3 LEU C C -3 177.991 178.197 -0.206 1
1 28 . 19 1 1 A 3 3 LEU CA C -3 55.314 56.473 -1.159 1
1 29 . 19 1 1 A 3 3 LEU CB C -3 42.244 41.769 0.475 1
1 33 . 19 1 1 A 3 3 LEU N N -3 122.986 121.278 1.708 1
1 34 . 19 1 1 A 4 4 GLY H H -2 8.397 8.471 -0.074 1
1 35 . 19 1 1 A 4 4 GLY HA2 H -2 4.024 3.925 0.099 1
1 36 . 19 1 1 A 4 4 GLY HA3 H -2 3.976 3.965 0.011 1
1 37 . 19 1 1 A 4 4 GLY C C -2 174.360 175.488 -1.128 1
1 38 . 19 1 1 A 4 4 GLY CA C -2 45.434 46.393 -0.959 1
1 39 . 19 1 1 A 4 4 GLY N N -2 110.666 110.376 0.290 1
1 56 . 19 1 1 A 7 7 SER H H 141 7.913 7.764 0.149 1
1 57 . 19 1 1 A 7 7 SER HA H 141 5.657 5.495 0.162 1
1 60 . 19 1 1 A 7 7 SER C C 141 173.753 172.887 0.866 1
1 61 . 19 1 1 A 7 7 SER CA C 141 56.758 57.728 -0.970 1
1 62 . 19 1 1 A 7 7 SER CB C 141 66.774 66.156 0.618 1
1 63 . 19 1 1 A 7 7 SER N N 141 113.824 112.037 1.787 1
1 64 . 19 1 1 A 8 8 LYS H H 142 8.656 8.596 0.060 1
1 65 . 19 1 1 A 8 8 LYS HA H 142 4.543 4.955 -0.412 1
1 74 . 19 1 1 A 8 8 LYS C C 142 174.403 174.660 -0.257 1
1 75 . 19 1 1 A 8 8 LYS CA C 142 55.578 55.197 0.381 1
1 76 . 19 1 1 A 8 8 LYS CB C 142 36.561 35.970 0.591 1
1 80 . 19 1 1 A 8 8 LYS N N 142 123.076 122.332 0.744 1
1 81 . 19 1 1 A 9 9 LYS H H 143 8.623 8.571 0.052 1
1 82 . 19 1 1 A 9 9 LYS HA H 143 4.119 4.388 -0.269 1
1 91 . 19 1 1 A 9 9 LYS C C 143 176.144 175.591 0.553 1
1 92 . 19 1 1 A 9 9 LYS CA C 143 56.683 56.078 0.605 1
1 93 . 19 1 1 A 9 9 LYS CB C 143 32.580 32.597 -0.017 1
1 97 . 19 1 1 A 9 9 LYS N N 143 129.542 127.598 1.944 1
1 98 . 19 1 1 A 10 10 ALA H H 144 8.151 8.753 -0.602 1
1 99 . 19 1 1 A 10 10 ALA HA H 144 5.208 4.878 0.330 1
1 103 . 19 1 1 A 10 10 ALA C C 144 175.577 175.086 0.491 1
1 104 . 19 1 1 A 10 10 ALA CA C 144 51.226 51.244 -0.018 1
1 105 . 19 1 1 A 10 10 ALA CB C 144 25.299 24.049 1.250 1
1 106 . 19 1 1 A 10 10 ALA N N 144 127.933 127.865 0.068 1
1 107 . 19 1 1 A 11 11 SER H H 145 8.679 8.698 -0.019 1
1 108 . 19 1 1 A 11 11 SER HA H 145 5.431 5.805 -0.374 1
1 111 . 19 1 1 A 11 11 SER C C 145 173.072 173.260 -0.188 1
1 112 . 19 1 1 A 11 11 SER CA C 145 57.772 57.171 0.601 1
1 113 . 19 1 1 A 11 11 SER CB C 145 67.301 66.447 0.854 1
1 114 . 19 1 1 A 11 11 SER N N 145 116.245 115.552 0.693 1
1 115 . 19 1 1 A 12 12 HIS H H 146 9.962 9.460 0.502 1
1 116 . 19 1 1 A 12 12 HIS HA H 146 6.332 5.982 0.350 1
1 121 . 19 1 1 A 12 12 HIS C C 146 173.006 172.325 0.681 1
1 122 . 19 1 1 A 12 12 HIS CA C 146 55.020 54.323 0.697 1
1 123 . 19 1 1 A 12 12 HIS CB C 146 37.071 33.035 4.036 1
1 126 . 19 1 1 A 12 12 HIS N N 146 119.181 118.156 1.025 1
1 127 . 19 1 1 A 13 13 ILE H H 147 8.976 9.079 -0.103 1
1 128 . 19 1 1 A 13 13 ILE HA H 147 3.528 4.541 -1.013 1
1 138 . 19 1 1 A 13 13 ILE C C 147 173.010 174.264 -1.254 1
1 139 . 19 1 1 A 13 13 ILE CA C 147 61.273 59.640 1.633 1
1 140 . 19 1 1 A 13 13 ILE CB C 147 41.773 41.243 0.530 1
1 144 . 19 1 1 A 13 13 ILE N N 147 121.873 119.282 2.591 1
1 145 . 19 1 1 A 14 14 LEU H H 148 7.627 8.936 -1.309 1
1 146 . 19 1 1 A 14 14 LEU HA H 148 4.814 4.946 -0.132 1
1 156 . 19 1 1 A 14 14 LEU C C 148 174.112 174.227 -0.115 1
1 157 . 19 1 1 A 14 14 LEU CA C 148 52.574 53.459 -0.885 1
1 158 . 19 1 1 A 14 14 LEU CB C 148 45.643 45.428 0.215 1
1 162 . 19 1 1 A 14 14 LEU N N 148 127.112 128.872 -1.760 1
1 163 . 19 1 1 A 15 15 ILE H H 149 9.524 9.307 0.217 1
1 164 . 19 1 1 A 15 15 ILE HA H 149 4.362 4.510 -0.148 1
1 174 . 19 1 1 A 15 15 ILE C C 149 175.452 175.471 -0.019 1
1 175 . 19 1 1 A 15 15 ILE CA C 149 58.516 60.614 -2.098 1
1 176 . 19 1 1 A 15 15 ILE CB C 149 36.560 38.117 -1.557 1
1 180 . 19 1 1 A 15 15 ILE N N 149 128.652 127.667 0.985 1
1 181 . 19 1 1 A 16 16 LYS H H 150 8.035 8.579 -0.544 1
1 182 . 19 1 1 A 16 16 LYS HA H 150 4.319 4.464 -0.145 1
1 191 . 19 1 1 A 16 16 LYS C C 150 175.038 176.401 -1.363 1
1 192 . 19 1 1 A 16 16 LYS CA C 150 57.817 56.707 1.110 1
1 193 . 19 1 1 A 16 16 LYS CB C 150 34.853 32.764 2.089 1
1 197 . 19 1 1 A 16 16 LYS N N 150 129.153 127.766 1.387 1
1 198 . 19 1 1 A 17 17 VAL H H 151 8.016 8.993 -0.977 1
1 199 . 19 1 1 A 17 17 VAL HA H 151 4.873 4.841 0.032 1
1 207 . 19 1 1 A 17 17 VAL C C 151 176.647 175.450 1.197 1
1 208 . 19 1 1 A 17 17 VAL CA C 151 60.088 61.252 -1.164 1
1 209 . 19 1 1 A 17 17 VAL CB C 151 34.082 33.710 0.372 1
1 212 . 19 1 1 A 17 17 VAL N N 151 121.288 124.483 -3.195 1
1 213 . 19 1 1 A 18 18 LYS H H 152 8.443 8.760 -0.317 1
1 214 . 19 1 1 A 18 18 LYS HA H 152 4.334 4.765 -0.431 1
1 223 . 19 1 1 A 18 18 LYS C C 152 176.345 177.372 -1.027 1
1 224 . 19 1 1 A 18 18 LYS CA C 152 57.016 54.470 2.546 1
1 225 . 19 1 1 A 18 18 LYS CB C 152 33.222 35.084 -1.862 1
1 229 . 19 1 1 A 18 18 LYS N N 152 128.408 126.922 1.486 1
1 230 . 19 1 1 A 19 19 SER H H 153 9.067 8.731 0.336 1
1 231 . 19 1 1 A 19 19 SER HA H 153 4.457 4.387 0.070 1
1 234 . 19 1 1 A 19 19 SER C C 153 174.236 174.222 0.014 1
1 235 . 19 1 1 A 19 19 SER CA C 153 59.642 59.724 -0.082 1
1 236 . 19 1 1 A 19 19 SER CB C 153 64.347 63.547 0.800 1
1 237 . 19 1 1 A 19 19 SER N N 153 121.522 115.644 5.878 1
1 238 . 19 1 1 A 20 20 LYS H H 154 7.961 7.507 0.454 1
1 239 . 19 1 1 A 20 20 LYS HA H 154 4.558 4.692 -0.134 1
1 244 . 19 1 1 A 20 20 LYS C C 154 177.256 176.883 0.373 1
1 245 . 19 1 1 A 20 20 LYS CA C 154 55.249 54.782 0.467 1
1 246 . 19 1 1 A 20 20 LYS CB C 154 34.531 35.346 -0.815 1
1 248 . 19 1 1 A 20 20 LYS N N 154 120.270 120.921 -0.651 1
1 249 . 19 1 1 A 21 21 LYS HA H 155 4.003 4.077 -0.074 1
1 258 . 19 1 1 A 21 21 LYS C C 155 177.015 177.747 -0.732 1
1 259 . 19 1 1 A 21 21 LYS CA C 155 59.091 58.743 0.348 1
1 260 . 19 1 1 A 21 21 LYS CB C 155 32.394 32.230 0.164 1
1 264 . 19 1 1 A 22 22 SER H H 156 7.625 7.768 -0.143 1
1 265 . 19 1 1 A 22 22 SER HA H 156 4.293 4.381 -0.088 1
1 268 . 19 1 1 A 22 22 SER C C 156 174.843 174.553 0.290 1
1 269 . 19 1 1 A 22 22 SER CA C 156 57.966 58.568 -0.602 1
1 270 . 19 1 1 A 22 22 SER CB C 156 63.369 63.510 -0.141 1
1 271 . 19 1 1 A 22 22 SER N N 156 109.549 112.034 -2.485 1
1 272 . 19 1 1 A 23 23 ASP H H 157 7.701 7.348 0.353 1
1 273 . 19 1 1 A 23 23 ASP HA H 157 4.548 4.568 -0.020 1
1 276 . 19 1 1 A 23 23 ASP C C 157 176.544 177.451 -0.907 1
1 277 . 19 1 1 A 23 23 ASP CA C 157 55.242 54.781 0.461 1
1 278 . 19 1 1 A 23 23 ASP CB C 157 41.103 42.308 -1.205 1
1 279 . 19 1 1 A 23 23 ASP N N 157 124.536 122.673 1.863 1
1 280 . 19 1 1 A 24 24 LYS H H 158 8.583 8.675 -0.092 1
1 281 . 19 1 1 A 24 24 LYS HA H 158 4.252 4.105 0.147 1
1 290 . 19 1 1 A 24 24 LYS C C 158 176.813 177.834 -1.021 1
1 291 . 19 1 1 A 24 24 LYS CA C 158 57.148 58.491 -1.343 1
1 292 . 19 1 1 A 24 24 LYS CB C 158 33.200 32.118 1.082 1
1 296 . 19 1 1 A 24 24 LYS N N 158 122.372 123.050 -0.678 1
1 297 . 19 1 1 A 25 25 GLU H H 159 8.001 8.085 -0.084 1
1 298 . 19 1 1 A 25 25 GLU HA H 159 4.521 4.248 0.273 1
1 303 . 19 1 1 A 25 25 GLU C C 159 175.995 176.563 -0.568 1
1 304 . 19 1 1 A 25 25 GLU CA C 159 55.727 57.464 -1.737 1
1 305 . 19 1 1 A 25 25 GLU CB C 159 31.918 30.478 1.440 1
1 307 . 19 1 1 A 25 25 GLU N N 159 118.705 118.165 0.540 1
1 308 . 19 1 1 A 26 26 GLY H H 160 8.458 7.534 0.924 1
1 309 . 19 1 1 A 26 26 GLY HA2 H 160 3.946 4.038 -0.092 1
1 310 . 19 1 1 A 26 26 GLY HA3 H 160 3.511 4.050 -0.539 1
1 311 . 19 1 1 A 26 26 GLY C C 160 172.201 171.840 0.361 1
1 312 . 19 1 1 A 26 26 GLY CA C 160 44.038 45.812 -1.774 1
1 313 . 19 1 1 A 26 26 GLY N N 160 107.642 105.088 2.554 1
1 314 . 19 1 1 A 27 27 LEU H H 161 8.259 8.613 -0.354 1
1 315 . 19 1 1 A 27 27 LEU HA H 161 4.775 5.133 -0.358 1
1 325 . 19 1 1 A 27 27 LEU C C 161 177.422 175.305 2.117 1
1 326 . 19 1 1 A 27 27 LEU CA C 161 53.322 53.151 0.171 1
1 327 . 19 1 1 A 27 27 LEU CB C 161 45.576 44.545 1.031 1
1 331 . 19 1 1 A 27 27 LEU N N 161 119.856 122.105 -2.249 1
1 332 . 19 1 1 A 28 28 ASP H H 162 8.848 8.486 0.362 1
1 333 . 19 1 1 A 28 28 ASP HA H 162 4.644 4.462 0.182 1
1 336 . 19 1 1 A 28 28 ASP C C 162 176.630 177.081 -0.451 1
1 337 . 19 1 1 A 28 28 ASP CA C 162 55.195 54.803 0.392 1
1 338 . 19 1 1 A 28 28 ASP CB C 162 41.673 42.672 -0.999 1
1 339 . 19 1 1 A 28 28 ASP N N 162 122.434 122.034 0.400 1
1 340 . 19 1 1 A 29 29 ASP H H 163 8.720 9.081 -0.361 1
1 341 . 19 1 1 A 29 29 ASP HA H 163 4.386 4.430 -0.044 1
1 344 . 19 1 1 A 29 29 ASP C C 163 176.604 178.575 -1.971 1
1 345 . 19 1 1 A 29 29 ASP CA C 163 59.690 56.816 2.874 1
1 346 . 19 1 1 A 29 29 ASP CB C 163 42.964 40.000 2.964 1
1 347 . 19 1 1 A 29 29 ASP N N 163 121.460 125.276 -3.816 1
1 348 . 19 1 1 A 30 30 LYS H H 164 8.434 8.005 0.429 1
1 349 . 19 1 1 A 30 30 LYS HA H 164 3.901 4.179 -0.278 1
1 358 . 19 1 1 A 30 30 LYS C C 164 179.479 179.151 0.328 1
1 359 . 19 1 1 A 30 30 LYS CA C 164 60.047 59.199 0.848 1
1 360 . 19 1 1 A 30 30 LYS CB C 164 32.038 32.409 -0.371 1
1 364 . 19 1 1 A 30 30 LYS N N 164 116.627 118.836 -2.209 1
1 365 . 19 1 1 A 31 31 GLU H H 165 7.755 8.349 -0.594 1
1 366 . 19 1 1 A 31 31 GLU HA H 165 3.998 3.993 0.005 1
1 371 . 19 1 1 A 31 31 GLU C C 165 179.031 179.209 -0.178 1
1 372 . 19 1 1 A 31 31 GLU CA C 165 59.335 59.386 -0.051 1
1 373 . 19 1 1 A 31 31 GLU CB C 165 29.972 29.322 0.650 1
1 375 . 19 1 1 A 31 31 GLU N N 165 120.456 120.321 0.135 1
1 376 . 19 1 1 A 32 32 ALA H H 166 9.060 8.475 0.585 1
1 377 . 19 1 1 A 32 32 ALA HA H 166 3.871 4.014 -0.143 1
1 381 . 19 1 1 A 32 32 ALA C C 166 178.029 179.026 -0.997 1
1 382 . 19 1 1 A 32 32 ALA CA C 166 54.997 55.486 -0.489 1
1 383 . 19 1 1 A 32 32 ALA CB C 166 19.727 18.430 1.297 1
1 384 . 19 1 1 A 32 32 ALA N N 166 124.406 122.182 2.224 1
1 385 . 19 1 1 A 33 33 LYS H H 167 8.228 7.721 0.507 1
1 386 . 19 1 1 A 33 33 LYS HA H 167 2.595 3.055 -0.460 1
1 395 . 19 1 1 A 33 33 LYS C C 167 177.938 178.006 -0.068 1
1 396 . 19 1 1 A 33 33 LYS CA C 167 59.573 59.276 0.297 1
1 397 . 19 1 1 A 33 33 LYS CB C 167 32.098 32.255 -0.157 1
1 401 . 19 1 1 A 33 33 LYS N N 167 119.833 118.258 1.575 1
1 402 . 19 1 1 A 34 34 GLN H H 168 7.392 7.816 -0.424 1
1 403 . 19 1 1 A 34 34 GLN HA H 168 3.943 3.950 -0.007 1
1 410 . 19 1 1 A 34 34 GLN C C 168 178.323 178.269 0.054 1
1 411 . 19 1 1 A 34 34 GLN CA C 168 58.883 59.258 -0.375 1
1 412 . 19 1 1 A 34 34 GLN CB C 168 28.485 28.110 0.375 1
1 414 . 19 1 1 A 34 34 GLN N N 168 117.208 117.802 -0.594 1
1 416 . 19 1 1 A 35 35 LYS H H 169 7.994 8.006 -0.012 1
1 417 . 19 1 1 A 35 35 LYS HA H 169 4.067 3.990 0.077 1
1 426 . 19 1 1 A 35 35 LYS C C 169 178.161 178.438 -0.277 1
1 427 . 19 1 1 A 35 35 LYS CA C 169 58.437 59.429 -0.992 1
1 428 . 19 1 1 A 35 35 LYS CB C 169 31.611 32.321 -0.710 1
1 432 . 19 1 1 A 35 35 LYS N N 169 120.898 119.768 1.130 1
1 433 . 19 1 1 A 36 36 ALA H H 170 8.431 8.308 0.123 1
1 434 . 19 1 1 A 36 36 ALA HA H 170 3.738 4.042 -0.304 1
1 438 . 19 1 1 A 36 36 ALA C C 170 178.862 179.965 -1.103 1
1 439 . 19 1 1 A 36 36 ALA CA C 170 55.351 55.006 0.345 1
1 440 . 19 1 1 A 36 36 ALA CB C 170 18.295 18.292 0.003 1
1 441 . 19 1 1 A 36 36 ALA N N 170 120.641 120.435 0.206 1
1 442 . 19 1 1 A 37 37 GLU H H 171 8.412 8.207 0.205 1
1 443 . 19 1 1 A 37 37 GLU HA H 171 3.867 3.944 -0.077 1
1 448 . 19 1 1 A 37 37 GLU C C 171 179.255 178.874 0.381 1
1 449 . 19 1 1 A 37 37 GLU CA C 171 59.543 59.657 -0.114 1
1 450 . 19 1 1 A 37 37 GLU CB C 171 29.569 29.293 0.276 1
1 452 . 19 1 1 A 37 37 GLU N N 171 118.224 117.755 0.469 1
1 453 . 19 1 1 A 38 38 GLU H H 172 8.019 8.245 -0.226 1
1 454 . 19 1 1 A 38 38 GLU HA H 172 3.952 4.086 -0.134 1
1 459 . 19 1 1 A 38 38 GLU C C 172 180.250 178.307 1.943 1
1 460 . 19 1 1 A 38 38 GLU CA C 172 59.627 59.211 0.416 1
1 461 . 19 1 1 A 38 38 GLU CB C 172 29.368 29.061 0.307 1
1 463 . 19 1 1 A 38 38 GLU N N 172 121.250 118.576 2.674 1
1 464 . 19 1 1 A 39 39 ILE H H 173 8.174 7.674 0.500 1
1 465 . 19 1 1 A 39 39 ILE HA H 173 3.643 3.803 -0.160 1
1 475 . 19 1 1 A 39 39 ILE C C 173 177.568 177.970 -0.402 1
1 476 . 19 1 1 A 39 39 ILE CA C 173 64.869 63.761 1.108 1
1 477 . 19 1 1 A 39 39 ILE CB C 173 38.160 37.409 0.751 1
1 481 . 19 1 1 A 39 39 ILE N N 173 121.527 117.547 3.980 1
1 482 . 19 1 1 A 40 40 GLN H H 174 8.860 8.301 0.559 1
1 483 . 19 1 1 A 40 40 GLN HA H 174 3.533 4.023 -0.490 1
1 490 . 19 1 1 A 40 40 GLN C C 174 179.022 179.076 -0.054 1
1 491 . 19 1 1 A 40 40 GLN CA C 174 61.316 59.411 1.905 1
1 492 . 19 1 1 A 40 40 GLN CB C 174 26.604 28.518 -1.914 1
1 494 . 19 1 1 A 40 40 GLN N N 174 121.956 121.051 0.905 1
1 496 . 19 1 1 A 41 41 LYS H H 175 7.879 7.879 0.000 1
1 497 . 19 1 1 A 41 41 LYS HA H 175 3.777 4.288 -0.511 1
1 506 . 19 1 1 A 41 41 LYS C C 175 178.779 177.754 1.025 1
1 507 . 19 1 1 A 41 41 LYS CA C 175 59.701 58.339 1.362 1
1 508 . 19 1 1 A 41 41 LYS CB C 175 32.581 32.192 0.389 1
1 512 . 19 1 1 A 41 41 LYS N N 175 119.012 118.524 0.488 1
1 513 . 19 1 1 A 42 42 GLU H H 176 7.447 7.829 -0.382 1
1 514 . 19 1 1 A 42 42 GLU HA H 176 4.059 4.247 -0.188 1
1 519 . 19 1 1 A 42 42 GLU C C 176 180.058 178.770 1.288 1
1 520 . 19 1 1 A 42 42 GLU CA C 176 59.456 58.770 0.686 1
1 521 . 19 1 1 A 42 42 GLU CB C 176 29.923 30.265 -0.342 1
1 523 . 19 1 1 A 42 42 GLU N N 176 120.054 118.831 1.223 1
1 524 . 19 1 1 A 43 43 VAL H H 177 8.618 7.985 0.633 1
1 525 . 19 1 1 A 43 43 VAL HA H 177 3.986 3.912 0.074 1
1 533 . 19 1 1 A 43 43 VAL C C 177 176.459 177.549 -1.090 1
1 534 . 19 1 1 A 43 43 VAL CA C 177 63.923 64.815 -0.892 1
1 535 . 19 1 1 A 43 43 VAL CB C 177 31.899 31.340 0.559 1
1 538 . 19 1 1 A 43 43 VAL N N 177 114.191 116.980 -2.789 1
1 539 . 19 1 1 A 44 44 SER H H 178 8.052 8.359 -0.307 1
1 540 . 19 1 1 A 44 44 SER HA H 178 4.098 4.282 -0.184 1
1 543 . 19 1 1 A 44 44 SER C C 178 176.548 175.916 0.632 1
1 544 . 19 1 1 A 44 44 SER CA C 178 61.160 61.176 -0.016 1
1 545 . 19 1 1 A 44 44 SER CB C 178 62.959 62.630 0.329 1
1 546 . 19 1 1 A 44 44 SER N N 178 114.202 115.715 -1.513 1
1 547 . 19 1 1 A 45 45 LYS H H 179 7.083 8.160 -1.077 1
1 548 . 19 1 1 A 45 45 LYS HA H 179 4.140 4.229 -0.089 1
1 557 . 19 1 1 A 45 45 LYS C C 179 177.288 176.212 1.076 1
1 558 . 19 1 1 A 45 45 LYS CA C 179 58.469 58.065 0.404 1
1 559 . 19 1 1 A 45 45 LYS CB C 179 32.671 32.162 0.509 1
1 563 . 19 1 1 A 45 45 LYS N N 179 120.935 117.724 3.211 1
1 564 . 19 1 1 A 46 46 ASP H H 180 7.098 7.903 -0.805 1
1 565 . 19 1 1 A 46 46 ASP HA H 180 4.917 5.047 -0.130 1
1 568 . 19 1 1 A 46 46 ASP CA C 180 51.492 51.594 -0.102 1
1 569 . 19 1 1 A 46 46 ASP CB C 180 40.595 41.054 -0.459 1
1 570 . 19 1 1 A 46 46 ASP N N 180 112.836 120.862 -8.026 1
1 571 . 19 1 1 A 47 47 PRO HA H 181 4.681 4.513 0.168 1
1 578 . 19 1 1 A 47 47 PRO C C 181 179.248 177.978 1.270 1
1 579 . 19 1 1 A 47 47 PRO CA C 181 64.718 64.557 0.161 1
1 580 . 19 1 1 A 47 47 PRO CB C 181 32.159 31.905 0.254 1
1 583 . 19 1 1 A 48 48 SER H H 182 8.248 8.258 -0.010 1
1 584 . 19 1 1 A 48 48 SER HA H 182 4.378 4.259 0.119 1
1 587 . 19 1 1 A 48 48 SER C C 182 176.071 175.253 0.818 1
1 588 . 19 1 1 A 48 48 SER CA C 182 61.377 60.794 0.583 1
1 589 . 19 1 1 A 48 48 SER CB C 182 62.455 63.117 -0.662 1
1 590 . 19 1 1 A 48 48 SER N N 182 116.986 112.963 4.023 1
1 591 . 19 1 1 A 49 49 LYS H H 183 7.842 7.468 0.374 1
1 592 . 19 1 1 A 49 49 LYS HA H 183 4.482 4.523 -0.041 1
1 601 . 19 1 1 A 49 49 LYS C C 183 175.605 177.196 -1.591 1
1 602 . 19 1 1 A 49 49 LYS CA C 183 55.824 55.771 0.053 1
1 603 . 19 1 1 A 49 49 LYS CB C 183 32.834 33.089 -0.255 1
1 607 . 19 1 1 A 49 49 LYS N N 183 121.698 117.772 3.926 1
1 608 . 19 1 1 A 50 50 PHE H H 184 7.634 7.724 -0.090 1
1 609 . 19 1 1 A 50 50 PHE HA H 184 3.510 4.146 -0.636 1
1 617 . 19 1 1 A 50 50 PHE C C 184 176.214 177.629 -1.415 1
1 618 . 19 1 1 A 50 50 PHE CA C 184 63.276 61.082 2.194 1
1 619 . 19 1 1 A 50 50 PHE CB C 184 40.948 39.172 1.776 1
1 623 . 19 1 1 A 50 50 PHE N N 184 120.120 121.339 -1.219 1
1 624 . 19 1 1 A 51 51 GLY H H 185 8.855 8.624 0.231 1
1 625 . 19 1 1 A 51 51 GLY HA2 H 185 3.993 3.907 0.086 1
1 626 . 19 1 1 A 51 51 GLY HA3 H 185 3.958 3.909 0.049 1
1 627 . 19 1 1 A 51 51 GLY C C 185 175.169 176.259 -1.090 1
1 628 . 19 1 1 A 51 51 GLY CA C 185 47.475 47.656 -0.181 1
1 629 . 19 1 1 A 51 51 GLY N N 185 105.550 106.331 -0.781 1
1 630 . 19 1 1 A 52 52 GLU H H 186 7.917 7.974 -0.057 1
1 631 . 19 1 1 A 52 52 GLU HA H 186 4.006 4.032 -0.026 1
1 636 . 19 1 1 A 52 52 GLU C C 186 179.499 179.403 0.096 1
1 637 . 19 1 1 A 52 52 GLU CA C 186 58.904 59.066 -0.162 1
1 638 . 19 1 1 A 52 52 GLU CB C 186 29.700 29.525 0.175 1
1 640 . 19 1 1 A 52 52 GLU N N 186 121.929 121.673 0.256 1
1 641 . 19 1 1 A 53 53 ILE H H 187 7.936 7.901 0.035 1
1 642 . 19 1 1 A 53 53 ILE HA H 187 3.648 3.730 -0.082 1
1 652 . 19 1 1 A 53 53 ILE C C 187 177.886 177.858 0.028 1
1 653 . 19 1 1 A 53 53 ILE CA C 187 64.366 64.615 -0.249 1
1 654 . 19 1 1 A 53 53 ILE CB C 187 36.478 37.171 -0.693 1
1 658 . 19 1 1 A 53 53 ILE N N 187 120.991 122.074 -1.083 1
1 659 . 19 1 1 A 54 54 ALA H H 188 8.895 8.483 0.412 1
1 660 . 19 1 1 A 54 54 ALA HA H 188 3.629 3.697 -0.068 1
1 664 . 19 1 1 A 54 54 ALA C C 188 179.437 179.514 -0.077 1
1 665 . 19 1 1 A 54 54 ALA CA C 188 55.974 55.221 0.753 1
1 666 . 19 1 1 A 54 54 ALA CB C 188 17.591 17.957 -0.366 1
1 667 . 19 1 1 A 54 54 ALA N N 188 125.308 121.784 3.524 1
1 668 . 19 1 1 A 55 55 LYS H H 189 8.049 7.636 0.413 1
1 669 . 19 1 1 A 55 55 LYS HA H 189 4.106 3.885 0.221 1
1 678 . 19 1 1 A 55 55 LYS C C 189 178.995 177.793 1.202 1
1 679 . 19 1 1 A 55 55 LYS CA C 189 59.312 59.113 0.199 1
1 680 . 19 1 1 A 55 55 LYS CB C 189 32.647 31.879 0.768 1
1 684 . 19 1 1 A 55 55 LYS N N 189 116.835 118.108 -1.273 1
1 685 . 19 1 1 A 56 56 LYS H H 190 7.215 7.849 -0.634 1
1 686 . 19 1 1 A 56 56 LYS HA H 190 4.172 4.344 -0.172 1
1 695 . 19 1 1 A 56 56 LYS C C 190 177.897 178.097 -0.200 1
1 696 . 19 1 1 A 56 56 LYS CA C 190 58.418 57.473 0.945 1
1 697 . 19 1 1 A 56 56 LYS CB C 190 34.652 33.497 1.155 1
1 701 . 19 1 1 A 56 56 LYS N N 190 117.170 117.787 -0.617 1
1 702 . 19 1 1 A 57 57 GLU H H 191 8.572 7.752 0.820 1
1 703 . 19 1 1 A 57 57 GLU HA H 191 4.643 4.365 0.278 1
1 708 . 19 1 1 A 57 57 GLU C C 191 177.903 176.049 1.854 1
1 709 . 19 1 1 A 57 57 GLU CA C 191 55.708 56.165 -0.457 1
1 710 . 19 1 1 A 57 57 GLU CB C 191 32.460 30.440 2.020 1
1 712 . 19 1 1 A 57 57 GLU N N 191 113.316 117.272 -3.956 1
1 713 . 19 1 1 A 58 58 SER H H 192 8.550 7.622 0.928 1
1 714 . 19 1 1 A 58 58 SER HA H 192 4.149 4.359 -0.210 1
1 717 . 19 1 1 A 58 58 SER C C 192 176.161 174.991 1.170 1
1 718 . 19 1 1 A 58 58 SER CA C 192 58.403 58.006 0.397 1
1 719 . 19 1 1 A 58 58 SER CB C 192 64.392 64.349 0.043 1
1 720 . 19 1 1 A 58 58 SER N N 192 109.861 115.928 -6.067 1
1 721 . 19 1 1 A 59 59 MET H H 193 9.533 8.738 0.795 1
1 722 . 19 1 1 A 59 59 MET HA H 193 4.457 4.561 -0.104 1
1 730 . 19 1 1 A 59 59 MET C C 193 175.204 175.584 -0.380 1
1 731 . 19 1 1 A 59 59 MET CA C 193 55.781 56.039 -0.258 1
1 732 . 19 1 1 A 59 59 MET CB C 193 32.855 33.449 -0.594 1
1 735 . 19 1 1 A 59 59 MET N N 193 124.493 123.270 1.223 1
1 736 . 19 1 1 A 60 60 ASP H H 194 7.514 7.869 -0.355 1
1 737 . 19 1 1 A 60 60 ASP HA H 194 4.886 4.568 0.318 1
1 740 . 19 1 1 A 60 60 ASP C C 194 175.517 176.682 -1.165 1
1 741 . 19 1 1 A 60 60 ASP CA C 194 52.286 53.373 -1.087 1
1 742 . 19 1 1 A 60 60 ASP CB C 194 40.222 41.280 -1.058 1
1 743 . 19 1 1 A 60 60 ASP N N 194 117.785 120.538 -2.753 1
1 744 . 19 1 1 A 61 61 THR H H 195 8.118 8.511 -0.393 1
1 745 . 19 1 1 A 61 61 THR HA H 195 3.918 3.912 0.006 1
1 750 . 19 1 1 A 61 61 THR C C 195 176.269 177.305 -1.036 1
1 751 . 19 1 1 A 61 61 THR CA C 195 65.469 65.347 0.122 1
1 752 . 19 1 1 A 61 61 THR CB C 195 68.741 68.389 0.352 1
1 754 . 19 1 1 A 61 61 THR N N 195 120.765 118.529 2.236 1
1 755 . 19 1 1 A 62 62 GLY H H 196 8.399 8.581 -0.182 1
1 756 . 19 1 1 A 62 62 GLY HA2 H 196 3.932 3.817 0.115 1
1 757 . 19 1 1 A 62 62 GLY HA3 H 196 3.900 3.820 0.080 1
1 758 . 19 1 1 A 62 62 GLY C C 196 174.948 176.587 -1.639 1
1 759 . 19 1 1 A 62 62 GLY CA C 196 46.768 47.652 -0.884 1
1 760 . 19 1 1 A 62 62 GLY N N 196 108.183 111.355 -3.172 1
1 761 . 19 1 1 A 63 63 SER H H 197 7.265 8.104 -0.839 1
1 762 . 19 1 1 A 63 63 SER HA H 197 4.554 4.400 0.154 1
1 765 . 19 1 1 A 63 63 SER C C 197 177.630 176.121 1.509 1
1 766 . 19 1 1 A 63 63 SER CA C 197 59.550 62.415 -2.865 1
1 767 . 19 1 1 A 63 63 SER CB C 197 65.504 63.378 2.126 1
1 768 . 19 1 1 A 63 63 SER N N 197 111.815 119.378 -7.563 1
1 769 . 19 1 1 A 64 64 ALA H H 198 8.675 8.311 0.364 1
1 770 . 19 1 1 A 64 64 ALA HA H 198 3.801 3.988 -0.187 1
1 774 . 19 1 1 A 64 64 ALA C C 198 178.492 179.152 -0.660 1
1 775 . 19 1 1 A 64 64 ALA CA C 198 56.794 55.328 1.466 1
1 776 . 19 1 1 A 64 64 ALA CB C 198 18.951 18.496 0.455 1
1 777 . 19 1 1 A 64 64 ALA N N 198 131.710 123.426 8.284 1
1 778 . 19 1 1 A 65 65 LYS H H 199 7.666 7.894 -0.228 1
1 779 . 19 1 1 A 65 65 LYS HA H 199 4.175 3.910 0.265 1
1 788 . 19 1 1 A 65 65 LYS C C 199 177.159 177.977 -0.818 1
1 789 . 19 1 1 A 65 65 LYS CA C 199 57.735 59.306 -1.571 1
1 790 . 19 1 1 A 65 65 LYS CB C 199 31.948 31.990 -0.042 1
1 794 . 19 1 1 A 65 65 LYS N N 199 111.375 118.312 -6.937 1
1 795 . 19 1 1 A 66 66 LYS H H 200 7.545 7.605 -0.060 1
1 796 . 19 1 1 A 66 66 LYS HA H 200 4.612 4.420 0.192 1
1 805 . 19 1 1 A 66 66 LYS C C 200 175.609 175.088 0.521 1
1 806 . 19 1 1 A 66 66 LYS CA C 200 54.468 55.978 -1.510 1
1 807 . 19 1 1 A 66 66 LYS CB C 200 31.525 32.138 -0.613 1
1 811 . 19 1 1 A 66 66 LYS N N 200 121.421 116.114 5.307 1
1 812 . 19 1 1 A 67 67 ASP H H 201 7.630 8.361 -0.731 1
1 813 . 19 1 1 A 67 67 ASP HA H 201 4.306 4.379 -0.073 1
1 816 . 19 1 1 A 67 67 ASP C C 201 175.025 176.370 -1.345 1
1 817 . 19 1 1 A 67 67 ASP CA C 201 56.400 55.390 1.010 1
1 818 . 19 1 1 A 67 67 ASP CB C 201 38.315 39.152 -0.837 1
1 819 . 19 1 1 A 67 67 ASP N N 201 116.216 117.642 -1.426 1
1 820 . 19 1 1 A 68 68 GLY H H 202 8.368 8.559 -0.191 1
1 821 . 19 1 1 A 68 68 GLY HA2 H 202 4.316 3.929 0.387 1
1 822 . 19 1 1 A 68 68 GLY HA3 H 202 3.731 3.983 -0.252 1
1 823 . 19 1 1 A 68 68 GLY C C 202 174.139 174.519 -0.380 1
1 824 . 19 1 1 A 68 68 GLY CA C 202 45.514 45.425 0.089 1
1 825 . 19 1 1 A 68 68 GLY N N 202 105.095 104.385 0.710 1
1 826 . 19 1 1 A 69 69 GLU H H 203 7.534 7.614 -0.080 1
1 827 . 19 1 1 A 69 69 GLU HA H 203 4.479 4.488 -0.009 1
1 832 . 19 1 1 A 69 69 GLU C C 203 176.961 176.615 0.346 1
1 833 . 19 1 1 A 69 69 GLU CA C 203 58.549 57.096 1.453 1
1 834 . 19 1 1 A 69 69 GLU CB C 203 30.998 30.613 0.385 1
1 836 . 19 1 1 A 69 69 GLU N N 203 120.426 120.909 -0.483 1
1 837 . 19 1 1 A 70 70 LEU H H 204 8.962 8.837 0.125 1
1 838 . 19 1 1 A 70 70 LEU HA H 204 4.438 4.665 -0.227 1
1 848 . 19 1 1 A 70 70 LEU C C 204 178.648 177.369 1.279 1
1 849 . 19 1 1 A 70 70 LEU CA C 204 53.977 54.817 -0.840 1
1 850 . 19 1 1 A 70 70 LEU CB C 204 43.612 43.705 -0.093 1
1 854 . 19 1 1 A 70 70 LEU N N 204 122.066 125.579 -3.513 1
1 855 . 19 1 1 A 71 71 GLY H H 205 8.104 7.667 0.437 1
1 856 . 19 1 1 A 71 71 GLY HA2 H 205 4.165 4.012 0.153 1
1 857 . 19 1 1 A 71 71 GLY HA3 H 205 3.552 4.106 -0.554 1
1 858 . 19 1 1 A 71 71 GLY C C 205 173.098 173.529 -0.431 1
1 859 . 19 1 1 A 71 71 GLY CA C 205 44.723 45.285 -0.562 1
1 860 . 19 1 1 A 71 71 GLY N N 205 110.168 106.985 3.183 1
1 861 . 19 1 1 A 72 72 TYR H H 206 8.457 8.604 -0.147 1
1 862 . 19 1 1 A 72 72 TYR HA H 206 4.184 4.676 -0.492 1
1 869 . 19 1 1 A 72 72 TYR C C 206 175.975 175.436 0.539 1
1 870 . 19 1 1 A 72 72 TYR CA C 206 59.722 58.855 0.867 1
1 871 . 19 1 1 A 72 72 TYR CB C 206 38.378 38.164 0.214 1
1 874 . 19 1 1 A 72 72 TYR N N 206 120.171 122.108 -1.937 1
1 875 . 19 1 1 A 73 73 VAL H H 207 8.782 9.006 -0.224 1
1 876 . 19 1 1 A 73 73 VAL HA H 207 4.056 4.334 -0.278 1
1 884 . 19 1 1 A 73 73 VAL C C 207 174.901 176.002 -1.101 1
1 885 . 19 1 1 A 73 73 VAL CA C 207 62.202 62.995 -0.793 1
1 886 . 19 1 1 A 73 73 VAL CB C 207 33.071 32.150 0.921 1
1 889 . 19 1 1 A 73 73 VAL N N 207 128.847 125.572 3.275 1
1 890 . 19 1 1 A 74 74 LEU H H 208 8.146 8.842 -0.696 1
1 891 . 19 1 1 A 74 74 LEU HA H 208 4.944 4.422 0.522 1
1 901 . 19 1 1 A 74 74 LEU C C 208 178.400 177.468 0.932 1
1 902 . 19 1 1 A 74 74 LEU CA C 208 53.520 55.043 -1.523 1
1 903 . 19 1 1 A 74 74 LEU CB C 208 43.499 42.380 1.119 1
1 907 . 19 1 1 A 74 74 LEU N N 208 127.599 129.339 -1.740 1
1 908 . 19 1 1 A 75 75 LYS H H 209 8.403 8.626 -0.223 1
1 909 . 19 1 1 A 75 75 LYS HA H 209 3.771 3.929 -0.158 1
1 918 . 19 1 1 A 75 75 LYS C C 209 177.536 177.432 0.104 1
1 919 . 19 1 1 A 75 75 LYS CA C 209 58.385 58.839 -0.454 1
1 920 . 19 1 1 A 75 75 LYS CB C 209 32.459 32.010 0.449 1
1 924 . 19 1 1 A 75 75 LYS N N 209 123.798 123.304 0.494 1
1 925 . 19 1 1 A 76 76 GLY H H 210 9.997 9.410 0.587 1
1 926 . 19 1 1 A 76 76 GLY HA2 H 210 4.255 4.014 0.241 1
1 927 . 19 1 1 A 76 76 GLY HA3 H 210 3.791 4.016 -0.225 1
1 928 . 19 1 1 A 76 76 GLY C C 210 175.091 175.746 -0.655 1
1 929 . 19 1 1 A 76 76 GLY CA C 210 45.465 45.426 0.039 1
1 930 . 19 1 1 A 76 76 GLY N N 210 114.705 112.955 1.750 1
1 931 . 19 1 1 A 77 77 GLN H H 211 7.726 7.879 -0.153 1
1 932 . 19 1 1 A 77 77 GLN HA H 211 4.373 4.248 0.125 1
1 939 . 19 1 1 A 77 77 GLN C C 211 176.301 175.876 0.425 1
1 940 . 19 1 1 A 77 77 GLN CA C 211 57.074 57.101 -0.027 1
1 941 . 19 1 1 A 77 77 GLN CB C 211 30.798 29.323 1.475 1
1 943 . 19 1 1 A 77 77 GLN N N 211 118.702 117.806 0.896 1
1 945 . 19 1 1 A 78 78 THR H H 212 8.225 7.526 0.699 1
1 946 . 19 1 1 A 78 78 THR HA H 212 4.620 4.594 0.026 1
1 951 . 19 1 1 A 78 78 THR C C 212 173.920 174.306 -0.386 1
1 952 . 19 1 1 A 78 78 THR CA C 212 60.087 59.851 0.236 1
1 953 . 19 1 1 A 78 78 THR CB C 212 71.412 70.983 0.429 1
1 955 . 19 1 1 A 78 78 THR N N 212 111.935 111.309 0.626 1
1 956 . 19 1 1 A 79 79 ASP H H 213 8.372 8.562 -0.190 1
1 957 . 19 1 1 A 79 79 ASP HA H 213 4.470 4.551 -0.081 1
1 960 . 19 1 1 A 79 79 ASP C C 213 176.759 177.266 -0.507 1
1 961 . 19 1 1 A 79 79 ASP CA C 213 54.927 54.444 0.483 1
1 962 . 19 1 1 A 79 79 ASP CB C 213 43.859 41.450 2.409 1
1 963 . 19 1 1 A 79 79 ASP N N 213 122.093 121.612 0.481 1
1 964 . 19 1 1 A 80 80 LYS H H 214 8.740 8.812 -0.072 1
1 965 . 19 1 1 A 80 80 LYS HA H 214 4.027 4.012 0.015 1
1 974 . 19 1 1 A 80 80 LYS C C 214 178.493 177.965 0.528 1
1 975 . 19 1 1 A 80 80 LYS CA C 214 59.802 59.413 0.389 1
1 976 . 19 1 1 A 80 80 LYS CB C 214 32.374 32.248 0.126 1
1 980 . 19 1 1 A 80 80 LYS N N 214 124.685 123.524 1.161 1
1 981 . 19 1 1 A 81 81 ASP H H 215 8.556 8.183 0.373 1
1 982 . 19 1 1 A 81 81 ASP HA H 215 4.566 4.364 0.202 1
1 985 . 19 1 1 A 81 81 ASP C C 215 178.889 178.816 0.073 1
1 986 . 19 1 1 A 81 81 ASP CA C 215 58.046 57.466 0.580 1
1 987 . 19 1 1 A 81 81 ASP CB C 215 40.872 40.714 0.158 1
1 988 . 19 1 1 A 81 81 ASP N N 215 121.413 119.397 2.016 1
1 989 . 19 1 1 A 82 82 PHE H H 216 8.205 8.338 -0.133 1
1 990 . 19 1 1 A 82 82 PHE HA H 216 3.686 4.032 -0.346 1
1 998 . 19 1 1 A 82 82 PHE C C 216 175.919 177.325 -1.406 1
1 999 . 19 1 1 A 82 82 PHE CA C 216 61.648 60.952 0.696 1
1 1000 . 19 1 1 A 82 82 PHE CB C 216 39.743 39.164 0.579 1
1 1004 . 19 1 1 A 82 82 PHE N N 216 124.401 122.107 2.294 1
1 1005 . 19 1 1 A 83 83 GLU H H 217 8.887 8.874 0.013 1
1 1006 . 19 1 1 A 83 83 GLU HA H 217 3.704 4.179 -0.475 1
1 1011 . 19 1 1 A 83 83 GLU C C 217 177.788 178.994 -1.206 1
1 1012 . 19 1 1 A 83 83 GLU CA C 217 60.545 60.200 0.345 1
1 1013 . 19 1 1 A 83 83 GLU CB C 217 30.639 29.458 1.181 1
1 1015 . 19 1 1 A 83 83 GLU N N 217 119.421 119.022 0.399 1
1 1016 . 19 1 1 A 84 84 LYS H H 218 8.055 7.987 0.068 1
1 1017 . 19 1 1 A 84 84 LYS HA H 218 3.947 4.127 -0.180 1
1 1026 . 19 1 1 A 84 84 LYS C C 218 178.783 178.704 0.079 1
1 1027 . 19 1 1 A 84 84 LYS CA C 218 59.327 58.896 0.431 1
1 1028 . 19 1 1 A 84 84 LYS CB C 218 32.539 32.218 0.321 1
1 1032 . 19 1 1 A 84 84 LYS N N 218 117.821 119.622 -1.801 1
1 1033 . 19 1 1 A 85 85 ALA H H 219 7.059 7.770 -0.711 1
1 1034 . 19 1 1 A 85 85 ALA HA H 219 4.040 4.025 0.015 1
1 1038 . 19 1 1 A 85 85 ALA C C 219 179.794 180.083 -0.289 1
1 1039 . 19 1 1 A 85 85 ALA CA C 219 54.407 54.815 -0.408 1
1 1040 . 19 1 1 A 85 85 ALA CB C 219 20.130 17.901 2.229 1
1 1041 . 19 1 1 A 85 85 ALA N N 219 118.905 121.442 -2.537 1
1 1042 . 19 1 1 A 86 86 LEU H H 220 8.157 8.202 -0.045 1
1 1043 . 19 1 1 A 86 86 LEU HA H 220 3.692 3.888 -0.196 1
1 1053 . 19 1 1 A 86 86 LEU C C 220 178.330 178.546 -0.216 1
1 1054 . 19 1 1 A 86 86 LEU CA C 220 57.752 58.017 -0.265 1
1 1055 . 19 1 1 A 86 86 LEU CB C 220 41.464 41.838 -0.374 1
1 1059 . 19 1 1 A 86 86 LEU N N 220 118.606 120.324 -1.718 1
1 1060 . 19 1 1 A 87 87 PHE H H 221 8.349 8.106 0.243 1
1 1061 . 19 1 1 A 87 87 PHE HA H 221 3.861 4.427 -0.566 1
1 1069 . 19 1 1 A 87 87 PHE C C 221 176.176 177.864 -1.688 1
1 1070 . 19 1 1 A 87 87 PHE CA C 221 61.780 61.563 0.217 1
1 1071 . 19 1 1 A 87 87 PHE CB C 221 37.549 37.845 -0.296 1
1 1075 . 19 1 1 A 87 87 PHE N N 221 112.449 116.815 -4.366 1
1 1076 . 19 1 1 A 88 88 LYS H H 222 7.061 8.232 -1.171 1
1 1077 . 19 1 1 A 88 88 LYS HA H 222 4.380 4.129 0.251 1
1 1086 . 19 1 1 A 88 88 LYS C C 222 177.089 177.315 -0.226 1
1 1087 . 19 1 1 A 88 88 LYS CA C 222 56.726 58.470 -1.744 1
1 1088 . 19 1 1 A 88 88 LYS CB C 222 33.738 32.440 1.298 1
1 1092 . 19 1 1 A 88 88 LYS N N 222 118.308 120.818 -2.510 1
1 1093 . 19 1 1 A 89 89 LEU H H 223 7.270 7.300 -0.030 1
1 1094 . 19 1 1 A 89 89 LEU HA H 223 4.168 4.100 0.068 1
1 1104 . 19 1 1 A 89 89 LEU C C 223 177.528 177.096 0.432 1
1 1105 . 19 1 1 A 89 89 LEU CA C 223 55.279 55.359 -0.080 1
1 1106 . 19 1 1 A 89 89 LEU CB C 223 43.240 42.156 1.084 1
1 1110 . 19 1 1 A 89 89 LEU N N 223 121.317 122.177 -0.860 1
1 1111 . 19 1 1 A 90 90 LYS H H 224 8.788 8.462 0.326 1
1 1112 . 19 1 1 A 90 90 LYS HA H 224 4.359 4.262 0.097 1
1 1121 . 19 1 1 A 90 90 LYS C C 224 175.839 175.511 0.328 1
1 1122 . 19 1 1 A 90 90 LYS CA C 224 54.772 55.961 -1.189 1
1 1123 . 19 1 1 A 90 90 LYS CB C 224 33.232 33.358 -0.126 1
1 1127 . 19 1 1 A 90 90 LYS N N 224 123.558 123.417 0.141 1
1 1128 . 19 1 1 A 91 91 ASP H H 225 8.125 8.617 -0.492 1
1 1129 . 19 1 1 A 91 91 ASP HA H 225 3.958 4.392 -0.434 1
1 1132 . 19 1 1 A 91 91 ASP C C 225 177.452 176.684 0.768 1
1 1133 . 19 1 1 A 91 91 ASP CA C 225 56.642 55.541 1.101 1
1 1134 . 19 1 1 A 91 91 ASP CB C 225 40.269 40.177 0.092 1
1 1135 . 19 1 1 A 91 91 ASP N N 225 119.419 120.882 -1.463 1
1 1136 . 19 1 1 A 92 92 GLY H H 226 8.681 8.637 0.044 1
1 1137 . 19 1 1 A 92 92 GLY HA2 H 226 4.131 3.826 0.305 1
1 1138 . 19 1 1 A 92 92 GLY HA3 H 226 3.579 3.854 -0.275 1
1 1139 . 19 1 1 A 92 92 GLY C C 226 173.614 173.813 -0.199 1
1 1140 . 19 1 1 A 92 92 GLY CA C 226 45.564 45.359 0.205 1
1 1141 . 19 1 1 A 92 92 GLY N N 226 113.802 111.942 1.860 1
1 1142 . 19 1 1 A 93 93 GLU H H 227 8.104 7.922 0.182 1
1 1143 . 19 1 1 A 93 93 GLU HA H 227 4.232 4.381 -0.149 1
1 1148 . 19 1 1 A 93 93 GLU C C 227 174.282 175.643 -1.361 1
1 1149 . 19 1 1 A 93 93 GLU CA C 227 56.651 56.220 0.431 1
1 1150 . 19 1 1 A 93 93 GLU CB C 227 32.190 31.030 1.160 1
1 1152 . 19 1 1 A 93 93 GLU N N 227 121.527 121.894 -0.367 1
1 1153 . 19 1 1 A 94 94 VAL H H 228 7.918 8.430 -0.512 1
1 1154 . 19 1 1 A 94 94 VAL HA H 228 4.857 4.628 0.229 1
1 1162 . 19 1 1 A 94 94 VAL C C 228 176.556 175.850 0.706 1
1 1163 . 19 1 1 A 94 94 VAL CA C 228 60.309 60.526 -0.217 1
1 1164 . 19 1 1 A 94 94 VAL CB C 228 33.847 34.667 -0.820 1
1 1167 . 19 1 1 A 94 94 VAL N N 228 119.768 126.435 -6.667 1
1 1168 . 19 1 1 A 95 95 SER H H 229 9.659 9.385 0.274 1
1 1169 . 19 1 1 A 95 95 SER HA H 229 4.313 4.680 -0.367 1
1 1172 . 19 1 1 A 95 95 SER C C 229 174.641 174.584 0.057 1
1 1173 . 19 1 1 A 95 95 SER CA C 229 59.208 57.862 1.346 1
1 1174 . 19 1 1 A 95 95 SER CB C 229 66.080 65.744 0.336 1
1 1175 . 19 1 1 A 95 95 SER N N 229 124.903 121.330 3.573 1
1 1176 . 19 1 1 A 96 96 GLU H H 230 8.014 8.402 -0.388 1
1 1177 . 19 1 1 A 96 96 GLU HA H 230 4.376 4.319 0.057 1
1 1182 . 19 1 1 A 96 96 GLU C C 230 176.641 175.894 0.747 1
1 1183 . 19 1 1 A 96 96 GLU CA C 230 56.236 56.019 0.217 1
1 1184 . 19 1 1 A 96 96 GLU CB C 230 30.324 30.409 -0.085 1
1 1186 . 19 1 1 A 96 96 GLU N N 230 115.510 119.484 -3.974 1
1 1187 . 19 1 1 A 97 97 VAL H H 231 8.741 8.345 0.396 1
1 1188 . 19 1 1 A 97 97 VAL HA H 231 4.171 4.139 0.032 1
1 1196 . 19 1 1 A 97 97 VAL C C 231 176.684 175.857 0.827 1
1 1197 . 19 1 1 A 97 97 VAL CA C 231 65.418 63.245 2.173 1
1 1198 . 19 1 1 A 97 97 VAL CB C 231 31.218 31.407 -0.189 1
1 1201 . 19 1 1 A 97 97 VAL N N 231 121.289 120.636 0.653 1
1 1202 . 19 1 1 A 98 98 VAL H H 232 9.218 9.388 -0.170 1
1 1203 . 19 1 1 A 98 98 VAL HA H 232 4.405 4.666 -0.261 1
1 1211 . 19 1 1 A 98 98 VAL C C 232 174.258 174.374 -0.116 1
1 1212 . 19 1 1 A 98 98 VAL CA C 232 60.937 61.239 -0.302 1
1 1213 . 19 1 1 A 98 98 VAL CB C 232 35.825 33.739 2.086 1
1 1216 . 19 1 1 A 98 98 VAL N N 232 130.544 128.843 1.701 1
1 1217 . 19 1 1 A 99 99 LYS H H 233 8.800 8.769 0.031 1
1 1218 . 19 1 1 A 99 99 LYS HA H 233 4.853 5.285 -0.432 1
1 1227 . 19 1 1 A 99 99 LYS C C 233 175.274 175.120 0.154 1
1 1228 . 19 1 1 A 99 99 LYS CA C 233 55.499 54.607 0.892 1
1 1229 . 19 1 1 A 99 99 LYS CB C 233 34.452 35.370 -0.918 1
1 1233 . 19 1 1 A 99 99 LYS N N 233 130.477 127.779 2.698 1
1 1234 . 19 1 1 A 100 100 SER H H 234 9.585 9.161 0.424 1
1 1235 . 19 1 1 A 100 100 SER HA H 234 5.150 4.906 0.244 1
1 1238 . 19 1 1 A 100 100 SER C C 234 175.493 174.067 1.426 1
1 1239 . 19 1 1 A 100 100 SER CA C 234 56.927 57.409 -0.482 1
1 1240 . 19 1 1 A 100 100 SER CB C 234 67.309 67.234 0.075 1
1 1241 . 19 1 1 A 100 100 SER N N 234 125.814 122.499 3.315 1
1 1242 . 19 1 1 A 101 101 SER H H 235 8.631 8.962 -0.331 1
1 1243 . 19 1 1 A 101 101 SER HA H 235 4.106 4.073 0.033 1
1 1246 . 19 1 1 A 101 101 SER C C 235 175.385 175.131 0.254 1
1 1247 . 19 1 1 A 101 101 SER CA C 235 61.123 61.521 -0.398 1
1 1248 . 19 1 1 A 101 101 SER CB C 235 62.818 62.504 0.314 1
1 1249 . 19 1 1 A 101 101 SER N N 235 115.089 117.178 -2.089 1
1 1250 . 19 1 1 A 102 102 PHE H H 236 8.957 7.650 1.307 1
1 1251 . 19 1 1 A 102 102 PHE HA H 236 4.610 4.635 -0.025 1
1 1259 . 19 1 1 A 102 102 PHE C C 236 176.453 175.603 0.850 1
1 1260 . 19 1 1 A 102 102 PHE CA C 236 58.382 57.964 0.418 1
1 1261 . 19 1 1 A 102 102 PHE CB C 236 40.275 39.702 0.573 1
1 1263 . 19 1 1 A 102 102 PHE N N 236 119.917 116.962 2.955 1
1 1264 . 19 1 1 A 103 103 GLY H H 237 7.377 7.186 0.191 1
1 1265 . 19 1 1 A 103 103 GLY HA2 H 237 4.453 3.988 0.465 1
1 1266 . 19 1 1 A 103 103 GLY HA3 H 237 3.472 4.153 -0.681 1
1 1267 . 19 1 1 A 103 103 GLY C C 237 169.627 172.438 -2.811 1
1 1268 . 19 1 1 A 103 103 GLY CA C 237 45.384 44.350 1.034 1
1 1269 . 19 1 1 A 103 103 GLY N N 237 108.809 106.473 2.336 1
1 1270 . 19 1 1 A 104 104 TYR H H 238 8.632 8.441 0.191 1
1 1271 . 19 1 1 A 104 104 TYR HA H 238 5.322 5.435 -0.113 1
1 1278 . 19 1 1 A 104 104 TYR C C 238 175.043 174.964 0.079 1
1 1279 . 19 1 1 A 104 104 TYR CA C 238 57.627 57.114 0.513 1
1 1280 . 19 1 1 A 104 104 TYR CB C 238 41.711 41.476 0.235 1
1 1283 . 19 1 1 A 104 104 TYR N N 238 120.030 121.819 -1.789 1
1 1284 . 19 1 1 A 105 105 HIS H H 239 10.070 9.477 0.593 1
1 1285 . 19 1 1 A 105 105 HIS HA H 239 6.046 5.610 0.436 1
1 1290 . 19 1 1 A 105 105 HIS C C 239 175.734 174.892 0.842 1
1 1291 . 19 1 1 A 105 105 HIS CA C 239 53.945 54.283 -0.338 1
1 1292 . 19 1 1 A 105 105 HIS CB C 239 32.450 34.398 -1.948 1
1 1295 . 19 1 1 A 105 105 HIS N N 239 119.504 119.064 0.440 1
1 1296 . 19 1 1 A 106 106 ILE H H 240 8.660 9.167 -0.507 1
1 1297 . 19 1 1 A 106 106 ILE HA H 240 4.120 4.936 -0.816 1
1 1307 . 19 1 1 A 106 106 ILE C C 240 174.758 175.228 -0.470 1
1 1308 . 19 1 1 A 106 106 ILE CA C 240 63.446 60.033 3.413 1
1 1309 . 19 1 1 A 106 106 ILE CB C 240 40.786 41.444 -0.658 1
1 1313 . 19 1 1 A 106 106 ILE N N 240 120.639 120.152 0.487 1
1 1314 . 19 1 1 A 107 107 ILE H H 241 9.033 9.269 -0.236 1
1 1315 . 19 1 1 A 107 107 ILE HA H 241 4.799 5.159 -0.360 1
1 1325 . 19 1 1 A 107 107 ILE C C 241 172.880 173.958 -1.078 1
1 1326 . 19 1 1 A 107 107 ILE CA C 241 60.563 59.634 0.929 1
1 1327 . 19 1 1 A 107 107 ILE CB C 241 41.652 40.388 1.264 1
1 1331 . 19 1 1 A 107 107 ILE N N 241 129.098 127.071 2.027 1
1 1332 . 19 1 1 A 108 108 LYS H H 242 8.692 9.088 -0.396 1
1 1333 . 19 1 1 A 108 108 LYS HA H 242 5.012 4.975 0.037 1
1 1342 . 19 1 1 A 108 108 LYS C C 242 174.484 175.478 -0.994 1
1 1343 . 19 1 1 A 108 108 LYS CA C 242 54.317 53.852 0.465 1
1 1344 . 19 1 1 A 108 108 LYS CB C 242 35.619 35.417 0.202 1
1 1348 . 19 1 1 A 108 108 LYS N N 242 127.179 126.553 0.626 1
1 1349 . 19 1 1 A 109 109 ALA H H 243 7.816 8.813 -0.997 1
1 1350 . 19 1 1 A 109 109 ALA HA H 243 4.604 4.380 0.224 1
1 1354 . 19 1 1 A 109 109 ALA C C 243 176.231 176.267 -0.036 1
1 1355 . 19 1 1 A 109 109 ALA CA C 243 50.505 51.790 -1.285 1
1 1356 . 19 1 1 A 109 109 ALA CB C 243 19.584 19.234 0.350 1
1 1357 . 19 1 1 A 109 109 ALA N N 243 129.619 127.814 1.805 1
1 1358 . 19 1 1 A 110 110 ASP H H 244 7.578 8.875 -1.297 1
1 1359 . 19 1 1 A 110 110 ASP HA H 244 4.424 5.185 -0.761 1
1 1362 . 19 1 1 A 110 110 ASP C C 244 175.259 174.563 0.696 1
1 1363 . 19 1 1 A 110 110 ASP CA C 244 54.489 53.252 1.237 1
1 1364 . 19 1 1 A 110 110 ASP CB C 244 42.693 43.164 -0.471 1
1 1365 . 19 1 1 A 110 110 ASP N N 244 125.434 122.529 2.905 1
1 4 . 20 1 1 A 2 2 PRO HA H -4 4.403 4.461 -0.058 1
1 11 . 20 1 1 A 2 2 PRO C C -4 176.990 176.513 0.477 1
1 12 . 20 1 1 A 2 2 PRO CA C -4 63.131 64.313 -1.182 1
1 13 . 20 1 1 A 2 2 PRO CB C -4 32.342 32.083 0.259 1
1 16 . 20 1 1 A 3 3 LEU H H -3 8.483 7.611 0.872 1
1 17 . 20 1 1 A 3 3 LEU HA H -3 4.333 4.122 0.211 1
1 27 . 20 1 1 A 3 3 LEU C C -3 177.991 176.859 1.132 1
1 28 . 20 1 1 A 3 3 LEU CA C -3 55.314 55.315 -0.001 1
1 29 . 20 1 1 A 3 3 LEU CB C -3 42.244 42.570 -0.326 1
1 33 . 20 1 1 A 3 3 LEU N N -3 122.986 120.420 2.566 1
1 34 . 20 1 1 A 4 4 GLY H H -2 8.397 8.908 -0.511 1
1 35 . 20 1 1 A 4 4 GLY HA2 H -2 4.024 3.879 0.145 1
1 36 . 20 1 1 A 4 4 GLY HA3 H -2 3.976 3.886 0.090 1
1 37 . 20 1 1 A 4 4 GLY C C -2 174.360 173.862 0.498 1
1 38 . 20 1 1 A 4 4 GLY CA C -2 45.434 46.406 -0.972 1
1 39 . 20 1 1 A 4 4 GLY N N -2 110.666 116.213 -5.547 1
1 56 . 20 1 1 A 7 7 SER H H 141 7.913 7.961 -0.048 1
1 57 . 20 1 1 A 7 7 SER HA H 141 5.657 5.186 0.471 1
1 60 . 20 1 1 A 7 7 SER C C 141 173.753 172.522 1.231 1
1 61 . 20 1 1 A 7 7 SER CA C 141 56.758 57.863 -1.105 1
1 62 . 20 1 1 A 7 7 SER CB C 141 66.774 65.470 1.304 1
1 63 . 20 1 1 A 7 7 SER N N 141 113.824 112.226 1.598 1
1 64 . 20 1 1 A 8 8 LYS H H 142 8.656 8.614 0.042 1
1 65 . 20 1 1 A 8 8 LYS HA H 142 4.543 5.191 -0.648 1
1 74 . 20 1 1 A 8 8 LYS C C 142 174.403 174.253 0.150 1
1 75 . 20 1 1 A 8 8 LYS CA C 142 55.578 54.806 0.772 1
1 76 . 20 1 1 A 8 8 LYS CB C 142 36.561 36.165 0.396 1
1 80 . 20 1 1 A 8 8 LYS N N 142 123.076 119.282 3.794 1
1 81 . 20 1 1 A 9 9 LYS H H 143 8.623 8.486 0.137 1
1 82 . 20 1 1 A 9 9 LYS HA H 143 4.119 4.661 -0.542 1
1 91 . 20 1 1 A 9 9 LYS C C 143 176.144 175.548 0.596 1
1 92 . 20 1 1 A 9 9 LYS CA C 143 56.683 56.116 0.567 1
1 93 . 20 1 1 A 9 9 LYS CB C 143 32.580 33.105 -0.525 1
1 97 . 20 1 1 A 9 9 LYS N N 143 129.542 122.780 6.762 1
1 98 . 20 1 1 A 10 10 ALA H H 144 8.151 8.764 -0.613 1
1 99 . 20 1 1 A 10 10 ALA HA H 144 5.208 4.883 0.325 1
1 103 . 20 1 1 A 10 10 ALA C C 144 175.577 175.074 0.503 1
1 104 . 20 1 1 A 10 10 ALA CA C 144 51.226 51.257 -0.031 1
1 105 . 20 1 1 A 10 10 ALA CB C 144 25.299 24.049 1.250 1
1 106 . 20 1 1 A 10 10 ALA N N 144 127.933 127.701 0.232 1
1 107 . 20 1 1 A 11 11 SER H H 145 8.679 8.802 -0.123 1
1 108 . 20 1 1 A 11 11 SER HA H 145 5.431 5.738 -0.307 1
1 111 . 20 1 1 A 11 11 SER C C 145 173.072 173.303 -0.231 1
1 112 . 20 1 1 A 11 11 SER CA C 145 57.772 57.132 0.640 1
1 113 . 20 1 1 A 11 11 SER CB C 145 67.301 66.087 1.214 1
1 114 . 20 1 1 A 11 11 SER N N 145 116.245 115.463 0.782 1
1 115 . 20 1 1 A 12 12 HIS H H 146 9.962 9.576 0.386 1
1 116 . 20 1 1 A 12 12 HIS HA H 146 6.332 6.065 0.267 1
1 121 . 20 1 1 A 12 12 HIS C C 146 173.006 172.347 0.659 1
1 122 . 20 1 1 A 12 12 HIS CA C 146 55.020 54.211 0.809 1
1 123 . 20 1 1 A 12 12 HIS CB C 146 37.071 33.912 3.159 1
1 126 . 20 1 1 A 12 12 HIS N N 146 119.181 118.485 0.696 1
1 127 . 20 1 1 A 13 13 ILE H H 147 8.976 8.894 0.082 1
1 128 . 20 1 1 A 13 13 ILE HA H 147 3.528 4.577 -1.049 1
1 138 . 20 1 1 A 13 13 ILE C C 147 173.010 173.911 -0.901 1
1 139 . 20 1 1 A 13 13 ILE CA C 147 61.273 59.643 1.630 1
1 140 . 20 1 1 A 13 13 ILE CB C 147 41.773 41.383 0.390 1
1 144 . 20 1 1 A 13 13 ILE N N 147 121.873 119.411 2.462 1
1 145 . 20 1 1 A 14 14 LEU H H 148 7.627 8.928 -1.301 1
1 146 . 20 1 1 A 14 14 LEU HA H 148 4.814 4.894 -0.080 1
1 156 . 20 1 1 A 14 14 LEU C C 148 174.112 174.393 -0.281 1
1 157 . 20 1 1 A 14 14 LEU CA C 148 52.574 52.998 -0.424 1
1 158 . 20 1 1 A 14 14 LEU CB C 148 45.643 44.903 0.740 1
1 162 . 20 1 1 A 14 14 LEU N N 148 127.112 129.443 -2.331 1
1 163 . 20 1 1 A 15 15 ILE H H 149 9.524 9.136 0.388 1
1 164 . 20 1 1 A 15 15 ILE HA H 149 4.362 4.593 -0.231 1
1 174 . 20 1 1 A 15 15 ILE C C 149 175.452 175.544 -0.092 1
1 175 . 20 1 1 A 15 15 ILE CA C 149 58.516 60.708 -2.192 1
1 176 . 20 1 1 A 15 15 ILE CB C 149 36.560 39.263 -2.703 1
1 180 . 20 1 1 A 15 15 ILE N N 149 128.652 127.234 1.418 1
1 181 . 20 1 1 A 16 16 LYS H H 150 8.035 8.658 -0.623 1
1 182 . 20 1 1 A 16 16 LYS HA H 150 4.319 4.474 -0.155 1
1 191 . 20 1 1 A 16 16 LYS C C 150 175.038 176.510 -1.472 1
1 192 . 20 1 1 A 16 16 LYS CA C 150 57.817 56.754 1.063 1
1 193 . 20 1 1 A 16 16 LYS CB C 150 34.853 32.776 2.077 1
1 197 . 20 1 1 A 16 16 LYS N N 150 129.153 127.918 1.235 1
1 198 . 20 1 1 A 17 17 VAL H H 151 8.016 8.976 -0.960 1
1 199 . 20 1 1 A 17 17 VAL HA H 151 4.873 4.989 -0.116 1
1 207 . 20 1 1 A 17 17 VAL C C 151 176.647 175.384 1.263 1
1 208 . 20 1 1 A 17 17 VAL CA C 151 60.088 61.016 -0.928 1
1 209 . 20 1 1 A 17 17 VAL CB C 151 34.082 34.334 -0.252 1
1 212 . 20 1 1 A 17 17 VAL N N 151 121.288 124.465 -3.177 1
1 213 . 20 1 1 A 18 18 LYS H H 152 8.443 8.740 -0.297 1
1 214 . 20 1 1 A 18 18 LYS HA H 152 4.334 4.729 -0.395 1
1 223 . 20 1 1 A 18 18 LYS C C 152 176.345 177.215 -0.870 1
1 224 . 20 1 1 A 18 18 LYS CA C 152 57.016 54.437 2.579 1
1 225 . 20 1 1 A 18 18 LYS CB C 152 33.222 34.933 -1.711 1
1 229 . 20 1 1 A 18 18 LYS N N 152 128.408 126.758 1.650 1
1 230 . 20 1 1 A 19 19 SER H H 153 9.067 8.628 0.439 1
1 231 . 20 1 1 A 19 19 SER HA H 153 4.457 4.503 -0.046 1
1 234 . 20 1 1 A 19 19 SER C C 153 174.236 174.563 -0.327 1
1 235 . 20 1 1 A 19 19 SER CA C 153 59.642 59.927 -0.285 1
1 236 . 20 1 1 A 19 19 SER CB C 153 64.347 64.100 0.247 1
1 237 . 20 1 1 A 19 19 SER N N 153 121.522 116.391 5.131 1
1 238 . 20 1 1 A 20 20 LYS H H 154 7.961 7.667 0.294 1
1 239 . 20 1 1 A 20 20 LYS HA H 154 4.558 4.704 -0.146 1
1 244 . 20 1 1 A 20 20 LYS C C 154 177.256 176.374 0.882 1
1 245 . 20 1 1 A 20 20 LYS CA C 154 55.249 54.912 0.337 1
1 246 . 20 1 1 A 20 20 LYS CB C 154 34.531 35.474 -0.943 1
1 248 . 20 1 1 A 20 20 LYS N N 154 120.270 119.232 1.038 1
1 249 . 20 1 1 A 21 21 LYS HA H 155 4.003 3.980 0.023 1
1 258 . 20 1 1 A 21 21 LYS C C 155 177.015 178.106 -1.091 1
1 259 . 20 1 1 A 21 21 LYS CA C 155 59.091 58.847 0.244 1
1 260 . 20 1 1 A 21 21 LYS CB C 155 32.394 32.296 0.098 1
1 264 . 20 1 1 A 22 22 SER H H 156 7.625 7.892 -0.267 1
1 265 . 20 1 1 A 22 22 SER HA H 156 4.293 4.408 -0.115 1
1 268 . 20 1 1 A 22 22 SER C C 156 174.843 174.066 0.777 1
1 269 . 20 1 1 A 22 22 SER CA C 156 57.966 60.363 -2.397 1
1 270 . 20 1 1 A 22 22 SER CB C 156 63.369 63.376 -0.007 1
1 271 . 20 1 1 A 22 22 SER N N 156 109.549 113.158 -3.609 1
1 272 . 20 1 1 A 23 23 ASP H H 157 7.701 7.266 0.435 1
1 273 . 20 1 1 A 23 23 ASP HA H 157 4.548 4.508 0.040 1
1 276 . 20 1 1 A 23 23 ASP C C 157 176.544 176.738 -0.194 1
1 277 . 20 1 1 A 23 23 ASP CA C 157 55.242 54.637 0.605 1
1 278 . 20 1 1 A 23 23 ASP CB C 157 41.103 42.352 -1.249 1
1 279 . 20 1 1 A 23 23 ASP N N 157 124.536 121.463 3.073 1
1 280 . 20 1 1 A 24 24 LYS H H 158 8.583 8.721 -0.138 1
1 281 . 20 1 1 A 24 24 LYS HA H 158 4.252 4.084 0.168 1
1 290 . 20 1 1 A 24 24 LYS C C 158 176.813 178.438 -1.625 1
1 291 . 20 1 1 A 24 24 LYS CA C 158 57.148 58.569 -1.421 1
1 292 . 20 1 1 A 24 24 LYS CB C 158 33.200 32.468 0.732 1
1 296 . 20 1 1 A 24 24 LYS N N 158 122.372 126.248 -3.876 1
1 297 . 20 1 1 A 25 25 GLU H H 159 8.001 8.001 0.000 1
1 298 . 20 1 1 A 25 25 GLU HA H 159 4.521 4.258 0.263 1
1 303 . 20 1 1 A 25 25 GLU C C 159 175.995 177.107 -1.112 1
1 304 . 20 1 1 A 25 25 GLU CA C 159 55.727 58.620 -2.893 1
1 305 . 20 1 1 A 25 25 GLU CB C 159 31.918 30.114 1.804 1
1 307 . 20 1 1 A 25 25 GLU N N 159 118.705 118.521 0.184 1
1 308 . 20 1 1 A 26 26 GLY H H 160 8.458 7.825 0.633 1
1 309 . 20 1 1 A 26 26 GLY HA2 H 160 3.946 4.082 -0.136 1
1 310 . 20 1 1 A 26 26 GLY HA3 H 160 3.511 4.093 -0.582 1
1 311 . 20 1 1 A 26 26 GLY C C 160 172.201 173.486 -1.285 1
1 312 . 20 1 1 A 26 26 GLY CA C 160 44.038 44.191 -0.153 1
1 313 . 20 1 1 A 26 26 GLY N N 160 107.642 108.844 -1.202 1
1 314 . 20 1 1 A 27 27 LEU H H 161 8.259 8.516 -0.257 1
1 315 . 20 1 1 A 27 27 LEU HA H 161 4.775 4.584 0.191 1
1 325 . 20 1 1 A 27 27 LEU C C 161 177.422 175.914 1.508 1
1 326 . 20 1 1 A 27 27 LEU CA C 161 53.322 54.125 -0.803 1
1 327 . 20 1 1 A 27 27 LEU CB C 161 45.576 42.629 2.947 1
1 331 . 20 1 1 A 27 27 LEU N N 161 119.856 120.833 -0.977 1
1 332 . 20 1 1 A 28 28 ASP H H 162 8.848 8.307 0.541 1
1 333 . 20 1 1 A 28 28 ASP HA H 162 4.644 4.529 0.115 1
1 336 . 20 1 1 A 28 28 ASP C C 162 176.630 176.965 -0.335 1
1 337 . 20 1 1 A 28 28 ASP CA C 162 55.195 54.523 0.672 1
1 338 . 20 1 1 A 28 28 ASP CB C 162 41.673 42.770 -1.097 1
1 339 . 20 1 1 A 28 28 ASP N N 162 122.434 121.456 0.978 1
1 340 . 20 1 1 A 29 29 ASP H H 163 8.720 9.059 -0.339 1
1 341 . 20 1 1 A 29 29 ASP HA H 163 4.386 4.442 -0.056 1
1 344 . 20 1 1 A 29 29 ASP C C 163 176.604 178.541 -1.937 1
1 345 . 20 1 1 A 29 29 ASP CA C 163 59.690 56.944 2.746 1
1 346 . 20 1 1 A 29 29 ASP CB C 163 42.964 40.034 2.930 1
1 347 . 20 1 1 A 29 29 ASP N N 163 121.460 125.166 -3.706 1
1 348 . 20 1 1 A 30 30 LYS H H 164 8.434 7.786 0.648 1
1 349 . 20 1 1 A 30 30 LYS HA H 164 3.901 3.962 -0.061 1
1 358 . 20 1 1 A 30 30 LYS C C 164 179.479 179.153 0.326 1
1 359 . 20 1 1 A 30 30 LYS CA C 164 60.047 59.449 0.598 1
1 360 . 20 1 1 A 30 30 LYS CB C 164 32.038 32.274 -0.236 1
1 364 . 20 1 1 A 30 30 LYS N N 164 116.627 119.492 -2.865 1
1 365 . 20 1 1 A 31 31 GLU H H 165 7.755 8.334 -0.579 1
1 366 . 20 1 1 A 31 31 GLU HA H 165 3.998 4.007 -0.009 1
1 371 . 20 1 1 A 31 31 GLU C C 165 179.031 179.223 -0.192 1
1 372 . 20 1 1 A 31 31 GLU CA C 165 59.335 59.203 0.132 1
1 373 . 20 1 1 A 31 31 GLU CB C 165 29.972 29.417 0.555 1
1 375 . 20 1 1 A 31 31 GLU N N 165 120.456 119.788 0.668 1
1 376 . 20 1 1 A 32 32 ALA H H 166 9.060 8.387 0.673 1
1 377 . 20 1 1 A 32 32 ALA HA H 166 3.871 4.010 -0.139 1
1 381 . 20 1 1 A 32 32 ALA C C 166 178.029 178.963 -0.934 1
1 382 . 20 1 1 A 32 32 ALA CA C 166 54.997 55.405 -0.408 1
1 383 . 20 1 1 A 32 32 ALA CB C 166 19.727 18.370 1.357 1
1 384 . 20 1 1 A 32 32 ALA N N 166 124.406 122.325 2.081 1
1 385 . 20 1 1 A 33 33 LYS H H 167 8.228 7.599 0.629 1
1 386 . 20 1 1 A 33 33 LYS HA H 167 2.595 3.021 -0.426 1
1 395 . 20 1 1 A 33 33 LYS C C 167 177.938 178.037 -0.099 1
1 396 . 20 1 1 A 33 33 LYS CA C 167 59.573 59.268 0.305 1
1 397 . 20 1 1 A 33 33 LYS CB C 167 32.098 32.222 -0.124 1
1 401 . 20 1 1 A 33 33 LYS N N 167 119.833 118.263 1.570 1
1 402 . 20 1 1 A 34 34 GLN H H 168 7.392 7.590 -0.198 1
1 403 . 20 1 1 A 34 34 GLN HA H 168 3.943 3.915 0.028 1
1 410 . 20 1 1 A 34 34 GLN C C 168 178.323 178.388 -0.065 1
1 411 . 20 1 1 A 34 34 GLN CA C 168 58.883 59.243 -0.360 1
1 412 . 20 1 1 A 34 34 GLN CB C 168 28.485 28.100 0.385 1
1 414 . 20 1 1 A 34 34 GLN N N 168 117.208 117.649 -0.441 1
1 416 . 20 1 1 A 35 35 LYS H H 169 7.994 7.843 0.151 1
1 417 . 20 1 1 A 35 35 LYS HA H 169 4.067 3.983 0.084 1
1 426 . 20 1 1 A 35 35 LYS C C 169 178.161 178.492 -0.331 1
1 427 . 20 1 1 A 35 35 LYS CA C 169 58.437 59.233 -0.796 1
1 428 . 20 1 1 A 35 35 LYS CB C 169 31.611 32.264 -0.653 1
1 432 . 20 1 1 A 35 35 LYS N N 169 120.898 119.581 1.317 1
1 433 . 20 1 1 A 36 36 ALA H H 170 8.431 8.288 0.143 1
1 434 . 20 1 1 A 36 36 ALA HA H 170 3.738 4.044 -0.306 1
1 438 . 20 1 1 A 36 36 ALA C C 170 178.862 179.866 -1.004 1
1 439 . 20 1 1 A 36 36 ALA CA C 170 55.351 55.000 0.351 1
1 440 . 20 1 1 A 36 36 ALA CB C 170 18.295 18.399 -0.104 1
1 441 . 20 1 1 A 36 36 ALA N N 170 120.641 120.539 0.102 1
1 442 . 20 1 1 A 37 37 GLU H H 171 8.412 8.058 0.354 1
1 443 . 20 1 1 A 37 37 GLU HA H 171 3.867 3.942 -0.075 1
1 448 . 20 1 1 A 37 37 GLU C C 171 179.255 179.303 -0.048 1
1 449 . 20 1 1 A 37 37 GLU CA C 171 59.543 59.621 -0.078 1
1 450 . 20 1 1 A 37 37 GLU CB C 171 29.569 29.555 0.014 1
1 452 . 20 1 1 A 37 37 GLU N N 171 118.224 117.597 0.627 1
1 453 . 20 1 1 A 38 38 GLU H H 172 8.019 8.051 -0.032 1
1 454 . 20 1 1 A 38 38 GLU HA H 172 3.952 4.037 -0.085 1
1 459 . 20 1 1 A 38 38 GLU C C 172 180.250 179.122 1.128 1
1 460 . 20 1 1 A 38 38 GLU CA C 172 59.627 59.142 0.485 1
1 461 . 20 1 1 A 38 38 GLU CB C 172 29.368 29.494 -0.126 1
1 463 . 20 1 1 A 38 38 GLU N N 172 121.250 120.245 1.005 1
1 464 . 20 1 1 A 39 39 ILE H H 173 8.174 7.698 0.476 1
1 465 . 20 1 1 A 39 39 ILE HA H 173 3.643 3.789 -0.146 1
1 475 . 20 1 1 A 39 39 ILE C C 173 177.568 177.946 -0.378 1
1 476 . 20 1 1 A 39 39 ILE CA C 173 64.869 63.721 1.148 1
1 477 . 20 1 1 A 39 39 ILE CB C 173 38.160 37.375 0.785 1
1 481 . 20 1 1 A 39 39 ILE N N 173 121.527 118.230 3.297 1
1 482 . 20 1 1 A 40 40 GLN H H 174 8.860 8.332 0.528 1
1 483 . 20 1 1 A 40 40 GLN HA H 174 3.533 3.999 -0.466 1
1 490 . 20 1 1 A 40 40 GLN C C 174 179.022 178.407 0.615 1
1 491 . 20 1 1 A 40 40 GLN CA C 174 61.316 59.225 2.091 1
1 492 . 20 1 1 A 40 40 GLN CB C 174 26.604 28.349 -1.745 1
1 494 . 20 1 1 A 40 40 GLN N N 174 121.956 121.039 0.917 1
1 496 . 20 1 1 A 41 41 LYS H H 175 7.879 7.836 0.043 1
1 497 . 20 1 1 A 41 41 LYS HA H 175 3.777 4.062 -0.285 1
1 506 . 20 1 1 A 41 41 LYS C C 175 178.779 178.947 -0.168 1
1 507 . 20 1 1 A 41 41 LYS CA C 175 59.701 58.960 0.741 1
1 508 . 20 1 1 A 41 41 LYS CB C 175 32.581 31.944 0.637 1
1 512 . 20 1 1 A 41 41 LYS N N 175 119.012 118.124 0.888 1
1 513 . 20 1 1 A 42 42 GLU H H 176 7.447 8.166 -0.719 1
1 514 . 20 1 1 A 42 42 GLU HA H 176 4.059 4.217 -0.158 1
1 519 . 20 1 1 A 42 42 GLU C C 176 180.058 178.917 1.141 1
1 520 . 20 1 1 A 42 42 GLU CA C 176 59.456 58.719 0.737 1
1 521 . 20 1 1 A 42 42 GLU CB C 176 29.923 30.235 -0.312 1
1 523 . 20 1 1 A 42 42 GLU N N 176 120.054 118.748 1.306 1
1 524 . 20 1 1 A 43 43 VAL H H 177 8.618 8.054 0.564 1
1 525 . 20 1 1 A 43 43 VAL HA H 177 3.986 3.929 0.057 1
1 533 . 20 1 1 A 43 43 VAL C C 177 176.459 178.064 -1.605 1
1 534 . 20 1 1 A 43 43 VAL CA C 177 63.923 64.965 -1.042 1
1 535 . 20 1 1 A 43 43 VAL CB C 177 31.899 31.300 0.599 1
1 538 . 20 1 1 A 43 43 VAL N N 177 114.191 117.006 -2.815 1
1 539 . 20 1 1 A 44 44 SER H H 178 8.052 8.417 -0.365 1
1 540 . 20 1 1 A 44 44 SER HA H 178 4.098 4.373 -0.275 1
1 543 . 20 1 1 A 44 44 SER C C 178 176.548 176.148 0.400 1
1 544 . 20 1 1 A 44 44 SER CA C 178 61.160 61.364 -0.204 1
1 545 . 20 1 1 A 44 44 SER CB C 178 62.959 63.313 -0.354 1
1 546 . 20 1 1 A 44 44 SER N N 178 114.202 117.421 -3.219 1
1 547 . 20 1 1 A 45 45 LYS H H 179 7.083 8.152 -1.069 1
1 548 . 20 1 1 A 45 45 LYS HA H 179 4.140 4.225 -0.085 1
1 557 . 20 1 1 A 45 45 LYS C C 179 177.288 176.108 1.180 1
1 558 . 20 1 1 A 45 45 LYS CA C 179 58.469 57.905 0.564 1
1 559 . 20 1 1 A 45 45 LYS CB C 179 32.671 31.572 1.099 1
1 563 . 20 1 1 A 45 45 LYS N N 179 120.935 118.693 2.242 1
1 564 . 20 1 1 A 46 46 ASP H H 180 7.098 7.938 -0.840 1
1 565 . 20 1 1 A 46 46 ASP HA H 180 4.917 5.007 -0.090 1
1 568 . 20 1 1 A 46 46 ASP CA C 180 51.492 51.590 -0.098 1
1 569 . 20 1 1 A 46 46 ASP CB C 180 40.595 41.375 -0.780 1
1 570 . 20 1 1 A 46 46 ASP N N 180 112.836 120.524 -7.688 1
1 571 . 20 1 1 A 47 47 PRO HA H 181 4.681 4.573 0.108 1
1 578 . 20 1 1 A 47 47 PRO C C 181 179.248 177.678 1.570 1
1 579 . 20 1 1 A 47 47 PRO CA C 181 64.718 64.302 0.416 1
1 580 . 20 1 1 A 47 47 PRO CB C 181 32.159 31.839 0.320 1
1 583 . 20 1 1 A 48 48 SER H H 182 8.248 8.287 -0.039 1
1 584 . 20 1 1 A 48 48 SER HA H 182 4.378 4.279 0.099 1
1 587 . 20 1 1 A 48 48 SER C C 182 176.071 175.335 0.736 1
1 588 . 20 1 1 A 48 48 SER CA C 182 61.377 60.913 0.464 1
1 589 . 20 1 1 A 48 48 SER CB C 182 62.455 63.228 -0.773 1
1 590 . 20 1 1 A 48 48 SER N N 182 116.986 113.131 3.855 1
1 591 . 20 1 1 A 49 49 LYS H H 183 7.842 7.414 0.428 1
1 592 . 20 1 1 A 49 49 LYS HA H 183 4.482 4.378 0.104 1
1 601 . 20 1 1 A 49 49 LYS C C 183 175.605 177.359 -1.754 1
1 602 . 20 1 1 A 49 49 LYS CA C 183 55.824 56.069 -0.245 1
1 603 . 20 1 1 A 49 49 LYS CB C 183 32.834 32.665 0.169 1
1 607 . 20 1 1 A 49 49 LYS N N 183 121.698 118.822 2.876 1
1 608 . 20 1 1 A 50 50 PHE H H 184 7.634 7.989 -0.355 1
1 609 . 20 1 1 A 50 50 PHE HA H 184 3.510 4.206 -0.696 1
1 617 . 20 1 1 A 50 50 PHE C C 184 176.214 177.473 -1.259 1
1 618 . 20 1 1 A 50 50 PHE CA C 184 63.276 61.086 2.190 1
1 619 . 20 1 1 A 50 50 PHE CB C 184 40.948 39.163 1.785 1
1 623 . 20 1 1 A 50 50 PHE N N 184 120.120 121.547 -1.427 1
1 624 . 20 1 1 A 51 51 GLY H H 185 8.855 8.573 0.282 1
1 625 . 20 1 1 A 51 51 GLY HA2 H 185 3.993 3.879 0.114 1
1 626 . 20 1 1 A 51 51 GLY HA3 H 185 3.958 3.917 0.041 1
1 627 . 20 1 1 A 51 51 GLY C C 185 175.169 176.251 -1.082 1
1 628 . 20 1 1 A 51 51 GLY CA C 185 47.475 47.500 -0.025 1
1 629 . 20 1 1 A 51 51 GLY N N 185 105.550 106.195 -0.645 1
1 630 . 20 1 1 A 52 52 GLU H H 186 7.917 7.967 -0.050 1
1 631 . 20 1 1 A 52 52 GLU HA H 186 4.006 4.045 -0.039 1
1 636 . 20 1 1 A 52 52 GLU C C 186 179.499 179.450 0.049 1
1 637 . 20 1 1 A 52 52 GLU CA C 186 58.904 59.218 -0.314 1
1 638 . 20 1 1 A 52 52 GLU CB C 186 29.700 29.783 -0.083 1
1 640 . 20 1 1 A 52 52 GLU N N 186 121.929 121.789 0.140 1
1 641 . 20 1 1 A 53 53 ILE H H 187 7.936 8.006 -0.070 1
1 642 . 20 1 1 A 53 53 ILE HA H 187 3.648 3.753 -0.105 1
1 652 . 20 1 1 A 53 53 ILE C C 187 177.886 177.830 0.056 1
1 653 . 20 1 1 A 53 53 ILE CA C 187 64.366 64.386 -0.020 1
1 654 . 20 1 1 A 53 53 ILE CB C 187 36.478 37.069 -0.591 1
1 658 . 20 1 1 A 53 53 ILE N N 187 120.991 121.147 -0.156 1
1 659 . 20 1 1 A 54 54 ALA H H 188 8.895 8.520 0.375 1
1 660 . 20 1 1 A 54 54 ALA HA H 188 3.629 3.790 -0.161 1
1 664 . 20 1 1 A 54 54 ALA C C 188 179.437 179.198 0.239 1
1 665 . 20 1 1 A 54 54 ALA CA C 188 55.974 55.544 0.430 1
1 666 . 20 1 1 A 54 54 ALA CB C 188 17.591 18.694 -1.103 1
1 667 . 20 1 1 A 54 54 ALA N N 188 125.308 122.099 3.209 1
1 668 . 20 1 1 A 55 55 LYS H H 189 8.049 7.622 0.427 1
1 669 . 20 1 1 A 55 55 LYS HA H 189 4.106 3.880 0.226 1
1 678 . 20 1 1 A 55 55 LYS C C 189 178.995 178.422 0.573 1
1 679 . 20 1 1 A 55 55 LYS CA C 189 59.312 59.214 0.098 1
1 680 . 20 1 1 A 55 55 LYS CB C 189 32.647 31.908 0.739 1
1 684 . 20 1 1 A 55 55 LYS N N 189 116.835 118.424 -1.589 1
1 685 . 20 1 1 A 56 56 LYS H H 190 7.215 8.090 -0.875 1
1 686 . 20 1 1 A 56 56 LYS HA H 190 4.172 4.214 -0.042 1
1 695 . 20 1 1 A 56 56 LYS C C 190 177.897 178.049 -0.152 1
1 696 . 20 1 1 A 56 56 LYS CA C 190 58.418 58.535 -0.117 1
1 697 . 20 1 1 A 56 56 LYS CB C 190 34.652 33.296 1.356 1
1 701 . 20 1 1 A 56 56 LYS N N 190 117.170 118.059 -0.889 1
1 702 . 20 1 1 A 57 57 GLU H H 191 8.572 7.885 0.687 1
1 703 . 20 1 1 A 57 57 GLU HA H 191 4.643 4.349 0.294 1
1 708 . 20 1 1 A 57 57 GLU C C 191 177.903 176.130 1.773 1
1 709 . 20 1 1 A 57 57 GLU CA C 191 55.708 56.472 -0.764 1
1 710 . 20 1 1 A 57 57 GLU CB C 191 32.460 31.019 1.441 1
1 712 . 20 1 1 A 57 57 GLU N N 191 113.316 116.802 -3.486 1
1 713 . 20 1 1 A 58 58 SER H H 192 8.550 7.671 0.879 1
1 714 . 20 1 1 A 58 58 SER HA H 192 4.149 4.355 -0.206 1
1 717 . 20 1 1 A 58 58 SER C C 192 176.161 175.188 0.973 1
1 718 . 20 1 1 A 58 58 SER CA C 192 58.403 58.268 0.135 1
1 719 . 20 1 1 A 58 58 SER CB C 192 64.392 64.284 0.108 1
1 720 . 20 1 1 A 58 58 SER N N 192 109.861 115.642 -5.781 1
1 721 . 20 1 1 A 59 59 MET H H 193 9.533 8.783 0.750 1
1 722 . 20 1 1 A 59 59 MET HA H 193 4.457 4.710 -0.253 1
1 730 . 20 1 1 A 59 59 MET C C 193 175.204 175.604 -0.400 1
1 731 . 20 1 1 A 59 59 MET CA C 193 55.781 54.542 1.239 1
1 732 . 20 1 1 A 59 59 MET CB C 193 32.855 32.215 0.640 1
1 735 . 20 1 1 A 59 59 MET N N 193 124.493 124.122 0.371 1
1 736 . 20 1 1 A 60 60 ASP H H 194 7.514 7.410 0.104 1
1 737 . 20 1 1 A 60 60 ASP HA H 194 4.886 4.557 0.329 1
1 740 . 20 1 1 A 60 60 ASP C C 194 175.517 176.746 -1.229 1
1 741 . 20 1 1 A 60 60 ASP CA C 194 52.286 53.565 -1.279 1
1 742 . 20 1 1 A 60 60 ASP CB C 194 40.222 40.617 -0.395 1
1 743 . 20 1 1 A 60 60 ASP N N 194 117.785 122.259 -4.474 1
1 744 . 20 1 1 A 61 61 THR H H 195 8.118 8.244 -0.126 1
1 745 . 20 1 1 A 61 61 THR HA H 195 3.918 3.959 -0.041 1
1 750 . 20 1 1 A 61 61 THR C C 195 176.269 177.000 -0.731 1
1 751 . 20 1 1 A 61 61 THR CA C 195 65.469 64.933 0.536 1
1 752 . 20 1 1 A 61 61 THR CB C 195 68.741 68.471 0.270 1
1 754 . 20 1 1 A 61 61 THR N N 195 120.765 118.870 1.895 1
1 755 . 20 1 1 A 62 62 GLY H H 196 8.399 8.489 -0.090 1
1 756 . 20 1 1 A 62 62 GLY HA2 H 196 3.932 3.811 0.121 1
1 757 . 20 1 1 A 62 62 GLY HA3 H 196 3.900 3.812 0.088 1
1 758 . 20 1 1 A 62 62 GLY C C 196 174.948 176.551 -1.603 1
1 759 . 20 1 1 A 62 62 GLY CA C 196 46.768 47.496 -0.728 1
1 760 . 20 1 1 A 62 62 GLY N N 196 108.183 111.499 -3.316 1
1 761 . 20 1 1 A 63 63 SER H H 197 7.265 8.189 -0.924 1
1 762 . 20 1 1 A 63 63 SER HA H 197 4.554 4.374 0.180 1
1 765 . 20 1 1 A 63 63 SER C C 197 177.630 176.053 1.577 1
1 766 . 20 1 1 A 63 63 SER CA C 197 59.550 62.384 -2.834 1
1 767 . 20 1 1 A 63 63 SER CB C 197 65.504 63.179 2.325 1
1 768 . 20 1 1 A 63 63 SER N N 197 111.815 119.257 -7.442 1
1 769 . 20 1 1 A 64 64 ALA H H 198 8.675 8.503 0.172 1
1 770 . 20 1 1 A 64 64 ALA HA H 198 3.801 3.943 -0.142 1
1 774 . 20 1 1 A 64 64 ALA C C 198 178.492 179.349 -0.857 1
1 775 . 20 1 1 A 64 64 ALA CA C 198 56.794 55.335 1.459 1
1 776 . 20 1 1 A 64 64 ALA CB C 198 18.951 18.300 0.651 1
1 777 . 20 1 1 A 64 64 ALA N N 198 131.710 123.492 8.218 1
1 778 . 20 1 1 A 65 65 LYS H H 199 7.666 7.676 -0.010 1
1 779 . 20 1 1 A 65 65 LYS HA H 199 4.175 4.027 0.148 1
1 788 . 20 1 1 A 65 65 LYS C C 199 177.159 177.895 -0.736 1
1 789 . 20 1 1 A 65 65 LYS CA C 199 57.735 59.036 -1.301 1
1 790 . 20 1 1 A 65 65 LYS CB C 199 31.948 31.922 0.026 1
1 794 . 20 1 1 A 65 65 LYS N N 199 111.375 118.515 -7.140 1
1 795 . 20 1 1 A 66 66 LYS H H 200 7.545 7.489 0.056 1
1 796 . 20 1 1 A 66 66 LYS HA H 200 4.612 4.470 0.142 1
1 805 . 20 1 1 A 66 66 LYS C C 200 175.609 175.916 -0.307 1
1 806 . 20 1 1 A 66 66 LYS CA C 200 54.468 55.583 -1.115 1
1 807 . 20 1 1 A 66 66 LYS CB C 200 31.525 32.469 -0.944 1
1 811 . 20 1 1 A 66 66 LYS N N 200 121.421 118.836 2.585 1
1 812 . 20 1 1 A 67 67 ASP H H 201 7.630 8.171 -0.541 1
1 813 . 20 1 1 A 67 67 ASP HA H 201 4.306 4.357 -0.051 1
1 816 . 20 1 1 A 67 67 ASP C C 201 175.025 176.309 -1.284 1
1 817 . 20 1 1 A 67 67 ASP CA C 201 56.400 55.357 1.043 1
1 818 . 20 1 1 A 67 67 ASP CB C 201 38.315 39.066 -0.751 1
1 819 . 20 1 1 A 67 67 ASP N N 201 116.216 116.073 0.143 1
1 820 . 20 1 1 A 68 68 GLY H H 202 8.368 8.812 -0.444 1
1 821 . 20 1 1 A 68 68 GLY HA2 H 202 4.316 3.934 0.382 1
1 822 . 20 1 1 A 68 68 GLY HA3 H 202 3.731 4.016 -0.285 1
1 823 . 20 1 1 A 68 68 GLY C C 202 174.139 174.428 -0.289 1
1 824 . 20 1 1 A 68 68 GLY CA C 202 45.514 45.449 0.065 1
1 825 . 20 1 1 A 68 68 GLY N N 202 105.095 104.977 0.118 1
1 826 . 20 1 1 A 69 69 GLU H H 203 7.534 7.754 -0.220 1
1 827 . 20 1 1 A 69 69 GLU HA H 203 4.479 4.372 0.107 1
1 832 . 20 1 1 A 69 69 GLU C C 203 176.961 176.495 0.466 1
1 833 . 20 1 1 A 69 69 GLU CA C 203 58.549 56.875 1.674 1
1 834 . 20 1 1 A 69 69 GLU CB C 203 30.998 30.311 0.687 1
1 836 . 20 1 1 A 69 69 GLU N N 203 120.426 120.812 -0.386 1
1 837 . 20 1 1 A 70 70 LEU H H 204 8.962 8.922 0.040 1
1 838 . 20 1 1 A 70 70 LEU HA H 204 4.438 4.550 -0.112 1
1 848 . 20 1 1 A 70 70 LEU C C 204 178.648 177.378 1.270 1
1 849 . 20 1 1 A 70 70 LEU CA C 204 53.977 55.336 -1.359 1
1 850 . 20 1 1 A 70 70 LEU CB C 204 43.612 43.539 0.073 1
1 854 . 20 1 1 A 70 70 LEU N N 204 122.066 125.740 -3.674 1
1 855 . 20 1 1 A 71 71 GLY H H 205 8.104 7.603 0.501 1
1 856 . 20 1 1 A 71 71 GLY HA2 H 205 4.165 3.946 0.219 1
1 857 . 20 1 1 A 71 71 GLY HA3 H 205 3.552 4.070 -0.518 1
1 858 . 20 1 1 A 71 71 GLY C C 205 173.098 173.310 -0.212 1
1 859 . 20 1 1 A 71 71 GLY CA C 205 44.723 45.100 -0.377 1
1 860 . 20 1 1 A 71 71 GLY N N 205 110.168 106.728 3.440 1
1 861 . 20 1 1 A 72 72 TYR H H 206 8.457 8.523 -0.066 1
1 862 . 20 1 1 A 72 72 TYR HA H 206 4.184 4.710 -0.526 1
1 869 . 20 1 1 A 72 72 TYR C C 206 175.975 175.667 0.308 1
1 870 . 20 1 1 A 72 72 TYR CA C 206 59.722 59.147 0.575 1
1 871 . 20 1 1 A 72 72 TYR CB C 206 38.378 38.433 -0.055 1
1 874 . 20 1 1 A 72 72 TYR N N 206 120.171 122.098 -1.927 1
1 875 . 20 1 1 A 73 73 VAL H H 207 8.782 9.174 -0.392 1
1 876 . 20 1 1 A 73 73 VAL HA H 207 4.056 4.446 -0.390 1
1 884 . 20 1 1 A 73 73 VAL C C 207 174.901 175.734 -0.833 1
1 885 . 20 1 1 A 73 73 VAL CA C 207 62.202 62.427 -0.225 1
1 886 . 20 1 1 A 73 73 VAL CB C 207 33.071 32.287 0.784 1
1 889 . 20 1 1 A 73 73 VAL N N 207 128.847 124.791 4.056 1
1 890 . 20 1 1 A 74 74 LEU H H 208 8.146 8.859 -0.713 1
1 891 . 20 1 1 A 74 74 LEU HA H 208 4.944 4.780 0.164 1
1 901 . 20 1 1 A 74 74 LEU C C 208 178.400 177.379 1.021 1
1 902 . 20 1 1 A 74 74 LEU CA C 208 53.520 53.801 -0.281 1
1 903 . 20 1 1 A 74 74 LEU CB C 208 43.499 42.905 0.594 1
1 907 . 20 1 1 A 74 74 LEU N N 208 127.599 129.190 -1.591 1
1 908 . 20 1 1 A 75 75 LYS H H 209 8.403 8.295 0.108 1
1 909 . 20 1 1 A 75 75 LYS HA H 209 3.771 3.938 -0.167 1
1 918 . 20 1 1 A 75 75 LYS C C 209 177.536 177.429 0.107 1
1 919 . 20 1 1 A 75 75 LYS CA C 209 58.385 58.962 -0.577 1
1 920 . 20 1 1 A 75 75 LYS CB C 209 32.459 32.065 0.394 1
1 924 . 20 1 1 A 75 75 LYS N N 209 123.798 123.109 0.689 1
1 925 . 20 1 1 A 76 76 GLY H H 210 9.997 9.353 0.644 1
1 926 . 20 1 1 A 76 76 GLY HA2 H 210 4.255 4.015 0.240 1
1 927 . 20 1 1 A 76 76 GLY HA3 H 210 3.791 4.017 -0.226 1
1 928 . 20 1 1 A 76 76 GLY C C 210 175.091 175.769 -0.678 1
1 929 . 20 1 1 A 76 76 GLY CA C 210 45.465 45.418 0.047 1
1 930 . 20 1 1 A 76 76 GLY N N 210 114.705 113.163 1.542 1
1 931 . 20 1 1 A 77 77 GLN H H 211 7.726 8.046 -0.320 1
1 932 . 20 1 1 A 77 77 GLN HA H 211 4.373 4.204 0.169 1
1 939 . 20 1 1 A 77 77 GLN C C 211 176.301 175.865 0.436 1
1 940 . 20 1 1 A 77 77 GLN CA C 211 57.074 57.445 -0.371 1
1 941 . 20 1 1 A 77 77 GLN CB C 211 30.798 29.333 1.465 1
1 943 . 20 1 1 A 77 77 GLN N N 211 118.702 117.963 0.739 1
1 945 . 20 1 1 A 78 78 THR H H 212 8.225 7.502 0.723 1
1 946 . 20 1 1 A 78 78 THR HA H 212 4.620 4.449 0.171 1
1 951 . 20 1 1 A 78 78 THR C C 212 173.920 174.212 -0.292 1
1 952 . 20 1 1 A 78 78 THR CA C 212 60.087 59.850 0.237 1
1 953 . 20 1 1 A 78 78 THR CB C 212 71.412 70.870 0.542 1
1 955 . 20 1 1 A 78 78 THR N N 212 111.935 111.232 0.703 1
1 956 . 20 1 1 A 79 79 ASP H H 213 8.372 8.167 0.205 1
1 957 . 20 1 1 A 79 79 ASP HA H 213 4.470 4.422 0.048 1
1 960 . 20 1 1 A 79 79 ASP C C 213 176.759 177.850 -1.091 1
1 961 . 20 1 1 A 79 79 ASP CA C 213 54.927 54.578 0.349 1
1 962 . 20 1 1 A 79 79 ASP CB C 213 43.859 42.688 1.171 1
1 963 . 20 1 1 A 79 79 ASP N N 213 122.093 122.631 -0.538 1
1 964 . 20 1 1 A 80 80 LYS H H 214 8.740 8.803 -0.063 1
1 965 . 20 1 1 A 80 80 LYS HA H 214 4.027 3.961 0.066 1
1 974 . 20 1 1 A 80 80 LYS C C 214 178.493 178.247 0.246 1
1 975 . 20 1 1 A 80 80 LYS CA C 214 59.802 59.580 0.222 1
1 976 . 20 1 1 A 80 80 LYS CB C 214 32.374 32.121 0.253 1
1 980 . 20 1 1 A 80 80 LYS N N 214 124.685 125.942 -1.257 1
1 981 . 20 1 1 A 81 81 ASP H H 215 8.556 8.219 0.337 1
1 982 . 20 1 1 A 81 81 ASP HA H 215 4.566 4.381 0.185 1
1 985 . 20 1 1 A 81 81 ASP C C 215 178.889 178.540 0.349 1
1 986 . 20 1 1 A 81 81 ASP CA C 215 58.046 57.228 0.818 1
1 987 . 20 1 1 A 81 81 ASP CB C 215 40.872 40.651 0.221 1
1 988 . 20 1 1 A 81 81 ASP N N 215 121.413 119.589 1.824 1
1 989 . 20 1 1 A 82 82 PHE H H 216 8.205 8.265 -0.060 1
1 990 . 20 1 1 A 82 82 PHE HA H 216 3.686 4.077 -0.391 1
1 998 . 20 1 1 A 82 82 PHE C C 216 175.919 177.343 -1.424 1
1 999 . 20 1 1 A 82 82 PHE CA C 216 61.648 60.960 0.688 1
1 1000 . 20 1 1 A 82 82 PHE CB C 216 39.743 39.230 0.513 1
1 1004 . 20 1 1 A 82 82 PHE N N 216 124.401 122.887 1.514 1
1 1005 . 20 1 1 A 83 83 GLU H H 217 8.887 8.851 0.036 1
1 1006 . 20 1 1 A 83 83 GLU HA H 217 3.704 4.173 -0.469 1
1 1011 . 20 1 1 A 83 83 GLU C C 217 177.788 179.178 -1.390 1
1 1012 . 20 1 1 A 83 83 GLU CA C 217 60.545 60.323 0.222 1
1 1013 . 20 1 1 A 83 83 GLU CB C 217 30.639 29.620 1.019 1
1 1015 . 20 1 1 A 83 83 GLU N N 217 119.421 118.984 0.437 1
1 1016 . 20 1 1 A 84 84 LYS H H 218 8.055 8.028 0.027 1
1 1017 . 20 1 1 A 84 84 LYS HA H 218 3.947 4.156 -0.209 1
1 1026 . 20 1 1 A 84 84 LYS C C 218 178.783 178.442 0.341 1
1 1027 . 20 1 1 A 84 84 LYS CA C 218 59.327 58.644 0.683 1
1 1028 . 20 1 1 A 84 84 LYS CB C 218 32.539 32.192 0.347 1
1 1032 . 20 1 1 A 84 84 LYS N N 218 117.821 119.413 -1.592 1
1 1033 . 20 1 1 A 85 85 ALA H H 219 7.059 7.656 -0.597 1
1 1034 . 20 1 1 A 85 85 ALA HA H 219 4.040 4.256 -0.216 1
1 1038 . 20 1 1 A 85 85 ALA C C 219 179.794 179.992 -0.198 1
1 1039 . 20 1 1 A 85 85 ALA CA C 219 54.407 54.541 -0.134 1
1 1040 . 20 1 1 A 85 85 ALA CB C 219 20.130 18.712 1.418 1
1 1041 . 20 1 1 A 85 85 ALA N N 219 118.905 122.003 -3.098 1
1 1042 . 20 1 1 A 86 86 LEU H H 220 8.157 8.403 -0.246 1
1 1043 . 20 1 1 A 86 86 LEU HA H 220 3.692 3.960 -0.268 1
1 1053 . 20 1 1 A 86 86 LEU C C 220 178.330 178.476 -0.146 1
1 1054 . 20 1 1 A 86 86 LEU CA C 220 57.752 58.093 -0.341 1
1 1055 . 20 1 1 A 86 86 LEU CB C 220 41.464 41.734 -0.270 1
1 1059 . 20 1 1 A 86 86 LEU N N 220 118.606 120.515 -1.909 1
1 1060 . 20 1 1 A 87 87 PHE H H 221 8.349 7.937 0.412 1
1 1061 . 20 1 1 A 87 87 PHE HA H 221 3.861 4.567 -0.706 1
1 1069 . 20 1 1 A 87 87 PHE C C 221 176.176 177.550 -1.374 1
1 1070 . 20 1 1 A 87 87 PHE CA C 221 61.780 60.836 0.944 1
1 1071 . 20 1 1 A 87 87 PHE CB C 221 37.549 37.629 -0.080 1
1 1075 . 20 1 1 A 87 87 PHE N N 221 112.449 116.815 -4.366 1
1 1076 . 20 1 1 A 88 88 LYS H H 222 7.061 7.296 -0.235 1
1 1077 . 20 1 1 A 88 88 LYS HA H 222 4.380 4.350 0.030 1
1 1086 . 20 1 1 A 88 88 LYS C C 222 177.089 177.361 -0.272 1
1 1087 . 20 1 1 A 88 88 LYS CA C 222 56.726 57.759 -1.033 1
1 1088 . 20 1 1 A 88 88 LYS CB C 222 33.738 33.084 0.654 1
1 1092 . 20 1 1 A 88 88 LYS N N 222 118.308 117.691 0.617 1
1 1093 . 20 1 1 A 89 89 LEU H H 223 7.270 7.198 0.072 1
1 1094 . 20 1 1 A 89 89 LEU HA H 223 4.168 4.166 0.002 1
1 1104 . 20 1 1 A 89 89 LEU C C 223 177.528 176.822 0.706 1
1 1105 . 20 1 1 A 89 89 LEU CA C 223 55.279 55.192 0.087 1
1 1106 . 20 1 1 A 89 89 LEU CB C 223 43.240 42.159 1.081 1
1 1110 . 20 1 1 A 89 89 LEU N N 223 121.317 120.797 0.520 1
1 1111 . 20 1 1 A 90 90 LYS H H 224 8.788 8.576 0.212 1
1 1112 . 20 1 1 A 90 90 LYS HA H 224 4.359 4.351 0.008 1
1 1121 . 20 1 1 A 90 90 LYS C C 224 175.839 176.484 -0.645 1
1 1122 . 20 1 1 A 90 90 LYS CA C 224 54.772 55.881 -1.109 1
1 1123 . 20 1 1 A 90 90 LYS CB C 224 33.232 33.365 -0.133 1
1 1127 . 20 1 1 A 90 90 LYS N N 224 123.558 123.249 0.309 1
1 1128 . 20 1 1 A 91 91 ASP H H 225 8.125 8.753 -0.628 1
1 1129 . 20 1 1 A 91 91 ASP HA H 225 3.958 4.166 -0.208 1
1 1132 . 20 1 1 A 91 91 ASP C C 225 177.452 177.157 0.295 1
1 1133 . 20 1 1 A 91 91 ASP CA C 225 56.642 56.267 0.375 1
1 1134 . 20 1 1 A 91 91 ASP CB C 225 40.269 40.218 0.051 1
1 1135 . 20 1 1 A 91 91 ASP N N 225 119.419 121.846 -2.427 1
1 1136 . 20 1 1 A 92 92 GLY H H 226 8.681 8.672 0.009 1
1 1137 . 20 1 1 A 92 92 GLY HA2 H 226 4.131 3.850 0.281 1
1 1138 . 20 1 1 A 92 92 GLY HA3 H 226 3.579 3.879 -0.300 1
1 1139 . 20 1 1 A 92 92 GLY C C 226 173.614 174.024 -0.410 1
1 1140 . 20 1 1 A 92 92 GLY CA C 226 45.564 45.344 0.220 1
1 1141 . 20 1 1 A 92 92 GLY N N 226 113.802 111.851 1.951 1
1 1142 . 20 1 1 A 93 93 GLU H H 227 8.104 8.092 0.012 1
1 1143 . 20 1 1 A 93 93 GLU HA H 227 4.232 4.408 -0.176 1
1 1148 . 20 1 1 A 93 93 GLU C C 227 174.282 175.671 -1.389 1
1 1149 . 20 1 1 A 93 93 GLU CA C 227 56.651 56.222 0.429 1
1 1150 . 20 1 1 A 93 93 GLU CB C 227 32.190 31.195 0.995 1
1 1152 . 20 1 1 A 93 93 GLU N N 227 121.527 121.911 -0.384 1
1 1153 . 20 1 1 A 94 94 VAL H H 228 7.918 8.522 -0.604 1
1 1154 . 20 1 1 A 94 94 VAL HA H 228 4.857 4.744 0.113 1
1 1162 . 20 1 1 A 94 94 VAL C C 228 176.556 175.640 0.916 1
1 1163 . 20 1 1 A 94 94 VAL CA C 228 60.309 60.290 0.019 1
1 1164 . 20 1 1 A 94 94 VAL CB C 228 33.847 35.362 -1.515 1
1 1167 . 20 1 1 A 94 94 VAL N N 228 119.768 125.892 -6.124 1
1 1168 . 20 1 1 A 95 95 SER H H 229 9.659 9.366 0.293 1
1 1169 . 20 1 1 A 95 95 SER HA H 229 4.313 4.662 -0.349 1
1 1172 . 20 1 1 A 95 95 SER C C 229 174.641 174.374 0.267 1
1 1173 . 20 1 1 A 95 95 SER CA C 229 59.208 57.868 1.340 1
1 1174 . 20 1 1 A 95 95 SER CB C 229 66.080 65.549 0.531 1
1 1175 . 20 1 1 A 95 95 SER N N 229 124.903 121.416 3.487 1
1 1176 . 20 1 1 A 96 96 GLU H H 230 8.014 8.642 -0.628 1
1 1177 . 20 1 1 A 96 96 GLU HA H 230 4.376 4.402 -0.026 1
1 1182 . 20 1 1 A 96 96 GLU C C 230 176.641 177.088 -0.447 1
1 1183 . 20 1 1 A 96 96 GLU CA C 230 56.236 56.649 -0.413 1
1 1184 . 20 1 1 A 96 96 GLU CB C 230 30.324 30.801 -0.477 1
1 1186 . 20 1 1 A 96 96 GLU N N 230 115.510 120.905 -5.395 1
1 1187 . 20 1 1 A 97 97 VAL H H 231 8.741 8.374 0.367 1
1 1188 . 20 1 1 A 97 97 VAL HA H 231 4.171 4.123 0.048 1
1 1196 . 20 1 1 A 97 97 VAL C C 231 176.684 175.733 0.951 1
1 1197 . 20 1 1 A 97 97 VAL CA C 231 65.418 63.233 2.185 1
1 1198 . 20 1 1 A 97 97 VAL CB C 231 31.218 31.442 -0.224 1
1 1201 . 20 1 1 A 97 97 VAL N N 231 121.289 121.539 -0.250 1
1 1202 . 20 1 1 A 98 98 VAL H H 232 9.218 9.523 -0.305 1
1 1203 . 20 1 1 A 98 98 VAL HA H 232 4.405 4.638 -0.233 1
1 1211 . 20 1 1 A 98 98 VAL C C 232 174.258 174.634 -0.376 1
1 1212 . 20 1 1 A 98 98 VAL CA C 232 60.937 61.295 -0.358 1
1 1213 . 20 1 1 A 98 98 VAL CB C 232 35.825 33.703 2.122 1
1 1216 . 20 1 1 A 98 98 VAL N N 232 130.544 129.026 1.518 1
1 1217 . 20 1 1 A 99 99 LYS H H 233 8.800 8.915 -0.115 1
1 1218 . 20 1 1 A 99 99 LYS HA H 233 4.853 5.052 -0.199 1
1 1227 . 20 1 1 A 99 99 LYS C C 233 175.274 175.157 0.117 1
1 1228 . 20 1 1 A 99 99 LYS CA C 233 55.499 55.038 0.461 1
1 1229 . 20 1 1 A 99 99 LYS CB C 233 34.452 34.555 -0.103 1
1 1233 . 20 1 1 A 99 99 LYS N N 233 130.477 128.422 2.055 1
1 1234 . 20 1 1 A 100 100 SER H H 234 9.585 8.976 0.609 1
1 1235 . 20 1 1 A 100 100 SER HA H 234 5.150 4.854 0.296 1
1 1238 . 20 1 1 A 100 100 SER C C 234 175.493 174.386 1.107 1
1 1239 . 20 1 1 A 100 100 SER CA C 234 56.927 57.535 -0.608 1
1 1240 . 20 1 1 A 100 100 SER CB C 234 67.309 67.375 -0.066 1
1 1241 . 20 1 1 A 100 100 SER N N 234 125.814 122.622 3.192 1
1 1242 . 20 1 1 A 101 101 SER H H 235 8.631 9.172 -0.541 1
1 1243 . 20 1 1 A 101 101 SER HA H 235 4.106 4.050 0.056 1
1 1246 . 20 1 1 A 101 101 SER C C 235 175.385 175.563 -0.178 1
1 1247 . 20 1 1 A 101 101 SER CA C 235 61.123 60.971 0.152 1
1 1248 . 20 1 1 A 101 101 SER CB C 235 62.818 62.619 0.199 1
1 1249 . 20 1 1 A 101 101 SER N N 235 115.089 118.175 -3.086 1
1 1250 . 20 1 1 A 102 102 PHE H H 236 8.957 7.729 1.228 1
1 1251 . 20 1 1 A 102 102 PHE HA H 236 4.610 4.610 0.000 1
1 1259 . 20 1 1 A 102 102 PHE C C 236 176.453 175.792 0.661 1
1 1260 . 20 1 1 A 102 102 PHE CA C 236 58.382 58.161 0.221 1
1 1261 . 20 1 1 A 102 102 PHE CB C 236 40.275 39.374 0.901 1
1 1263 . 20 1 1 A 102 102 PHE N N 236 119.917 117.995 1.922 1
1 1264 . 20 1 1 A 103 103 GLY H H 237 7.377 7.292 0.085 1
1 1265 . 20 1 1 A 103 103 GLY HA2 H 237 4.453 3.986 0.467 1
1 1266 . 20 1 1 A 103 103 GLY HA3 H 237 3.472 4.143 -0.671 1
1 1267 . 20 1 1 A 103 103 GLY C C 237 169.627 172.393 -2.766 1
1 1268 . 20 1 1 A 103 103 GLY CA C 237 45.384 44.598 0.786 1
1 1269 . 20 1 1 A 103 103 GLY N N 237 108.809 106.243 2.566 1
1 1270 . 20 1 1 A 104 104 TYR H H 238 8.632 8.484 0.148 1
1 1271 . 20 1 1 A 104 104 TYR HA H 238 5.322 5.491 -0.169 1
1 1278 . 20 1 1 A 104 104 TYR C C 238 175.043 175.318 -0.275 1
1 1279 . 20 1 1 A 104 104 TYR CA C 238 57.627 57.091 0.536 1
1 1280 . 20 1 1 A 104 104 TYR CB C 238 41.711 41.674 0.037 1
1 1283 . 20 1 1 A 104 104 TYR N N 238 120.030 121.804 -1.774 1
1 1284 . 20 1 1 A 105 105 HIS H H 239 10.070 9.398 0.672 1
1 1285 . 20 1 1 A 105 105 HIS HA H 239 6.046 5.530 0.516 1
1 1290 . 20 1 1 A 105 105 HIS C C 239 175.734 174.686 1.048 1
1 1291 . 20 1 1 A 105 105 HIS CA C 239 53.945 54.511 -0.566 1
1 1292 . 20 1 1 A 105 105 HIS CB C 239 32.450 34.334 -1.884 1
1 1295 . 20 1 1 A 105 105 HIS N N 239 119.504 118.512 0.992 1
1 1296 . 20 1 1 A 106 106 ILE H H 240 8.660 8.763 -0.103 1
1 1297 . 20 1 1 A 106 106 ILE HA H 240 4.120 4.879 -0.759 1
1 1307 . 20 1 1 A 106 106 ILE C C 240 174.758 175.339 -0.581 1
1 1308 . 20 1 1 A 106 106 ILE CA C 240 63.446 60.038 3.408 1
1 1309 . 20 1 1 A 106 106 ILE CB C 240 40.786 41.597 -0.811 1
1 1313 . 20 1 1 A 106 106 ILE N N 240 120.639 119.769 0.870 1
1 1314 . 20 1 1 A 107 107 ILE H H 241 9.033 9.054 -0.021 1
1 1315 . 20 1 1 A 107 107 ILE HA H 241 4.799 5.033 -0.234 1
1 1325 . 20 1 1 A 107 107 ILE C C 241 172.880 173.982 -1.102 1
1 1326 . 20 1 1 A 107 107 ILE CA C 241 60.563 59.947 0.616 1
1 1327 . 20 1 1 A 107 107 ILE CB C 241 41.652 40.880 0.772 1
1 1331 . 20 1 1 A 107 107 ILE N N 241 129.098 127.047 2.051 1
1 1332 . 20 1 1 A 108 108 LYS H H 242 8.692 8.981 -0.289 1
1 1333 . 20 1 1 A 108 108 LYS HA H 242 5.012 5.014 -0.002 1
1 1342 . 20 1 1 A 108 108 LYS C C 242 174.484 175.793 -1.309 1
1 1343 . 20 1 1 A 108 108 LYS CA C 242 54.317 54.014 0.303 1
1 1344 . 20 1 1 A 108 108 LYS CB C 242 35.619 35.160 0.459 1
1 1348 . 20 1 1 A 108 108 LYS N N 242 127.179 128.488 -1.309 1
1 1349 . 20 1 1 A 109 109 ALA H H 243 7.816 8.897 -1.081 1
1 1350 . 20 1 1 A 109 109 ALA HA H 243 4.604 4.445 0.159 1
1 1354 . 20 1 1 A 109 109 ALA C C 243 176.231 176.411 -0.180 1
1 1355 . 20 1 1 A 109 109 ALA CA C 243 50.505 51.437 -0.932 1
1 1356 . 20 1 1 A 109 109 ALA CB C 243 19.584 19.510 0.074 1
1 1357 . 20 1 1 A 109 109 ALA N N 243 129.619 128.045 1.574 1
1 1358 . 20 1 1 A 110 110 ASP H H 244 7.578 8.803 -1.225 1
1 1359 . 20 1 1 A 110 110 ASP HA H 244 4.424 5.236 -0.812 1
1 1362 . 20 1 1 A 110 110 ASP C C 244 175.259 174.244 1.015 1
1 1363 . 20 1 1 A 110 110 ASP CA C 244 54.489 52.350 2.139 1
1 1364 . 20 1 1 A 110 110 ASP CB C 244 42.693 44.591 -1.898 1
1 1365 . 20 1 1 A 110 110 ASP N N 244 125.434 122.483 2.951 1
1 4 . 21 1 1 A 2 2 PRO HA H -4 4.403 4.614 -0.211 1
1 11 . 21 1 1 A 2 2 PRO C C -4 176.990 176.259 0.731 1
1 12 . 21 1 1 A 2 2 PRO CA C -4 63.131 62.857 0.274 1
1 13 . 21 1 1 A 2 2 PRO CB C -4 32.342 32.228 0.114 1
1 16 . 21 1 1 A 3 3 LEU H H -3 8.483 8.397 0.086 1
1 17 . 21 1 1 A 3 3 LEU HA H -3 4.333 4.600 -0.267 1
1 27 . 21 1 1 A 3 3 LEU C C -3 177.991 177.659 0.332 1
1 28 . 21 1 1 A 3 3 LEU CA C -3 55.314 54.520 0.794 1
1 29 . 21 1 1 A 3 3 LEU CB C -3 42.244 42.724 -0.480 1
1 33 . 21 1 1 A 3 3 LEU N N -3 122.986 121.861 1.125 1
1 34 . 21 1 1 A 4 4 GLY H H -2 8.397 8.667 -0.270 1
1 35 . 21 1 1 A 4 4 GLY HA2 H -2 4.024 4.185 -0.161 1
1 36 . 21 1 1 A 4 4 GLY HA3 H -2 3.976 4.186 -0.210 1
1 37 . 21 1 1 A 4 4 GLY C C -2 174.360 174.221 0.139 1
1 38 . 21 1 1 A 4 4 GLY CA C -2 45.434 44.444 0.990 1
1 39 . 21 1 1 A 4 4 GLY N N -2 110.666 109.605 1.061 1
1 56 . 21 1 1 A 7 7 SER H H 141 7.913 8.175 -0.262 1
1 57 . 21 1 1 A 7 7 SER HA H 141 5.657 5.460 0.197 1
1 60 . 21 1 1 A 7 7 SER C C 141 173.753 173.224 0.529 1
1 61 . 21 1 1 A 7 7 SER CA C 141 56.758 56.526 0.232 1
1 62 . 21 1 1 A 7 7 SER CB C 141 66.774 66.625 0.149 1
1 63 . 21 1 1 A 7 7 SER N N 141 113.824 113.313 0.511 1
1 64 . 21 1 1 A 8 8 LYS H H 142 8.656 8.545 0.111 1
1 65 . 21 1 1 A 8 8 LYS HA H 142 4.543 4.984 -0.441 1
1 74 . 21 1 1 A 8 8 LYS C C 142 174.403 174.948 -0.545 1
1 75 . 21 1 1 A 8 8 LYS CA C 142 55.578 54.467 1.111 1
1 76 . 21 1 1 A 8 8 LYS CB C 142 36.561 35.848 0.713 1
1 80 . 21 1 1 A 8 8 LYS N N 142 123.076 120.249 2.827 1
1 81 . 21 1 1 A 9 9 LYS H H 143 8.623 8.454 0.169 1
1 82 . 21 1 1 A 9 9 LYS HA H 143 4.119 4.306 -0.187 1
1 91 . 21 1 1 A 9 9 LYS C C 143 176.144 175.491 0.653 1
1 92 . 21 1 1 A 9 9 LYS CA C 143 56.683 56.147 0.536 1
1 93 . 21 1 1 A 9 9 LYS CB C 143 32.580 32.419 0.161 1
1 97 . 21 1 1 A 9 9 LYS N N 143 129.542 124.294 5.248 1
1 98 . 21 1 1 A 10 10 ALA H H 144 8.151 8.690 -0.539 1
1 99 . 21 1 1 A 10 10 ALA HA H 144 5.208 5.003 0.205 1
1 103 . 21 1 1 A 10 10 ALA C C 144 175.577 174.993 0.584 1
1 104 . 21 1 1 A 10 10 ALA CA C 144 51.226 51.139 0.087 1
1 105 . 21 1 1 A 10 10 ALA CB C 144 25.299 24.318 0.981 1
1 106 . 21 1 1 A 10 10 ALA N N 144 127.933 128.142 -0.209 1
1 107 . 21 1 1 A 11 11 SER H H 145 8.679 8.774 -0.095 1
1 108 . 21 1 1 A 11 11 SER HA H 145 5.431 5.839 -0.408 1
1 111 . 21 1 1 A 11 11 SER C C 145 173.072 173.219 -0.147 1
1 112 . 21 1 1 A 11 11 SER CA C 145 57.772 56.977 0.795 1
1 113 . 21 1 1 A 11 11 SER CB C 145 67.301 66.265 1.036 1
1 114 . 21 1 1 A 11 11 SER N N 145 116.245 115.368 0.877 1
1 115 . 21 1 1 A 12 12 HIS H H 146 9.962 9.564 0.398 1
1 116 . 21 1 1 A 12 12 HIS HA H 146 6.332 6.050 0.282 1
1 121 . 21 1 1 A 12 12 HIS C C 146 173.006 172.560 0.446 1
1 122 . 21 1 1 A 12 12 HIS CA C 146 55.020 54.375 0.645 1
1 123 . 21 1 1 A 12 12 HIS CB C 146 37.071 32.881 4.190 1
1 126 . 21 1 1 A 12 12 HIS N N 146 119.181 118.481 0.700 1
1 127 . 21 1 1 A 13 13 ILE H H 147 8.976 8.905 0.071 1
1 128 . 21 1 1 A 13 13 ILE HA H 147 3.528 4.488 -0.960 1
1 138 . 21 1 1 A 13 13 ILE C C 147 173.010 173.778 -0.768 1
1 139 . 21 1 1 A 13 13 ILE CA C 147 61.273 59.483 1.790 1
1 140 . 21 1 1 A 13 13 ILE CB C 147 41.773 41.806 -0.033 1
1 144 . 21 1 1 A 13 13 ILE N N 147 121.873 119.078 2.795 1
1 145 . 21 1 1 A 14 14 LEU H H 148 7.627 8.971 -1.344 1
1 146 . 21 1 1 A 14 14 LEU HA H 148 4.814 4.954 -0.140 1
1 156 . 21 1 1 A 14 14 LEU C C 148 174.112 174.391 -0.279 1
1 157 . 21 1 1 A 14 14 LEU CA C 148 52.574 53.014 -0.440 1
1 158 . 21 1 1 A 14 14 LEU CB C 148 45.643 45.038 0.605 1
1 162 . 21 1 1 A 14 14 LEU N N 148 127.112 129.452 -2.340 1
1 163 . 21 1 1 A 15 15 ILE H H 149 9.524 9.316 0.208 1
1 164 . 21 1 1 A 15 15 ILE HA H 149 4.362 4.713 -0.351 1
1 174 . 21 1 1 A 15 15 ILE C C 149 175.452 175.148 0.304 1
1 175 . 21 1 1 A 15 15 ILE CA C 149 58.516 60.455 -1.939 1
1 176 . 21 1 1 A 15 15 ILE CB C 149 36.560 40.132 -3.572 1
1 180 . 21 1 1 A 15 15 ILE N N 149 128.652 126.559 2.093 1
1 181 . 21 1 1 A 16 16 LYS H H 150 8.035 8.565 -0.530 1
1 182 . 21 1 1 A 16 16 LYS HA H 150 4.319 4.610 -0.291 1
1 191 . 21 1 1 A 16 16 LYS C C 150 175.038 176.108 -1.070 1
1 192 . 21 1 1 A 16 16 LYS CA C 150 57.817 56.395 1.422 1
1 193 . 21 1 1 A 16 16 LYS CB C 150 34.853 33.321 1.532 1
1 197 . 21 1 1 A 16 16 LYS N N 150 129.153 127.557 1.596 1
1 198 . 21 1 1 A 17 17 VAL H H 151 8.016 8.974 -0.958 1
1 199 . 21 1 1 A 17 17 VAL HA H 151 4.873 4.674 0.199 1
1 207 . 21 1 1 A 17 17 VAL C C 151 176.647 175.008 1.639 1
1 208 . 21 1 1 A 17 17 VAL CA C 151 60.088 61.337 -1.249 1
1 209 . 21 1 1 A 17 17 VAL CB C 151 34.082 33.875 0.207 1
1 212 . 21 1 1 A 17 17 VAL N N 151 121.288 122.715 -1.427 1
1 213 . 21 1 1 A 18 18 LYS H H 152 8.443 8.922 -0.479 1
1 214 . 21 1 1 A 18 18 LYS HA H 152 4.334 4.389 -0.055 1
1 223 . 21 1 1 A 18 18 LYS C C 152 176.345 176.949 -0.604 1
1 224 . 21 1 1 A 18 18 LYS CA C 152 57.016 56.278 0.738 1
1 225 . 21 1 1 A 18 18 LYS CB C 152 33.222 32.483 0.739 1
1 229 . 21 1 1 A 18 18 LYS N N 152 128.408 127.595 0.813 1
1 230 . 21 1 1 A 19 19 SER H H 153 9.067 8.677 0.390 1
1 231 . 21 1 1 A 19 19 SER HA H 153 4.457 4.527 -0.070 1
1 234 . 21 1 1 A 19 19 SER C C 153 174.236 174.602 -0.366 1
1 235 . 21 1 1 A 19 19 SER CA C 153 59.642 59.763 -0.121 1
1 236 . 21 1 1 A 19 19 SER CB C 153 64.347 64.279 0.068 1
1 237 . 21 1 1 A 19 19 SER N N 153 121.522 118.283 3.239 1
1 238 . 21 1 1 A 20 20 LYS H H 154 7.961 7.706 0.255 1
1 239 . 21 1 1 A 20 20 LYS HA H 154 4.558 4.688 -0.130 1
1 244 . 21 1 1 A 20 20 LYS C C 154 177.256 176.999 0.257 1
1 245 . 21 1 1 A 20 20 LYS CA C 154 55.249 54.677 0.572 1
1 246 . 21 1 1 A 20 20 LYS CB C 154 34.531 34.822 -0.291 1
1 248 . 21 1 1 A 20 20 LYS N N 154 120.270 119.385 0.885 1
1 249 . 21 1 1 A 21 21 LYS HA H 155 4.003 4.079 -0.076 1
1 258 . 21 1 1 A 21 21 LYS C C 155 177.015 177.929 -0.914 1
1 259 . 21 1 1 A 21 21 LYS CA C 155 59.091 59.024 0.067 1
1 260 . 21 1 1 A 21 21 LYS CB C 155 32.394 32.033 0.361 1
1 264 . 21 1 1 A 22 22 SER H H 156 7.625 7.700 -0.075 1
1 265 . 21 1 1 A 22 22 SER HA H 156 4.293 4.362 -0.069 1
1 268 . 21 1 1 A 22 22 SER C C 156 174.843 174.473 0.370 1
1 269 . 21 1 1 A 22 22 SER CA C 156 57.966 58.867 -0.901 1
1 270 . 21 1 1 A 22 22 SER CB C 156 63.369 63.504 -0.135 1
1 271 . 21 1 1 A 22 22 SER N N 156 109.549 111.819 -2.270 1
1 272 . 21 1 1 A 23 23 ASP H H 157 7.701 7.440 0.261 1
1 273 . 21 1 1 A 23 23 ASP HA H 157 4.548 4.560 -0.012 1
1 276 . 21 1 1 A 23 23 ASP C C 157 176.544 176.197 0.347 1
1 277 . 21 1 1 A 23 23 ASP CA C 157 55.242 54.477 0.765 1
1 278 . 21 1 1 A 23 23 ASP CB C 157 41.103 41.695 -0.592 1
1 279 . 21 1 1 A 23 23 ASP N N 157 124.536 122.959 1.577 1
1 280 . 21 1 1 A 24 24 LYS H H 158 8.583 8.728 -0.145 1
1 281 . 21 1 1 A 24 24 LYS HA H 158 4.252 4.508 -0.256 1
1 290 . 21 1 1 A 24 24 LYS C C 158 176.813 177.018 -0.205 1
1 291 . 21 1 1 A 24 24 LYS CA C 158 57.148 56.107 1.041 1
1 292 . 21 1 1 A 24 24 LYS CB C 158 33.200 33.027 0.173 1
1 296 . 21 1 1 A 24 24 LYS N N 158 122.372 123.463 -1.091 1
1 297 . 21 1 1 A 25 25 GLU H H 159 8.001 8.357 -0.356 1
1 298 . 21 1 1 A 25 25 GLU HA H 159 4.521 4.159 0.362 1
1 303 . 21 1 1 A 25 25 GLU C C 159 175.995 177.041 -1.046 1
1 304 . 21 1 1 A 25 25 GLU CA C 159 55.727 59.152 -3.425 1
1 305 . 21 1 1 A 25 25 GLU CB C 159 31.918 30.356 1.562 1
1 307 . 21 1 1 A 25 25 GLU N N 159 118.705 119.472 -0.767 1
1 308 . 21 1 1 A 26 26 GLY H H 160 8.458 7.288 1.170 1
1 309 . 21 1 1 A 26 26 GLY HA2 H 160 3.946 4.050 -0.104 1
1 310 . 21 1 1 A 26 26 GLY HA3 H 160 3.511 4.058 -0.547 1
1 311 . 21 1 1 A 26 26 GLY C C 160 172.201 173.452 -1.251 1
1 312 . 21 1 1 A 26 26 GLY CA C 160 44.038 44.287 -0.249 1
1 313 . 21 1 1 A 26 26 GLY N N 160 107.642 109.052 -1.410 1
1 314 . 21 1 1 A 27 27 LEU H H 161 8.259 8.692 -0.433 1
1 315 . 21 1 1 A 27 27 LEU HA H 161 4.775 4.923 -0.148 1
1 325 . 21 1 1 A 27 27 LEU C C 161 177.422 175.530 1.892 1
1 326 . 21 1 1 A 27 27 LEU CA C 161 53.322 53.322 0.000 1
1 327 . 21 1 1 A 27 27 LEU CB C 161 45.576 43.354 2.222 1
1 331 . 21 1 1 A 27 27 LEU N N 161 119.856 121.123 -1.267 1
1 332 . 21 1 1 A 28 28 ASP H H 162 8.848 8.513 0.335 1
1 333 . 21 1 1 A 28 28 ASP HA H 162 4.644 4.746 -0.102 1
1 336 . 21 1 1 A 28 28 ASP C C 162 176.630 176.816 -0.186 1
1 337 . 21 1 1 A 28 28 ASP CA C 162 55.195 54.229 0.966 1
1 338 . 21 1 1 A 28 28 ASP CB C 162 41.673 42.346 -0.673 1
1 339 . 21 1 1 A 28 28 ASP N N 162 122.434 121.487 0.947 1
1 340 . 21 1 1 A 29 29 ASP H H 163 8.720 9.180 -0.460 1
1 341 . 21 1 1 A 29 29 ASP HA H 163 4.386 4.441 -0.055 1
1 344 . 21 1 1 A 29 29 ASP C C 163 176.604 178.495 -1.891 1
1 345 . 21 1 1 A 29 29 ASP CA C 163 59.690 57.037 2.653 1
1 346 . 21 1 1 A 29 29 ASP CB C 163 42.964 39.834 3.130 1
1 347 . 21 1 1 A 29 29 ASP N N 163 121.460 124.435 -2.975 1
1 348 . 21 1 1 A 30 30 LYS H H 164 8.434 7.533 0.901 1
1 349 . 21 1 1 A 30 30 LYS HA H 164 3.901 3.979 -0.078 1
1 358 . 21 1 1 A 30 30 LYS C C 164 179.479 178.957 0.522 1
1 359 . 21 1 1 A 30 30 LYS CA C 164 60.047 59.393 0.654 1
1 360 . 21 1 1 A 30 30 LYS CB C 164 32.038 32.249 -0.211 1
1 364 . 21 1 1 A 30 30 LYS N N 164 116.627 119.772 -3.145 1
1 365 . 21 1 1 A 31 31 GLU H H 165 7.755 8.440 -0.685 1
1 366 . 21 1 1 A 31 31 GLU HA H 165 3.998 4.055 -0.057 1
1 371 . 21 1 1 A 31 31 GLU C C 165 179.031 179.145 -0.114 1
1 372 . 21 1 1 A 31 31 GLU CA C 165 59.335 59.097 0.238 1
1 373 . 21 1 1 A 31 31 GLU CB C 165 29.972 29.743 0.229 1
1 375 . 21 1 1 A 31 31 GLU N N 165 120.456 119.796 0.660 1
1 376 . 21 1 1 A 32 32 ALA H H 166 9.060 8.560 0.500 1
1 377 . 21 1 1 A 32 32 ALA HA H 166 3.871 4.041 -0.170 1
1 381 . 21 1 1 A 32 32 ALA C C 166 178.029 179.030 -1.001 1
1 382 . 21 1 1 A 32 32 ALA CA C 166 54.997 55.234 -0.237 1
1 383 . 21 1 1 A 32 32 ALA CB C 166 19.727 18.506 1.221 1
1 384 . 21 1 1 A 32 32 ALA N N 166 124.406 122.180 2.226 1
1 385 . 21 1 1 A 33 33 LYS H H 167 8.228 7.737 0.491 1
1 386 . 21 1 1 A 33 33 LYS HA H 167 2.595 3.080 -0.485 1
1 395 . 21 1 1 A 33 33 LYS C C 167 177.938 178.296 -0.358 1
1 396 . 21 1 1 A 33 33 LYS CA C 167 59.573 59.436 0.137 1
1 397 . 21 1 1 A 33 33 LYS CB C 167 32.098 32.283 -0.185 1
1 401 . 21 1 1 A 33 33 LYS N N 167 119.833 118.081 1.752 1
1 402 . 21 1 1 A 34 34 GLN H H 168 7.392 7.488 -0.096 1
1 403 . 21 1 1 A 34 34 GLN HA H 168 3.943 3.936 0.007 1
1 410 . 21 1 1 A 34 34 GLN C C 168 178.323 178.473 -0.150 1
1 411 . 21 1 1 A 34 34 GLN CA C 168 58.883 59.214 -0.331 1
1 412 . 21 1 1 A 34 34 GLN CB C 168 28.485 28.214 0.271 1
1 414 . 21 1 1 A 34 34 GLN N N 168 117.208 118.049 -0.841 1
1 416 . 21 1 1 A 35 35 LYS H H 169 7.994 8.176 -0.182 1
1 417 . 21 1 1 A 35 35 LYS HA H 169 4.067 4.019 0.048 1
1 426 . 21 1 1 A 35 35 LYS C C 169 178.161 178.442 -0.281 1
1 427 . 21 1 1 A 35 35 LYS CA C 169 58.437 58.704 -0.267 1
1 428 . 21 1 1 A 35 35 LYS CB C 169 31.611 32.127 -0.516 1
1 432 . 21 1 1 A 35 35 LYS N N 169 120.898 119.293 1.605 1
1 433 . 21 1 1 A 36 36 ALA H H 170 8.431 8.373 0.058 1
1 434 . 21 1 1 A 36 36 ALA HA H 170 3.738 4.009 -0.271 1
1 438 . 21 1 1 A 36 36 ALA C C 170 178.862 179.817 -0.955 1
1 439 . 21 1 1 A 36 36 ALA CA C 170 55.351 54.973 0.378 1
1 440 . 21 1 1 A 36 36 ALA CB C 170 18.295 18.299 -0.004 1
1 441 . 21 1 1 A 36 36 ALA N N 170 120.641 121.149 -0.508 1
1 442 . 21 1 1 A 37 37 GLU H H 171 8.412 7.845 0.567 1
1 443 . 21 1 1 A 37 37 GLU HA H 171 3.867 3.964 -0.097 1
1 448 . 21 1 1 A 37 37 GLU C C 171 179.255 179.256 -0.001 1
1 449 . 21 1 1 A 37 37 GLU CA C 171 59.543 59.356 0.187 1
1 450 . 21 1 1 A 37 37 GLU CB C 171 29.569 29.181 0.388 1
1 452 . 21 1 1 A 37 37 GLU N N 171 118.224 117.725 0.499 1
1 453 . 21 1 1 A 38 38 GLU H H 172 8.019 8.292 -0.273 1
1 454 . 21 1 1 A 38 38 GLU HA H 172 3.952 4.060 -0.108 1
1 459 . 21 1 1 A 38 38 GLU C C 172 180.250 178.509 1.741 1
1 460 . 21 1 1 A 38 38 GLU CA C 172 59.627 59.247 0.380 1
1 461 . 21 1 1 A 38 38 GLU CB C 172 29.368 28.959 0.409 1
1 463 . 21 1 1 A 38 38 GLU N N 172 121.250 118.538 2.712 1
1 464 . 21 1 1 A 39 39 ILE H H 173 8.174 7.383 0.791 1
1 465 . 21 1 1 A 39 39 ILE HA H 173 3.643 3.799 -0.156 1
1 475 . 21 1 1 A 39 39 ILE C C 173 177.568 177.992 -0.424 1
1 476 . 21 1 1 A 39 39 ILE CA C 173 64.869 63.793 1.076 1
1 477 . 21 1 1 A 39 39 ILE CB C 173 38.160 37.275 0.885 1
1 481 . 21 1 1 A 39 39 ILE N N 173 121.527 117.450 4.077 1
1 482 . 21 1 1 A 40 40 GLN H H 174 8.860 8.273 0.587 1
1 483 . 21 1 1 A 40 40 GLN HA H 174 3.533 3.940 -0.407 1
1 490 . 21 1 1 A 40 40 GLN C C 174 179.022 178.502 0.520 1
1 491 . 21 1 1 A 40 40 GLN CA C 174 61.316 59.349 1.967 1
1 492 . 21 1 1 A 40 40 GLN CB C 174 26.604 28.509 -1.905 1
1 494 . 21 1 1 A 40 40 GLN N N 174 121.956 121.072 0.884 1
1 496 . 21 1 1 A 41 41 LYS H H 175 7.879 7.896 -0.017 1
1 497 . 21 1 1 A 41 41 LYS HA H 175 3.777 4.224 -0.447 1
1 506 . 21 1 1 A 41 41 LYS C C 175 178.779 178.229 0.550 1
1 507 . 21 1 1 A 41 41 LYS CA C 175 59.701 58.736 0.965 1
1 508 . 21 1 1 A 41 41 LYS CB C 175 32.581 31.561 1.020 1
1 512 . 21 1 1 A 41 41 LYS N N 175 119.012 118.408 0.604 1
1 513 . 21 1 1 A 42 42 GLU H H 176 7.447 7.759 -0.312 1
1 514 . 21 1 1 A 42 42 GLU HA H 176 4.059 4.140 -0.081 1
1 519 . 21 1 1 A 42 42 GLU C C 176 180.058 178.565 1.493 1
1 520 . 21 1 1 A 42 42 GLU CA C 176 59.456 59.202 0.254 1
1 521 . 21 1 1 A 42 42 GLU CB C 176 29.923 29.038 0.885 1
1 523 . 21 1 1 A 42 42 GLU N N 176 120.054 118.833 1.221 1
1 524 . 21 1 1 A 43 43 VAL H H 177 8.618 7.917 0.701 1
1 525 . 21 1 1 A 43 43 VAL HA H 177 3.986 3.874 0.112 1
1 533 . 21 1 1 A 43 43 VAL C C 177 176.459 177.609 -1.150 1
1 534 . 21 1 1 A 43 43 VAL CA C 177 63.923 64.608 -0.685 1
1 535 . 21 1 1 A 43 43 VAL CB C 177 31.899 31.435 0.464 1
1 538 . 21 1 1 A 43 43 VAL N N 177 114.191 117.221 -3.030 1
1 539 . 21 1 1 A 44 44 SER H H 178 8.052 8.389 -0.337 1
1 540 . 21 1 1 A 44 44 SER HA H 178 4.098 4.255 -0.157 1
1 543 . 21 1 1 A 44 44 SER C C 178 176.548 176.263 0.285 1
1 544 . 21 1 1 A 44 44 SER CA C 178 61.160 61.232 -0.072 1
1 545 . 21 1 1 A 44 44 SER CB C 178 62.959 62.542 0.417 1
1 546 . 21 1 1 A 44 44 SER N N 178 114.202 115.738 -1.536 1
1 547 . 21 1 1 A 45 45 LYS H H 179 7.083 8.366 -1.283 1
1 548 . 21 1 1 A 45 45 LYS HA H 179 4.140 4.181 -0.041 1
1 557 . 21 1 1 A 45 45 LYS C C 179 177.288 176.177 1.111 1
1 558 . 21 1 1 A 45 45 LYS CA C 179 58.469 58.054 0.415 1
1 559 . 21 1 1 A 45 45 LYS CB C 179 32.671 31.594 1.077 1
1 563 . 21 1 1 A 45 45 LYS N N 179 120.935 118.598 2.337 1
1 564 . 21 1 1 A 46 46 ASP H H 180 7.098 7.870 -0.772 1
1 565 . 21 1 1 A 46 46 ASP HA H 180 4.917 4.965 -0.048 1
1 568 . 21 1 1 A 46 46 ASP CA C 180 51.492 51.908 -0.416 1
1 569 . 21 1 1 A 46 46 ASP CB C 180 40.595 41.211 -0.616 1
1 570 . 21 1 1 A 46 46 ASP N N 180 112.836 119.801 -6.965 1
1 571 . 21 1 1 A 47 47 PRO HA H 181 4.681 4.456 0.225 1
1 578 . 21 1 1 A 47 47 PRO C C 181 179.248 177.741 1.507 1
1 579 . 21 1 1 A 47 47 PRO CA C 181 64.718 64.432 0.286 1
1 580 . 21 1 1 A 47 47 PRO CB C 181 32.159 32.047 0.112 1
1 583 . 21 1 1 A 48 48 SER H H 182 8.248 7.930 0.318 1
1 584 . 21 1 1 A 48 48 SER HA H 182 4.378 4.309 0.069 1
1 587 . 21 1 1 A 48 48 SER C C 182 176.071 175.583 0.488 1
1 588 . 21 1 1 A 48 48 SER CA C 182 61.377 60.801 0.576 1
1 589 . 21 1 1 A 48 48 SER CB C 182 62.455 63.126 -0.671 1
1 590 . 21 1 1 A 48 48 SER N N 182 116.986 112.962 4.024 1
1 591 . 21 1 1 A 49 49 LYS H H 183 7.842 7.594 0.248 1
1 592 . 21 1 1 A 49 49 LYS HA H 183 4.482 4.293 0.189 1
1 601 . 21 1 1 A 49 49 LYS C C 183 175.605 177.662 -2.057 1
1 602 . 21 1 1 A 49 49 LYS CA C 183 55.824 56.984 -1.160 1
1 603 . 21 1 1 A 49 49 LYS CB C 183 32.834 32.675 0.159 1
1 607 . 21 1 1 A 49 49 LYS N N 183 121.698 119.857 1.841 1
1 608 . 21 1 1 A 50 50 PHE H H 184 7.634 7.742 -0.108 1
1 609 . 21 1 1 A 50 50 PHE HA H 184 3.510 4.197 -0.687 1
1 617 . 21 1 1 A 50 50 PHE C C 184 176.214 177.520 -1.306 1
1 618 . 21 1 1 A 50 50 PHE CA C 184 63.276 61.060 2.216 1
1 619 . 21 1 1 A 50 50 PHE CB C 184 40.948 39.160 1.788 1
1 623 . 21 1 1 A 50 50 PHE N N 184 120.120 121.502 -1.382 1
1 624 . 21 1 1 A 51 51 GLY H H 185 8.855 8.563 0.292 1
1 625 . 21 1 1 A 51 51 GLY HA2 H 185 3.993 3.879 0.114 1
1 626 . 21 1 1 A 51 51 GLY HA3 H 185 3.958 3.930 0.028 1
1 627 . 21 1 1 A 51 51 GLY C C 185 175.169 176.225 -1.056 1
1 628 . 21 1 1 A 51 51 GLY CA C 185 47.475 47.549 -0.074 1
1 629 . 21 1 1 A 51 51 GLY N N 185 105.550 106.250 -0.700 1
1 630 . 21 1 1 A 52 52 GLU H H 186 7.917 7.962 -0.045 1
1 631 . 21 1 1 A 52 52 GLU HA H 186 4.006 4.052 -0.046 1
1 636 . 21 1 1 A 52 52 GLU C C 186 179.499 179.652 -0.153 1
1 637 . 21 1 1 A 52 52 GLU CA C 186 58.904 59.214 -0.310 1
1 638 . 21 1 1 A 52 52 GLU CB C 186 29.700 29.503 0.197 1
1 640 . 21 1 1 A 52 52 GLU N N 186 121.929 121.737 0.192 1
1 641 . 21 1 1 A 53 53 ILE H H 187 7.936 8.067 -0.131 1
1 642 . 21 1 1 A 53 53 ILE HA H 187 3.648 3.648 0.000 1
1 652 . 21 1 1 A 53 53 ILE C C 187 177.886 177.664 0.222 1
1 653 . 21 1 1 A 53 53 ILE CA C 187 64.366 65.201 -0.835 1
1 654 . 21 1 1 A 53 53 ILE CB C 187 36.478 37.614 -1.136 1
1 658 . 21 1 1 A 53 53 ILE N N 187 120.991 121.496 -0.505 1
1 659 . 21 1 1 A 54 54 ALA H H 188 8.895 8.553 0.342 1
1 660 . 21 1 1 A 54 54 ALA HA H 188 3.629 3.801 -0.172 1
1 664 . 21 1 1 A 54 54 ALA C C 188 179.437 178.893 0.544 1
1 665 . 21 1 1 A 54 54 ALA CA C 188 55.974 55.624 0.350 1
1 666 . 21 1 1 A 54 54 ALA CB C 188 17.591 18.740 -1.149 1
1 667 . 21 1 1 A 54 54 ALA N N 188 125.308 122.152 3.156 1
1 668 . 21 1 1 A 55 55 LYS H H 189 8.049 7.792 0.257 1
1 669 . 21 1 1 A 55 55 LYS HA H 189 4.106 3.871 0.235 1
1 678 . 21 1 1 A 55 55 LYS C C 189 178.995 178.418 0.577 1
1 679 . 21 1 1 A 55 55 LYS CA C 189 59.312 59.416 -0.104 1
1 680 . 21 1 1 A 55 55 LYS CB C 189 32.647 32.159 0.488 1
1 684 . 21 1 1 A 55 55 LYS N N 189 116.835 118.513 -1.678 1
1 685 . 21 1 1 A 56 56 LYS H H 190 7.215 8.049 -0.834 1
1 686 . 21 1 1 A 56 56 LYS HA H 190 4.172 4.214 -0.042 1
1 695 . 21 1 1 A 56 56 LYS C C 190 177.897 178.051 -0.154 1
1 696 . 21 1 1 A 56 56 LYS CA C 190 58.418 58.620 -0.202 1
1 697 . 21 1 1 A 56 56 LYS CB C 190 34.652 33.252 1.400 1
1 701 . 21 1 1 A 56 56 LYS N N 190 117.170 118.165 -0.995 1
1 702 . 21 1 1 A 57 57 GLU H H 191 8.572 7.819 0.753 1
1 703 . 21 1 1 A 57 57 GLU HA H 191 4.643 4.364 0.279 1
1 708 . 21 1 1 A 57 57 GLU C C 191 177.903 176.053 1.850 1
1 709 . 21 1 1 A 57 57 GLU CA C 191 55.708 56.325 -0.617 1
1 710 . 21 1 1 A 57 57 GLU CB C 191 32.460 30.651 1.809 1
1 712 . 21 1 1 A 57 57 GLU N N 191 113.316 116.749 -3.433 1
1 713 . 21 1 1 A 58 58 SER H H 192 8.550 7.637 0.913 1
1 714 . 21 1 1 A 58 58 SER HA H 192 4.149 4.401 -0.252 1
1 717 . 21 1 1 A 58 58 SER C C 192 176.161 175.190 0.971 1
1 718 . 21 1 1 A 58 58 SER CA C 192 58.403 57.944 0.459 1
1 719 . 21 1 1 A 58 58 SER CB C 192 64.392 64.379 0.013 1
1 720 . 21 1 1 A 58 58 SER N N 192 109.861 115.669 -5.808 1
1 721 . 21 1 1 A 59 59 MET H H 193 9.533 8.756 0.777 1
1 722 . 21 1 1 A 59 59 MET HA H 193 4.457 4.519 -0.062 1
1 730 . 21 1 1 A 59 59 MET C C 193 175.204 175.711 -0.507 1
1 731 . 21 1 1 A 59 59 MET CA C 193 55.781 56.217 -0.436 1
1 732 . 21 1 1 A 59 59 MET CB C 193 32.855 33.245 -0.390 1
1 735 . 21 1 1 A 59 59 MET N N 193 124.493 123.670 0.823 1
1 736 . 21 1 1 A 60 60 ASP H H 194 7.514 7.494 0.020 1
1 737 . 21 1 1 A 60 60 ASP HA H 194 4.886 4.590 0.296 1
1 740 . 21 1 1 A 60 60 ASP C C 194 175.517 176.830 -1.313 1
1 741 . 21 1 1 A 60 60 ASP CA C 194 52.286 53.285 -0.999 1
1 742 . 21 1 1 A 60 60 ASP CB C 194 40.222 40.717 -0.495 1
1 743 . 21 1 1 A 60 60 ASP N N 194 117.785 121.176 -3.391 1
1 744 . 21 1 1 A 61 61 THR H H 195 8.118 8.402 -0.284 1
1 745 . 21 1 1 A 61 61 THR HA H 195 3.918 3.972 -0.054 1
1 750 . 21 1 1 A 61 61 THR C C 195 176.269 176.930 -0.661 1
1 751 . 21 1 1 A 61 61 THR CA C 195 65.469 64.888 0.581 1
1 752 . 21 1 1 A 61 61 THR CB C 195 68.741 68.558 0.183 1
1 754 . 21 1 1 A 61 61 THR N N 195 120.765 118.769 1.996 1
1 755 . 21 1 1 A 62 62 GLY H H 196 8.399 8.467 -0.068 1
1 756 . 21 1 1 A 62 62 GLY HA2 H 196 3.932 3.883 0.049 1
1 757 . 21 1 1 A 62 62 GLY HA3 H 196 3.900 3.886 0.014 1
1 758 . 21 1 1 A 62 62 GLY C C 196 174.948 176.256 -1.308 1
1 759 . 21 1 1 A 62 62 GLY CA C 196 46.768 47.498 -0.730 1
1 760 . 21 1 1 A 62 62 GLY N N 196 108.183 111.654 -3.471 1
1 761 . 21 1 1 A 63 63 SER H H 197 7.265 8.354 -1.089 1
1 762 . 21 1 1 A 63 63 SER HA H 197 4.554 4.183 0.371 1
1 765 . 21 1 1 A 63 63 SER C C 197 177.630 177.132 0.498 1
1 766 . 21 1 1 A 63 63 SER CA C 197 59.550 61.434 -1.884 1
1 767 . 21 1 1 A 63 63 SER CB C 197 65.504 62.762 2.742 1
1 768 . 21 1 1 A 63 63 SER N N 197 111.815 117.174 -5.359 1
1 769 . 21 1 1 A 64 64 ALA H H 198 8.675 8.350 0.325 1
1 770 . 21 1 1 A 64 64 ALA HA H 198 3.801 3.956 -0.155 1
1 774 . 21 1 1 A 64 64 ALA C C 198 178.492 179.349 -0.857 1
1 775 . 21 1 1 A 64 64 ALA CA C 198 56.794 55.364 1.430 1
1 776 . 21 1 1 A 64 64 ALA CB C 198 18.951 18.314 0.637 1
1 777 . 21 1 1 A 64 64 ALA N N 198 131.710 124.570 7.140 1
1 778 . 21 1 1 A 65 65 LYS H H 199 7.666 7.657 0.009 1
1 779 . 21 1 1 A 65 65 LYS HA H 199 4.175 4.031 0.144 1
1 788 . 21 1 1 A 65 65 LYS C C 199 177.159 177.716 -0.557 1
1 789 . 21 1 1 A 65 65 LYS CA C 199 57.735 58.873 -1.138 1
1 790 . 21 1 1 A 65 65 LYS CB C 199 31.948 31.900 0.048 1
1 794 . 21 1 1 A 65 65 LYS N N 199 111.375 118.447 -7.072 1
1 795 . 21 1 1 A 66 66 LYS H H 200 7.545 7.548 -0.003 1
1 796 . 21 1 1 A 66 66 LYS HA H 200 4.612 4.439 0.173 1
1 805 . 21 1 1 A 66 66 LYS C C 200 175.609 175.061 0.548 1
1 806 . 21 1 1 A 66 66 LYS CA C 200 54.468 55.795 -1.327 1
1 807 . 21 1 1 A 66 66 LYS CB C 200 31.525 32.144 -0.619 1
1 811 . 21 1 1 A 66 66 LYS N N 200 121.421 116.204 5.217 1
1 812 . 21 1 1 A 67 67 ASP H H 201 7.630 8.147 -0.517 1
1 813 . 21 1 1 A 67 67 ASP HA H 201 4.306 4.366 -0.060 1
1 816 . 21 1 1 A 67 67 ASP C C 201 175.025 176.366 -1.341 1
1 817 . 21 1 1 A 67 67 ASP CA C 201 56.400 55.407 0.993 1
1 818 . 21 1 1 A 67 67 ASP CB C 201 38.315 39.177 -0.862 1
1 819 . 21 1 1 A 67 67 ASP N N 201 116.216 117.181 -0.965 1
1 820 . 21 1 1 A 68 68 GLY H H 202 8.368 8.551 -0.183 1
1 821 . 21 1 1 A 68 68 GLY HA2 H 202 4.316 3.930 0.386 1
1 822 . 21 1 1 A 68 68 GLY HA3 H 202 3.731 4.000 -0.269 1
1 823 . 21 1 1 A 68 68 GLY C C 202 174.139 174.445 -0.306 1
1 824 . 21 1 1 A 68 68 GLY CA C 202 45.514 45.412 0.102 1
1 825 . 21 1 1 A 68 68 GLY N N 202 105.095 104.287 0.808 1
1 826 . 21 1 1 A 69 69 GLU H H 203 7.534 7.478 0.056 1
1 827 . 21 1 1 A 69 69 GLU HA H 203 4.479 4.405 0.074 1
1 832 . 21 1 1 A 69 69 GLU C C 203 176.961 176.596 0.365 1
1 833 . 21 1 1 A 69 69 GLU CA C 203 58.549 56.973 1.576 1
1 834 . 21 1 1 A 69 69 GLU CB C 203 30.998 30.646 0.352 1
1 836 . 21 1 1 A 69 69 GLU N N 203 120.426 120.694 -0.268 1
1 837 . 21 1 1 A 70 70 LEU H H 204 8.962 9.053 -0.091 1
1 838 . 21 1 1 A 70 70 LEU HA H 204 4.438 4.605 -0.167 1
1 848 . 21 1 1 A 70 70 LEU C C 204 178.648 177.290 1.358 1
1 849 . 21 1 1 A 70 70 LEU CA C 204 53.977 55.231 -1.254 1
1 850 . 21 1 1 A 70 70 LEU CB C 204 43.612 43.605 0.007 1
1 854 . 21 1 1 A 70 70 LEU N N 204 122.066 125.654 -3.588 1
1 855 . 21 1 1 A 71 71 GLY H H 205 8.104 7.626 0.478 1
1 856 . 21 1 1 A 71 71 GLY HA2 H 205 4.165 4.024 0.141 1
1 857 . 21 1 1 A 71 71 GLY HA3 H 205 3.552 4.121 -0.569 1
1 858 . 21 1 1 A 71 71 GLY C C 205 173.098 173.385 -0.287 1
1 859 . 21 1 1 A 71 71 GLY CA C 205 44.723 44.893 -0.170 1
1 860 . 21 1 1 A 71 71 GLY N N 205 110.168 106.639 3.529 1
1 861 . 21 1 1 A 72 72 TYR H H 206 8.457 8.559 -0.102 1
1 862 . 21 1 1 A 72 72 TYR HA H 206 4.184 4.805 -0.621 1
1 869 . 21 1 1 A 72 72 TYR C C 206 175.975 175.545 0.430 1
1 870 . 21 1 1 A 72 72 TYR CA C 206 59.722 58.919 0.803 1
1 871 . 21 1 1 A 72 72 TYR CB C 206 38.378 38.267 0.111 1
1 874 . 21 1 1 A 72 72 TYR N N 206 120.171 122.028 -1.857 1
1 875 . 21 1 1 A 73 73 VAL H H 207 8.782 9.113 -0.331 1
1 876 . 21 1 1 A 73 73 VAL HA H 207 4.056 4.400 -0.344 1
1 884 . 21 1 1 A 73 73 VAL C C 207 174.901 175.740 -0.839 1
1 885 . 21 1 1 A 73 73 VAL CA C 207 62.202 62.554 -0.352 1
1 886 . 21 1 1 A 73 73 VAL CB C 207 33.071 31.944 1.127 1
1 889 . 21 1 1 A 73 73 VAL N N 207 128.847 125.051 3.796 1
1 890 . 21 1 1 A 74 74 LEU H H 208 8.146 8.828 -0.682 1
1 891 . 21 1 1 A 74 74 LEU HA H 208 4.944 4.884 0.060 1
1 901 . 21 1 1 A 74 74 LEU C C 208 178.400 177.350 1.050 1
1 902 . 21 1 1 A 74 74 LEU CA C 208 53.520 53.344 0.176 1
1 903 . 21 1 1 A 74 74 LEU CB C 208 43.499 43.316 0.183 1
1 907 . 21 1 1 A 74 74 LEU N N 208 127.599 129.484 -1.885 1
1 908 . 21 1 1 A 75 75 LYS H H 209 8.403 8.706 -0.303 1
1 909 . 21 1 1 A 75 75 LYS HA H 209 3.771 3.909 -0.138 1
1 918 . 21 1 1 A 75 75 LYS C C 209 177.536 177.428 0.108 1
1 919 . 21 1 1 A 75 75 LYS CA C 209 58.385 58.902 -0.517 1
1 920 . 21 1 1 A 75 75 LYS CB C 209 32.459 32.058 0.401 1
1 924 . 21 1 1 A 75 75 LYS N N 209 123.798 122.252 1.546 1
1 925 . 21 1 1 A 76 76 GLY H H 210 9.997 9.358 0.639 1
1 926 . 21 1 1 A 76 76 GLY HA2 H 210 4.255 4.018 0.237 1
1 927 . 21 1 1 A 76 76 GLY HA3 H 210 3.791 4.021 -0.230 1
1 928 . 21 1 1 A 76 76 GLY C C 210 175.091 175.540 -0.449 1
1 929 . 21 1 1 A 76 76 GLY CA C 210 45.465 45.630 -0.165 1
1 930 . 21 1 1 A 76 76 GLY N N 210 114.705 113.334 1.371 1
1 931 . 21 1 1 A 77 77 GLN H H 211 7.726 8.072 -0.346 1
1 932 . 21 1 1 A 77 77 GLN HA H 211 4.373 4.207 0.166 1
1 939 . 21 1 1 A 77 77 GLN C C 211 176.301 175.999 0.302 1
1 940 . 21 1 1 A 77 77 GLN CA C 211 57.074 57.067 0.007 1
1 941 . 21 1 1 A 77 77 GLN CB C 211 30.798 29.300 1.498 1
1 943 . 21 1 1 A 77 77 GLN N N 211 118.702 118.011 0.691 1
1 945 . 21 1 1 A 78 78 THR H H 212 8.225 7.386 0.839 1
1 946 . 21 1 1 A 78 78 THR HA H 212 4.620 4.674 -0.054 1
1 951 . 21 1 1 A 78 78 THR C C 212 173.920 173.756 0.164 1
1 952 . 21 1 1 A 78 78 THR CA C 212 60.087 58.970 1.117 1
1 953 . 21 1 1 A 78 78 THR CB C 212 71.412 71.109 0.303 1
1 955 . 21 1 1 A 78 78 THR N N 212 111.935 110.070 1.865 1
1 956 . 21 1 1 A 79 79 ASP H H 213 8.372 8.482 -0.110 1
1 957 . 21 1 1 A 79 79 ASP HA H 213 4.470 4.571 -0.101 1
1 960 . 21 1 1 A 79 79 ASP C C 213 176.759 177.418 -0.659 1
1 961 . 21 1 1 A 79 79 ASP CA C 213 54.927 54.325 0.602 1
1 962 . 21 1 1 A 79 79 ASP CB C 213 43.859 41.607 2.252 1
1 963 . 21 1 1 A 79 79 ASP N N 213 122.093 121.492 0.601 1
1 964 . 21 1 1 A 80 80 LYS H H 214 8.740 8.803 -0.063 1
1 965 . 21 1 1 A 80 80 LYS HA H 214 4.027 3.988 0.039 1
1 974 . 21 1 1 A 80 80 LYS C C 214 178.493 178.030 0.463 1
1 975 . 21 1 1 A 80 80 LYS CA C 214 59.802 59.706 0.096 1
1 976 . 21 1 1 A 80 80 LYS CB C 214 32.374 32.201 0.173 1
1 980 . 21 1 1 A 80 80 LYS N N 214 124.685 123.574 1.111 1
1 981 . 21 1 1 A 81 81 ASP H H 215 8.556 8.290 0.266 1
1 982 . 21 1 1 A 81 81 ASP HA H 215 4.566 4.382 0.184 1
1 985 . 21 1 1 A 81 81 ASP C C 215 178.889 178.820 0.069 1
1 986 . 21 1 1 A 81 81 ASP CA C 215 58.046 57.446 0.600 1
1 987 . 21 1 1 A 81 81 ASP CB C 215 40.872 40.416 0.456 1
1 988 . 21 1 1 A 81 81 ASP N N 215 121.413 119.475 1.938 1
1 989 . 21 1 1 A 82 82 PHE H H 216 8.205 8.349 -0.144 1
1 990 . 21 1 1 A 82 82 PHE HA H 216 3.686 4.068 -0.382 1
1 998 . 21 1 1 A 82 82 PHE C C 216 175.919 177.372 -1.453 1
1 999 . 21 1 1 A 82 82 PHE CA C 216 61.648 60.858 0.790 1
1 1000 . 21 1 1 A 82 82 PHE CB C 216 39.743 39.159 0.584 1
1 1004 . 21 1 1 A 82 82 PHE N N 216 124.401 122.605 1.796 1
1 1005 . 21 1 1 A 83 83 GLU H H 217 8.887 8.918 -0.031 1
1 1006 . 21 1 1 A 83 83 GLU HA H 217 3.704 4.191 -0.487 1
1 1011 . 21 1 1 A 83 83 GLU C C 217 177.788 178.912 -1.124 1
1 1012 . 21 1 1 A 83 83 GLU CA C 217 60.545 60.254 0.291 1
1 1013 . 21 1 1 A 83 83 GLU CB C 217 30.639 29.439 1.200 1
1 1015 . 21 1 1 A 83 83 GLU N N 217 119.421 119.063 0.358 1
1 1016 . 21 1 1 A 84 84 LYS H H 218 8.055 7.947 0.108 1
1 1017 . 21 1 1 A 84 84 LYS HA H 218 3.947 4.130 -0.183 1
1 1026 . 21 1 1 A 84 84 LYS C C 218 178.783 178.773 0.010 1
1 1027 . 21 1 1 A 84 84 LYS CA C 218 59.327 59.041 0.286 1
1 1028 . 21 1 1 A 84 84 LYS CB C 218 32.539 32.265 0.274 1
1 1032 . 21 1 1 A 84 84 LYS N N 218 117.821 119.637 -1.816 1
1 1033 . 21 1 1 A 85 85 ALA H H 219 7.059 7.725 -0.666 1
1 1034 . 21 1 1 A 85 85 ALA HA H 219 4.040 4.025 0.015 1
1 1038 . 21 1 1 A 85 85 ALA C C 219 179.794 180.126 -0.332 1
1 1039 . 21 1 1 A 85 85 ALA CA C 219 54.407 54.859 -0.452 1
1 1040 . 21 1 1 A 85 85 ALA CB C 219 20.130 17.944 2.186 1
1 1041 . 21 1 1 A 85 85 ALA N N 219 118.905 121.421 -2.516 1
1 1042 . 21 1 1 A 86 86 LEU H H 220 8.157 8.319 -0.162 1
1 1043 . 21 1 1 A 86 86 LEU HA H 220 3.692 3.949 -0.257 1
1 1053 . 21 1 1 A 86 86 LEU C C 220 178.330 178.552 -0.222 1
1 1054 . 21 1 1 A 86 86 LEU CA C 220 57.752 58.084 -0.332 1
1 1055 . 21 1 1 A 86 86 LEU CB C 220 41.464 41.783 -0.319 1
1 1059 . 21 1 1 A 86 86 LEU N N 220 118.606 120.426 -1.820 1
1 1060 . 21 1 1 A 87 87 PHE H H 221 8.349 8.118 0.231 1
1 1061 . 21 1 1 A 87 87 PHE HA H 221 3.861 4.510 -0.649 1
1 1069 . 21 1 1 A 87 87 PHE C C 221 176.176 177.554 -1.378 1
1 1070 . 21 1 1 A 87 87 PHE CA C 221 61.780 61.493 0.287 1
1 1071 . 21 1 1 A 87 87 PHE CB C 221 37.549 37.919 -0.370 1
1 1075 . 21 1 1 A 87 87 PHE N N 221 112.449 116.712 -4.263 1
1 1076 . 21 1 1 A 88 88 LYS H H 222 7.061 7.639 -0.578 1
1 1077 . 21 1 1 A 88 88 LYS HA H 222 4.380 4.364 0.016 1
1 1086 . 21 1 1 A 88 88 LYS C C 222 177.089 176.600 0.489 1
1 1087 . 21 1 1 A 88 88 LYS CA C 222 56.726 57.133 -0.407 1
1 1088 . 21 1 1 A 88 88 LYS CB C 222 33.738 32.826 0.912 1
1 1092 . 21 1 1 A 88 88 LYS N N 222 118.308 116.987 1.321 1
1 1093 . 21 1 1 A 89 89 LEU H H 223 7.270 7.244 0.026 1
1 1094 . 21 1 1 A 89 89 LEU HA H 223 4.168 4.154 0.014 1
1 1104 . 21 1 1 A 89 89 LEU C C 223 177.528 176.987 0.541 1
1 1105 . 21 1 1 A 89 89 LEU CA C 223 55.279 54.863 0.416 1
1 1106 . 21 1 1 A 89 89 LEU CB C 223 43.240 42.227 1.013 1
1 1110 . 21 1 1 A 89 89 LEU N N 223 121.317 121.513 -0.196 1
1 1111 . 21 1 1 A 90 90 LYS H H 224 8.788 8.483 0.305 1
1 1112 . 21 1 1 A 90 90 LYS HA H 224 4.359 4.482 -0.123 1
1 1121 . 21 1 1 A 90 90 LYS C C 224 175.839 176.761 -0.922 1
1 1122 . 21 1 1 A 90 90 LYS CA C 224 54.772 55.213 -0.441 1
1 1123 . 21 1 1 A 90 90 LYS CB C 224 33.232 33.186 0.046 1
1 1127 . 21 1 1 A 90 90 LYS N N 224 123.558 122.467 1.091 1
1 1128 . 21 1 1 A 91 91 ASP H H 225 8.125 8.792 -0.667 1
1 1129 . 21 1 1 A 91 91 ASP HA H 225 3.958 4.141 -0.183 1
1 1132 . 21 1 1 A 91 91 ASP C C 225 177.452 177.040 0.412 1
1 1133 . 21 1 1 A 91 91 ASP CA C 225 56.642 56.132 0.510 1
1 1134 . 21 1 1 A 91 91 ASP CB C 225 40.269 40.099 0.170 1
1 1135 . 21 1 1 A 91 91 ASP N N 225 119.419 122.622 -3.203 1
1 1136 . 21 1 1 A 92 92 GLY H H 226 8.681 8.926 -0.245 1
1 1137 . 21 1 1 A 92 92 GLY HA2 H 226 4.131 3.883 0.248 1
1 1138 . 21 1 1 A 92 92 GLY HA3 H 226 3.579 3.910 -0.331 1
1 1139 . 21 1 1 A 92 92 GLY C C 226 173.614 174.058 -0.444 1
1 1140 . 21 1 1 A 92 92 GLY CA C 226 45.564 44.926 0.638 1
1 1141 . 21 1 1 A 92 92 GLY N N 226 113.802 111.825 1.977 1
1 1142 . 21 1 1 A 93 93 GLU H H 227 8.104 8.071 0.033 1
1 1143 . 21 1 1 A 93 93 GLU HA H 227 4.232 4.423 -0.191 1
1 1148 . 21 1 1 A 93 93 GLU C C 227 174.282 176.080 -1.798 1
1 1149 . 21 1 1 A 93 93 GLU CA C 227 56.651 55.918 0.733 1
1 1150 . 21 1 1 A 93 93 GLU CB C 227 32.190 31.062 1.128 1
1 1152 . 21 1 1 A 93 93 GLU N N 227 121.527 121.910 -0.383 1
1 1153 . 21 1 1 A 94 94 VAL H H 228 7.918 8.550 -0.632 1
1 1154 . 21 1 1 A 94 94 VAL HA H 228 4.857 4.836 0.021 1
1 1162 . 21 1 1 A 94 94 VAL C C 228 176.556 175.765 0.791 1
1 1163 . 21 1 1 A 94 94 VAL CA C 228 60.309 59.823 0.486 1
1 1164 . 21 1 1 A 94 94 VAL CB C 228 33.847 34.359 -0.512 1
1 1167 . 21 1 1 A 94 94 VAL N N 228 119.768 120.307 -0.539 1
1 1168 . 21 1 1 A 95 95 SER H H 229 9.659 9.116 0.543 1
1 1169 . 21 1 1 A 95 95 SER HA H 229 4.313 4.713 -0.400 1
1 1172 . 21 1 1 A 95 95 SER C C 229 174.641 174.443 0.198 1
1 1173 . 21 1 1 A 95 95 SER CA C 229 59.208 57.611 1.597 1
1 1174 . 21 1 1 A 95 95 SER CB C 229 66.080 65.756 0.324 1
1 1175 . 21 1 1 A 95 95 SER N N 229 124.903 116.361 8.542 1
1 1176 . 21 1 1 A 96 96 GLU H H 230 8.014 8.572 -0.558 1
1 1177 . 21 1 1 A 96 96 GLU HA H 230 4.376 4.473 -0.097 1
1 1182 . 21 1 1 A 96 96 GLU C C 230 176.641 177.140 -0.499 1
1 1183 . 21 1 1 A 96 96 GLU CA C 230 56.236 56.326 -0.090 1
1 1184 . 21 1 1 A 96 96 GLU CB C 230 30.324 30.835 -0.511 1
1 1186 . 21 1 1 A 96 96 GLU N N 230 115.510 120.929 -5.419 1
1 1187 . 21 1 1 A 97 97 VAL H H 231 8.741 8.435 0.306 1
1 1188 . 21 1 1 A 97 97 VAL HA H 231 4.171 4.219 -0.048 1
1 1196 . 21 1 1 A 97 97 VAL C C 231 176.684 175.572 1.112 1
1 1197 . 21 1 1 A 97 97 VAL CA C 231 65.418 63.217 2.201 1
1 1198 . 21 1 1 A 97 97 VAL CB C 231 31.218 31.476 -0.258 1
1 1201 . 21 1 1 A 97 97 VAL N N 231 121.289 121.276 0.013 1
1 1202 . 21 1 1 A 98 98 VAL H H 232 9.218 9.569 -0.351 1
1 1203 . 21 1 1 A 98 98 VAL HA H 232 4.405 4.635 -0.230 1
1 1211 . 21 1 1 A 98 98 VAL C C 232 174.258 174.599 -0.341 1
1 1212 . 21 1 1 A 98 98 VAL CA C 232 60.937 61.133 -0.196 1
1 1213 . 21 1 1 A 98 98 VAL CB C 232 35.825 34.239 1.586 1
1 1216 . 21 1 1 A 98 98 VAL N N 232 130.544 128.881 1.663 1
1 1217 . 21 1 1 A 99 99 LYS H H 233 8.800 8.996 -0.196 1
1 1218 . 21 1 1 A 99 99 LYS HA H 233 4.853 4.819 0.034 1
1 1227 . 21 1 1 A 99 99 LYS C C 233 175.274 175.952 -0.678 1
1 1228 . 21 1 1 A 99 99 LYS CA C 233 55.499 55.815 -0.316 1
1 1229 . 21 1 1 A 99 99 LYS CB C 233 34.452 33.580 0.872 1
1 1233 . 21 1 1 A 99 99 LYS N N 233 130.477 129.074 1.403 1
1 1234 . 21 1 1 A 100 100 SER H H 234 9.585 8.650 0.935 1
1 1235 . 21 1 1 A 100 100 SER HA H 234 5.150 5.023 0.127 1
1 1238 . 21 1 1 A 100 100 SER C C 234 175.493 174.964 0.529 1
1 1239 . 21 1 1 A 100 100 SER CA C 234 56.927 56.660 0.267 1
1 1240 . 21 1 1 A 100 100 SER CB C 234 67.309 66.791 0.518 1
1 1241 . 21 1 1 A 100 100 SER N N 234 125.814 119.968 5.846 1
1 1242 . 21 1 1 A 101 101 SER H H 235 8.631 8.941 -0.310 1
1 1243 . 21 1 1 A 101 101 SER HA H 235 4.106 4.126 -0.020 1
1 1246 . 21 1 1 A 101 101 SER C C 235 175.385 175.171 0.214 1
1 1247 . 21 1 1 A 101 101 SER CA C 235 61.123 61.281 -0.158 1
1 1248 . 21 1 1 A 101 101 SER CB C 235 62.818 62.822 -0.004 1
1 1249 . 21 1 1 A 101 101 SER N N 235 115.089 116.103 -1.014 1
1 1250 . 21 1 1 A 102 102 PHE H H 236 8.957 7.502 1.455 1
1 1251 . 21 1 1 A 102 102 PHE HA H 236 4.610 4.552 0.058 1
1 1259 . 21 1 1 A 102 102 PHE C C 236 176.453 175.670 0.783 1
1 1260 . 21 1 1 A 102 102 PHE CA C 236 58.382 58.715 -0.333 1
1 1261 . 21 1 1 A 102 102 PHE CB C 236 40.275 40.155 0.120 1
1 1263 . 21 1 1 A 102 102 PHE N N 236 119.917 117.807 2.110 1
1 1264 . 21 1 1 A 103 103 GLY H H 237 7.377 7.284 0.093 1
1 1265 . 21 1 1 A 103 103 GLY HA2 H 237 4.453 3.968 0.485 1
1 1266 . 21 1 1 A 103 103 GLY HA3 H 237 3.472 4.127 -0.655 1
1 1267 . 21 1 1 A 103 103 GLY C C 237 169.627 171.617 -1.990 1
1 1268 . 21 1 1 A 103 103 GLY CA C 237 45.384 45.587 -0.203 1
1 1269 . 21 1 1 A 103 103 GLY N N 237 108.809 105.386 3.423 1
1 1270 . 21 1 1 A 104 104 TYR H H 238 8.632 8.690 -0.058 1
1 1271 . 21 1 1 A 104 104 TYR HA H 238 5.322 5.739 -0.417 1
1 1278 . 21 1 1 A 104 104 TYR C C 238 175.043 174.925 0.118 1
1 1279 . 21 1 1 A 104 104 TYR CA C 238 57.627 56.492 1.135 1
1 1280 . 21 1 1 A 104 104 TYR CB C 238 41.711 43.179 -1.468 1
1 1283 . 21 1 1 A 104 104 TYR N N 238 120.030 121.131 -1.101 1
1 1284 . 21 1 1 A 105 105 HIS H H 239 10.070 9.545 0.525 1
1 1285 . 21 1 1 A 105 105 HIS HA H 239 6.046 5.657 0.389 1
1 1290 . 21 1 1 A 105 105 HIS C C 239 175.734 174.683 1.051 1
1 1291 . 21 1 1 A 105 105 HIS CA C 239 53.945 54.466 -0.521 1
1 1292 . 21 1 1 A 105 105 HIS CB C 239 32.450 34.399 -1.949 1
1 1295 . 21 1 1 A 105 105 HIS N N 239 119.504 118.477 1.027 1
1 1296 . 21 1 1 A 106 106 ILE H H 240 8.660 8.839 -0.179 1
1 1297 . 21 1 1 A 106 106 ILE HA H 240 4.120 4.895 -0.775 1
1 1307 . 21 1 1 A 106 106 ILE C C 240 174.758 175.263 -0.505 1
1 1308 . 21 1 1 A 106 106 ILE CA C 240 63.446 59.919 3.527 1
1 1309 . 21 1 1 A 106 106 ILE CB C 240 40.786 41.492 -0.706 1
1 1313 . 21 1 1 A 106 106 ILE N N 240 120.639 119.897 0.742 1
1 1314 . 21 1 1 A 107 107 ILE H H 241 9.033 9.274 -0.241 1
1 1315 . 21 1 1 A 107 107 ILE HA H 241 4.799 5.165 -0.366 1
1 1325 . 21 1 1 A 107 107 ILE C C 241 172.880 174.521 -1.641 1
1 1326 . 21 1 1 A 107 107 ILE CA C 241 60.563 59.574 0.989 1
1 1327 . 21 1 1 A 107 107 ILE CB C 241 41.652 40.817 0.835 1
1 1331 . 21 1 1 A 107 107 ILE N N 241 129.098 127.043 2.055 1
1 1332 . 21 1 1 A 108 108 LYS H H 242 8.692 8.979 -0.287 1
1 1333 . 21 1 1 A 108 108 LYS HA H 242 5.012 5.029 -0.017 1
1 1342 . 21 1 1 A 108 108 LYS C C 242 174.484 175.289 -0.805 1
1 1343 . 21 1 1 A 108 108 LYS CA C 242 54.317 54.028 0.289 1
1 1344 . 21 1 1 A 108 108 LYS CB C 242 35.619 35.553 0.066 1
1 1348 . 21 1 1 A 108 108 LYS N N 242 127.179 125.930 1.249 1
1 1349 . 21 1 1 A 109 109 ALA H H 243 7.816 8.941 -1.125 1
1 1350 . 21 1 1 A 109 109 ALA HA H 243 4.604 4.706 -0.102 1
1 1354 . 21 1 1 A 109 109 ALA C C 243 176.231 176.095 0.136 1
1 1355 . 21 1 1 A 109 109 ALA CA C 243 50.505 50.944 -0.439 1
1 1356 . 21 1 1 A 109 109 ALA CB C 243 19.584 20.131 -0.547 1
1 1357 . 21 1 1 A 109 109 ALA N N 243 129.619 127.892 1.727 1
1 1358 . 21 1 1 A 110 110 ASP H H 244 7.578 8.524 -0.946 1
1 1359 . 21 1 1 A 110 110 ASP HA H 244 4.424 5.176 -0.752 1
1 1362 . 21 1 1 A 110 110 ASP C C 244 175.259 175.222 0.037 1
1 1363 . 21 1 1 A 110 110 ASP CA C 244 54.489 52.400 2.089 1
1 1364 . 21 1 1 A 110 110 ASP CB C 244 42.693 44.398 -1.705 1
1 1365 . 21 1 1 A 110 110 ASP N N 244 125.434 122.013 3.421 1
1 4 . 22 1 1 A 2 2 PRO HA H -4 4.403 4.615 -0.212 1
1 11 . 22 1 1 A 2 2 PRO C C -4 176.990 176.891 0.099 1
1 12 . 22 1 1 A 2 2 PRO CA C -4 63.131 62.797 0.334 1
1 13 . 22 1 1 A 2 2 PRO CB C -4 32.342 32.293 0.049 1
1 16 . 22 1 1 A 3 3 LEU H H -3 8.483 8.772 -0.289 1
1 17 . 22 1 1 A 3 3 LEU HA H -3 4.333 4.552 -0.219 1
1 27 . 22 1 1 A 3 3 LEU C C -3 177.991 177.005 0.986 1
1 28 . 22 1 1 A 3 3 LEU CA C -3 55.314 55.406 -0.092 1
1 29 . 22 1 1 A 3 3 LEU CB C -3 42.244 43.366 -1.122 1
1 33 . 22 1 1 A 3 3 LEU N N -3 122.986 119.851 3.135 1
1 34 . 22 1 1 A 4 4 GLY H H -2 8.397 7.937 0.460 1
1 35 . 22 1 1 A 4 4 GLY HA2 H -2 4.024 4.000 0.024 1
1 36 . 22 1 1 A 4 4 GLY HA3 H -2 3.976 4.013 -0.037 1
1 37 . 22 1 1 A 4 4 GLY C C -2 174.360 173.952 0.408 1
1 38 . 22 1 1 A 4 4 GLY CA C -2 45.434 44.554 0.880 1
1 39 . 22 1 1 A 4 4 GLY N N -2 110.666 108.086 2.580 1
1 56 . 22 1 1 A 7 7 SER H H 141 7.913 7.879 0.034 1
1 57 . 22 1 1 A 7 7 SER HA H 141 5.657 5.288 0.369 1
1 60 . 22 1 1 A 7 7 SER C C 141 173.753 172.514 1.239 1
1 61 . 22 1 1 A 7 7 SER CA C 141 56.758 57.820 -1.062 1
1 62 . 22 1 1 A 7 7 SER CB C 141 66.774 65.667 1.107 1
1 63 . 22 1 1 A 7 7 SER N N 141 113.824 112.278 1.546 1
1 64 . 22 1 1 A 8 8 LYS H H 142 8.656 8.532 0.124 1
1 65 . 22 1 1 A 8 8 LYS HA H 142 4.543 5.211 -0.668 1
1 74 . 22 1 1 A 8 8 LYS C C 142 174.403 174.324 0.079 1
1 75 . 22 1 1 A 8 8 LYS CA C 142 55.578 54.725 0.853 1
1 76 . 22 1 1 A 8 8 LYS CB C 142 36.561 36.089 0.472 1
1 80 . 22 1 1 A 8 8 LYS N N 142 123.076 119.441 3.635 1
1 81 . 22 1 1 A 9 9 LYS H H 143 8.623 8.368 0.255 1
1 82 . 22 1 1 A 9 9 LYS HA H 143 4.119 4.398 -0.279 1
1 91 . 22 1 1 A 9 9 LYS C C 143 176.144 175.584 0.560 1
1 92 . 22 1 1 A 9 9 LYS CA C 143 56.683 56.075 0.608 1
1 93 . 22 1 1 A 9 9 LYS CB C 143 32.580 32.691 -0.111 1
1 97 . 22 1 1 A 9 9 LYS N N 143 129.542 122.835 6.707 1
1 98 . 22 1 1 A 10 10 ALA H H 144 8.151 8.728 -0.577 1
1 99 . 22 1 1 A 10 10 ALA HA H 144 5.208 4.954 0.254 1
1 103 . 22 1 1 A 10 10 ALA C C 144 175.577 175.001 0.576 1
1 104 . 22 1 1 A 10 10 ALA CA C 144 51.226 51.228 -0.002 1
1 105 . 22 1 1 A 10 10 ALA CB C 144 25.299 24.179 1.120 1
1 106 . 22 1 1 A 10 10 ALA N N 144 127.933 127.653 0.280 1
1 107 . 22 1 1 A 11 11 SER H H 145 8.679 8.796 -0.117 1
1 108 . 22 1 1 A 11 11 SER HA H 145 5.431 5.669 -0.238 1
1 111 . 22 1 1 A 11 11 SER C C 145 173.072 173.248 -0.176 1
1 112 . 22 1 1 A 11 11 SER CA C 145 57.772 57.284 0.488 1
1 113 . 22 1 1 A 11 11 SER CB C 145 67.301 66.350 0.951 1
1 114 . 22 1 1 A 11 11 SER N N 145 116.245 115.465 0.780 1
1 115 . 22 1 1 A 12 12 HIS H H 146 9.962 9.438 0.524 1
1 116 . 22 1 1 A 12 12 HIS HA H 146 6.332 6.032 0.300 1
1 121 . 22 1 1 A 12 12 HIS C C 146 173.006 172.386 0.620 1
1 122 . 22 1 1 A 12 12 HIS CA C 146 55.020 54.332 0.688 1
1 123 . 22 1 1 A 12 12 HIS CB C 146 37.071 33.225 3.846 1
1 126 . 22 1 1 A 12 12 HIS N N 146 119.181 118.290 0.891 1
1 127 . 22 1 1 A 13 13 ILE H H 147 8.976 8.988 -0.012 1
1 128 . 22 1 1 A 13 13 ILE HA H 147 3.528 4.512 -0.984 1
1 138 . 22 1 1 A 13 13 ILE C C 147 173.010 174.094 -1.084 1
1 139 . 22 1 1 A 13 13 ILE CA C 147 61.273 59.720 1.553 1
1 140 . 22 1 1 A 13 13 ILE CB C 147 41.773 41.733 0.040 1
1 144 . 22 1 1 A 13 13 ILE N N 147 121.873 119.478 2.395 1
1 145 . 22 1 1 A 14 14 LEU H H 148 7.627 8.958 -1.331 1
1 146 . 22 1 1 A 14 14 LEU HA H 148 4.814 5.219 -0.405 1
1 156 . 22 1 1 A 14 14 LEU C C 148 174.112 174.462 -0.350 1
1 157 . 22 1 1 A 14 14 LEU CA C 148 52.574 52.993 -0.419 1
1 158 . 22 1 1 A 14 14 LEU CB C 148 45.643 45.325 0.318 1
1 162 . 22 1 1 A 14 14 LEU N N 148 127.112 129.683 -2.571 1
1 163 . 22 1 1 A 15 15 ILE H H 149 9.524 9.316 0.208 1
1 164 . 22 1 1 A 15 15 ILE HA H 149 4.362 4.720 -0.358 1
1 174 . 22 1 1 A 15 15 ILE C C 149 175.452 175.414 0.038 1
1 175 . 22 1 1 A 15 15 ILE CA C 149 58.516 60.452 -1.936 1
1 176 . 22 1 1 A 15 15 ILE CB C 149 36.560 40.170 -3.610 1
1 180 . 22 1 1 A 15 15 ILE N N 149 128.652 126.661 1.991 1
1 181 . 22 1 1 A 16 16 LYS H H 150 8.035 8.437 -0.402 1
1 182 . 22 1 1 A 16 16 LYS HA H 150 4.319 4.519 -0.200 1
1 191 . 22 1 1 A 16 16 LYS C C 150 175.038 176.295 -1.257 1
1 192 . 22 1 1 A 16 16 LYS CA C 150 57.817 56.419 1.398 1
1 193 . 22 1 1 A 16 16 LYS CB C 150 34.853 33.076 1.777 1
1 197 . 22 1 1 A 16 16 LYS N N 150 129.153 127.879 1.274 1
1 198 . 22 1 1 A 17 17 VAL H H 151 8.016 8.860 -0.844 1
1 199 . 22 1 1 A 17 17 VAL HA H 151 4.873 4.616 0.257 1
1 207 . 22 1 1 A 17 17 VAL C C 151 176.647 175.373 1.274 1
1 208 . 22 1 1 A 17 17 VAL CA C 151 60.088 61.304 -1.216 1
1 209 . 22 1 1 A 17 17 VAL CB C 151 34.082 33.480 0.602 1
1 212 . 22 1 1 A 17 17 VAL N N 151 121.288 123.922 -2.634 1
1 213 . 22 1 1 A 18 18 LYS H H 152 8.443 9.028 -0.585 1
1 214 . 22 1 1 A 18 18 LYS HA H 152 4.334 4.340 -0.006 1
1 223 . 22 1 1 A 18 18 LYS C C 152 176.345 177.200 -0.855 1
1 224 . 22 1 1 A 18 18 LYS CA C 152 57.016 56.432 0.584 1
1 225 . 22 1 1 A 18 18 LYS CB C 152 33.222 32.359 0.863 1
1 229 . 22 1 1 A 18 18 LYS N N 152 128.408 127.208 1.200 1
1 230 . 22 1 1 A 19 19 SER H H 153 9.067 8.695 0.372 1
1 231 . 22 1 1 A 19 19 SER HA H 153 4.457 4.488 -0.031 1
1 234 . 22 1 1 A 19 19 SER C C 153 174.236 174.595 -0.359 1
1 235 . 22 1 1 A 19 19 SER CA C 153 59.642 60.063 -0.421 1
1 236 . 22 1 1 A 19 19 SER CB C 153 64.347 64.206 0.141 1
1 237 . 22 1 1 A 19 19 SER N N 153 121.522 118.435 3.087 1
1 238 . 22 1 1 A 20 20 LYS H H 154 7.961 7.733 0.228 1
1 239 . 22 1 1 A 20 20 LYS HA H 154 4.558 4.624 -0.066 1
1 244 . 22 1 1 A 20 20 LYS C C 154 177.256 176.374 0.882 1
1 245 . 22 1 1 A 20 20 LYS CA C 154 55.249 54.788 0.461 1
1 246 . 22 1 1 A 20 20 LYS CB C 154 34.531 35.243 -0.712 1
1 248 . 22 1 1 A 20 20 LYS N N 154 120.270 118.629 1.641 1
1 249 . 22 1 1 A 21 21 LYS HA H 155 4.003 3.901 0.102 1
1 258 . 22 1 1 A 21 21 LYS C C 155 177.015 178.000 -0.985 1
1 259 . 22 1 1 A 21 21 LYS CA C 155 59.091 59.584 -0.493 1
1 260 . 22 1 1 A 21 21 LYS CB C 155 32.394 32.264 0.130 1
1 264 . 22 1 1 A 22 22 SER H H 156 7.625 7.710 -0.085 1
1 265 . 22 1 1 A 22 22 SER HA H 156 4.293 4.502 -0.209 1
1 268 . 22 1 1 A 22 22 SER C C 156 174.843 174.067 0.776 1
1 269 . 22 1 1 A 22 22 SER CA C 156 57.966 58.627 -0.661 1
1 270 . 22 1 1 A 22 22 SER CB C 156 63.369 63.537 -0.168 1
1 271 . 22 1 1 A 22 22 SER N N 156 109.549 112.461 -2.912 1
1 272 . 22 1 1 A 23 23 ASP H H 157 7.701 7.485 0.216 1
1 273 . 22 1 1 A 23 23 ASP HA H 157 4.548 4.428 0.120 1
1 276 . 22 1 1 A 23 23 ASP C C 157 176.544 176.853 -0.309 1
1 277 . 22 1 1 A 23 23 ASP CA C 157 55.242 54.641 0.601 1
1 278 . 22 1 1 A 23 23 ASP CB C 157 41.103 43.113 -2.010 1
1 279 . 22 1 1 A 23 23 ASP N N 157 124.536 123.080 1.456 1
1 280 . 22 1 1 A 24 24 LYS H H 158 8.583 8.594 -0.011 1
1 281 . 22 1 1 A 24 24 LYS HA H 158 4.252 4.144 0.108 1
1 290 . 22 1 1 A 24 24 LYS C C 158 176.813 175.547 1.266 1
1 291 . 22 1 1 A 24 24 LYS CA C 158 57.148 57.938 -0.790 1
1 292 . 22 1 1 A 24 24 LYS CB C 158 33.200 33.221 -0.021 1
1 296 . 22 1 1 A 24 24 LYS N N 158 122.372 124.767 -2.395 1
1 297 . 22 1 1 A 25 25 GLU H H 159 8.001 7.805 0.196 1
1 298 . 22 1 1 A 25 25 GLU HA H 159 4.521 4.866 -0.345 1
1 303 . 22 1 1 A 25 25 GLU C C 159 175.995 175.590 0.405 1
1 304 . 22 1 1 A 25 25 GLU CA C 159 55.727 55.321 0.406 1
1 305 . 22 1 1 A 25 25 GLU CB C 159 31.918 32.753 -0.835 1
1 307 . 22 1 1 A 25 25 GLU N N 159 118.705 118.410 0.295 1
1 308 . 22 1 1 A 26 26 GLY H H 160 8.458 8.245 0.213 1
1 309 . 22 1 1 A 26 26 GLY HA2 H 160 3.946 4.100 -0.154 1
1 310 . 22 1 1 A 26 26 GLY HA3 H 160 3.511 4.110 -0.599 1
1 311 . 22 1 1 A 26 26 GLY C C 160 172.201 172.781 -0.580 1
1 312 . 22 1 1 A 26 26 GLY CA C 160 44.038 44.224 -0.186 1
1 313 . 22 1 1 A 26 26 GLY N N 160 107.642 113.566 -5.924 1
1 314 . 22 1 1 A 27 27 LEU H H 161 8.259 8.245 0.014 1
1 315 . 22 1 1 A 27 27 LEU HA H 161 4.775 5.086 -0.311 1
1 325 . 22 1 1 A 27 27 LEU C C 161 177.422 175.371 2.051 1
1 326 . 22 1 1 A 27 27 LEU CA C 161 53.322 52.975 0.347 1
1 327 . 22 1 1 A 27 27 LEU CB C 161 45.576 44.015 1.561 1
1 331 . 22 1 1 A 27 27 LEU N N 161 119.856 120.572 -0.716 1
1 332 . 22 1 1 A 28 28 ASP H H 162 8.848 8.433 0.415 1
1 333 . 22 1 1 A 28 28 ASP HA H 162 4.644 4.480 0.164 1
1 336 . 22 1 1 A 28 28 ASP C C 162 176.630 177.217 -0.587 1
1 337 . 22 1 1 A 28 28 ASP CA C 162 55.195 54.783 0.412 1
1 338 . 22 1 1 A 28 28 ASP CB C 162 41.673 43.010 -1.337 1
1 339 . 22 1 1 A 28 28 ASP N N 162 122.434 122.408 0.026 1
1 340 . 22 1 1 A 29 29 ASP H H 163 8.720 9.164 -0.444 1
1 341 . 22 1 1 A 29 29 ASP HA H 163 4.386 4.341 0.045 1
1 344 . 22 1 1 A 29 29 ASP C C 163 176.604 177.993 -1.389 1
1 345 . 22 1 1 A 29 29 ASP CA C 163 59.690 58.401 1.289 1
1 346 . 22 1 1 A 29 29 ASP CB C 163 42.964 41.276 1.688 1
1 347 . 22 1 1 A 29 29 ASP N N 163 121.460 126.709 -5.249 1
1 348 . 22 1 1 A 30 30 LYS H H 164 8.434 7.612 0.822 1
1 349 . 22 1 1 A 30 30 LYS HA H 164 3.901 3.986 -0.085 1
1 358 . 22 1 1 A 30 30 LYS C C 164 179.479 179.205 0.274 1
1 359 . 22 1 1 A 30 30 LYS CA C 164 60.047 59.473 0.574 1
1 360 . 22 1 1 A 30 30 LYS CB C 164 32.038 32.261 -0.223 1
1 364 . 22 1 1 A 30 30 LYS N N 164 116.627 119.504 -2.877 1
1 365 . 22 1 1 A 31 31 GLU H H 165 7.755 8.341 -0.586 1
1 366 . 22 1 1 A 31 31 GLU HA H 165 3.998 3.998 0.000 1
1 371 . 22 1 1 A 31 31 GLU C C 165 179.031 179.301 -0.270 1
1 372 . 22 1 1 A 31 31 GLU CA C 165 59.335 59.296 0.039 1
1 373 . 22 1 1 A 31 31 GLU CB C 165 29.972 29.371 0.601 1
1 375 . 22 1 1 A 31 31 GLU N N 165 120.456 119.807 0.649 1
1 376 . 22 1 1 A 32 32 ALA H H 166 9.060 8.616 0.444 1
1 377 . 22 1 1 A 32 32 ALA HA H 166 3.871 4.046 -0.175 1
1 381 . 22 1 1 A 32 32 ALA C C 166 178.029 179.119 -1.090 1
1 382 . 22 1 1 A 32 32 ALA CA C 166 54.997 55.325 -0.328 1
1 383 . 22 1 1 A 32 32 ALA CB C 166 19.727 18.486 1.241 1
1 384 . 22 1 1 A 32 32 ALA N N 166 124.406 122.383 2.023 1
1 385 . 22 1 1 A 33 33 LYS H H 167 8.228 7.717 0.511 1
1 386 . 22 1 1 A 33 33 LYS HA H 167 2.595 2.908 -0.313 1
1 395 . 22 1 1 A 33 33 LYS C C 167 177.938 178.118 -0.180 1
1 396 . 22 1 1 A 33 33 LYS CA C 167 59.573 59.322 0.251 1
1 397 . 22 1 1 A 33 33 LYS CB C 167 32.098 32.212 -0.114 1
1 401 . 22 1 1 A 33 33 LYS N N 167 119.833 118.148 1.685 1
1 402 . 22 1 1 A 34 34 GLN H H 168 7.392 7.802 -0.410 1
1 403 . 22 1 1 A 34 34 GLN HA H 168 3.943 3.890 0.053 1
1 410 . 22 1 1 A 34 34 GLN C C 168 178.323 178.490 -0.167 1
1 411 . 22 1 1 A 34 34 GLN CA C 168 58.883 59.436 -0.553 1
1 412 . 22 1 1 A 34 34 GLN CB C 168 28.485 28.101 0.384 1
1 414 . 22 1 1 A 34 34 GLN N N 168 117.208 118.218 -1.010 1
1 416 . 22 1 1 A 35 35 LYS H H 169 7.994 8.047 -0.053 1
1 417 . 22 1 1 A 35 35 LYS HA H 169 4.067 3.997 0.070 1
1 426 . 22 1 1 A 35 35 LYS C C 169 178.161 178.466 -0.305 1
1 427 . 22 1 1 A 35 35 LYS CA C 169 58.437 59.334 -0.897 1
1 428 . 22 1 1 A 35 35 LYS CB C 169 31.611 32.227 -0.616 1
1 432 . 22 1 1 A 35 35 LYS N N 169 120.898 119.879 1.019 1
1 433 . 22 1 1 A 36 36 ALA H H 170 8.431 8.231 0.200 1
1 434 . 22 1 1 A 36 36 ALA HA H 170 3.738 4.056 -0.318 1
1 438 . 22 1 1 A 36 36 ALA C C 170 178.862 179.747 -0.885 1
1 439 . 22 1 1 A 36 36 ALA CA C 170 55.351 54.929 0.422 1
1 440 . 22 1 1 A 36 36 ALA CB C 170 18.295 18.481 -0.186 1
1 441 . 22 1 1 A 36 36 ALA N N 170 120.641 119.843 0.798 1
1 442 . 22 1 1 A 37 37 GLU H H 171 8.412 8.185 0.227 1
1 443 . 22 1 1 A 37 37 GLU HA H 171 3.867 3.939 -0.072 1
1 448 . 22 1 1 A 37 37 GLU C C 171 179.255 178.451 0.804 1
1 449 . 22 1 1 A 37 37 GLU CA C 171 59.543 59.581 -0.038 1
1 450 . 22 1 1 A 37 37 GLU CB C 171 29.569 29.481 0.088 1
1 452 . 22 1 1 A 37 37 GLU N N 171 118.224 117.735 0.489 1
1 453 . 22 1 1 A 38 38 GLU H H 172 8.019 8.277 -0.258 1
1 454 . 22 1 1 A 38 38 GLU HA H 172 3.952 4.058 -0.106 1
1 459 . 22 1 1 A 38 38 GLU C C 172 180.250 178.488 1.762 1
1 460 . 22 1 1 A 38 38 GLU CA C 172 59.627 59.215 0.412 1
1 461 . 22 1 1 A 38 38 GLU CB C 172 29.368 29.112 0.256 1
1 463 . 22 1 1 A 38 38 GLU N N 172 121.250 118.502 2.748 1
1 464 . 22 1 1 A 39 39 ILE H H 173 8.174 7.667 0.507 1
1 465 . 22 1 1 A 39 39 ILE HA H 173 3.643 3.789 -0.146 1
1 475 . 22 1 1 A 39 39 ILE C C 173 177.568 177.864 -0.296 1
1 476 . 22 1 1 A 39 39 ILE CA C 173 64.869 63.705 1.164 1
1 477 . 22 1 1 A 39 39 ILE CB C 173 38.160 37.335 0.825 1
1 481 . 22 1 1 A 39 39 ILE N N 173 121.527 117.026 4.501 1
1 482 . 22 1 1 A 40 40 GLN H H 174 8.860 8.297 0.563 1
1 483 . 22 1 1 A 40 40 GLN HA H 174 3.533 4.000 -0.467 1
1 490 . 22 1 1 A 40 40 GLN C C 174 179.022 178.574 0.448 1
1 491 . 22 1 1 A 40 40 GLN CA C 174 61.316 59.219 2.097 1
1 492 . 22 1 1 A 40 40 GLN CB C 174 26.604 28.419 -1.815 1
1 494 . 22 1 1 A 40 40 GLN N N 174 121.956 121.052 0.904 1
1 496 . 22 1 1 A 41 41 LYS H H 175 7.879 7.812 0.067 1
1 497 . 22 1 1 A 41 41 LYS HA H 175 3.777 4.193 -0.416 1
1 506 . 22 1 1 A 41 41 LYS C C 175 178.779 179.326 -0.547 1
1 507 . 22 1 1 A 41 41 LYS CA C 175 59.701 59.128 0.573 1
1 508 . 22 1 1 A 41 41 LYS CB C 175 32.581 31.972 0.609 1
1 512 . 22 1 1 A 41 41 LYS N N 175 119.012 118.479 0.533 1
1 513 . 22 1 1 A 42 42 GLU H H 176 7.447 7.867 -0.420 1
1 514 . 22 1 1 A 42 42 GLU HA H 176 4.059 4.130 -0.071 1
1 519 . 22 1 1 A 42 42 GLU C C 176 180.058 178.577 1.481 1
1 520 . 22 1 1 A 42 42 GLU CA C 176 59.456 59.153 0.303 1
1 521 . 22 1 1 A 42 42 GLU CB C 176 29.923 29.544 0.379 1
1 523 . 22 1 1 A 42 42 GLU N N 176 120.054 119.797 0.257 1
1 524 . 22 1 1 A 43 43 VAL H H 177 8.618 7.939 0.679 1
1 525 . 22 1 1 A 43 43 VAL HA H 177 3.986 3.901 0.085 1
1 533 . 22 1 1 A 43 43 VAL C C 177 176.459 177.595 -1.136 1
1 534 . 22 1 1 A 43 43 VAL CA C 177 63.923 64.615 -0.692 1
1 535 . 22 1 1 A 43 43 VAL CB C 177 31.899 31.576 0.323 1
1 538 . 22 1 1 A 43 43 VAL N N 177 114.191 117.073 -2.882 1
1 539 . 22 1 1 A 44 44 SER H H 178 8.052 8.488 -0.436 1
1 540 . 22 1 1 A 44 44 SER HA H 178 4.098 4.285 -0.187 1
1 543 . 22 1 1 A 44 44 SER C C 178 176.548 176.012 0.536 1
1 544 . 22 1 1 A 44 44 SER CA C 178 61.160 60.980 0.180 1
1 545 . 22 1 1 A 44 44 SER CB C 178 62.959 62.649 0.310 1
1 546 . 22 1 1 A 44 44 SER N N 178 114.202 115.651 -1.449 1
1 547 . 22 1 1 A 45 45 LYS H H 179 7.083 8.178 -1.095 1
1 548 . 22 1 1 A 45 45 LYS HA H 179 4.140 4.182 -0.042 1
1 557 . 22 1 1 A 45 45 LYS C C 179 177.288 176.192 1.096 1
1 558 . 22 1 1 A 45 45 LYS CA C 179 58.469 57.975 0.494 1
1 559 . 22 1 1 A 45 45 LYS CB C 179 32.671 31.510 1.161 1
1 563 . 22 1 1 A 45 45 LYS N N 179 120.935 118.572 2.363 1
1 564 . 22 1 1 A 46 46 ASP H H 180 7.098 7.535 -0.437 1
1 565 . 22 1 1 A 46 46 ASP HA H 180 4.917 4.987 -0.070 1
1 568 . 22 1 1 A 46 46 ASP CA C 180 51.492 51.740 -0.248 1
1 569 . 22 1 1 A 46 46 ASP CB C 180 40.595 41.173 -0.578 1
1 570 . 22 1 1 A 46 46 ASP N N 180 112.836 120.331 -7.495 1
1 571 . 22 1 1 A 47 47 PRO HA H 181 4.681 4.518 0.163 1
1 578 . 22 1 1 A 47 47 PRO C C 181 179.248 177.636 1.612 1
1 579 . 22 1 1 A 47 47 PRO CA C 181 64.718 64.265 0.453 1
1 580 . 22 1 1 A 47 47 PRO CB C 181 32.159 31.973 0.186 1
1 583 . 22 1 1 A 48 48 SER H H 182 8.248 8.327 -0.079 1
1 584 . 22 1 1 A 48 48 SER HA H 182 4.378 4.280 0.098 1
1 587 . 22 1 1 A 48 48 SER C C 182 176.071 175.470 0.601 1
1 588 . 22 1 1 A 48 48 SER CA C 182 61.377 60.853 0.524 1
1 589 . 22 1 1 A 48 48 SER CB C 182 62.455 63.167 -0.712 1
1 590 . 22 1 1 A 48 48 SER N N 182 116.986 113.773 3.213 1
1 591 . 22 1 1 A 49 49 LYS H H 183 7.842 7.481 0.361 1
1 592 . 22 1 1 A 49 49 LYS HA H 183 4.482 4.304 0.178 1
1 601 . 22 1 1 A 49 49 LYS C C 183 175.605 177.430 -1.825 1
1 602 . 22 1 1 A 49 49 LYS CA C 183 55.824 56.797 -0.973 1
1 603 . 22 1 1 A 49 49 LYS CB C 183 32.834 32.673 0.161 1
1 607 . 22 1 1 A 49 49 LYS N N 183 121.698 119.470 2.228 1
1 608 . 22 1 1 A 50 50 PHE H H 184 7.634 8.006 -0.372 1
1 609 . 22 1 1 A 50 50 PHE HA H 184 3.510 4.207 -0.697 1
1 617 . 22 1 1 A 50 50 PHE C C 184 176.214 177.501 -1.287 1
1 618 . 22 1 1 A 50 50 PHE CA C 184 63.276 61.082 2.194 1
1 619 . 22 1 1 A 50 50 PHE CB C 184 40.948 39.160 1.788 1
1 623 . 22 1 1 A 50 50 PHE N N 184 120.120 121.601 -1.481 1
1 624 . 22 1 1 A 51 51 GLY H H 185 8.855 8.554 0.301 1
1 625 . 22 1 1 A 51 51 GLY HA2 H 185 3.993 3.870 0.123 1
1 626 . 22 1 1 A 51 51 GLY HA3 H 185 3.958 3.891 0.067 1
1 627 . 22 1 1 A 51 51 GLY C C 185 175.169 176.235 -1.066 1
1 628 . 22 1 1 A 51 51 GLY CA C 185 47.475 47.531 -0.056 1
1 629 . 22 1 1 A 51 51 GLY N N 185 105.550 106.106 -0.556 1
1 630 . 22 1 1 A 52 52 GLU H H 186 7.917 7.942 -0.025 1
1 631 . 22 1 1 A 52 52 GLU HA H 186 4.006 4.027 -0.021 1
1 636 . 22 1 1 A 52 52 GLU C C 186 179.499 179.586 -0.087 1
1 637 . 22 1 1 A 52 52 GLU CA C 186 58.904 59.214 -0.310 1
1 638 . 22 1 1 A 52 52 GLU CB C 186 29.700 29.841 -0.141 1
1 640 . 22 1 1 A 52 52 GLU N N 186 121.929 121.768 0.161 1
1 641 . 22 1 1 A 53 53 ILE H H 187 7.936 7.987 -0.051 1
1 642 . 22 1 1 A 53 53 ILE HA H 187 3.648 3.757 -0.109 1
1 652 . 22 1 1 A 53 53 ILE C C 187 177.886 177.901 -0.015 1
1 653 . 22 1 1 A 53 53 ILE CA C 187 64.366 64.385 -0.019 1
1 654 . 22 1 1 A 53 53 ILE CB C 187 36.478 37.198 -0.720 1
1 658 . 22 1 1 A 53 53 ILE N N 187 120.991 120.887 0.104 1
1 659 . 22 1 1 A 54 54 ALA H H 188 8.895 8.555 0.340 1
1 660 . 22 1 1 A 54 54 ALA HA H 188 3.629 3.728 -0.099 1
1 664 . 22 1 1 A 54 54 ALA C C 188 179.437 179.755 -0.318 1
1 665 . 22 1 1 A 54 54 ALA CA C 188 55.974 55.558 0.416 1
1 666 . 22 1 1 A 54 54 ALA CB C 188 17.591 18.270 -0.679 1
1 667 . 22 1 1 A 54 54 ALA N N 188 125.308 121.899 3.409 1
1 668 . 22 1 1 A 55 55 LYS H H 189 8.049 7.642 0.407 1
1 669 . 22 1 1 A 55 55 LYS HA H 189 4.106 4.070 0.036 1
1 678 . 22 1 1 A 55 55 LYS C C 189 178.995 177.520 1.475 1
1 679 . 22 1 1 A 55 55 LYS CA C 189 59.312 58.458 0.854 1
1 680 . 22 1 1 A 55 55 LYS CB C 189 32.647 32.276 0.371 1
1 684 . 22 1 1 A 55 55 LYS N N 189 116.835 118.252 -1.417 1
1 685 . 22 1 1 A 56 56 LYS H H 190 7.215 7.794 -0.579 1
1 686 . 22 1 1 A 56 56 LYS HA H 190 4.172 4.379 -0.207 1
1 695 . 22 1 1 A 56 56 LYS C C 190 177.897 177.826 0.071 1
1 696 . 22 1 1 A 56 56 LYS CA C 190 58.418 57.008 1.410 1
1 697 . 22 1 1 A 56 56 LYS CB C 190 34.652 33.965 0.687 1
1 701 . 22 1 1 A 56 56 LYS N N 190 117.170 117.399 -0.229 1
1 702 . 22 1 1 A 57 57 GLU H H 191 8.572 8.200 0.372 1
1 703 . 22 1 1 A 57 57 GLU HA H 191 4.643 4.354 0.289 1
1 708 . 22 1 1 A 57 57 GLU C C 191 177.903 176.072 1.831 1
1 709 . 22 1 1 A 57 57 GLU CA C 191 55.708 55.970 -0.262 1
1 710 . 22 1 1 A 57 57 GLU CB C 191 32.460 30.959 1.501 1
1 712 . 22 1 1 A 57 57 GLU N N 191 113.316 117.213 -3.897 1
1 713 . 22 1 1 A 58 58 SER H H 192 8.550 7.611 0.939 1
1 714 . 22 1 1 A 58 58 SER HA H 192 4.149 4.361 -0.212 1
1 717 . 22 1 1 A 58 58 SER C C 192 176.161 175.261 0.900 1
1 718 . 22 1 1 A 58 58 SER CA C 192 58.403 57.991 0.412 1
1 719 . 22 1 1 A 58 58 SER CB C 192 64.392 64.278 0.114 1
1 720 . 22 1 1 A 58 58 SER N N 192 109.861 115.944 -6.083 1
1 721 . 22 1 1 A 59 59 MET H H 193 9.533 8.789 0.744 1
1 722 . 22 1 1 A 59 59 MET HA H 193 4.457 4.536 -0.079 1
1 730 . 22 1 1 A 59 59 MET C C 193 175.204 175.497 -0.293 1
1 731 . 22 1 1 A 59 59 MET CA C 193 55.781 55.916 -0.135 1
1 732 . 22 1 1 A 59 59 MET CB C 193 32.855 32.948 -0.093 1
1 735 . 22 1 1 A 59 59 MET N N 193 124.493 123.578 0.915 1
1 736 . 22 1 1 A 60 60 ASP H H 194 7.514 7.319 0.195 1
1 737 . 22 1 1 A 60 60 ASP HA H 194 4.886 4.597 0.289 1
1 740 . 22 1 1 A 60 60 ASP C C 194 175.517 176.664 -1.147 1
1 741 . 22 1 1 A 60 60 ASP CA C 194 52.286 53.149 -0.863 1
1 742 . 22 1 1 A 60 60 ASP CB C 194 40.222 40.812 -0.590 1
1 743 . 22 1 1 A 60 60 ASP N N 194 117.785 121.379 -3.594 1
1 744 . 22 1 1 A 61 61 THR H H 195 8.118 8.426 -0.308 1
1 745 . 22 1 1 A 61 61 THR HA H 195 3.918 3.939 -0.021 1
1 750 . 22 1 1 A 61 61 THR C C 195 176.269 177.054 -0.785 1
1 751 . 22 1 1 A 61 61 THR CA C 195 65.469 65.231 0.238 1
1 752 . 22 1 1 A 61 61 THR CB C 195 68.741 68.382 0.359 1
1 754 . 22 1 1 A 61 61 THR N N 195 120.765 118.513 2.252 1
1 755 . 22 1 1 A 62 62 GLY H H 196 8.399 8.500 -0.101 1
1 756 . 22 1 1 A 62 62 GLY HA2 H 196 3.932 3.863 0.069 1
1 757 . 22 1 1 A 62 62 GLY HA3 H 196 3.900 3.864 0.036 1
1 758 . 22 1 1 A 62 62 GLY C C 196 174.948 176.643 -1.695 1
1 759 . 22 1 1 A 62 62 GLY CA C 196 46.768 47.210 -0.442 1
1 760 . 22 1 1 A 62 62 GLY N N 196 108.183 111.395 -3.212 1
1 761 . 22 1 1 A 63 63 SER H H 197 7.265 8.149 -0.884 1
1 762 . 22 1 1 A 63 63 SER HA H 197 4.554 4.447 0.107 1
1 765 . 22 1 1 A 63 63 SER C C 197 177.630 175.885 1.745 1
1 766 . 22 1 1 A 63 63 SER CA C 197 59.550 62.181 -2.631 1
1 767 . 22 1 1 A 63 63 SER CB C 197 65.504 63.591 1.913 1
1 768 . 22 1 1 A 63 63 SER N N 197 111.815 118.915 -7.100 1
1 769 . 22 1 1 A 64 64 ALA H H 198 8.675 8.391 0.284 1
1 770 . 22 1 1 A 64 64 ALA HA H 198 3.801 3.954 -0.153 1
1 774 . 22 1 1 A 64 64 ALA C C 198 178.492 179.652 -1.160 1
1 775 . 22 1 1 A 64 64 ALA CA C 198 56.794 55.357 1.437 1
1 776 . 22 1 1 A 64 64 ALA CB C 198 18.951 18.438 0.513 1
1 777 . 22 1 1 A 64 64 ALA N N 198 131.710 123.494 8.216 1
1 778 . 22 1 1 A 65 65 LYS H H 199 7.666 7.904 -0.238 1
1 779 . 22 1 1 A 65 65 LYS HA H 199 4.175 4.115 0.060 1
1 788 . 22 1 1 A 65 65 LYS C C 199 177.159 177.411 -0.252 1
1 789 . 22 1 1 A 65 65 LYS CA C 199 57.735 58.821 -1.086 1
1 790 . 22 1 1 A 65 65 LYS CB C 199 31.948 31.491 0.457 1
1 794 . 22 1 1 A 65 65 LYS N N 199 111.375 115.624 -4.249 1
1 795 . 22 1 1 A 66 66 LYS H H 200 7.545 7.494 0.051 1
1 796 . 22 1 1 A 66 66 LYS HA H 200 4.612 4.413 0.199 1
1 805 . 22 1 1 A 66 66 LYS C C 200 175.609 175.230 0.379 1
1 806 . 22 1 1 A 66 66 LYS CA C 200 54.468 55.967 -1.499 1
1 807 . 22 1 1 A 66 66 LYS CB C 200 31.525 32.416 -0.891 1
1 811 . 22 1 1 A 66 66 LYS N N 200 121.421 117.875 3.546 1
1 812 . 22 1 1 A 67 67 ASP H H 201 7.630 8.243 -0.613 1
1 813 . 22 1 1 A 67 67 ASP HA H 201 4.306 4.364 -0.058 1
1 816 . 22 1 1 A 67 67 ASP C C 201 175.025 176.313 -1.288 1
1 817 . 22 1 1 A 67 67 ASP CA C 201 56.400 55.379 1.021 1
1 818 . 22 1 1 A 67 67 ASP CB C 201 38.315 39.059 -0.744 1
1 819 . 22 1 1 A 67 67 ASP N N 201 116.216 116.974 -0.758 1
1 820 . 22 1 1 A 68 68 GLY H H 202 8.368 8.487 -0.119 1
1 821 . 22 1 1 A 68 68 GLY HA2 H 202 4.316 3.912 0.404 1
1 822 . 22 1 1 A 68 68 GLY HA3 H 202 3.731 3.975 -0.244 1
1 823 . 22 1 1 A 68 68 GLY C C 202 174.139 174.760 -0.621 1
1 824 . 22 1 1 A 68 68 GLY CA C 202 45.514 45.289 0.225 1
1 825 . 22 1 1 A 68 68 GLY N N 202 105.095 104.858 0.237 1
1 826 . 22 1 1 A 69 69 GLU H H 203 7.534 8.046 -0.512 1
1 827 . 22 1 1 A 69 69 GLU HA H 203 4.479 4.434 0.045 1
1 832 . 22 1 1 A 69 69 GLU C C 203 176.961 176.061 0.900 1
1 833 . 22 1 1 A 69 69 GLU CA C 203 58.549 56.532 2.017 1
1 834 . 22 1 1 A 69 69 GLU CB C 203 30.998 30.479 0.519 1
1 836 . 22 1 1 A 69 69 GLU N N 203 120.426 120.008 0.418 1
1 837 . 22 1 1 A 70 70 LEU H H 204 8.962 9.068 -0.106 1
1 838 . 22 1 1 A 70 70 LEU HA H 204 4.438 4.649 -0.211 1
1 848 . 22 1 1 A 70 70 LEU C C 204 178.648 177.310 1.338 1
1 849 . 22 1 1 A 70 70 LEU CA C 204 53.977 54.777 -0.800 1
1 850 . 22 1 1 A 70 70 LEU CB C 204 43.612 43.624 -0.012 1
1 854 . 22 1 1 A 70 70 LEU N N 204 122.066 123.549 -1.483 1
1 855 . 22 1 1 A 71 71 GLY H H 205 8.104 7.614 0.490 1
1 856 . 22 1 1 A 71 71 GLY HA2 H 205 4.165 4.018 0.147 1
1 857 . 22 1 1 A 71 71 GLY HA3 H 205 3.552 4.119 -0.567 1
1 858 . 22 1 1 A 71 71 GLY C C 205 173.098 173.475 -0.377 1
1 859 . 22 1 1 A 71 71 GLY CA C 205 44.723 45.116 -0.393 1
1 860 . 22 1 1 A 71 71 GLY N N 205 110.168 106.829 3.339 1
1 861 . 22 1 1 A 72 72 TYR H H 206 8.457 8.657 -0.200 1
1 862 . 22 1 1 A 72 72 TYR HA H 206 4.184 4.684 -0.500 1
1 869 . 22 1 1 A 72 72 TYR C C 206 175.975 175.445 0.530 1
1 870 . 22 1 1 A 72 72 TYR CA C 206 59.722 58.817 0.905 1
1 871 . 22 1 1 A 72 72 TYR CB C 206 38.378 38.215 0.163 1
1 874 . 22 1 1 A 72 72 TYR N N 206 120.171 122.091 -1.920 1
1 875 . 22 1 1 A 73 73 VAL H H 207 8.782 9.031 -0.249 1
1 876 . 22 1 1 A 73 73 VAL HA H 207 4.056 4.406 -0.350 1
1 884 . 22 1 1 A 73 73 VAL C C 207 174.901 176.017 -1.116 1
1 885 . 22 1 1 A 73 73 VAL CA C 207 62.202 62.624 -0.422 1
1 886 . 22 1 1 A 73 73 VAL CB C 207 33.071 32.202 0.869 1
1 889 . 22 1 1 A 73 73 VAL N N 207 128.847 125.558 3.289 1
1 890 . 22 1 1 A 74 74 LEU H H 208 8.146 8.791 -0.645 1
1 891 . 22 1 1 A 74 74 LEU HA H 208 4.944 4.382 0.562 1
1 901 . 22 1 1 A 74 74 LEU C C 208 178.400 177.598 0.802 1
1 902 . 22 1 1 A 74 74 LEU CA C 208 53.520 54.950 -1.430 1
1 903 . 22 1 1 A 74 74 LEU CB C 208 43.499 42.379 1.120 1
1 907 . 22 1 1 A 74 74 LEU N N 208 127.599 129.356 -1.757 1
1 908 . 22 1 1 A 75 75 LYS H H 209 8.403 8.515 -0.112 1
1 909 . 22 1 1 A 75 75 LYS HA H 209 3.771 3.977 -0.206 1
1 918 . 22 1 1 A 75 75 LYS C C 209 177.536 177.463 0.073 1
1 919 . 22 1 1 A 75 75 LYS CA C 209 58.385 58.988 -0.603 1
1 920 . 22 1 1 A 75 75 LYS CB C 209 32.459 32.201 0.258 1
1 924 . 22 1 1 A 75 75 LYS N N 209 123.798 123.069 0.729 1
1 925 . 22 1 1 A 76 76 GLY H H 210 9.997 9.378 0.619 1
1 926 . 22 1 1 A 76 76 GLY HA2 H 210 4.255 4.002 0.253 1
1 927 . 22 1 1 A 76 76 GLY HA3 H 210 3.791 4.003 -0.212 1
1 928 . 22 1 1 A 76 76 GLY C C 210 175.091 175.754 -0.663 1
1 929 . 22 1 1 A 76 76 GLY CA C 210 45.465 45.497 -0.032 1
1 930 . 22 1 1 A 76 76 GLY N N 210 114.705 113.509 1.196 1
1 931 . 22 1 1 A 77 77 GLN H H 211 7.726 8.104 -0.378 1
1 932 . 22 1 1 A 77 77 GLN HA H 211 4.373 4.200 0.173 1
1 939 . 22 1 1 A 77 77 GLN C C 211 176.301 176.179 0.122 1
1 940 . 22 1 1 A 77 77 GLN CA C 211 57.074 57.760 -0.686 1
1 941 . 22 1 1 A 77 77 GLN CB C 211 30.798 29.369 1.429 1
1 943 . 22 1 1 A 77 77 GLN N N 211 118.702 117.978 0.724 1
1 945 . 22 1 1 A 78 78 THR H H 212 8.225 7.524 0.701 1
1 946 . 22 1 1 A 78 78 THR HA H 212 4.620 4.657 -0.037 1
1 951 . 22 1 1 A 78 78 THR C C 212 173.920 174.256 -0.336 1
1 952 . 22 1 1 A 78 78 THR CA C 212 60.087 59.472 0.615 1
1 953 . 22 1 1 A 78 78 THR CB C 212 71.412 70.843 0.569 1
1 955 . 22 1 1 A 78 78 THR N N 212 111.935 110.872 1.063 1
1 956 . 22 1 1 A 79 79 ASP H H 213 8.372 8.581 -0.209 1
1 957 . 22 1 1 A 79 79 ASP HA H 213 4.470 4.599 -0.129 1
1 960 . 22 1 1 A 79 79 ASP C C 213 176.759 177.877 -1.118 1
1 961 . 22 1 1 A 79 79 ASP CA C 213 54.927 54.373 0.554 1
1 962 . 22 1 1 A 79 79 ASP CB C 213 43.859 41.692 2.167 1
1 963 . 22 1 1 A 79 79 ASP N N 213 122.093 121.424 0.669 1
1 964 . 22 1 1 A 80 80 LYS H H 214 8.740 8.868 -0.128 1
1 965 . 22 1 1 A 80 80 LYS HA H 214 4.027 4.083 -0.056 1
1 974 . 22 1 1 A 80 80 LYS C C 214 178.493 178.144 0.349 1
1 975 . 22 1 1 A 80 80 LYS CA C 214 59.802 59.167 0.635 1
1 976 . 22 1 1 A 80 80 LYS CB C 214 32.374 32.010 0.364 1
1 980 . 22 1 1 A 80 80 LYS N N 214 124.685 122.349 2.336 1
1 981 . 22 1 1 A 81 81 ASP H H 215 8.556 8.108 0.448 1
1 982 . 22 1 1 A 81 81 ASP HA H 215 4.566 4.386 0.180 1
1 985 . 22 1 1 A 81 81 ASP C C 215 178.889 178.535 0.354 1
1 986 . 22 1 1 A 81 81 ASP CA C 215 58.046 57.196 0.850 1
1 987 . 22 1 1 A 81 81 ASP CB C 215 40.872 40.572 0.300 1
1 988 . 22 1 1 A 81 81 ASP N N 215 121.413 120.046 1.367 1
1 989 . 22 1 1 A 82 82 PHE H H 216 8.205 8.250 -0.045 1
1 990 . 22 1 1 A 82 82 PHE HA H 216 3.686 4.045 -0.359 1
1 998 . 22 1 1 A 82 82 PHE C C 216 175.919 177.319 -1.400 1
1 999 . 22 1 1 A 82 82 PHE CA C 216 61.648 60.816 0.832 1
1 1000 . 22 1 1 A 82 82 PHE CB C 216 39.743 39.194 0.549 1
1 1004 . 22 1 1 A 82 82 PHE N N 216 124.401 122.477 1.924 1
1 1005 . 22 1 1 A 83 83 GLU H H 217 8.887 8.872 0.015 1
1 1006 . 22 1 1 A 83 83 GLU HA H 217 3.704 4.170 -0.466 1
1 1011 . 22 1 1 A 83 83 GLU C C 217 177.788 178.993 -1.205 1
1 1012 . 22 1 1 A 83 83 GLU CA C 217 60.545 60.249 0.296 1
1 1013 . 22 1 1 A 83 83 GLU CB C 217 30.639 29.500 1.139 1
1 1015 . 22 1 1 A 83 83 GLU N N 217 119.421 119.105 0.316 1
1 1016 . 22 1 1 A 84 84 LYS H H 218 8.055 7.981 0.074 1
1 1017 . 22 1 1 A 84 84 LYS HA H 218 3.947 4.135 -0.188 1
1 1026 . 22 1 1 A 84 84 LYS C C 218 178.783 178.675 0.108 1
1 1027 . 22 1 1 A 84 84 LYS CA C 218 59.327 58.860 0.467 1
1 1028 . 22 1 1 A 84 84 LYS CB C 218 32.539 32.185 0.354 1
1 1032 . 22 1 1 A 84 84 LYS N N 218 117.821 119.637 -1.816 1
1 1033 . 22 1 1 A 85 85 ALA H H 219 7.059 7.625 -0.566 1
1 1034 . 22 1 1 A 85 85 ALA HA H 219 4.040 4.036 0.004 1
1 1038 . 22 1 1 A 85 85 ALA C C 219 179.794 180.198 -0.404 1
1 1039 . 22 1 1 A 85 85 ALA CA C 219 54.407 54.840 -0.433 1
1 1040 . 22 1 1 A 85 85 ALA CB C 219 20.130 18.117 2.013 1
1 1041 . 22 1 1 A 85 85 ALA N N 219 118.905 121.481 -2.576 1
1 1042 . 22 1 1 A 86 86 LEU H H 220 8.157 8.246 -0.089 1
1 1043 . 22 1 1 A 86 86 LEU HA H 220 3.692 3.945 -0.253 1
1 1053 . 22 1 1 A 86 86 LEU C C 220 178.330 178.577 -0.247 1
1 1054 . 22 1 1 A 86 86 LEU CA C 220 57.752 58.001 -0.249 1
1 1055 . 22 1 1 A 86 86 LEU CB C 220 41.464 41.884 -0.420 1
1 1059 . 22 1 1 A 86 86 LEU N N 220 118.606 120.362 -1.756 1
1 1060 . 22 1 1 A 87 87 PHE H H 221 8.349 8.177 0.172 1
1 1061 . 22 1 1 A 87 87 PHE HA H 221 3.861 4.471 -0.610 1
1 1069 . 22 1 1 A 87 87 PHE C C 221 176.176 177.869 -1.693 1
1 1070 . 22 1 1 A 87 87 PHE CA C 221 61.780 61.530 0.250 1
1 1071 . 22 1 1 A 87 87 PHE CB C 221 37.549 37.799 -0.250 1
1 1075 . 22 1 1 A 87 87 PHE N N 221 112.449 116.846 -4.397 1
1 1076 . 22 1 1 A 88 88 LYS H H 222 7.061 8.177 -1.116 1
1 1077 . 22 1 1 A 88 88 LYS HA H 222 4.380 4.109 0.271 1
1 1086 . 22 1 1 A 88 88 LYS C C 222 177.089 177.274 -0.185 1
1 1087 . 22 1 1 A 88 88 LYS CA C 222 56.726 58.538 -1.812 1
1 1088 . 22 1 1 A 88 88 LYS CB C 222 33.738 32.253 1.485 1
1 1092 . 22 1 1 A 88 88 LYS N N 222 118.308 121.193 -2.885 1
1 1093 . 22 1 1 A 89 89 LEU H H 223 7.270 7.182 0.088 1
1 1094 . 22 1 1 A 89 89 LEU HA H 223 4.168 4.154 0.014 1
1 1104 . 22 1 1 A 89 89 LEU C C 223 177.528 177.072 0.456 1
1 1105 . 22 1 1 A 89 89 LEU CA C 223 55.279 55.170 0.109 1
1 1106 . 22 1 1 A 89 89 LEU CB C 223 43.240 42.313 0.927 1
1 1110 . 22 1 1 A 89 89 LEU N N 223 121.317 121.893 -0.576 1
1 1111 . 22 1 1 A 90 90 LYS H H 224 8.788 8.501 0.287 1
1 1112 . 22 1 1 A 90 90 LYS HA H 224 4.359 4.309 0.050 1
1 1121 . 22 1 1 A 90 90 LYS C C 224 175.839 175.653 0.186 1
1 1122 . 22 1 1 A 90 90 LYS CA C 224 54.772 55.971 -1.199 1
1 1123 . 22 1 1 A 90 90 LYS CB C 224 33.232 33.219 0.013 1
1 1127 . 22 1 1 A 90 90 LYS N N 224 123.558 122.539 1.019 1
1 1128 . 22 1 1 A 91 91 ASP H H 225 8.125 8.658 -0.533 1
1 1129 . 22 1 1 A 91 91 ASP HA H 225 3.958 4.366 -0.408 1
1 1132 . 22 1 1 A 91 91 ASP C C 225 177.452 176.547 0.905 1
1 1133 . 22 1 1 A 91 91 ASP CA C 225 56.642 55.521 1.121 1
1 1134 . 22 1 1 A 91 91 ASP CB C 225 40.269 40.188 0.081 1
1 1135 . 22 1 1 A 91 91 ASP N N 225 119.419 121.536 -2.117 1
1 1136 . 22 1 1 A 92 92 GLY H H 226 8.681 8.922 -0.241 1
1 1137 . 22 1 1 A 92 92 GLY HA2 H 226 4.131 3.895 0.236 1
1 1138 . 22 1 1 A 92 92 GLY HA3 H 226 3.579 3.921 -0.342 1
1 1139 . 22 1 1 A 92 92 GLY C C 226 173.614 174.174 -0.560 1
1 1140 . 22 1 1 A 92 92 GLY CA C 226 45.564 44.907 0.657 1
1 1141 . 22 1 1 A 92 92 GLY N N 226 113.802 112.132 1.670 1
1 1142 . 22 1 1 A 93 93 GLU H H 227 8.104 8.016 0.088 1
1 1143 . 22 1 1 A 93 93 GLU HA H 227 4.232 4.391 -0.159 1
1 1148 . 22 1 1 A 93 93 GLU C C 227 174.282 175.612 -1.330 1
1 1149 . 22 1 1 A 93 93 GLU CA C 227 56.651 56.211 0.440 1
1 1150 . 22 1 1 A 93 93 GLU CB C 227 32.190 31.208 0.982 1
1 1152 . 22 1 1 A 93 93 GLU N N 227 121.527 121.978 -0.451 1
1 1153 . 22 1 1 A 94 94 VAL H H 228 7.918 8.432 -0.514 1
1 1154 . 22 1 1 A 94 94 VAL HA H 228 4.857 4.657 0.200 1
1 1162 . 22 1 1 A 94 94 VAL C C 228 176.556 175.675 0.881 1
1 1163 . 22 1 1 A 94 94 VAL CA C 228 60.309 60.337 -0.028 1
1 1164 . 22 1 1 A 94 94 VAL CB C 228 33.847 35.170 -1.323 1
1 1167 . 22 1 1 A 94 94 VAL N N 228 119.768 126.129 -6.361 1
1 1168 . 22 1 1 A 95 95 SER H H 229 9.659 9.424 0.235 1
1 1169 . 22 1 1 A 95 95 SER HA H 229 4.313 4.633 -0.320 1
1 1172 . 22 1 1 A 95 95 SER C C 229 174.641 174.429 0.212 1
1 1173 . 22 1 1 A 95 95 SER CA C 229 59.208 57.905 1.303 1
1 1174 . 22 1 1 A 95 95 SER CB C 229 66.080 65.664 0.416 1
1 1175 . 22 1 1 A 95 95 SER N N 229 124.903 121.275 3.628 1
1 1176 . 22 1 1 A 96 96 GLU H H 230 8.014 8.626 -0.612 1
1 1177 . 22 1 1 A 96 96 GLU HA H 230 4.376 4.405 -0.029 1
1 1182 . 22 1 1 A 96 96 GLU C C 230 176.641 177.194 -0.553 1
1 1183 . 22 1 1 A 96 96 GLU CA C 230 56.236 56.500 -0.264 1
1 1184 . 22 1 1 A 96 96 GLU CB C 230 30.324 30.704 -0.380 1
1 1186 . 22 1 1 A 96 96 GLU N N 230 115.510 120.828 -5.318 1
1 1187 . 22 1 1 A 97 97 VAL H H 231 8.741 8.261 0.480 1
1 1188 . 22 1 1 A 97 97 VAL HA H 231 4.171 4.152 0.019 1
1 1196 . 22 1 1 A 97 97 VAL C C 231 176.684 175.795 0.889 1
1 1197 . 22 1 1 A 97 97 VAL CA C 231 65.418 63.117 2.301 1
1 1198 . 22 1 1 A 97 97 VAL CB C 231 31.218 31.700 -0.482 1
1 1201 . 22 1 1 A 97 97 VAL N N 231 121.289 121.566 -0.277 1
1 1202 . 22 1 1 A 98 98 VAL H H 232 9.218 9.328 -0.110 1
1 1203 . 22 1 1 A 98 98 VAL HA H 232 4.405 4.697 -0.292 1
1 1211 . 22 1 1 A 98 98 VAL C C 232 174.258 174.203 0.055 1
1 1212 . 22 1 1 A 98 98 VAL CA C 232 60.937 61.144 -0.207 1
1 1213 . 22 1 1 A 98 98 VAL CB C 232 35.825 34.199 1.626 1
1 1216 . 22 1 1 A 98 98 VAL N N 232 130.544 128.204 2.340 1
1 1217 . 22 1 1 A 99 99 LYS H H 233 8.800 8.832 -0.032 1
1 1218 . 22 1 1 A 99 99 LYS HA H 233 4.853 5.348 -0.495 1
1 1227 . 22 1 1 A 99 99 LYS C C 233 175.274 175.109 0.165 1
1 1228 . 22 1 1 A 99 99 LYS CA C 233 55.499 54.510 0.989 1
1 1229 . 22 1 1 A 99 99 LYS CB C 233 34.452 35.745 -1.293 1
1 1233 . 22 1 1 A 99 99 LYS N N 233 130.477 127.258 3.219 1
1 1234 . 22 1 1 A 100 100 SER H H 234 9.585 9.147 0.438 1
1 1235 . 22 1 1 A 100 100 SER HA H 234 5.150 4.908 0.242 1
1 1238 . 22 1 1 A 100 100 SER C C 234 175.493 174.086 1.407 1
1 1239 . 22 1 1 A 100 100 SER CA C 234 56.927 57.416 -0.489 1
1 1240 . 22 1 1 A 100 100 SER CB C 234 67.309 67.294 0.015 1
1 1241 . 22 1 1 A 100 100 SER N N 234 125.814 122.466 3.348 1
1 1242 . 22 1 1 A 101 101 SER H H 235 8.631 8.758 -0.127 1
1 1243 . 22 1 1 A 101 101 SER HA H 235 4.106 4.090 0.016 1
1 1246 . 22 1 1 A 101 101 SER C C 235 175.385 175.616 -0.231 1
1 1247 . 22 1 1 A 101 101 SER CA C 235 61.123 61.589 -0.466 1
1 1248 . 22 1 1 A 101 101 SER CB C 235 62.818 62.546 0.272 1
1 1249 . 22 1 1 A 101 101 SER N N 235 115.089 117.123 -2.034 1
1 1250 . 22 1 1 A 102 102 PHE H H 236 8.957 7.699 1.258 1
1 1251 . 22 1 1 A 102 102 PHE HA H 236 4.610 4.597 0.013 1
1 1259 . 22 1 1 A 102 102 PHE C C 236 176.453 175.964 0.489 1
1 1260 . 22 1 1 A 102 102 PHE CA C 236 58.382 58.171 0.211 1
1 1261 . 22 1 1 A 102 102 PHE CB C 236 40.275 39.441 0.834 1
1 1263 . 22 1 1 A 102 102 PHE N N 236 119.917 117.711 2.206 1
1 1264 . 22 1 1 A 103 103 GLY H H 237 7.377 7.421 -0.044 1
1 1265 . 22 1 1 A 103 103 GLY HA2 H 237 4.453 4.005 0.448 1
1 1266 . 22 1 1 A 103 103 GLY HA3 H 237 3.472 4.157 -0.685 1
1 1267 . 22 1 1 A 103 103 GLY C C 237 169.627 172.484 -2.857 1
1 1268 . 22 1 1 A 103 103 GLY CA C 237 45.384 44.466 0.918 1
1 1269 . 22 1 1 A 103 103 GLY N N 237 108.809 106.199 2.610 1
1 1270 . 22 1 1 A 104 104 TYR H H 238 8.632 8.523 0.109 1
1 1271 . 22 1 1 A 104 104 TYR HA H 238 5.322 5.389 -0.067 1
1 1278 . 22 1 1 A 104 104 TYR C C 238 175.043 175.040 0.003 1
1 1279 . 22 1 1 A 104 104 TYR CA C 238 57.627 57.230 0.397 1
1 1280 . 22 1 1 A 104 104 TYR CB C 238 41.711 41.589 0.122 1
1 1283 . 22 1 1 A 104 104 TYR N N 238 120.030 121.851 -1.821 1
1 1284 . 22 1 1 A 105 105 HIS H H 239 10.070 9.514 0.556 1
1 1285 . 22 1 1 A 105 105 HIS HA H 239 6.046 5.571 0.475 1
1 1290 . 22 1 1 A 105 105 HIS C C 239 175.734 174.824 0.910 1
1 1291 . 22 1 1 A 105 105 HIS CA C 239 53.945 54.319 -0.374 1
1 1292 . 22 1 1 A 105 105 HIS CB C 239 32.450 34.212 -1.762 1
1 1295 . 22 1 1 A 105 105 HIS N N 239 119.504 118.967 0.537 1
1 1296 . 22 1 1 A 106 106 ILE H H 240 8.660 9.177 -0.517 1
1 1297 . 22 1 1 A 106 106 ILE HA H 240 4.120 4.904 -0.784 1
1 1307 . 22 1 1 A 106 106 ILE C C 240 174.758 175.361 -0.603 1
1 1308 . 22 1 1 A 106 106 ILE CA C 240 63.446 60.051 3.395 1
1 1309 . 22 1 1 A 106 106 ILE CB C 240 40.786 41.687 -0.901 1
1 1313 . 22 1 1 A 106 106 ILE N N 240 120.639 120.485 0.154 1
1 1314 . 22 1 1 A 107 107 ILE H H 241 9.033 9.155 -0.122 1
1 1315 . 22 1 1 A 107 107 ILE HA H 241 4.799 5.145 -0.346 1
1 1325 . 22 1 1 A 107 107 ILE C C 241 172.880 173.927 -1.047 1
1 1326 . 22 1 1 A 107 107 ILE CA C 241 60.563 59.680 0.883 1
1 1327 . 22 1 1 A 107 107 ILE CB C 241 41.652 40.718 0.934 1
1 1331 . 22 1 1 A 107 107 ILE N N 241 129.098 127.027 2.071 1
1 1332 . 22 1 1 A 108 108 LYS H H 242 8.692 9.031 -0.339 1
1 1333 . 22 1 1 A 108 108 LYS HA H 242 5.012 4.848 0.164 1
1 1342 . 22 1 1 A 108 108 LYS C C 242 174.484 175.583 -1.099 1
1 1343 . 22 1 1 A 108 108 LYS CA C 242 54.317 53.874 0.443 1
1 1344 . 22 1 1 A 108 108 LYS CB C 242 35.619 35.240 0.379 1
1 1348 . 22 1 1 A 108 108 LYS N N 242 127.179 127.973 -0.794 1
1 1349 . 22 1 1 A 109 109 ALA H H 243 7.816 9.040 -1.224 1
1 1350 . 22 1 1 A 109 109 ALA HA H 243 4.604 4.744 -0.140 1
1 1354 . 22 1 1 A 109 109 ALA C C 243 176.231 175.921 0.310 1
1 1355 . 22 1 1 A 109 109 ALA CA C 243 50.505 50.939 -0.434 1
1 1356 . 22 1 1 A 109 109 ALA CB C 243 19.584 20.021 -0.437 1
1 1357 . 22 1 1 A 109 109 ALA N N 243 129.619 128.034 1.585 1
1 1358 . 22 1 1 A 110 110 ASP H H 244 7.578 8.603 -1.025 1
1 1359 . 22 1 1 A 110 110 ASP HA H 244 4.424 5.091 -0.667 1
1 1362 . 22 1 1 A 110 110 ASP C C 244 175.259 175.121 0.138 1
1 1363 . 22 1 1 A 110 110 ASP CA C 244 54.489 52.231 2.258 1
1 1364 . 22 1 1 A 110 110 ASP CB C 244 42.693 44.265 -1.572 1
1 1365 . 22 1 1 A 110 110 ASP N N 244 125.434 122.319 3.115 1
1 4 . 23 1 1 A 2 2 PRO HA H -4 4.403 4.547 -0.144 1
1 11 . 23 1 1 A 2 2 PRO C C -4 176.990 176.353 0.637 1
1 12 . 23 1 1 A 2 2 PRO CA C -4 63.131 62.965 0.166 1
1 13 . 23 1 1 A 2 2 PRO CB C -4 32.342 32.095 0.247 1
1 16 . 23 1 1 A 3 3 LEU H H -3 8.483 8.401 0.082 1
1 17 . 23 1 1 A 3 3 LEU HA H -3 4.333 3.966 0.367 1
1 27 . 23 1 1 A 3 3 LEU C C -3 177.991 177.553 0.438 1
1 28 . 23 1 1 A 3 3 LEU CA C -3 55.314 56.060 -0.746 1
1 29 . 23 1 1 A 3 3 LEU CB C -3 42.244 41.820 0.424 1
1 33 . 23 1 1 A 3 3 LEU N N -3 122.986 123.283 -0.297 1
1 34 . 23 1 1 A 4 4 GLY H H -2 8.397 9.115 -0.718 1
1 35 . 23 1 1 A 4 4 GLY HA2 H -2 4.024 3.860 0.164 1
1 36 . 23 1 1 A 4 4 GLY HA3 H -2 3.976 3.889 0.087 1
1 37 . 23 1 1 A 4 4 GLY C C -2 174.360 174.017 0.343 1
1 38 . 23 1 1 A 4 4 GLY CA C -2 45.434 44.889 0.545 1
1 39 . 23 1 1 A 4 4 GLY N N -2 110.666 116.356 -5.690 1
1 56 . 23 1 1 A 7 7 SER H H 141 7.913 7.776 0.137 1
1 57 . 23 1 1 A 7 7 SER HA H 141 5.657 5.466 0.191 1
1 60 . 23 1 1 A 7 7 SER C C 141 173.753 172.374 1.379 1
1 61 . 23 1 1 A 7 7 SER CA C 141 56.758 57.456 -0.698 1
1 62 . 23 1 1 A 7 7 SER CB C 141 66.774 66.478 0.296 1
1 63 . 23 1 1 A 7 7 SER N N 141 113.824 112.652 1.172 1
1 64 . 23 1 1 A 8 8 LYS H H 142 8.656 8.398 0.258 1
1 65 . 23 1 1 A 8 8 LYS HA H 142 4.543 4.918 -0.375 1
1 74 . 23 1 1 A 8 8 LYS C C 142 174.403 174.878 -0.475 1
1 75 . 23 1 1 A 8 8 LYS CA C 142 55.578 54.363 1.215 1
1 76 . 23 1 1 A 8 8 LYS CB C 142 36.561 35.774 0.787 1
1 80 . 23 1 1 A 8 8 LYS N N 142 123.076 119.699 3.377 1
1 81 . 23 1 1 A 9 9 LYS H H 143 8.623 8.646 -0.023 1
1 82 . 23 1 1 A 9 9 LYS HA H 143 4.119 4.660 -0.541 1
1 91 . 23 1 1 A 9 9 LYS C C 143 176.144 175.738 0.406 1
1 92 . 23 1 1 A 9 9 LYS CA C 143 56.683 56.161 0.522 1
1 93 . 23 1 1 A 9 9 LYS CB C 143 32.580 32.826 -0.246 1
1 97 . 23 1 1 A 9 9 LYS N N 143 129.542 123.458 6.084 1
1 98 . 23 1 1 A 10 10 ALA H H 144 8.151 8.739 -0.588 1
1 99 . 23 1 1 A 10 10 ALA HA H 144 5.208 4.922 0.286 1
1 103 . 23 1 1 A 10 10 ALA C C 144 175.577 175.039 0.538 1
1 104 . 23 1 1 A 10 10 ALA CA C 144 51.226 51.258 -0.032 1
1 105 . 23 1 1 A 10 10 ALA CB C 144 25.299 24.223 1.076 1
1 106 . 23 1 1 A 10 10 ALA N N 144 127.933 127.490 0.443 1
1 107 . 23 1 1 A 11 11 SER H H 145 8.679 8.858 -0.179 1
1 108 . 23 1 1 A 11 11 SER HA H 145 5.431 5.857 -0.426 1
1 111 . 23 1 1 A 11 11 SER C C 145 173.072 173.227 -0.155 1
1 112 . 23 1 1 A 11 11 SER CA C 145 57.772 56.964 0.808 1
1 113 . 23 1 1 A 11 11 SER CB C 145 67.301 66.309 0.992 1
1 114 . 23 1 1 A 11 11 SER N N 145 116.245 115.534 0.711 1
1 115 . 23 1 1 A 12 12 HIS H H 146 9.962 9.577 0.385 1
1 116 . 23 1 1 A 12 12 HIS HA H 146 6.332 6.041 0.291 1
1 121 . 23 1 1 A 12 12 HIS C C 146 173.006 172.685 0.321 1
1 122 . 23 1 1 A 12 12 HIS CA C 146 55.020 54.321 0.699 1
1 123 . 23 1 1 A 12 12 HIS CB C 146 37.071 33.440 3.631 1
1 126 . 23 1 1 A 12 12 HIS N N 146 119.181 118.626 0.555 1
1 127 . 23 1 1 A 13 13 ILE H H 147 8.976 8.986 -0.010 1
1 128 . 23 1 1 A 13 13 ILE HA H 147 3.528 4.539 -1.011 1
1 138 . 23 1 1 A 13 13 ILE C C 147 173.010 173.869 -0.859 1
1 139 . 23 1 1 A 13 13 ILE CA C 147 61.273 59.514 1.759 1
1 140 . 23 1 1 A 13 13 ILE CB C 147 41.773 41.947 -0.174 1
1 144 . 23 1 1 A 13 13 ILE N N 147 121.873 119.427 2.446 1
1 145 . 23 1 1 A 14 14 LEU H H 148 7.627 8.956 -1.329 1
1 146 . 23 1 1 A 14 14 LEU HA H 148 4.814 4.943 -0.129 1
1 156 . 23 1 1 A 14 14 LEU C C 148 174.112 174.327 -0.215 1
1 157 . 23 1 1 A 14 14 LEU CA C 148 52.574 53.002 -0.428 1
1 158 . 23 1 1 A 14 14 LEU CB C 148 45.643 45.011 0.632 1
1 162 . 23 1 1 A 14 14 LEU N N 148 127.112 129.626 -2.514 1
1 163 . 23 1 1 A 15 15 ILE H H 149 9.524 9.281 0.243 1
1 164 . 23 1 1 A 15 15 ILE HA H 149 4.362 4.710 -0.348 1
1 174 . 23 1 1 A 15 15 ILE C C 149 175.452 175.407 0.045 1
1 175 . 23 1 1 A 15 15 ILE CA C 149 58.516 60.458 -1.942 1
1 176 . 23 1 1 A 15 15 ILE CB C 149 36.560 39.936 -3.376 1
1 180 . 23 1 1 A 15 15 ILE N N 149 128.652 126.885 1.767 1
1 181 . 23 1 1 A 16 16 LYS H H 150 8.035 8.424 -0.389 1
1 182 . 23 1 1 A 16 16 LYS HA H 150 4.319 4.480 -0.161 1
1 191 . 23 1 1 A 16 16 LYS C C 150 175.038 176.335 -1.297 1
1 192 . 23 1 1 A 16 16 LYS CA C 150 57.817 56.495 1.322 1
1 193 . 23 1 1 A 16 16 LYS CB C 150 34.853 33.093 1.760 1
1 197 . 23 1 1 A 16 16 LYS N N 150 129.153 127.994 1.159 1
1 198 . 23 1 1 A 17 17 VAL H H 151 8.016 9.038 -1.022 1
1 199 . 23 1 1 A 17 17 VAL HA H 151 4.873 4.835 0.038 1
1 207 . 23 1 1 A 17 17 VAL C C 151 176.647 175.097 1.550 1
1 208 . 23 1 1 A 17 17 VAL CA C 151 60.088 61.257 -1.169 1
1 209 . 23 1 1 A 17 17 VAL CB C 151 34.082 33.795 0.287 1
1 212 . 23 1 1 A 17 17 VAL N N 151 121.288 123.983 -2.695 1
1 213 . 23 1 1 A 18 18 LYS H H 152 8.443 8.725 -0.282 1
1 214 . 23 1 1 A 18 18 LYS HA H 152 4.334 4.735 -0.401 1
1 223 . 23 1 1 A 18 18 LYS C C 152 176.345 177.027 -0.682 1
1 224 . 23 1 1 A 18 18 LYS CA C 152 57.016 54.458 2.558 1
1 225 . 23 1 1 A 18 18 LYS CB C 152 33.222 34.769 -1.547 1
1 229 . 23 1 1 A 18 18 LYS N N 152 128.408 127.236 1.172 1
1 230 . 23 1 1 A 19 19 SER H H 153 9.067 8.694 0.373 1
1 231 . 23 1 1 A 19 19 SER HA H 153 4.457 4.464 -0.007 1
1 234 . 23 1 1 A 19 19 SER C C 153 174.236 175.103 -0.867 1
1 235 . 23 1 1 A 19 19 SER CA C 153 59.642 60.725 -1.083 1
1 236 . 23 1 1 A 19 19 SER CB C 153 64.347 63.657 0.690 1
1 237 . 23 1 1 A 19 19 SER N N 153 121.522 116.308 5.214 1
1 238 . 23 1 1 A 20 20 LYS H H 154 7.961 7.580 0.381 1
1 239 . 23 1 1 A 20 20 LYS HA H 154 4.558 4.429 0.129 1
1 244 . 23 1 1 A 20 20 LYS C C 154 177.256 176.941 0.315 1
1 245 . 23 1 1 A 20 20 LYS CA C 154 55.249 55.721 -0.472 1
1 246 . 23 1 1 A 20 20 LYS CB C 154 34.531 32.541 1.990 1
1 248 . 23 1 1 A 20 20 LYS N N 154 120.270 120.598 -0.328 1
1 249 . 23 1 1 A 21 21 LYS HA H 155 4.003 3.944 0.059 1
1 258 . 23 1 1 A 21 21 LYS C C 155 177.015 178.236 -1.221 1
1 259 . 23 1 1 A 21 21 LYS CA C 155 59.091 58.795 0.296 1
1 260 . 23 1 1 A 21 21 LYS CB C 155 32.394 32.365 0.029 1
1 264 . 23 1 1 A 22 22 SER H H 156 7.625 7.738 -0.113 1
1 265 . 23 1 1 A 22 22 SER HA H 156 4.293 4.432 -0.139 1
1 268 . 23 1 1 A 22 22 SER C C 156 174.843 173.939 0.904 1
1 269 . 23 1 1 A 22 22 SER CA C 156 57.966 59.330 -1.364 1
1 270 . 23 1 1 A 22 22 SER CB C 156 63.369 63.748 -0.379 1
1 271 . 23 1 1 A 22 22 SER N N 156 109.549 112.568 -3.019 1
1 272 . 23 1 1 A 23 23 ASP H H 157 7.701 7.425 0.276 1
1 273 . 23 1 1 A 23 23 ASP HA H 157 4.548 4.485 0.063 1
1 276 . 23 1 1 A 23 23 ASP C C 157 176.544 176.615 -0.071 1
1 277 . 23 1 1 A 23 23 ASP CA C 157 55.242 54.779 0.463 1
1 278 . 23 1 1 A 23 23 ASP CB C 157 41.103 41.751 -0.648 1
1 279 . 23 1 1 A 23 23 ASP N N 157 124.536 122.136 2.400 1
1 280 . 23 1 1 A 24 24 LYS H H 158 8.583 8.982 -0.399 1
1 281 . 23 1 1 A 24 24 LYS HA H 158 4.252 4.363 -0.111 1
1 290 . 23 1 1 A 24 24 LYS C C 158 176.813 177.602 -0.789 1
1 291 . 23 1 1 A 24 24 LYS CA C 158 57.148 56.929 0.219 1
1 292 . 23 1 1 A 24 24 LYS CB C 158 33.200 32.570 0.630 1
1 296 . 23 1 1 A 24 24 LYS N N 158 122.372 126.759 -4.387 1
1 297 . 23 1 1 A 25 25 GLU H H 159 8.001 8.033 -0.032 1
1 298 . 23 1 1 A 25 25 GLU HA H 159 4.521 4.091 0.430 1
1 303 . 23 1 1 A 25 25 GLU C C 159 175.995 176.487 -0.492 1
1 304 . 23 1 1 A 25 25 GLU CA C 159 55.727 59.080 -3.353 1
1 305 . 23 1 1 A 25 25 GLU CB C 159 31.918 30.114 1.804 1
1 307 . 23 1 1 A 25 25 GLU N N 159 118.705 119.565 -0.860 1
1 308 . 23 1 1 A 26 26 GLY H H 160 8.458 7.798 0.660 1
1 309 . 23 1 1 A 26 26 GLY HA2 H 160 3.946 4.085 -0.139 1
1 310 . 23 1 1 A 26 26 GLY HA3 H 160 3.511 4.095 -0.584 1
1 311 . 23 1 1 A 26 26 GLY C C 160 172.201 172.940 -0.739 1
1 312 . 23 1 1 A 26 26 GLY CA C 160 44.038 45.027 -0.989 1
1 313 . 23 1 1 A 26 26 GLY N N 160 107.642 107.236 0.406 1
1 314 . 23 1 1 A 27 27 LEU H H 161 8.259 8.458 -0.199 1
1 315 . 23 1 1 A 27 27 LEU HA H 161 4.775 5.168 -0.393 1
1 325 . 23 1 1 A 27 27 LEU C C 161 177.422 175.331 2.091 1
1 326 . 23 1 1 A 27 27 LEU CA C 161 53.322 53.363 -0.041 1
1 327 . 23 1 1 A 27 27 LEU CB C 161 45.576 45.185 0.391 1
1 331 . 23 1 1 A 27 27 LEU N N 161 119.856 121.954 -2.098 1
1 332 . 23 1 1 A 28 28 ASP H H 162 8.848 8.710 0.138 1
1 333 . 23 1 1 A 28 28 ASP HA H 162 4.644 4.536 0.108 1
1 336 . 23 1 1 A 28 28 ASP C C 162 176.630 177.057 -0.427 1
1 337 . 23 1 1 A 28 28 ASP CA C 162 55.195 54.592 0.603 1
1 338 . 23 1 1 A 28 28 ASP CB C 162 41.673 42.828 -1.155 1
1 339 . 23 1 1 A 28 28 ASP N N 162 122.434 121.953 0.481 1
1 340 . 23 1 1 A 29 29 ASP H H 163 8.720 9.085 -0.365 1
1 341 . 23 1 1 A 29 29 ASP HA H 163 4.386 4.409 -0.023 1
1 344 . 23 1 1 A 29 29 ASP C C 163 176.604 178.561 -1.957 1
1 345 . 23 1 1 A 29 29 ASP CA C 163 59.690 56.856 2.834 1
1 346 . 23 1 1 A 29 29 ASP CB C 163 42.964 39.977 2.987 1
1 347 . 23 1 1 A 29 29 ASP N N 163 121.460 125.227 -3.767 1
1 348 . 23 1 1 A 30 30 LYS H H 164 8.434 7.810 0.624 1
1 349 . 23 1 1 A 30 30 LYS HA H 164 3.901 3.991 -0.090 1
1 358 . 23 1 1 A 30 30 LYS C C 164 179.479 179.371 0.108 1
1 359 . 23 1 1 A 30 30 LYS CA C 164 60.047 59.383 0.664 1
1 360 . 23 1 1 A 30 30 LYS CB C 164 32.038 32.433 -0.395 1
1 364 . 23 1 1 A 30 30 LYS N N 164 116.627 119.360 -2.733 1
1 365 . 23 1 1 A 31 31 GLU H H 165 7.755 8.316 -0.561 1
1 366 . 23 1 1 A 31 31 GLU HA H 165 3.998 3.993 0.005 1
1 371 . 23 1 1 A 31 31 GLU C C 165 179.031 179.295 -0.264 1
1 372 . 23 1 1 A 31 31 GLU CA C 165 59.335 59.382 -0.047 1
1 373 . 23 1 1 A 31 31 GLU CB C 165 29.972 29.255 0.717 1
1 375 . 23 1 1 A 31 31 GLU N N 165 120.456 119.896 0.560 1
1 376 . 23 1 1 A 32 32 ALA H H 166 9.060 8.598 0.462 1
1 377 . 23 1 1 A 32 32 ALA HA H 166 3.871 4.007 -0.136 1
1 381 . 23 1 1 A 32 32 ALA C C 166 178.029 179.122 -1.093 1
1 382 . 23 1 1 A 32 32 ALA CA C 166 54.997 55.363 -0.366 1
1 383 . 23 1 1 A 32 32 ALA CB C 166 19.727 18.337 1.390 1
1 384 . 23 1 1 A 32 32 ALA N N 166 124.406 122.281 2.125 1
1 385 . 23 1 1 A 33 33 LYS H H 167 8.228 7.514 0.714 1
1 386 . 23 1 1 A 33 33 LYS HA H 167 2.595 3.014 -0.419 1
1 395 . 23 1 1 A 33 33 LYS C C 167 177.938 178.137 -0.199 1
1 396 . 23 1 1 A 33 33 LYS CA C 167 59.573 59.296 0.277 1
1 397 . 23 1 1 A 33 33 LYS CB C 167 32.098 32.107 -0.009 1
1 401 . 23 1 1 A 33 33 LYS N N 167 119.833 118.199 1.634 1
1 402 . 23 1 1 A 34 34 GLN H H 168 7.392 7.753 -0.361 1
1 403 . 23 1 1 A 34 34 GLN HA H 168 3.943 3.884 0.059 1
1 410 . 23 1 1 A 34 34 GLN C C 168 178.323 178.460 -0.137 1
1 411 . 23 1 1 A 34 34 GLN CA C 168 58.883 59.549 -0.666 1
1 412 . 23 1 1 A 34 34 GLN CB C 168 28.485 28.073 0.412 1
1 414 . 23 1 1 A 34 34 GLN N N 168 117.208 117.954 -0.746 1
1 416 . 23 1 1 A 35 35 LYS H H 169 7.994 8.074 -0.080 1
1 417 . 23 1 1 A 35 35 LYS HA H 169 4.067 4.011 0.056 1
1 426 . 23 1 1 A 35 35 LYS C C 169 178.161 178.619 -0.458 1
1 427 . 23 1 1 A 35 35 LYS CA C 169 58.437 59.051 -0.614 1
1 428 . 23 1 1 A 35 35 LYS CB C 169 31.611 32.154 -0.543 1
1 432 . 23 1 1 A 35 35 LYS N N 169 120.898 119.769 1.129 1
1 433 . 23 1 1 A 36 36 ALA H H 170 8.431 8.270 0.161 1
1 434 . 23 1 1 A 36 36 ALA HA H 170 3.738 4.015 -0.277 1
1 438 . 23 1 1 A 36 36 ALA C C 170 178.862 179.340 -0.478 1
1 439 . 23 1 1 A 36 36 ALA CA C 170 55.351 55.139 0.212 1
1 440 . 23 1 1 A 36 36 ALA CB C 170 18.295 18.104 0.191 1
1 441 . 23 1 1 A 36 36 ALA N N 170 120.641 120.432 0.209 1
1 442 . 23 1 1 A 37 37 GLU H H 171 8.412 8.155 0.257 1
1 443 . 23 1 1 A 37 37 GLU HA H 171 3.867 3.954 -0.087 1
1 448 . 23 1 1 A 37 37 GLU C C 171 179.255 179.132 0.123 1
1 449 . 23 1 1 A 37 37 GLU CA C 171 59.543 59.516 0.027 1
1 450 . 23 1 1 A 37 37 GLU CB C 171 29.569 29.516 0.053 1
1 452 . 23 1 1 A 37 37 GLU N N 171 118.224 117.951 0.273 1
1 453 . 23 1 1 A 38 38 GLU H H 172 8.019 8.328 -0.309 1
1 454 . 23 1 1 A 38 38 GLU HA H 172 3.952 4.080 -0.128 1
1 459 . 23 1 1 A 38 38 GLU C C 172 180.250 178.307 1.943 1
1 460 . 23 1 1 A 38 38 GLU CA C 172 59.627 59.162 0.465 1
1 461 . 23 1 1 A 38 38 GLU CB C 172 29.368 28.665 0.703 1
1 463 . 23 1 1 A 38 38 GLU N N 172 121.250 118.594 2.656 1
1 464 . 23 1 1 A 39 39 ILE H H 173 8.174 7.191 0.983 1
1 465 . 23 1 1 A 39 39 ILE HA H 173 3.643 3.778 -0.135 1
1 475 . 23 1 1 A 39 39 ILE C C 173 177.568 178.063 -0.495 1
1 476 . 23 1 1 A 39 39 ILE CA C 173 64.869 63.912 0.957 1
1 477 . 23 1 1 A 39 39 ILE CB C 173 38.160 37.422 0.738 1
1 481 . 23 1 1 A 39 39 ILE N N 173 121.527 117.539 3.988 1
1 482 . 23 1 1 A 40 40 GLN H H 174 8.860 8.245 0.615 1
1 483 . 23 1 1 A 40 40 GLN HA H 174 3.533 3.978 -0.445 1
1 490 . 23 1 1 A 40 40 GLN C C 174 179.022 178.485 0.537 1
1 491 . 23 1 1 A 40 40 GLN CA C 174 61.316 59.256 2.060 1
1 492 . 23 1 1 A 40 40 GLN CB C 174 26.604 28.440 -1.836 1
1 494 . 23 1 1 A 40 40 GLN N N 174 121.956 121.113 0.843 1
1 496 . 23 1 1 A 41 41 LYS H H 175 7.879 8.138 -0.259 1
1 497 . 23 1 1 A 41 41 LYS HA H 175 3.777 4.222 -0.445 1
1 506 . 23 1 1 A 41 41 LYS C C 175 178.779 178.339 0.440 1
1 507 . 23 1 1 A 41 41 LYS CA C 175 59.701 58.779 0.922 1
1 508 . 23 1 1 A 41 41 LYS CB C 175 32.581 31.615 0.966 1
1 512 . 23 1 1 A 41 41 LYS N N 175 119.012 118.341 0.671 1
1 513 . 23 1 1 A 42 42 GLU H H 176 7.447 8.177 -0.730 1
1 514 . 23 1 1 A 42 42 GLU HA H 176 4.059 4.136 -0.077 1
1 519 . 23 1 1 A 42 42 GLU C C 176 180.058 178.762 1.296 1
1 520 . 23 1 1 A 42 42 GLU CA C 176 59.456 59.197 0.259 1
1 521 . 23 1 1 A 42 42 GLU CB C 176 29.923 29.217 0.706 1
1 523 . 23 1 1 A 42 42 GLU N N 176 120.054 119.017 1.037 1
1 524 . 23 1 1 A 43 43 VAL H H 177 8.618 7.925 0.693 1
1 525 . 23 1 1 A 43 43 VAL HA H 177 3.986 3.944 0.042 1
1 533 . 23 1 1 A 43 43 VAL C C 177 176.459 177.521 -1.062 1
1 534 . 23 1 1 A 43 43 VAL CA C 177 63.923 64.967 -1.044 1
1 535 . 23 1 1 A 43 43 VAL CB C 177 31.899 31.398 0.501 1
1 538 . 23 1 1 A 43 43 VAL N N 177 114.191 117.297 -3.106 1
1 539 . 23 1 1 A 44 44 SER H H 178 8.052 8.261 -0.209 1
1 540 . 23 1 1 A 44 44 SER HA H 178 4.098 4.259 -0.161 1
1 543 . 23 1 1 A 44 44 SER C C 178 176.548 176.250 0.298 1
1 544 . 23 1 1 A 44 44 SER CA C 178 61.160 61.375 -0.215 1
1 545 . 23 1 1 A 44 44 SER CB C 178 62.959 62.623 0.336 1
1 546 . 23 1 1 A 44 44 SER N N 178 114.202 116.060 -1.858 1
1 547 . 23 1 1 A 45 45 LYS H H 179 7.083 8.208 -1.125 1
1 548 . 23 1 1 A 45 45 LYS HA H 179 4.140 4.183 -0.043 1
1 557 . 23 1 1 A 45 45 LYS C C 179 177.288 176.179 1.109 1
1 558 . 23 1 1 A 45 45 LYS CA C 179 58.469 58.004 0.465 1
1 559 . 23 1 1 A 45 45 LYS CB C 179 32.671 31.672 0.999 1
1 563 . 23 1 1 A 45 45 LYS N N 179 120.935 117.723 3.212 1
1 564 . 23 1 1 A 46 46 ASP H H 180 7.098 7.870 -0.772 1
1 565 . 23 1 1 A 46 46 ASP HA H 180 4.917 4.958 -0.041 1
1 568 . 23 1 1 A 46 46 ASP CA C 180 51.492 51.520 -0.028 1
1 569 . 23 1 1 A 46 46 ASP CB C 180 40.595 41.573 -0.978 1
1 570 . 23 1 1 A 46 46 ASP N N 180 112.836 119.785 -6.949 1
1 571 . 23 1 1 A 47 47 PRO HA H 181 4.681 4.480 0.201 1
1 578 . 23 1 1 A 47 47 PRO C C 181 179.248 177.510 1.738 1
1 579 . 23 1 1 A 47 47 PRO CA C 181 64.718 64.308 0.410 1
1 580 . 23 1 1 A 47 47 PRO CB C 181 32.159 31.966 0.193 1
1 583 . 23 1 1 A 48 48 SER H H 182 8.248 8.323 -0.075 1
1 584 . 23 1 1 A 48 48 SER HA H 182 4.378 4.372 0.006 1
1 587 . 23 1 1 A 48 48 SER C C 182 176.071 175.938 0.133 1
1 588 . 23 1 1 A 48 48 SER CA C 182 61.377 60.153 1.224 1
1 589 . 23 1 1 A 48 48 SER CB C 182 62.455 63.208 -0.753 1
1 590 . 23 1 1 A 48 48 SER N N 182 116.986 112.501 4.485 1
1 591 . 23 1 1 A 49 49 LYS H H 183 7.842 7.463 0.379 1
1 592 . 23 1 1 A 49 49 LYS HA H 183 4.482 4.278 0.204 1
1 601 . 23 1 1 A 49 49 LYS C C 183 175.605 177.821 -2.216 1
1 602 . 23 1 1 A 49 49 LYS CA C 183 55.824 57.466 -1.642 1
1 603 . 23 1 1 A 49 49 LYS CB C 183 32.834 32.571 0.263 1
1 607 . 23 1 1 A 49 49 LYS N N 183 121.698 119.761 1.937 1
1 608 . 23 1 1 A 50 50 PHE H H 184 7.634 7.860 -0.226 1
1 609 . 23 1 1 A 50 50 PHE HA H 184 3.510 4.253 -0.743 1
1 617 . 23 1 1 A 50 50 PHE C C 184 176.214 177.653 -1.439 1
1 618 . 23 1 1 A 50 50 PHE CA C 184 63.276 61.001 2.275 1
1 619 . 23 1 1 A 50 50 PHE CB C 184 40.948 38.972 1.976 1
1 623 . 23 1 1 A 50 50 PHE N N 184 120.120 121.733 -1.613 1
1 624 . 23 1 1 A 51 51 GLY H H 185 8.855 8.631 0.224 1
1 625 . 23 1 1 A 51 51 GLY HA2 H 185 3.993 3.910 0.083 1
1 626 . 23 1 1 A 51 51 GLY HA3 H 185 3.958 3.953 0.005 1
1 627 . 23 1 1 A 51 51 GLY C C 185 175.169 176.247 -1.078 1
1 628 . 23 1 1 A 51 51 GLY CA C 185 47.475 47.080 0.395 1
1 629 . 23 1 1 A 51 51 GLY N N 185 105.550 106.199 -0.649 1
1 630 . 23 1 1 A 52 52 GLU H H 186 7.917 7.700 0.217 1
1 631 . 23 1 1 A 52 52 GLU HA H 186 4.006 4.073 -0.067 1
1 636 . 23 1 1 A 52 52 GLU C C 186 179.499 179.470 0.029 1
1 637 . 23 1 1 A 52 52 GLU CA C 186 58.904 59.244 -0.340 1
1 638 . 23 1 1 A 52 52 GLU CB C 186 29.700 29.672 0.028 1
1 640 . 23 1 1 A 52 52 GLU N N 186 121.929 120.908 1.021 1
1 641 . 23 1 1 A 53 53 ILE H H 187 7.936 8.250 -0.314 1
1 642 . 23 1 1 A 53 53 ILE HA H 187 3.648 3.641 0.007 1
1 652 . 23 1 1 A 53 53 ILE C C 187 177.886 177.675 0.211 1
1 653 . 23 1 1 A 53 53 ILE CA C 187 64.366 65.281 -0.915 1
1 654 . 23 1 1 A 53 53 ILE CB C 187 36.478 37.773 -1.295 1
1 658 . 23 1 1 A 53 53 ILE N N 187 120.991 121.060 -0.069 1
1 659 . 23 1 1 A 54 54 ALA H H 188 8.895 8.531 0.364 1
1 660 . 23 1 1 A 54 54 ALA HA H 188 3.629 3.781 -0.152 1
1 664 . 23 1 1 A 54 54 ALA C C 188 179.437 179.224 0.213 1
1 665 . 23 1 1 A 54 54 ALA CA C 188 55.974 55.711 0.263 1
1 666 . 23 1 1 A 54 54 ALA CB C 188 17.591 18.587 -0.996 1
1 667 . 23 1 1 A 54 54 ALA N N 188 125.308 122.183 3.125 1
1 668 . 23 1 1 A 55 55 LYS H H 189 8.049 7.528 0.521 1
1 669 . 23 1 1 A 55 55 LYS HA H 189 4.106 3.886 0.220 1
1 678 . 23 1 1 A 55 55 LYS C C 189 178.995 178.226 0.769 1
1 679 . 23 1 1 A 55 55 LYS CA C 189 59.312 59.240 0.072 1
1 680 . 23 1 1 A 55 55 LYS CB C 189 32.647 31.967 0.680 1
1 684 . 23 1 1 A 55 55 LYS N N 189 116.835 118.486 -1.651 1
1 685 . 23 1 1 A 56 56 LYS H H 190 7.215 7.554 -0.339 1
1 686 . 23 1 1 A 56 56 LYS HA H 190 4.172 4.247 -0.075 1
1 695 . 23 1 1 A 56 56 LYS C C 190 177.897 178.040 -0.143 1
1 696 . 23 1 1 A 56 56 LYS CA C 190 58.418 58.114 0.304 1
1 697 . 23 1 1 A 56 56 LYS CB C 190 34.652 33.251 1.401 1
1 701 . 23 1 1 A 56 56 LYS N N 190 117.170 117.925 -0.755 1
1 702 . 23 1 1 A 57 57 GLU H H 191 8.572 7.920 0.652 1
1 703 . 23 1 1 A 57 57 GLU HA H 191 4.643 4.363 0.280 1
1 708 . 23 1 1 A 57 57 GLU C C 191 177.903 176.054 1.849 1
1 709 . 23 1 1 A 57 57 GLU CA C 191 55.708 56.093 -0.385 1
1 710 . 23 1 1 A 57 57 GLU CB C 191 32.460 30.894 1.566 1
1 712 . 23 1 1 A 57 57 GLU N N 191 113.316 116.938 -3.622 1
1 713 . 23 1 1 A 58 58 SER H H 192 8.550 7.754 0.796 1
1 714 . 23 1 1 A 58 58 SER HA H 192 4.149 4.393 -0.244 1
1 717 . 23 1 1 A 58 58 SER C C 192 176.161 175.121 1.040 1
1 718 . 23 1 1 A 58 58 SER CA C 192 58.403 58.002 0.401 1
1 719 . 23 1 1 A 58 58 SER CB C 192 64.392 64.296 0.096 1
1 720 . 23 1 1 A 58 58 SER N N 192 109.861 115.672 -5.811 1
1 721 . 23 1 1 A 59 59 MET H H 193 9.533 9.111 0.422 1
1 722 . 23 1 1 A 59 59 MET HA H 193 4.457 4.586 -0.129 1
1 730 . 23 1 1 A 59 59 MET C C 193 175.204 175.950 -0.746 1
1 731 . 23 1 1 A 59 59 MET CA C 193 55.781 55.089 0.692 1
1 732 . 23 1 1 A 59 59 MET CB C 193 32.855 32.221 0.634 1
1 735 . 23 1 1 A 59 59 MET N N 193 124.493 123.868 0.625 1
1 736 . 23 1 1 A 60 60 ASP H H 194 7.514 7.339 0.175 1
1 737 . 23 1 1 A 60 60 ASP HA H 194 4.886 4.603 0.283 1
1 740 . 23 1 1 A 60 60 ASP C C 194 175.517 176.841 -1.324 1
1 741 . 23 1 1 A 60 60 ASP CA C 194 52.286 52.682 -0.396 1
1 742 . 23 1 1 A 60 60 ASP CB C 194 40.222 39.373 0.849 1
1 743 . 23 1 1 A 60 60 ASP N N 194 117.785 121.948 -4.163 1
1 744 . 23 1 1 A 61 61 THR H H 195 8.118 7.686 0.432 1
1 745 . 23 1 1 A 61 61 THR HA H 195 3.918 3.825 0.093 1
1 750 . 23 1 1 A 61 61 THR C C 195 176.269 177.179 -0.910 1
1 751 . 23 1 1 A 61 61 THR CA C 195 65.469 66.448 -0.979 1
1 752 . 23 1 1 A 61 61 THR CB C 195 68.741 68.622 0.119 1
1 754 . 23 1 1 A 61 61 THR N N 195 120.765 118.125 2.640 1
1 755 . 23 1 1 A 62 62 GLY H H 196 8.399 8.622 -0.223 1
1 756 . 23 1 1 A 62 62 GLY HA2 H 196 3.932 3.938 -0.006 1
1 757 . 23 1 1 A 62 62 GLY HA3 H 196 3.900 3.939 -0.039 1
1 758 . 23 1 1 A 62 62 GLY C C 196 174.948 175.446 -0.498 1
1 759 . 23 1 1 A 62 62 GLY CA C 196 46.768 46.580 0.188 1
1 760 . 23 1 1 A 62 62 GLY N N 196 108.183 108.447 -0.264 1
1 761 . 23 1 1 A 63 63 SER H H 197 7.265 7.932 -0.667 1
1 762 . 23 1 1 A 63 63 SER HA H 197 4.554 4.520 0.034 1
1 765 . 23 1 1 A 63 63 SER C C 197 177.630 176.231 1.399 1
1 766 . 23 1 1 A 63 63 SER CA C 197 59.550 60.903 -1.353 1
1 767 . 23 1 1 A 63 63 SER CB C 197 65.504 63.502 2.002 1
1 768 . 23 1 1 A 63 63 SER N N 197 111.815 116.955 -5.140 1
1 769 . 23 1 1 A 64 64 ALA H H 198 8.675 8.532 0.143 1
1 770 . 23 1 1 A 64 64 ALA HA H 198 3.801 3.985 -0.184 1
1 774 . 23 1 1 A 64 64 ALA C C 198 178.492 179.795 -1.303 1
1 775 . 23 1 1 A 64 64 ALA CA C 198 56.794 55.493 1.301 1
1 776 . 23 1 1 A 64 64 ALA CB C 198 18.951 18.244 0.707 1
1 777 . 23 1 1 A 64 64 ALA N N 198 131.710 123.631 8.079 1
1 778 . 23 1 1 A 65 65 LYS H H 199 7.666 8.004 -0.338 1
1 779 . 23 1 1 A 65 65 LYS HA H 199 4.175 4.144 0.031 1
1 788 . 23 1 1 A 65 65 LYS C C 199 177.159 177.206 -0.047 1
1 789 . 23 1 1 A 65 65 LYS CA C 199 57.735 58.169 -0.434 1
1 790 . 23 1 1 A 65 65 LYS CB C 199 31.948 32.028 -0.080 1
1 794 . 23 1 1 A 65 65 LYS N N 199 111.375 118.063 -6.688 1
1 795 . 23 1 1 A 66 66 LYS H H 200 7.545 7.664 -0.119 1
1 796 . 23 1 1 A 66 66 LYS HA H 200 4.612 4.479 0.133 1
1 805 . 23 1 1 A 66 66 LYS C C 200 175.609 175.816 -0.207 1
1 806 . 23 1 1 A 66 66 LYS CA C 200 54.468 55.718 -1.250 1
1 807 . 23 1 1 A 66 66 LYS CB C 200 31.525 32.885 -1.360 1
1 811 . 23 1 1 A 66 66 LYS N N 200 121.421 118.578 2.843 1
1 812 . 23 1 1 A 67 67 ASP H H 201 7.630 8.243 -0.613 1
1 813 . 23 1 1 A 67 67 ASP HA H 201 4.306 4.390 -0.084 1
1 816 . 23 1 1 A 67 67 ASP C C 201 175.025 176.302 -1.277 1
1 817 . 23 1 1 A 67 67 ASP CA C 201 56.400 55.295 1.105 1
1 818 . 23 1 1 A 67 67 ASP CB C 201 38.315 39.032 -0.717 1
1 819 . 23 1 1 A 67 67 ASP N N 201 116.216 116.825 -0.609 1
1 820 . 23 1 1 A 68 68 GLY H H 202 8.368 8.630 -0.262 1
1 821 . 23 1 1 A 68 68 GLY HA2 H 202 4.316 3.949 0.367 1
1 822 . 23 1 1 A 68 68 GLY HA3 H 202 3.731 4.016 -0.285 1
1 823 . 23 1 1 A 68 68 GLY C C 202 174.139 174.637 -0.498 1
1 824 . 23 1 1 A 68 68 GLY CA C 202 45.514 45.396 0.118 1
1 825 . 23 1 1 A 68 68 GLY N N 202 105.095 105.135 -0.040 1
1 826 . 23 1 1 A 69 69 GLU H H 203 7.534 8.047 -0.513 1
1 827 . 23 1 1 A 69 69 GLU HA H 203 4.479 4.430 0.049 1
1 832 . 23 1 1 A 69 69 GLU C C 203 176.961 176.156 0.805 1
1 833 . 23 1 1 A 69 69 GLU CA C 203 58.549 56.356 2.193 1
1 834 . 23 1 1 A 69 69 GLU CB C 203 30.998 30.269 0.729 1
1 836 . 23 1 1 A 69 69 GLU N N 203 120.426 120.205 0.221 1
1 837 . 23 1 1 A 70 70 LEU H H 204 8.962 9.141 -0.179 1
1 838 . 23 1 1 A 70 70 LEU HA H 204 4.438 4.479 -0.041 1
1 848 . 23 1 1 A 70 70 LEU C C 204 178.648 177.340 1.308 1
1 849 . 23 1 1 A 70 70 LEU CA C 204 53.977 55.631 -1.654 1
1 850 . 23 1 1 A 70 70 LEU CB C 204 43.612 43.392 0.220 1
1 854 . 23 1 1 A 70 70 LEU N N 204 122.066 124.122 -2.056 1
1 855 . 23 1 1 A 71 71 GLY H H 205 8.104 7.584 0.520 1
1 856 . 23 1 1 A 71 71 GLY HA2 H 205 4.165 3.964 0.201 1
1 857 . 23 1 1 A 71 71 GLY HA3 H 205 3.552 4.079 -0.527 1
1 858 . 23 1 1 A 71 71 GLY C C 205 173.098 173.463 -0.365 1
1 859 . 23 1 1 A 71 71 GLY CA C 205 44.723 45.065 -0.342 1
1 860 . 23 1 1 A 71 71 GLY N N 205 110.168 106.681 3.487 1
1 861 . 23 1 1 A 72 72 TYR H H 206 8.457 8.565 -0.108 1
1 862 . 23 1 1 A 72 72 TYR HA H 206 4.184 4.678 -0.494 1
1 869 . 23 1 1 A 72 72 TYR C C 206 175.975 175.610 0.365 1
1 870 . 23 1 1 A 72 72 TYR CA C 206 59.722 58.920 0.802 1
1 871 . 23 1 1 A 72 72 TYR CB C 206 38.378 38.252 0.126 1
1 874 . 23 1 1 A 72 72 TYR N N 206 120.171 122.308 -2.137 1
1 875 . 23 1 1 A 73 73 VAL H H 207 8.782 9.224 -0.442 1
1 876 . 23 1 1 A 73 73 VAL HA H 207 4.056 4.540 -0.484 1
1 884 . 23 1 1 A 73 73 VAL C C 207 174.901 175.845 -0.944 1
1 885 . 23 1 1 A 73 73 VAL CA C 207 62.202 62.775 -0.573 1
1 886 . 23 1 1 A 73 73 VAL CB C 207 33.071 31.863 1.208 1
1 889 . 23 1 1 A 73 73 VAL N N 207 128.847 125.367 3.480 1
1 890 . 23 1 1 A 74 74 LEU H H 208 8.146 8.632 -0.486 1
1 891 . 23 1 1 A 74 74 LEU HA H 208 4.944 4.400 0.544 1
1 901 . 23 1 1 A 74 74 LEU C C 208 178.400 177.639 0.761 1
1 902 . 23 1 1 A 74 74 LEU CA C 208 53.520 55.238 -1.718 1
1 903 . 23 1 1 A 74 74 LEU CB C 208 43.499 42.234 1.265 1
1 907 . 23 1 1 A 74 74 LEU N N 208 127.599 129.319 -1.720 1
1 908 . 23 1 1 A 75 75 LYS H H 209 8.403 8.633 -0.230 1
1 909 . 23 1 1 A 75 75 LYS HA H 209 3.771 3.921 -0.150 1
1 918 . 23 1 1 A 75 75 LYS C C 209 177.536 177.467 0.069 1
1 919 . 23 1 1 A 75 75 LYS CA C 209 58.385 58.963 -0.578 1
1 920 . 23 1 1 A 75 75 LYS CB C 209 32.459 32.102 0.357 1
1 924 . 23 1 1 A 75 75 LYS N N 209 123.798 123.062 0.736 1
1 925 . 23 1 1 A 76 76 GLY H H 210 9.997 9.300 0.697 1
1 926 . 23 1 1 A 76 76 GLY HA2 H 210 4.255 3.975 0.280 1
1 927 . 23 1 1 A 76 76 GLY HA3 H 210 3.791 3.983 -0.192 1
1 928 . 23 1 1 A 76 76 GLY C C 210 175.091 175.739 -0.648 1
1 929 . 23 1 1 A 76 76 GLY CA C 210 45.465 45.413 0.052 1
1 930 . 23 1 1 A 76 76 GLY N N 210 114.705 113.376 1.329 1
1 931 . 23 1 1 A 77 77 GLN H H 211 7.726 7.972 -0.246 1
1 932 . 23 1 1 A 77 77 GLN HA H 211 4.373 4.174 0.199 1
1 939 . 23 1 1 A 77 77 GLN C C 211 176.301 175.909 0.392 1
1 940 . 23 1 1 A 77 77 GLN CA C 211 57.074 58.006 -0.932 1
1 941 . 23 1 1 A 77 77 GLN CB C 211 30.798 29.083 1.715 1
1 943 . 23 1 1 A 77 77 GLN N N 211 118.702 117.953 0.749 1
1 945 . 23 1 1 A 78 78 THR H H 212 8.225 7.474 0.751 1
1 946 . 23 1 1 A 78 78 THR HA H 212 4.620 4.426 0.194 1
1 951 . 23 1 1 A 78 78 THR C C 212 173.920 174.267 -0.347 1
1 952 . 23 1 1 A 78 78 THR CA C 212 60.087 59.805 0.282 1
1 953 . 23 1 1 A 78 78 THR CB C 212 71.412 70.747 0.665 1
1 955 . 23 1 1 A 78 78 THR N N 212 111.935 111.482 0.453 1
1 956 . 23 1 1 A 79 79 ASP H H 213 8.372 8.520 -0.148 1
1 957 . 23 1 1 A 79 79 ASP HA H 213 4.470 4.563 -0.093 1
1 960 . 23 1 1 A 79 79 ASP C C 213 176.759 177.927 -1.168 1
1 961 . 23 1 1 A 79 79 ASP CA C 213 54.927 54.343 0.584 1
1 962 . 23 1 1 A 79 79 ASP CB C 213 43.859 41.609 2.250 1
1 963 . 23 1 1 A 79 79 ASP N N 213 122.093 121.381 0.712 1
1 964 . 23 1 1 A 80 80 LYS H H 214 8.740 8.828 -0.088 1
1 965 . 23 1 1 A 80 80 LYS HA H 214 4.027 4.048 -0.021 1
1 974 . 23 1 1 A 80 80 LYS C C 214 178.493 178.227 0.266 1
1 975 . 23 1 1 A 80 80 LYS CA C 214 59.802 59.141 0.661 1
1 976 . 23 1 1 A 80 80 LYS CB C 214 32.374 31.995 0.379 1
1 980 . 23 1 1 A 80 80 LYS N N 214 124.685 122.336 2.349 1
1 981 . 23 1 1 A 81 81 ASP H H 215 8.556 8.093 0.463 1
1 982 . 23 1 1 A 81 81 ASP HA H 215 4.566 4.359 0.207 1
1 985 . 23 1 1 A 81 81 ASP C C 215 178.889 178.596 0.293 1
1 986 . 23 1 1 A 81 81 ASP CA C 215 58.046 57.260 0.786 1
1 987 . 23 1 1 A 81 81 ASP CB C 215 40.872 40.550 0.322 1
1 988 . 23 1 1 A 81 81 ASP N N 215 121.413 120.039 1.374 1
1 989 . 23 1 1 A 82 82 PHE H H 216 8.205 8.278 -0.073 1
1 990 . 23 1 1 A 82 82 PHE HA H 216 3.686 4.072 -0.386 1
1 998 . 23 1 1 A 82 82 PHE C C 216 175.919 177.408 -1.489 1
1 999 . 23 1 1 A 82 82 PHE CA C 216 61.648 60.814 0.834 1
1 1000 . 23 1 1 A 82 82 PHE CB C 216 39.743 39.214 0.529 1
1 1004 . 23 1 1 A 82 82 PHE N N 216 124.401 122.428 1.973 1
1 1005 . 23 1 1 A 83 83 GLU H H 217 8.887 8.786 0.101 1
1 1006 . 23 1 1 A 83 83 GLU HA H 217 3.704 4.069 -0.365 1
1 1011 . 23 1 1 A 83 83 GLU C C 217 177.788 178.687 -0.899 1
1 1012 . 23 1 1 A 83 83 GLU CA C 217 60.545 60.218 0.327 1
1 1013 . 23 1 1 A 83 83 GLU CB C 217 30.639 29.649 0.990 1
1 1015 . 23 1 1 A 83 83 GLU N N 217 119.421 119.092 0.329 1
1 1016 . 23 1 1 A 84 84 LYS H H 218 8.055 7.952 0.103 1
1 1017 . 23 1 1 A 84 84 LYS HA H 218 3.947 4.080 -0.133 1
1 1026 . 23 1 1 A 84 84 LYS C C 218 178.783 178.804 -0.021 1
1 1027 . 23 1 1 A 84 84 LYS CA C 218 59.327 59.010 0.317 1
1 1028 . 23 1 1 A 84 84 LYS CB C 218 32.539 32.178 0.361 1
1 1032 . 23 1 1 A 84 84 LYS N N 218 117.821 119.530 -1.709 1
1 1033 . 23 1 1 A 85 85 ALA H H 219 7.059 7.688 -0.629 1
1 1034 . 23 1 1 A 85 85 ALA HA H 219 4.040 4.049 -0.009 1
1 1038 . 23 1 1 A 85 85 ALA C C 219 179.794 180.253 -0.459 1
1 1039 . 23 1 1 A 85 85 ALA CA C 219 54.407 54.837 -0.430 1
1 1040 . 23 1 1 A 85 85 ALA CB C 219 20.130 18.042 2.088 1
1 1041 . 23 1 1 A 85 85 ALA N N 219 118.905 121.399 -2.494 1
1 1042 . 23 1 1 A 86 86 LEU H H 220 8.157 8.355 -0.198 1
1 1043 . 23 1 1 A 86 86 LEU HA H 220 3.692 4.046 -0.354 1
1 1053 . 23 1 1 A 86 86 LEU C C 220 178.330 178.677 -0.347 1
1 1054 . 23 1 1 A 86 86 LEU CA C 220 57.752 58.154 -0.402 1
1 1055 . 23 1 1 A 86 86 LEU CB C 220 41.464 41.886 -0.422 1
1 1059 . 23 1 1 A 86 86 LEU N N 220 118.606 120.636 -2.030 1
1 1060 . 23 1 1 A 87 87 PHE H H 221 8.349 8.291 0.058 1
1 1061 . 23 1 1 A 87 87 PHE HA H 221 3.861 4.425 -0.564 1
1 1069 . 23 1 1 A 87 87 PHE C C 221 176.176 177.828 -1.652 1
1 1070 . 23 1 1 A 87 87 PHE CA C 221 61.780 61.860 -0.080 1
1 1071 . 23 1 1 A 87 87 PHE CB C 221 37.549 37.880 -0.331 1
1 1075 . 23 1 1 A 87 87 PHE N N 221 112.449 116.570 -4.121 1
1 1076 . 23 1 1 A 88 88 LYS H H 222 7.061 7.836 -0.775 1
1 1077 . 23 1 1 A 88 88 LYS HA H 222 4.380 4.146 0.234 1
1 1086 . 23 1 1 A 88 88 LYS C C 222 177.089 177.184 -0.095 1
1 1087 . 23 1 1 A 88 88 LYS CA C 222 56.726 58.435 -1.709 1
1 1088 . 23 1 1 A 88 88 LYS CB C 222 33.738 32.243 1.495 1
1 1092 . 23 1 1 A 88 88 LYS N N 222 118.308 120.976 -2.668 1
1 1093 . 23 1 1 A 89 89 LEU H H 223 7.270 7.157 0.113 1
1 1094 . 23 1 1 A 89 89 LEU HA H 223 4.168 4.227 -0.059 1
1 1104 . 23 1 1 A 89 89 LEU C C 223 177.528 176.705 0.823 1
1 1105 . 23 1 1 A 89 89 LEU CA C 223 55.279 54.671 0.608 1
1 1106 . 23 1 1 A 89 89 LEU CB C 223 43.240 42.129 1.111 1
1 1110 . 23 1 1 A 89 89 LEU N N 223 121.317 122.346 -1.029 1
1 1111 . 23 1 1 A 90 90 LYS H H 224 8.788 8.445 0.343 1
1 1112 . 23 1 1 A 90 90 LYS HA H 224 4.359 4.635 -0.276 1
1 1121 . 23 1 1 A 90 90 LYS C C 224 175.839 175.527 0.312 1
1 1122 . 23 1 1 A 90 90 LYS CA C 224 54.772 54.338 0.434 1
1 1123 . 23 1 1 A 90 90 LYS CB C 224 33.232 34.116 -0.884 1
1 1127 . 23 1 1 A 90 90 LYS N N 224 123.558 121.902 1.656 1
1 1128 . 23 1 1 A 91 91 ASP H H 225 8.125 8.652 -0.527 1
1 1129 . 23 1 1 A 91 91 ASP HA H 225 3.958 4.383 -0.425 1
1 1132 . 23 1 1 A 91 91 ASP C C 225 177.452 176.595 0.857 1
1 1133 . 23 1 1 A 91 91 ASP CA C 225 56.642 55.535 1.107 1
1 1134 . 23 1 1 A 91 91 ASP CB C 225 40.269 40.178 0.091 1
1 1135 . 23 1 1 A 91 91 ASP N N 225 119.419 121.600 -2.181 1
1 1136 . 23 1 1 A 92 92 GLY H H 226 8.681 8.830 -0.149 1
1 1137 . 23 1 1 A 92 92 GLY HA2 H 226 4.131 3.890 0.241 1
1 1138 . 23 1 1 A 92 92 GLY HA3 H 226 3.579 3.912 -0.333 1
1 1139 . 23 1 1 A 92 92 GLY C C 226 173.614 173.952 -0.338 1
1 1140 . 23 1 1 A 92 92 GLY CA C 226 45.564 45.004 0.560 1
1 1141 . 23 1 1 A 92 92 GLY N N 226 113.802 112.081 1.721 1
1 1142 . 23 1 1 A 93 93 GLU H H 227 8.104 8.082 0.022 1
1 1143 . 23 1 1 A 93 93 GLU HA H 227 4.232 4.434 -0.202 1
1 1148 . 23 1 1 A 93 93 GLU C C 227 174.282 176.101 -1.819 1
1 1149 . 23 1 1 A 93 93 GLU CA C 227 56.651 56.047 0.604 1
1 1150 . 23 1 1 A 93 93 GLU CB C 227 32.190 31.001 1.189 1
1 1152 . 23 1 1 A 93 93 GLU N N 227 121.527 121.865 -0.338 1
1 1153 . 23 1 1 A 94 94 VAL H H 228 7.918 8.543 -0.625 1
1 1154 . 23 1 1 A 94 94 VAL HA H 228 4.857 4.865 -0.008 1
1 1162 . 23 1 1 A 94 94 VAL C C 228 176.556 175.834 0.722 1
1 1163 . 23 1 1 A 94 94 VAL CA C 228 60.309 59.848 0.461 1
1 1164 . 23 1 1 A 94 94 VAL CB C 228 33.847 34.364 -0.517 1
1 1167 . 23 1 1 A 94 94 VAL N N 228 119.768 120.327 -0.559 1
1 1168 . 23 1 1 A 95 95 SER H H 229 9.659 9.140 0.519 1
1 1169 . 23 1 1 A 95 95 SER HA H 229 4.313 4.713 -0.400 1
1 1172 . 23 1 1 A 95 95 SER C C 229 174.641 174.583 0.058 1
1 1173 . 23 1 1 A 95 95 SER CA C 229 59.208 57.641 1.567 1
1 1174 . 23 1 1 A 95 95 SER CB C 229 66.080 65.786 0.294 1
1 1175 . 23 1 1 A 95 95 SER N N 229 124.903 116.374 8.529 1
1 1176 . 23 1 1 A 96 96 GLU H H 230 8.014 8.389 -0.375 1
1 1177 . 23 1 1 A 96 96 GLU HA H 230 4.376 4.359 0.017 1
1 1182 . 23 1 1 A 96 96 GLU C C 230 176.641 175.959 0.682 1
1 1183 . 23 1 1 A 96 96 GLU CA C 230 56.236 55.737 0.499 1
1 1184 . 23 1 1 A 96 96 GLU CB C 230 30.324 30.321 0.003 1
1 1186 . 23 1 1 A 96 96 GLU N N 230 115.510 119.033 -3.523 1
1 1187 . 23 1 1 A 97 97 VAL H H 231 8.741 8.408 0.333 1
1 1188 . 23 1 1 A 97 97 VAL HA H 231 4.171 4.221 -0.050 1
1 1196 . 23 1 1 A 97 97 VAL C C 231 176.684 175.782 0.902 1
1 1197 . 23 1 1 A 97 97 VAL CA C 231 65.418 63.034 2.384 1
1 1198 . 23 1 1 A 97 97 VAL CB C 231 31.218 31.413 -0.195 1
1 1201 . 23 1 1 A 97 97 VAL N N 231 121.289 120.823 0.466 1
1 1202 . 23 1 1 A 98 98 VAL H H 232 9.218 9.447 -0.229 1
1 1203 . 23 1 1 A 98 98 VAL HA H 232 4.405 4.675 -0.270 1
1 1211 . 23 1 1 A 98 98 VAL C C 232 174.258 174.628 -0.370 1
1 1212 . 23 1 1 A 98 98 VAL CA C 232 60.937 61.426 -0.489 1
1 1213 . 23 1 1 A 98 98 VAL CB C 232 35.825 33.424 2.401 1
1 1216 . 23 1 1 A 98 98 VAL N N 232 130.544 129.017 1.527 1
1 1217 . 23 1 1 A 99 99 LYS H H 233 8.800 8.934 -0.134 1
1 1218 . 23 1 1 A 99 99 LYS HA H 233 4.853 5.030 -0.177 1
1 1227 . 23 1 1 A 99 99 LYS C C 233 175.274 175.245 0.029 1
1 1228 . 23 1 1 A 99 99 LYS CA C 233 55.499 55.145 0.354 1
1 1229 . 23 1 1 A 99 99 LYS CB C 233 34.452 33.870 0.582 1
1 1233 . 23 1 1 A 99 99 LYS N N 233 130.477 128.538 1.939 1
1 1234 . 23 1 1 A 100 100 SER H H 234 9.585 8.966 0.619 1
1 1235 . 23 1 1 A 100 100 SER HA H 234 5.150 4.922 0.228 1
1 1238 . 23 1 1 A 100 100 SER C C 234 175.493 174.066 1.427 1
1 1239 . 23 1 1 A 100 100 SER CA C 234 56.927 57.512 -0.585 1
1 1240 . 23 1 1 A 100 100 SER CB C 234 67.309 67.369 -0.060 1
1 1241 . 23 1 1 A 100 100 SER N N 234 125.814 123.335 2.479 1
1 1242 . 23 1 1 A 101 101 SER H H 235 8.631 8.859 -0.228 1
1 1243 . 23 1 1 A 101 101 SER HA H 235 4.106 4.075 0.031 1
1 1246 . 23 1 1 A 101 101 SER C C 235 175.385 175.430 -0.045 1
1 1247 . 23 1 1 A 101 101 SER CA C 235 61.123 61.512 -0.389 1
1 1248 . 23 1 1 A 101 101 SER CB C 235 62.818 62.575 0.243 1
1 1249 . 23 1 1 A 101 101 SER N N 235 115.089 117.195 -2.106 1
1 1250 . 23 1 1 A 102 102 PHE H H 236 8.957 7.646 1.311 1
1 1251 . 23 1 1 A 102 102 PHE HA H 236 4.610 4.621 -0.011 1
1 1259 . 23 1 1 A 102 102 PHE C C 236 176.453 175.777 0.676 1
1 1260 . 23 1 1 A 102 102 PHE CA C 236 58.382 58.117 0.265 1
1 1261 . 23 1 1 A 102 102 PHE CB C 236 40.275 39.606 0.669 1
1 1263 . 23 1 1 A 102 102 PHE N N 236 119.917 117.886 2.031 1
1 1264 . 23 1 1 A 103 103 GLY H H 237 7.377 7.396 -0.019 1
1 1265 . 23 1 1 A 103 103 GLY HA2 H 237 4.453 3.944 0.509 1
1 1266 . 23 1 1 A 103 103 GLY HA3 H 237 3.472 4.119 -0.647 1
1 1267 . 23 1 1 A 103 103 GLY C C 237 169.627 172.385 -2.758 1
1 1268 . 23 1 1 A 103 103 GLY CA C 237 45.384 44.641 0.743 1
1 1269 . 23 1 1 A 103 103 GLY N N 237 108.809 106.318 2.491 1
1 1270 . 23 1 1 A 104 104 TYR H H 238 8.632 8.628 0.004 1
1 1271 . 23 1 1 A 104 104 TYR HA H 238 5.322 5.647 -0.325 1
1 1278 . 23 1 1 A 104 104 TYR C C 238 175.043 175.038 0.005 1
1 1279 . 23 1 1 A 104 104 TYR CA C 238 57.627 56.930 0.697 1
1 1280 . 23 1 1 A 104 104 TYR CB C 238 41.711 42.246 -0.535 1
1 1283 . 23 1 1 A 104 104 TYR N N 238 120.030 121.713 -1.683 1
1 1284 . 23 1 1 A 105 105 HIS H H 239 10.070 9.440 0.630 1
1 1285 . 23 1 1 A 105 105 HIS HA H 239 6.046 5.573 0.473 1
1 1290 . 23 1 1 A 105 105 HIS C C 239 175.734 174.654 1.080 1
1 1291 . 23 1 1 A 105 105 HIS CA C 239 53.945 54.506 -0.561 1
1 1292 . 23 1 1 A 105 105 HIS CB C 239 32.450 34.279 -1.829 1
1 1295 . 23 1 1 A 105 105 HIS N N 239 119.504 118.545 0.959 1
1 1296 . 23 1 1 A 106 106 ILE H H 240 8.660 8.774 -0.114 1
1 1297 . 23 1 1 A 106 106 ILE HA H 240 4.120 4.831 -0.711 1
1 1307 . 23 1 1 A 106 106 ILE C C 240 174.758 175.426 -0.668 1
1 1308 . 23 1 1 A 106 106 ILE CA C 240 63.446 59.595 3.851 1
1 1309 . 23 1 1 A 106 106 ILE CB C 240 40.786 41.851 -1.065 1
1 1313 . 23 1 1 A 106 106 ILE N N 240 120.639 119.684 0.955 1
1 1314 . 23 1 1 A 107 107 ILE H H 241 9.033 9.250 -0.217 1
1 1315 . 23 1 1 A 107 107 ILE HA H 241 4.799 5.120 -0.321 1
1 1325 . 23 1 1 A 107 107 ILE C C 241 172.880 174.518 -1.638 1
1 1326 . 23 1 1 A 107 107 ILE CA C 241 60.563 59.435 1.128 1
1 1327 . 23 1 1 A 107 107 ILE CB C 241 41.652 41.222 0.430 1
1 1331 . 23 1 1 A 107 107 ILE N N 241 129.098 126.751 2.347 1
1 1332 . 23 1 1 A 108 108 LYS H H 242 8.692 8.873 -0.181 1
1 1333 . 23 1 1 A 108 108 LYS HA H 242 5.012 5.165 -0.153 1
1 1342 . 23 1 1 A 108 108 LYS C C 242 174.484 175.285 -0.801 1
1 1343 . 23 1 1 A 108 108 LYS CA C 242 54.317 54.206 0.111 1
1 1344 . 23 1 1 A 108 108 LYS CB C 242 35.619 35.490 0.129 1
1 1348 . 23 1 1 A 108 108 LYS N N 242 127.179 125.727 1.452 1
1 1349 . 23 1 1 A 109 109 ALA H H 243 7.816 8.943 -1.127 1
1 1350 . 23 1 1 A 109 109 ALA HA H 243 4.604 4.729 -0.125 1
1 1354 . 23 1 1 A 109 109 ALA C C 243 176.231 176.111 0.120 1
1 1355 . 23 1 1 A 109 109 ALA CA C 243 50.505 51.058 -0.553 1
1 1356 . 23 1 1 A 109 109 ALA CB C 243 19.584 19.909 -0.325 1
1 1357 . 23 1 1 A 109 109 ALA N N 243 129.619 127.884 1.735 1
1 1358 . 23 1 1 A 110 110 ASP H H 244 7.578 8.508 -0.930 1
1 1359 . 23 1 1 A 110 110 ASP HA H 244 4.424 4.967 -0.543 1
1 1362 . 23 1 1 A 110 110 ASP C C 244 175.259 176.229 -0.970 1
1 1363 . 23 1 1 A 110 110 ASP CA C 244 54.489 52.474 2.015 1
1 1364 . 23 1 1 A 110 110 ASP CB C 244 42.693 43.097 -0.404 1
1 1365 . 23 1 1 A 110 110 ASP N N 244 125.434 122.121 3.313 1
1 4 . 24 1 1 A 2 2 PRO HA H -4 4.403 4.545 -0.142 1
1 11 . 24 1 1 A 2 2 PRO C C -4 176.990 175.380 1.610 1
1 12 . 24 1 1 A 2 2 PRO CA C -4 63.131 63.037 0.094 1
1 13 . 24 1 1 A 2 2 PRO CB C -4 32.342 32.629 -0.287 1
1 16 . 24 1 1 A 3 3 LEU H H -3 8.483 8.513 -0.030 1
1 17 . 24 1 1 A 3 3 LEU HA H -3 4.333 5.051 -0.718 1
1 27 . 24 1 1 A 3 3 LEU C C -3 177.991 176.339 1.652 1
1 28 . 24 1 1 A 3 3 LEU CA C -3 55.314 53.295 2.019 1
1 29 . 24 1 1 A 3 3 LEU CB C -3 42.244 45.364 -3.120 1
1 33 . 24 1 1 A 3 3 LEU N N -3 122.986 121.977 1.009 1
1 34 . 24 1 1 A 4 4 GLY H H -2 8.397 8.853 -0.456 1
1 35 . 24 1 1 A 4 4 GLY HA2 H -2 4.024 4.333 -0.309 1
1 36 . 24 1 1 A 4 4 GLY HA3 H -2 3.976 4.342 -0.366 1
1 37 . 24 1 1 A 4 4 GLY C C -2 174.360 172.606 1.754 1
1 38 . 24 1 1 A 4 4 GLY CA C -2 45.434 44.000 1.434 1
1 39 . 24 1 1 A 4 4 GLY N N -2 110.666 111.740 -1.074 1
1 56 . 24 1 1 A 7 7 SER H H 141 7.913 8.120 -0.207 1
1 57 . 24 1 1 A 7 7 SER HA H 141 5.657 5.460 0.197 1
1 60 . 24 1 1 A 7 7 SER C C 141 173.753 173.253 0.500 1
1 61 . 24 1 1 A 7 7 SER CA C 141 56.758 56.674 0.084 1
1 62 . 24 1 1 A 7 7 SER CB C 141 66.774 66.778 -0.004 1
1 63 . 24 1 1 A 7 7 SER N N 141 113.824 112.982 0.842 1
1 64 . 24 1 1 A 8 8 LYS H H 142 8.656 8.623 0.033 1
1 65 . 24 1 1 A 8 8 LYS HA H 142 4.543 5.112 -0.569 1
1 74 . 24 1 1 A 8 8 LYS C C 142 174.403 174.323 0.080 1
1 75 . 24 1 1 A 8 8 LYS CA C 142 55.578 54.686 0.892 1
1 76 . 24 1 1 A 8 8 LYS CB C 142 36.561 36.209 0.352 1
1 80 . 24 1 1 A 8 8 LYS N N 142 123.076 118.506 4.570 1
1 81 . 24 1 1 A 9 9 LYS H H 143 8.623 8.290 0.333 1
1 82 . 24 1 1 A 9 9 LYS HA H 143 4.119 4.429 -0.310 1
1 91 . 24 1 1 A 9 9 LYS C C 143 176.144 175.534 0.610 1
1 92 . 24 1 1 A 9 9 LYS CA C 143 56.683 55.964 0.719 1
1 93 . 24 1 1 A 9 9 LYS CB C 143 32.580 32.646 -0.066 1
1 97 . 24 1 1 A 9 9 LYS N N 143 129.542 122.814 6.728 1
1 98 . 24 1 1 A 10 10 ALA H H 144 8.151 8.679 -0.528 1
1 99 . 24 1 1 A 10 10 ALA HA H 144 5.208 4.901 0.307 1
1 103 . 24 1 1 A 10 10 ALA C C 144 175.577 175.009 0.568 1
1 104 . 24 1 1 A 10 10 ALA CA C 144 51.226 51.214 0.012 1
1 105 . 24 1 1 A 10 10 ALA CB C 144 25.299 24.140 1.159 1
1 106 . 24 1 1 A 10 10 ALA N N 144 127.933 127.819 0.114 1
1 107 . 24 1 1 A 11 11 SER H H 145 8.679 8.763 -0.084 1
1 108 . 24 1 1 A 11 11 SER HA H 145 5.431 5.760 -0.329 1
1 111 . 24 1 1 A 11 11 SER C C 145 173.072 173.154 -0.082 1
1 112 . 24 1 1 A 11 11 SER CA C 145 57.772 57.113 0.659 1
1 113 . 24 1 1 A 11 11 SER CB C 145 67.301 66.194 1.107 1
1 114 . 24 1 1 A 11 11 SER N N 145 116.245 115.499 0.746 1
1 115 . 24 1 1 A 12 12 HIS H H 146 9.962 9.568 0.394 1
1 116 . 24 1 1 A 12 12 HIS HA H 146 6.332 6.040 0.292 1
1 121 . 24 1 1 A 12 12 HIS C C 146 173.006 172.565 0.441 1
1 122 . 24 1 1 A 12 12 HIS CA C 146 55.020 54.332 0.688 1
1 123 . 24 1 1 A 12 12 HIS CB C 146 37.071 33.270 3.801 1
1 126 . 24 1 1 A 12 12 HIS N N 146 119.181 118.398 0.783 1
1 127 . 24 1 1 A 13 13 ILE H H 147 8.976 8.949 0.027 1
1 128 . 24 1 1 A 13 13 ILE HA H 147 3.528 4.461 -0.933 1
1 138 . 24 1 1 A 13 13 ILE C C 147 173.010 173.792 -0.782 1
1 139 . 24 1 1 A 13 13 ILE CA C 147 61.273 59.772 1.501 1
1 140 . 24 1 1 A 13 13 ILE CB C 147 41.773 41.941 -0.168 1
1 144 . 24 1 1 A 13 13 ILE N N 147 121.873 119.245 2.628 1
1 145 . 24 1 1 A 14 14 LEU H H 148 7.627 8.831 -1.204 1
1 146 . 24 1 1 A 14 14 LEU HA H 148 4.814 5.131 -0.317 1
1 156 . 24 1 1 A 14 14 LEU C C 148 174.112 174.374 -0.262 1
1 157 . 24 1 1 A 14 14 LEU CA C 148 52.574 53.095 -0.521 1
1 158 . 24 1 1 A 14 14 LEU CB C 148 45.643 45.424 0.219 1
1 162 . 24 1 1 A 14 14 LEU N N 148 127.112 129.547 -2.435 1
1 163 . 24 1 1 A 15 15 ILE H H 149 9.524 9.305 0.219 1
1 164 . 24 1 1 A 15 15 ILE HA H 149 4.362 4.583 -0.221 1
1 174 . 24 1 1 A 15 15 ILE C C 149 175.452 175.630 -0.178 1
1 175 . 24 1 1 A 15 15 ILE CA C 149 58.516 60.490 -1.974 1
1 176 . 24 1 1 A 15 15 ILE CB C 149 36.560 37.778 -1.218 1
1 180 . 24 1 1 A 15 15 ILE N N 149 128.652 128.155 0.497 1
1 181 . 24 1 1 A 16 16 LYS H H 150 8.035 8.474 -0.439 1
1 182 . 24 1 1 A 16 16 LYS HA H 150 4.319 4.333 -0.014 1
1 191 . 24 1 1 A 16 16 LYS C C 150 175.038 176.542 -1.504 1
1 192 . 24 1 1 A 16 16 LYS CA C 150 57.817 56.677 1.140 1
1 193 . 24 1 1 A 16 16 LYS CB C 150 34.853 32.733 2.120 1
1 197 . 24 1 1 A 16 16 LYS N N 150 129.153 127.922 1.231 1
1 198 . 24 1 1 A 17 17 VAL H H 151 8.016 9.000 -0.984 1
1 199 . 24 1 1 A 17 17 VAL HA H 151 4.873 4.886 -0.013 1
1 207 . 24 1 1 A 17 17 VAL C C 151 176.647 175.579 1.068 1
1 208 . 24 1 1 A 17 17 VAL CA C 151 60.088 61.151 -1.063 1
1 209 . 24 1 1 A 17 17 VAL CB C 151 34.082 33.780 0.302 1
1 212 . 24 1 1 A 17 17 VAL N N 151 121.288 124.821 -3.533 1
1 213 . 24 1 1 A 18 18 LYS H H 152 8.443 8.933 -0.490 1
1 214 . 24 1 1 A 18 18 LYS HA H 152 4.334 4.693 -0.359 1
1 223 . 24 1 1 A 18 18 LYS C C 152 176.345 177.593 -1.248 1
1 224 . 24 1 1 A 18 18 LYS CA C 152 57.016 54.488 2.528 1
1 225 . 24 1 1 A 18 18 LYS CB C 152 33.222 34.742 -1.520 1
1 229 . 24 1 1 A 18 18 LYS N N 152 128.408 126.923 1.485 1
1 230 . 24 1 1 A 19 19 SER H H 153 9.067 8.776 0.291 1
1 231 . 24 1 1 A 19 19 SER HA H 153 4.457 4.294 0.163 1
1 234 . 24 1 1 A 19 19 SER C C 153 174.236 174.319 -0.083 1
1 235 . 24 1 1 A 19 19 SER CA C 153 59.642 60.164 -0.522 1
1 236 . 24 1 1 A 19 19 SER CB C 153 64.347 63.467 0.880 1
1 237 . 24 1 1 A 19 19 SER N N 153 121.522 115.539 5.983 1
1 238 . 24 1 1 A 20 20 LYS H H 154 7.961 7.556 0.405 1
1 239 . 24 1 1 A 20 20 LYS HA H 154 4.558 4.630 -0.072 1
1 244 . 24 1 1 A 20 20 LYS C C 154 177.256 176.303 0.953 1
1 245 . 24 1 1 A 20 20 LYS CA C 154 55.249 55.312 -0.063 1
1 246 . 24 1 1 A 20 20 LYS CB C 154 34.531 34.597 -0.066 1
1 248 . 24 1 1 A 20 20 LYS N N 154 120.270 117.162 3.108 1
1 249 . 24 1 1 A 21 21 LYS HA H 155 4.003 4.067 -0.064 1
1 258 . 24 1 1 A 21 21 LYS C C 155 177.015 177.266 -0.251 1
1 259 . 24 1 1 A 21 21 LYS CA C 155 59.091 58.432 0.659 1
1 260 . 24 1 1 A 21 21 LYS CB C 155 32.394 31.963 0.431 1
1 264 . 24 1 1 A 22 22 SER H H 156 7.625 7.666 -0.041 1
1 265 . 24 1 1 A 22 22 SER HA H 156 4.293 4.369 -0.076 1
1 268 . 24 1 1 A 22 22 SER C C 156 174.843 174.456 0.387 1
1 269 . 24 1 1 A 22 22 SER CA C 156 57.966 59.360 -1.394 1
1 270 . 24 1 1 A 22 22 SER CB C 156 63.369 63.451 -0.082 1
1 271 . 24 1 1 A 22 22 SER N N 156 109.549 112.674 -3.125 1
1 272 . 24 1 1 A 23 23 ASP H H 157 7.701 7.388 0.313 1
1 273 . 24 1 1 A 23 23 ASP HA H 157 4.548 4.516 0.032 1
1 276 . 24 1 1 A 23 23 ASP C C 157 176.544 177.177 -0.633 1
1 277 . 24 1 1 A 23 23 ASP CA C 157 55.242 54.644 0.598 1
1 278 . 24 1 1 A 23 23 ASP CB C 157 41.103 42.545 -1.442 1
1 279 . 24 1 1 A 23 23 ASP N N 157 124.536 122.554 1.982 1
1 280 . 24 1 1 A 24 24 LYS H H 158 8.583 9.060 -0.477 1
1 281 . 24 1 1 A 24 24 LYS HA H 158 4.252 4.135 0.117 1
1 290 . 24 1 1 A 24 24 LYS C C 158 176.813 178.413 -1.600 1
1 291 . 24 1 1 A 24 24 LYS CA C 158 57.148 58.725 -1.577 1
1 292 . 24 1 1 A 24 24 LYS CB C 158 33.200 32.253 0.947 1
1 296 . 24 1 1 A 24 24 LYS N N 158 122.372 126.689 -4.317 1
1 297 . 24 1 1 A 25 25 GLU H H 159 8.001 8.045 -0.044 1
1 298 . 24 1 1 A 25 25 GLU HA H 159 4.521 4.242 0.279 1
1 303 . 24 1 1 A 25 25 GLU C C 159 175.995 176.317 -0.322 1
1 304 . 24 1 1 A 25 25 GLU CA C 159 55.727 57.918 -2.191 1
1 305 . 24 1 1 A 25 25 GLU CB C 159 31.918 30.893 1.025 1
1 307 . 24 1 1 A 25 25 GLU N N 159 118.705 118.883 -0.178 1
1 308 . 24 1 1 A 26 26 GLY H H 160 8.458 7.405 1.053 1
1 309 . 24 1 1 A 26 26 GLY HA2 H 160 3.946 4.039 -0.093 1
1 310 . 24 1 1 A 26 26 GLY HA3 H 160 3.511 4.048 -0.537 1
1 311 . 24 1 1 A 26 26 GLY C C 160 172.201 171.641 0.560 1
1 312 . 24 1 1 A 26 26 GLY CA C 160 44.038 45.431 -1.393 1
1 313 . 24 1 1 A 26 26 GLY N N 160 107.642 106.874 0.768 1
1 314 . 24 1 1 A 27 27 LEU H H 161 8.259 8.612 -0.353 1
1 315 . 24 1 1 A 27 27 LEU HA H 161 4.775 4.739 0.036 1
1 325 . 24 1 1 A 27 27 LEU C C 161 177.422 176.922 0.500 1
1 326 . 24 1 1 A 27 27 LEU CA C 161 53.322 54.063 -0.741 1
1 327 . 24 1 1 A 27 27 LEU CB C 161 45.576 42.664 2.912 1
1 331 . 24 1 1 A 27 27 LEU N N 161 119.856 121.627 -1.771 1
1 332 . 24 1 1 A 28 28 ASP H H 162 8.848 8.642 0.206 1
1 333 . 24 1 1 A 28 28 ASP HA H 162 4.644 4.653 -0.009 1
1 336 . 24 1 1 A 28 28 ASP C C 162 176.630 177.520 -0.890 1
1 337 . 24 1 1 A 28 28 ASP CA C 162 55.195 54.615 0.580 1
1 338 . 24 1 1 A 28 28 ASP CB C 162 41.673 41.462 0.211 1
1 339 . 24 1 1 A 28 28 ASP N N 162 122.434 120.354 2.080 1
1 340 . 24 1 1 A 29 29 ASP H H 163 8.720 9.095 -0.375 1
1 341 . 24 1 1 A 29 29 ASP HA H 163 4.386 4.431 -0.045 1
1 344 . 24 1 1 A 29 29 ASP C C 163 176.604 178.518 -1.914 1
1 345 . 24 1 1 A 29 29 ASP CA C 163 59.690 56.979 2.711 1
1 346 . 24 1 1 A 29 29 ASP CB C 163 42.964 39.882 3.082 1
1 347 . 24 1 1 A 29 29 ASP N N 163 121.460 122.857 -1.397 1
1 348 . 24 1 1 A 30 30 LYS H H 164 8.434 7.979 0.455 1
1 349 . 24 1 1 A 30 30 LYS HA H 164 3.901 3.986 -0.085 1
1 358 . 24 1 1 A 30 30 LYS C C 164 179.479 179.256 0.223 1
1 359 . 24 1 1 A 30 30 LYS CA C 164 60.047 59.373 0.674 1
1 360 . 24 1 1 A 30 30 LYS CB C 164 32.038 32.218 -0.180 1
1 364 . 24 1 1 A 30 30 LYS N N 164 116.627 119.780 -3.153 1
1 365 . 24 1 1 A 31 31 GLU H H 165 7.755 8.272 -0.517 1
1 366 . 24 1 1 A 31 31 GLU HA H 165 3.998 3.999 -0.001 1
1 371 . 24 1 1 A 31 31 GLU C C 165 179.031 179.286 -0.255 1
1 372 . 24 1 1 A 31 31 GLU CA C 165 59.335 59.297 0.038 1
1 373 . 24 1 1 A 31 31 GLU CB C 165 29.972 29.358 0.614 1
1 375 . 24 1 1 A 31 31 GLU N N 165 120.456 119.865 0.591 1
1 376 . 24 1 1 A 32 32 ALA H H 166 9.060 8.460 0.600 1
1 377 . 24 1 1 A 32 32 ALA HA H 166 3.871 4.022 -0.151 1
1 381 . 24 1 1 A 32 32 ALA C C 166 178.029 178.940 -0.911 1
1 382 . 24 1 1 A 32 32 ALA CA C 166 54.997 55.405 -0.408 1
1 383 . 24 1 1 A 32 32 ALA CB C 166 19.727 18.367 1.360 1
1 384 . 24 1 1 A 32 32 ALA N N 166 124.406 122.313 2.093 1
1 385 . 24 1 1 A 33 33 LYS H H 167 8.228 7.867 0.361 1
1 386 . 24 1 1 A 33 33 LYS HA H 167 2.595 3.088 -0.493 1
1 395 . 24 1 1 A 33 33 LYS C C 167 177.938 178.186 -0.248 1
1 396 . 24 1 1 A 33 33 LYS CA C 167 59.573 59.395 0.178 1
1 397 . 24 1 1 A 33 33 LYS CB C 167 32.098 32.203 -0.105 1
1 401 . 24 1 1 A 33 33 LYS N N 167 119.833 118.249 1.584 1
1 402 . 24 1 1 A 34 34 GLN H H 168 7.392 7.715 -0.323 1
1 403 . 24 1 1 A 34 34 GLN HA H 168 3.943 3.935 0.008 1
1 410 . 24 1 1 A 34 34 GLN C C 168 178.323 178.377 -0.054 1
1 411 . 24 1 1 A 34 34 GLN CA C 168 58.883 59.244 -0.361 1
1 412 . 24 1 1 A 34 34 GLN CB C 168 28.485 28.130 0.355 1
1 414 . 24 1 1 A 34 34 GLN N N 168 117.208 117.976 -0.768 1
1 416 . 24 1 1 A 35 35 LYS H H 169 7.994 8.012 -0.018 1
1 417 . 24 1 1 A 35 35 LYS HA H 169 4.067 3.979 0.088 1
1 426 . 24 1 1 A 35 35 LYS C C 169 178.161 178.430 -0.269 1
1 427 . 24 1 1 A 35 35 LYS CA C 169 58.437 59.400 -0.963 1
1 428 . 24 1 1 A 35 35 LYS CB C 169 31.611 32.330 -0.719 1
1 432 . 24 1 1 A 35 35 LYS N N 169 120.898 119.748 1.150 1
1 433 . 24 1 1 A 36 36 ALA H H 170 8.431 8.349 0.082 1
1 434 . 24 1 1 A 36 36 ALA HA H 170 3.738 4.041 -0.303 1
1 438 . 24 1 1 A 36 36 ALA C C 170 178.862 179.895 -1.033 1
1 439 . 24 1 1 A 36 36 ALA CA C 170 55.351 54.943 0.408 1
1 440 . 24 1 1 A 36 36 ALA CB C 170 18.295 18.448 -0.153 1
1 441 . 24 1 1 A 36 36 ALA N N 170 120.641 119.487 1.154 1
1 442 . 24 1 1 A 37 37 GLU H H 171 8.412 8.045 0.367 1
1 443 . 24 1 1 A 37 37 GLU HA H 171 3.867 3.953 -0.086 1
1 448 . 24 1 1 A 37 37 GLU C C 171 179.255 179.142 0.113 1
1 449 . 24 1 1 A 37 37 GLU CA C 171 59.543 59.445 0.098 1
1 450 . 24 1 1 A 37 37 GLU CB C 171 29.569 29.584 -0.015 1
1 452 . 24 1 1 A 37 37 GLU N N 171 118.224 117.731 0.493 1
1 453 . 24 1 1 A 38 38 GLU H H 172 8.019 8.216 -0.197 1
1 454 . 24 1 1 A 38 38 GLU HA H 172 3.952 4.063 -0.111 1
1 459 . 24 1 1 A 38 38 GLU C C 172 180.250 178.358 1.892 1
1 460 . 24 1 1 A 38 38 GLU CA C 172 59.627 59.203 0.424 1
1 461 . 24 1 1 A 38 38 GLU CB C 172 29.368 28.828 0.540 1
1 463 . 24 1 1 A 38 38 GLU N N 172 121.250 118.620 2.630 1
1 464 . 24 1 1 A 39 39 ILE H H 173 8.174 7.630 0.544 1
1 465 . 24 1 1 A 39 39 ILE HA H 173 3.643 3.790 -0.147 1
1 475 . 24 1 1 A 39 39 ILE C C 173 177.568 177.923 -0.355 1
1 476 . 24 1 1 A 39 39 ILE CA C 173 64.869 63.727 1.142 1
1 477 . 24 1 1 A 39 39 ILE CB C 173 38.160 37.384 0.776 1
1 481 . 24 1 1 A 39 39 ILE N N 173 121.527 117.418 4.109 1
1 482 . 24 1 1 A 40 40 GLN H H 174 8.860 8.332 0.528 1
1 483 . 24 1 1 A 40 40 GLN HA H 174 3.533 4.020 -0.487 1
1 490 . 24 1 1 A 40 40 GLN C C 174 179.022 178.254 0.768 1
1 491 . 24 1 1 A 40 40 GLN CA C 174 61.316 59.243 2.073 1
1 492 . 24 1 1 A 40 40 GLN CB C 174 26.604 28.367 -1.763 1
1 494 . 24 1 1 A 40 40 GLN N N 174 121.956 121.040 0.916 1
1 496 . 24 1 1 A 41 41 LYS H H 175 7.879 7.845 0.034 1
1 497 . 24 1 1 A 41 41 LYS HA H 175 3.777 4.102 -0.325 1
1 506 . 24 1 1 A 41 41 LYS C C 175 178.779 179.203 -0.424 1
1 507 . 24 1 1 A 41 41 LYS CA C 175 59.701 59.092 0.609 1
1 508 . 24 1 1 A 41 41 LYS CB C 175 32.581 31.954 0.627 1
1 512 . 24 1 1 A 41 41 LYS N N 175 119.012 118.284 0.728 1
1 513 . 24 1 1 A 42 42 GLU H H 176 7.447 7.634 -0.187 1
1 514 . 24 1 1 A 42 42 GLU HA H 176 4.059 4.134 -0.075 1
1 519 . 24 1 1 A 42 42 GLU C C 176 180.058 178.544 1.514 1
1 520 . 24 1 1 A 42 42 GLU CA C 176 59.456 59.200 0.256 1
1 521 . 24 1 1 A 42 42 GLU CB C 176 29.923 29.117 0.806 1
1 523 . 24 1 1 A 42 42 GLU N N 176 120.054 119.103 0.951 1
1 524 . 24 1 1 A 43 43 VAL H H 177 8.618 8.027 0.591 1
1 525 . 24 1 1 A 43 43 VAL HA H 177 3.986 3.943 0.043 1
1 533 . 24 1 1 A 43 43 VAL C C 177 176.459 177.514 -1.055 1
1 534 . 24 1 1 A 43 43 VAL CA C 177 63.923 64.769 -0.846 1
1 535 . 24 1 1 A 43 43 VAL CB C 177 31.899 31.413 0.486 1
1 538 . 24 1 1 A 43 43 VAL N N 177 114.191 117.199 -3.008 1
1 539 . 24 1 1 A 44 44 SER H H 178 8.052 8.434 -0.382 1
1 540 . 24 1 1 A 44 44 SER HA H 178 4.098 4.261 -0.163 1
1 543 . 24 1 1 A 44 44 SER C C 178 176.548 176.274 0.274 1
1 544 . 24 1 1 A 44 44 SER CA C 178 61.160 61.077 0.083 1
1 545 . 24 1 1 A 44 44 SER CB C 178 62.959 62.694 0.265 1
1 546 . 24 1 1 A 44 44 SER N N 178 114.202 115.942 -1.740 1
1 547 . 24 1 1 A 45 45 LYS H H 179 7.083 8.182 -1.099 1
1 548 . 24 1 1 A 45 45 LYS HA H 179 4.140 4.180 -0.040 1
1 557 . 24 1 1 A 45 45 LYS C C 179 177.288 176.132 1.156 1
1 558 . 24 1 1 A 45 45 LYS CA C 179 58.469 58.039 0.430 1
1 559 . 24 1 1 A 45 45 LYS CB C 179 32.671 31.672 0.999 1
1 563 . 24 1 1 A 45 45 LYS N N 179 120.935 118.101 2.834 1
1 564 . 24 1 1 A 46 46 ASP H H 180 7.098 7.868 -0.770 1
1 565 . 24 1 1 A 46 46 ASP HA H 180 4.917 4.957 -0.040 1
1 568 . 24 1 1 A 46 46 ASP CA C 180 51.492 51.540 -0.048 1
1 569 . 24 1 1 A 46 46 ASP CB C 180 40.595 41.552 -0.957 1
1 570 . 24 1 1 A 46 46 ASP N N 180 112.836 119.771 -6.935 1
1 571 . 24 1 1 A 47 47 PRO HA H 181 4.681 4.428 0.253 1
1 578 . 24 1 1 A 47 47 PRO C C 181 179.248 177.518 1.730 1
1 579 . 24 1 1 A 47 47 PRO CA C 181 64.718 64.333 0.385 1
1 580 . 24 1 1 A 47 47 PRO CB C 181 32.159 31.950 0.209 1
1 583 . 24 1 1 A 48 48 SER H H 182 8.248 8.293 -0.045 1
1 584 . 24 1 1 A 48 48 SER HA H 182 4.378 4.352 0.026 1
1 587 . 24 1 1 A 48 48 SER C C 182 176.071 176.397 -0.326 1
1 588 . 24 1 1 A 48 48 SER CA C 182 61.377 60.527 0.850 1
1 589 . 24 1 1 A 48 48 SER CB C 182 62.455 63.206 -0.751 1
1 590 . 24 1 1 A 48 48 SER N N 182 116.986 112.740 4.246 1
1 591 . 24 1 1 A 49 49 LYS H H 183 7.842 7.479 0.363 1
1 592 . 24 1 1 A 49 49 LYS HA H 183 4.482 4.264 0.218 1
1 601 . 24 1 1 A 49 49 LYS C C 183 175.605 177.963 -2.358 1
1 602 . 24 1 1 A 49 49 LYS CA C 183 55.824 57.653 -1.829 1
1 603 . 24 1 1 A 49 49 LYS CB C 183 32.834 32.644 0.190 1
1 607 . 24 1 1 A 49 49 LYS N N 183 121.698 120.987 0.711 1
1 608 . 24 1 1 A 50 50 PHE H H 184 7.634 8.169 -0.535 1
1 609 . 24 1 1 A 50 50 PHE HA H 184 3.510 4.210 -0.700 1
1 617 . 24 1 1 A 50 50 PHE C C 184 176.214 177.600 -1.386 1
1 618 . 24 1 1 A 50 50 PHE CA C 184 63.276 60.945 2.331 1
1 619 . 24 1 1 A 50 50 PHE CB C 184 40.948 38.966 1.982 1
1 623 . 24 1 1 A 50 50 PHE N N 184 120.120 121.779 -1.659 1
1 624 . 24 1 1 A 51 51 GLY H H 185 8.855 8.558 0.297 1
1 625 . 24 1 1 A 51 51 GLY HA2 H 185 3.993 3.851 0.142 1
1 626 . 24 1 1 A 51 51 GLY HA3 H 185 3.958 3.910 0.048 1
1 627 . 24 1 1 A 51 51 GLY C C 185 175.169 176.146 -0.977 1
1 628 . 24 1 1 A 51 51 GLY CA C 185 47.475 47.526 -0.051 1
1 629 . 24 1 1 A 51 51 GLY N N 185 105.550 106.254 -0.704 1
1 630 . 24 1 1 A 52 52 GLU H H 186 7.917 7.959 -0.042 1
1 631 . 24 1 1 A 52 52 GLU HA H 186 4.006 4.057 -0.051 1
1 636 . 24 1 1 A 52 52 GLU C C 186 179.499 179.625 -0.126 1
1 637 . 24 1 1 A 52 52 GLU CA C 186 58.904 59.222 -0.318 1
1 638 . 24 1 1 A 52 52 GLU CB C 186 29.700 29.721 -0.021 1
1 640 . 24 1 1 A 52 52 GLU N N 186 121.929 121.721 0.208 1
1 641 . 24 1 1 A 53 53 ILE H H 187 7.936 8.109 -0.173 1
1 642 . 24 1 1 A 53 53 ILE HA H 187 3.648 3.729 -0.081 1
1 652 . 24 1 1 A 53 53 ILE C C 187 177.886 177.783 0.103 1
1 653 . 24 1 1 A 53 53 ILE CA C 187 64.366 64.668 -0.302 1
1 654 . 24 1 1 A 53 53 ILE CB C 187 36.478 37.474 -0.996 1
1 658 . 24 1 1 A 53 53 ILE N N 187 120.991 121.490 -0.499 1
1 659 . 24 1 1 A 54 54 ALA H H 188 8.895 8.447 0.448 1
1 660 . 24 1 1 A 54 54 ALA HA H 188 3.629 3.787 -0.158 1
1 664 . 24 1 1 A 54 54 ALA C C 188 179.437 179.781 -0.344 1
1 665 . 24 1 1 A 54 54 ALA CA C 188 55.974 55.361 0.613 1
1 666 . 24 1 1 A 54 54 ALA CB C 188 17.591 18.305 -0.714 1
1 667 . 24 1 1 A 54 54 ALA N N 188 125.308 121.857 3.451 1
1 668 . 24 1 1 A 55 55 LYS H H 189 8.049 7.633 0.416 1
1 669 . 24 1 1 A 55 55 LYS HA H 189 4.106 3.974 0.132 1
1 678 . 24 1 1 A 55 55 LYS C C 189 178.995 177.931 1.064 1
1 679 . 24 1 1 A 55 55 LYS CA C 189 59.312 59.272 0.040 1
1 680 . 24 1 1 A 55 55 LYS CB C 189 32.647 32.165 0.482 1
1 684 . 24 1 1 A 55 55 LYS N N 189 116.835 118.272 -1.437 1
1 685 . 24 1 1 A 56 56 LYS H H 190 7.215 7.732 -0.517 1
1 686 . 24 1 1 A 56 56 LYS HA H 190 4.172 4.372 -0.200 1
1 695 . 24 1 1 A 56 56 LYS C C 190 177.897 178.110 -0.213 1
1 696 . 24 1 1 A 56 56 LYS CA C 190 58.418 57.450 0.968 1
1 697 . 24 1 1 A 56 56 LYS CB C 190 34.652 33.594 1.058 1
1 701 . 24 1 1 A 56 56 LYS N N 190 117.170 116.835 0.335 1
1 702 . 24 1 1 A 57 57 GLU H H 191 8.572 7.955 0.617 1
1 703 . 24 1 1 A 57 57 GLU HA H 191 4.643 4.352 0.291 1
1 708 . 24 1 1 A 57 57 GLU C C 191 177.903 176.151 1.752 1
1 709 . 24 1 1 A 57 57 GLU CA C 191 55.708 56.470 -0.762 1
1 710 . 24 1 1 A 57 57 GLU CB C 191 32.460 30.790 1.670 1
1 712 . 24 1 1 A 57 57 GLU N N 191 113.316 117.324 -4.008 1
1 713 . 24 1 1 A 58 58 SER H H 192 8.550 7.265 1.285 1
1 714 . 24 1 1 A 58 58 SER HA H 192 4.149 4.367 -0.218 1
1 717 . 24 1 1 A 58 58 SER C C 192 176.161 175.352 0.809 1
1 718 . 24 1 1 A 58 58 SER CA C 192 58.403 58.275 0.128 1
1 719 . 24 1 1 A 58 58 SER CB C 192 64.392 64.253 0.139 1
1 720 . 24 1 1 A 58 58 SER N N 192 109.861 115.722 -5.861 1
1 721 . 24 1 1 A 59 59 MET H H 193 9.533 8.824 0.709 1
1 722 . 24 1 1 A 59 59 MET HA H 193 4.457 4.851 -0.394 1
1 730 . 24 1 1 A 59 59 MET C C 193 175.204 175.675 -0.471 1
1 731 . 24 1 1 A 59 59 MET CA C 193 55.781 54.402 1.379 1
1 732 . 24 1 1 A 59 59 MET CB C 193 32.855 32.072 0.783 1
1 735 . 24 1 1 A 59 59 MET N N 193 124.493 124.309 0.184 1
1 736 . 24 1 1 A 60 60 ASP H H 194 7.514 7.353 0.161 1
1 737 . 24 1 1 A 60 60 ASP HA H 194 4.886 4.614 0.272 1
1 740 . 24 1 1 A 60 60 ASP C C 194 175.517 176.609 -1.092 1
1 741 . 24 1 1 A 60 60 ASP CA C 194 52.286 53.046 -0.760 1
1 742 . 24 1 1 A 60 60 ASP CB C 194 40.222 40.654 -0.432 1
1 743 . 24 1 1 A 60 60 ASP N N 194 117.785 122.558 -4.773 1
1 744 . 24 1 1 A 61 61 THR H H 195 8.118 8.289 -0.171 1
1 745 . 24 1 1 A 61 61 THR HA H 195 3.918 3.860 0.058 1
1 750 . 24 1 1 A 61 61 THR C C 195 176.269 176.934 -0.665 1
1 751 . 24 1 1 A 61 61 THR CA C 195 65.469 66.503 -1.034 1
1 752 . 24 1 1 A 61 61 THR CB C 195 68.741 68.311 0.430 1
1 754 . 24 1 1 A 61 61 THR N N 195 120.765 118.484 2.281 1
1 755 . 24 1 1 A 62 62 GLY H H 196 8.399 8.537 -0.138 1
1 756 . 24 1 1 A 62 62 GLY HA2 H 196 3.932 3.821 0.111 1
1 757 . 24 1 1 A 62 62 GLY HA3 H 196 3.900 3.822 0.078 1
1 758 . 24 1 1 A 62 62 GLY C C 196 174.948 176.121 -1.173 1
1 759 . 24 1 1 A 62 62 GLY CA C 196 46.768 47.478 -0.710 1
1 760 . 24 1 1 A 62 62 GLY N N 196 108.183 108.589 -0.406 1
1 761 . 24 1 1 A 63 63 SER H H 197 7.265 8.546 -1.281 1
1 762 . 24 1 1 A 63 63 SER HA H 197 4.554 4.206 0.348 1
1 765 . 24 1 1 A 63 63 SER C C 197 177.630 177.002 0.628 1
1 766 . 24 1 1 A 63 63 SER CA C 197 59.550 61.475 -1.925 1
1 767 . 24 1 1 A 63 63 SER CB C 197 65.504 62.868 2.636 1
1 768 . 24 1 1 A 63 63 SER N N 197 111.815 116.644 -4.829 1
1 769 . 24 1 1 A 64 64 ALA H H 198 8.675 8.380 0.295 1
1 770 . 24 1 1 A 64 64 ALA HA H 198 3.801 3.955 -0.154 1
1 774 . 24 1 1 A 64 64 ALA C C 198 178.492 179.373 -0.881 1
1 775 . 24 1 1 A 64 64 ALA CA C 198 56.794 55.331 1.463 1
1 776 . 24 1 1 A 64 64 ALA CB C 198 18.951 18.309 0.642 1
1 777 . 24 1 1 A 64 64 ALA N N 198 131.710 123.383 8.327 1
1 778 . 24 1 1 A 65 65 LYS H H 199 7.666 7.909 -0.243 1
1 779 . 24 1 1 A 65 65 LYS HA H 199 4.175 3.990 0.185 1
1 788 . 24 1 1 A 65 65 LYS C C 199 177.159 178.009 -0.850 1
1 789 . 24 1 1 A 65 65 LYS CA C 199 57.735 59.053 -1.318 1
1 790 . 24 1 1 A 65 65 LYS CB C 199 31.948 31.911 0.037 1
1 794 . 24 1 1 A 65 65 LYS N N 199 111.375 118.514 -7.139 1
1 795 . 24 1 1 A 66 66 LYS H H 200 7.545 7.459 0.086 1
1 796 . 24 1 1 A 66 66 LYS HA H 200 4.612 4.482 0.130 1
1 805 . 24 1 1 A 66 66 LYS C C 200 175.609 175.783 -0.174 1
1 806 . 24 1 1 A 66 66 LYS CA C 200 54.468 55.617 -1.149 1
1 807 . 24 1 1 A 66 66 LYS CB C 200 31.525 32.568 -1.043 1
1 811 . 24 1 1 A 66 66 LYS N N 200 121.421 119.123 2.298 1
1 812 . 24 1 1 A 67 67 ASP H H 201 7.630 8.210 -0.580 1
1 813 . 24 1 1 A 67 67 ASP HA H 201 4.306 4.358 -0.052 1
1 816 . 24 1 1 A 67 67 ASP C C 201 175.025 176.295 -1.270 1
1 817 . 24 1 1 A 67 67 ASP CA C 201 56.400 55.387 1.013 1
1 818 . 24 1 1 A 67 67 ASP CB C 201 38.315 39.036 -0.721 1
1 819 . 24 1 1 A 67 67 ASP N N 201 116.216 116.144 0.072 1
1 820 . 24 1 1 A 68 68 GLY H H 202 8.368 8.707 -0.339 1
1 821 . 24 1 1 A 68 68 GLY HA2 H 202 4.316 3.930 0.386 1
1 822 . 24 1 1 A 68 68 GLY HA3 H 202 3.731 4.002 -0.271 1
1 823 . 24 1 1 A 68 68 GLY C C 202 174.139 174.476 -0.337 1
1 824 . 24 1 1 A 68 68 GLY CA C 202 45.514 45.409 0.105 1
1 825 . 24 1 1 A 68 68 GLY N N 202 105.095 104.906 0.189 1
1 826 . 24 1 1 A 69 69 GLU H H 203 7.534 7.793 -0.259 1
1 827 . 24 1 1 A 69 69 GLU HA H 203 4.479 4.393 0.086 1
1 832 . 24 1 1 A 69 69 GLU C C 203 176.961 176.564 0.397 1
1 833 . 24 1 1 A 69 69 GLU CA C 203 58.549 57.008 1.541 1
1 834 . 24 1 1 A 69 69 GLU CB C 203 30.998 30.659 0.339 1
1 836 . 24 1 1 A 69 69 GLU N N 203 120.426 120.802 -0.376 1
1 837 . 24 1 1 A 70 70 LEU H H 204 8.962 8.915 0.047 1
1 838 . 24 1 1 A 70 70 LEU HA H 204 4.438 4.641 -0.203 1
1 848 . 24 1 1 A 70 70 LEU C C 204 178.648 177.321 1.327 1
1 849 . 24 1 1 A 70 70 LEU CA C 204 53.977 54.891 -0.914 1
1 850 . 24 1 1 A 70 70 LEU CB C 204 43.612 43.666 -0.054 1
1 854 . 24 1 1 A 70 70 LEU N N 204 122.066 125.642 -3.576 1
1 855 . 24 1 1 A 71 71 GLY H H 205 8.104 7.596 0.508 1
1 856 . 24 1 1 A 71 71 GLY HA2 H 205 4.165 4.059 0.106 1
1 857 . 24 1 1 A 71 71 GLY HA3 H 205 3.552 4.140 -0.588 1
1 858 . 24 1 1 A 71 71 GLY C C 205 173.098 173.506 -0.408 1
1 859 . 24 1 1 A 71 71 GLY CA C 205 44.723 45.252 -0.529 1
1 860 . 24 1 1 A 71 71 GLY N N 205 110.168 106.921 3.247 1
1 861 . 24 1 1 A 72 72 TYR H H 206 8.457 8.698 -0.241 1
1 862 . 24 1 1 A 72 72 TYR HA H 206 4.184 4.699 -0.515 1
1 869 . 24 1 1 A 72 72 TYR C C 206 175.975 175.519 0.456 1
1 870 . 24 1 1 A 72 72 TYR CA C 206 59.722 59.147 0.575 1
1 871 . 24 1 1 A 72 72 TYR CB C 206 38.378 38.322 0.056 1
1 874 . 24 1 1 A 72 72 TYR N N 206 120.171 122.120 -1.949 1
1 875 . 24 1 1 A 73 73 VAL H H 207 8.782 9.027 -0.245 1
1 876 . 24 1 1 A 73 73 VAL HA H 207 4.056 4.429 -0.373 1
1 884 . 24 1 1 A 73 73 VAL C C 207 174.901 175.826 -0.925 1
1 885 . 24 1 1 A 73 73 VAL CA C 207 62.202 62.621 -0.419 1
1 886 . 24 1 1 A 73 73 VAL CB C 207 33.071 31.933 1.138 1
1 889 . 24 1 1 A 73 73 VAL N N 207 128.847 125.089 3.758 1
1 890 . 24 1 1 A 74 74 LEU H H 208 8.146 8.907 -0.761 1
1 891 . 24 1 1 A 74 74 LEU HA H 208 4.944 4.570 0.374 1
1 901 . 24 1 1 A 74 74 LEU C C 208 178.400 177.472 0.928 1
1 902 . 24 1 1 A 74 74 LEU CA C 208 53.520 54.385 -0.865 1
1 903 . 24 1 1 A 74 74 LEU CB C 208 43.499 42.378 1.121 1
1 907 . 24 1 1 A 74 74 LEU N N 208 127.599 129.357 -1.758 1
1 908 . 24 1 1 A 75 75 LYS H H 209 8.403 8.803 -0.400 1
1 909 . 24 1 1 A 75 75 LYS HA H 209 3.771 3.827 -0.056 1
1 918 . 24 1 1 A 75 75 LYS C C 209 177.536 177.374 0.162 1
1 919 . 24 1 1 A 75 75 LYS CA C 209 58.385 58.706 -0.321 1
1 920 . 24 1 1 A 75 75 LYS CB C 209 32.459 31.953 0.506 1
1 924 . 24 1 1 A 75 75 LYS N N 209 123.798 122.990 0.808 1
1 925 . 24 1 1 A 76 76 GLY H H 210 9.997 9.356 0.641 1
1 926 . 24 1 1 A 76 76 GLY HA2 H 210 4.255 4.008 0.247 1
1 927 . 24 1 1 A 76 76 GLY HA3 H 210 3.791 4.010 -0.219 1
1 928 . 24 1 1 A 76 76 GLY C C 210 175.091 175.795 -0.704 1
1 929 . 24 1 1 A 76 76 GLY CA C 210 45.465 45.389 0.076 1
1 930 . 24 1 1 A 76 76 GLY N N 210 114.705 112.924 1.781 1
1 931 . 24 1 1 A 77 77 GLN H H 211 7.726 7.943 -0.217 1
1 932 . 24 1 1 A 77 77 GLN HA H 211 4.373 4.207 0.166 1
1 939 . 24 1 1 A 77 77 GLN C C 211 176.301 175.866 0.435 1
1 940 . 24 1 1 A 77 77 GLN CA C 211 57.074 57.249 -0.175 1
1 941 . 24 1 1 A 77 77 GLN CB C 211 30.798 29.302 1.496 1
1 943 . 24 1 1 A 77 77 GLN N N 211 118.702 117.925 0.777 1
1 945 . 24 1 1 A 78 78 THR H H 212 8.225 7.504 0.721 1
1 946 . 24 1 1 A 78 78 THR HA H 212 4.620 4.572 0.048 1
1 951 . 24 1 1 A 78 78 THR C C 212 173.920 174.133 -0.213 1
1 952 . 24 1 1 A 78 78 THR CA C 212 60.087 59.639 0.448 1
1 953 . 24 1 1 A 78 78 THR CB C 212 71.412 70.863 0.549 1
1 955 . 24 1 1 A 78 78 THR N N 212 111.935 111.136 0.799 1
1 956 . 24 1 1 A 79 79 ASP H H 213 8.372 8.224 0.148 1
1 957 . 24 1 1 A 79 79 ASP HA H 213 4.470 4.464 0.006 1
1 960 . 24 1 1 A 79 79 ASP C C 213 176.759 177.785 -1.026 1
1 961 . 24 1 1 A 79 79 ASP CA C 213 54.927 54.514 0.413 1
1 962 . 24 1 1 A 79 79 ASP CB C 213 43.859 42.813 1.046 1
1 963 . 24 1 1 A 79 79 ASP N N 213 122.093 122.828 -0.735 1
1 964 . 24 1 1 A 80 80 LYS H H 214 8.740 8.821 -0.081 1
1 965 . 24 1 1 A 80 80 LYS HA H 214 4.027 4.089 -0.062 1
1 974 . 24 1 1 A 80 80 LYS C C 214 178.493 177.953 0.540 1
1 975 . 24 1 1 A 80 80 LYS CA C 214 59.802 59.156 0.646 1
1 976 . 24 1 1 A 80 80 LYS CB C 214 32.374 31.996 0.378 1
1 980 . 24 1 1 A 80 80 LYS N N 214 124.685 123.665 1.020 1
1 981 . 24 1 1 A 81 81 ASP H H 215 8.556 8.053 0.503 1
1 982 . 24 1 1 A 81 81 ASP HA H 215 4.566 4.423 0.143 1
1 985 . 24 1 1 A 81 81 ASP C C 215 178.889 178.559 0.330 1
1 986 . 24 1 1 A 81 81 ASP CA C 215 58.046 56.890 1.156 1
1 987 . 24 1 1 A 81 81 ASP CB C 215 40.872 40.836 0.036 1
1 988 . 24 1 1 A 81 81 ASP N N 215 121.413 119.726 1.687 1
1 989 . 24 1 1 A 82 82 PHE H H 216 8.205 8.134 0.071 1
1 990 . 24 1 1 A 82 82 PHE HA H 216 3.686 4.089 -0.403 1
1 998 . 24 1 1 A 82 82 PHE C C 216 175.919 177.423 -1.504 1
1 999 . 24 1 1 A 82 82 PHE CA C 216 61.648 60.852 0.796 1
1 1000 . 24 1 1 A 82 82 PHE CB C 216 39.743 39.211 0.532 1
1 1004 . 24 1 1 A 82 82 PHE N N 216 124.401 122.710 1.691 1
1 1005 . 24 1 1 A 83 83 GLU H H 217 8.887 8.920 -0.033 1
1 1006 . 24 1 1 A 83 83 GLU HA H 217 3.704 4.195 -0.491 1
1 1011 . 24 1 1 A 83 83 GLU C C 217 177.788 179.219 -1.431 1
1 1012 . 24 1 1 A 83 83 GLU CA C 217 60.545 60.298 0.247 1
1 1013 . 24 1 1 A 83 83 GLU CB C 217 30.639 29.586 1.053 1
1 1015 . 24 1 1 A 83 83 GLU N N 217 119.421 118.922 0.499 1
1 1016 . 24 1 1 A 84 84 LYS H H 218 8.055 7.648 0.407 1
1 1017 . 24 1 1 A 84 84 LYS HA H 218 3.947 4.158 -0.211 1
1 1026 . 24 1 1 A 84 84 LYS C C 218 178.783 178.736 0.047 1
1 1027 . 24 1 1 A 84 84 LYS CA C 218 59.327 58.495 0.832 1
1 1028 . 24 1 1 A 84 84 LYS CB C 218 32.539 32.076 0.463 1
1 1032 . 24 1 1 A 84 84 LYS N N 218 117.821 119.356 -1.535 1
1 1033 . 24 1 1 A 85 85 ALA H H 219 7.059 7.691 -0.632 1
1 1034 . 24 1 1 A 85 85 ALA HA H 219 4.040 4.034 0.006 1
1 1038 . 24 1 1 A 85 85 ALA C C 219 179.794 179.853 -0.059 1
1 1039 . 24 1 1 A 85 85 ALA CA C 219 54.407 54.930 -0.523 1
1 1040 . 24 1 1 A 85 85 ALA CB C 219 20.130 18.401 1.729 1
1 1041 . 24 1 1 A 85 85 ALA N N 219 118.905 122.298 -3.393 1
1 1042 . 24 1 1 A 86 86 LEU H H 220 8.157 8.274 -0.117 1
1 1043 . 24 1 1 A 86 86 LEU HA H 220 3.692 3.922 -0.230 1
1 1053 . 24 1 1 A 86 86 LEU C C 220 178.330 178.471 -0.141 1
1 1054 . 24 1 1 A 86 86 LEU CA C 220 57.752 58.087 -0.335 1
1 1055 . 24 1 1 A 86 86 LEU CB C 220 41.464 41.678 -0.214 1
1 1059 . 24 1 1 A 86 86 LEU N N 220 118.606 120.175 -1.569 1
1 1060 . 24 1 1 A 87 87 PHE H H 221 8.349 7.970 0.379 1
1 1061 . 24 1 1 A 87 87 PHE HA H 221 3.861 4.503 -0.642 1
1 1069 . 24 1 1 A 87 87 PHE C C 221 176.176 177.559 -1.383 1
1 1070 . 24 1 1 A 87 87 PHE CA C 221 61.780 61.508 0.272 1
1 1071 . 24 1 1 A 87 87 PHE CB C 221 37.549 37.959 -0.410 1
1 1075 . 24 1 1 A 87 87 PHE N N 221 112.449 116.684 -4.235 1
1 1076 . 24 1 1 A 88 88 LYS H H 222 7.061 7.850 -0.789 1
1 1077 . 24 1 1 A 88 88 LYS HA H 222 4.380 4.193 0.187 1
1 1086 . 24 1 1 A 88 88 LYS C C 222 177.089 177.181 -0.092 1
1 1087 . 24 1 1 A 88 88 LYS CA C 222 56.726 58.115 -1.389 1
1 1088 . 24 1 1 A 88 88 LYS CB C 222 33.738 32.456 1.282 1
1 1092 . 24 1 1 A 88 88 LYS N N 222 118.308 120.009 -1.701 1
1 1093 . 24 1 1 A 89 89 LEU H H 223 7.270 7.086 0.184 1
1 1094 . 24 1 1 A 89 89 LEU HA H 223 4.168 4.101 0.067 1
1 1104 . 24 1 1 A 89 89 LEU C C 223 177.528 177.173 0.355 1
1 1105 . 24 1 1 A 89 89 LEU CA C 223 55.279 55.257 0.022 1
1 1106 . 24 1 1 A 89 89 LEU CB C 223 43.240 42.207 1.033 1
1 1110 . 24 1 1 A 89 89 LEU N N 223 121.317 122.408 -1.091 1
1 1111 . 24 1 1 A 90 90 LYS H H 224 8.788 8.513 0.275 1
1 1112 . 24 1 1 A 90 90 LYS HA H 224 4.359 4.286 0.073 1
1 1121 . 24 1 1 A 90 90 LYS C C 224 175.839 176.511 -0.672 1
1 1122 . 24 1 1 A 90 90 LYS CA C 224 54.772 55.952 -1.180 1
1 1123 . 24 1 1 A 90 90 LYS CB C 224 33.232 33.214 0.018 1
1 1127 . 24 1 1 A 90 90 LYS N N 224 123.558 122.853 0.705 1
1 1128 . 24 1 1 A 91 91 ASP H H 225 8.125 8.767 -0.642 1
1 1129 . 24 1 1 A 91 91 ASP HA H 225 3.958 4.187 -0.229 1
1 1132 . 24 1 1 A 91 91 ASP C C 225 177.452 177.251 0.201 1
1 1133 . 24 1 1 A 91 91 ASP CA C 225 56.642 56.253 0.389 1
1 1134 . 24 1 1 A 91 91 ASP CB C 225 40.269 40.232 0.037 1
1 1135 . 24 1 1 A 91 91 ASP N N 225 119.419 121.908 -2.489 1
1 1136 . 24 1 1 A 92 92 GLY H H 226 8.681 8.199 0.482 1
1 1137 . 24 1 1 A 92 92 GLY HA2 H 226 4.131 3.828 0.303 1
1 1138 . 24 1 1 A 92 92 GLY HA3 H 226 3.579 3.855 -0.276 1
1 1139 . 24 1 1 A 92 92 GLY C C 226 173.614 173.852 -0.238 1
1 1140 . 24 1 1 A 92 92 GLY CA C 226 45.564 45.420 0.144 1
1 1141 . 24 1 1 A 92 92 GLY N N 226 113.802 111.607 2.195 1
1 1142 . 24 1 1 A 93 93 GLU H H 227 8.104 7.929 0.175 1
1 1143 . 24 1 1 A 93 93 GLU HA H 227 4.232 4.421 -0.189 1
1 1148 . 24 1 1 A 93 93 GLU C C 227 174.282 175.602 -1.320 1
1 1149 . 24 1 1 A 93 93 GLU CA C 227 56.651 56.170 0.481 1
1 1150 . 24 1 1 A 93 93 GLU CB C 227 32.190 31.002 1.188 1
1 1152 . 24 1 1 A 93 93 GLU N N 227 121.527 121.782 -0.255 1
1 1153 . 24 1 1 A 94 94 VAL H H 228 7.918 8.509 -0.591 1
1 1154 . 24 1 1 A 94 94 VAL HA H 228 4.857 4.743 0.114 1
1 1162 . 24 1 1 A 94 94 VAL C C 228 176.556 175.692 0.864 1
1 1163 . 24 1 1 A 94 94 VAL CA C 228 60.309 60.513 -0.204 1
1 1164 . 24 1 1 A 94 94 VAL CB C 228 33.847 35.080 -1.233 1
1 1167 . 24 1 1 A 94 94 VAL N N 228 119.768 126.234 -6.466 1
1 1168 . 24 1 1 A 95 95 SER H H 229 9.659 9.429 0.230 1
1 1169 . 24 1 1 A 95 95 SER HA H 229 4.313 4.640 -0.327 1
1 1172 . 24 1 1 A 95 95 SER C C 229 174.641 174.494 0.147 1
1 1173 . 24 1 1 A 95 95 SER CA C 229 59.208 57.832 1.376 1
1 1174 . 24 1 1 A 95 95 SER CB C 229 66.080 65.606 0.474 1
1 1175 . 24 1 1 A 95 95 SER N N 229 124.903 121.421 3.482 1
1 1176 . 24 1 1 A 96 96 GLU H H 230 8.014 8.396 -0.382 1
1 1177 . 24 1 1 A 96 96 GLU HA H 230 4.376 4.304 0.072 1
1 1182 . 24 1 1 A 96 96 GLU C C 230 176.641 175.933 0.708 1
1 1183 . 24 1 1 A 96 96 GLU CA C 230 56.236 56.007 0.229 1
1 1184 . 24 1 1 A 96 96 GLU CB C 230 30.324 30.424 -0.100 1
1 1186 . 24 1 1 A 96 96 GLU N N 230 115.510 119.250 -3.740 1
1 1187 . 24 1 1 A 97 97 VAL H H 231 8.741 8.330 0.411 1
1 1188 . 24 1 1 A 97 97 VAL HA H 231 4.171 4.136 0.035 1
1 1196 . 24 1 1 A 97 97 VAL C C 231 176.684 175.584 1.100 1
1 1197 . 24 1 1 A 97 97 VAL CA C 231 65.418 63.149 2.269 1
1 1198 . 24 1 1 A 97 97 VAL CB C 231 31.218 31.623 -0.405 1
1 1201 . 24 1 1 A 97 97 VAL N N 231 121.289 120.672 0.617 1
1 1202 . 24 1 1 A 98 98 VAL H H 232 9.218 9.558 -0.340 1
1 1203 . 24 1 1 A 98 98 VAL HA H 232 4.405 4.666 -0.261 1
1 1211 . 24 1 1 A 98 98 VAL C C 232 174.258 174.555 -0.297 1
1 1212 . 24 1 1 A 98 98 VAL CA C 232 60.937 61.202 -0.265 1
1 1213 . 24 1 1 A 98 98 VAL CB C 232 35.825 33.916 1.909 1
1 1216 . 24 1 1 A 98 98 VAL N N 232 130.544 128.819 1.725 1
1 1217 . 24 1 1 A 99 99 LYS H H 233 8.800 8.917 -0.117 1
1 1218 . 24 1 1 A 99 99 LYS HA H 233 4.853 5.089 -0.236 1
1 1227 . 24 1 1 A 99 99 LYS C C 233 175.274 175.156 0.118 1
1 1228 . 24 1 1 A 99 99 LYS CA C 233 55.499 55.047 0.452 1
1 1229 . 24 1 1 A 99 99 LYS CB C 233 34.452 34.500 -0.048 1
1 1233 . 24 1 1 A 99 99 LYS N N 233 130.477 128.379 2.098 1
1 1234 . 24 1 1 A 100 100 SER H H 234 9.585 8.971 0.614 1
1 1235 . 24 1 1 A 100 100 SER HA H 234 5.150 4.906 0.244 1
1 1238 . 24 1 1 A 100 100 SER C C 234 175.493 174.055 1.438 1
1 1239 . 24 1 1 A 100 100 SER CA C 234 56.927 57.527 -0.600 1
1 1240 . 24 1 1 A 100 100 SER CB C 234 67.309 67.442 -0.133 1
1 1241 . 24 1 1 A 100 100 SER N N 234 125.814 123.238 2.576 1
1 1242 . 24 1 1 A 101 101 SER H H 235 8.631 8.404 0.227 1
1 1243 . 24 1 1 A 101 101 SER HA H 235 4.106 4.078 0.028 1
1 1246 . 24 1 1 A 101 101 SER C C 235 175.385 175.430 -0.045 1
1 1247 . 24 1 1 A 101 101 SER CA C 235 61.123 61.515 -0.392 1
1 1248 . 24 1 1 A 101 101 SER CB C 235 62.818 62.582 0.236 1
1 1249 . 24 1 1 A 101 101 SER N N 235 115.089 117.212 -2.123 1
1 1250 . 24 1 1 A 102 102 PHE H H 236 8.957 7.639 1.318 1
1 1251 . 24 1 1 A 102 102 PHE HA H 236 4.610 4.612 -0.002 1
1 1259 . 24 1 1 A 102 102 PHE C C 236 176.453 175.794 0.659 1
1 1260 . 24 1 1 A 102 102 PHE CA C 236 58.382 58.097 0.285 1
1 1261 . 24 1 1 A 102 102 PHE CB C 236 40.275 39.475 0.800 1
1 1263 . 24 1 1 A 102 102 PHE N N 236 119.917 117.653 2.264 1
1 1264 . 24 1 1 A 103 103 GLY H H 237 7.377 7.308 0.069 1
1 1265 . 24 1 1 A 103 103 GLY HA2 H 237 4.453 3.974 0.479 1
1 1266 . 24 1 1 A 103 103 GLY HA3 H 237 3.472 4.135 -0.663 1
1 1267 . 24 1 1 A 103 103 GLY C C 237 169.627 172.420 -2.793 1
1 1268 . 24 1 1 A 103 103 GLY CA C 237 45.384 44.567 0.817 1
1 1269 . 24 1 1 A 103 103 GLY N N 237 108.809 106.220 2.589 1
1 1270 . 24 1 1 A 104 104 TYR H H 238 8.632 8.489 0.143 1
1 1271 . 24 1 1 A 104 104 TYR HA H 238 5.322 5.580 -0.258 1
1 1278 . 24 1 1 A 104 104 TYR C C 238 175.043 175.189 -0.146 1
1 1279 . 24 1 1 A 104 104 TYR CA C 238 57.627 56.921 0.706 1
1 1280 . 24 1 1 A 104 104 TYR CB C 238 41.711 41.547 0.164 1
1 1283 . 24 1 1 A 104 104 TYR N N 238 120.030 121.641 -1.611 1
1 1284 . 24 1 1 A 105 105 HIS H H 239 10.070 9.683 0.387 1
1 1285 . 24 1 1 A 105 105 HIS HA H 239 6.046 5.772 0.274 1
1 1290 . 24 1 1 A 105 105 HIS C C 239 175.734 175.040 0.694 1
1 1291 . 24 1 1 A 105 105 HIS CA C 239 53.945 54.130 -0.185 1
1 1292 . 24 1 1 A 105 105 HIS CB C 239 32.450 33.618 -1.168 1
1 1295 . 24 1 1 A 105 105 HIS N N 239 119.504 120.378 -0.874 1
1 1296 . 24 1 1 A 106 106 ILE H H 240 8.660 9.000 -0.340 1
1 1297 . 24 1 1 A 106 106 ILE HA H 240 4.120 4.944 -0.824 1
1 1307 . 24 1 1 A 106 106 ILE C C 240 174.758 175.298 -0.540 1
1 1308 . 24 1 1 A 106 106 ILE CA C 240 63.446 60.013 3.433 1
1 1309 . 24 1 1 A 106 106 ILE CB C 240 40.786 41.196 -0.410 1
1 1313 . 24 1 1 A 106 106 ILE N N 240 120.639 120.139 0.500 1
1 1314 . 24 1 1 A 107 107 ILE H H 241 9.033 9.219 -0.186 1
1 1315 . 24 1 1 A 107 107 ILE HA H 241 4.799 5.071 -0.272 1
1 1325 . 24 1 1 A 107 107 ILE C C 241 172.880 174.204 -1.324 1
1 1326 . 24 1 1 A 107 107 ILE CA C 241 60.563 59.565 0.998 1
1 1327 . 24 1 1 A 107 107 ILE CB C 241 41.652 40.745 0.907 1
1 1331 . 24 1 1 A 107 107 ILE N N 241 129.098 127.187 1.911 1
1 1332 . 24 1 1 A 108 108 LYS H H 242 8.692 9.105 -0.413 1
1 1333 . 24 1 1 A 108 108 LYS HA H 242 5.012 5.017 -0.005 1
1 1342 . 24 1 1 A 108 108 LYS C C 242 174.484 175.461 -0.977 1
1 1343 . 24 1 1 A 108 108 LYS CA C 242 54.317 54.157 0.160 1
1 1344 . 24 1 1 A 108 108 LYS CB C 242 35.619 35.337 0.282 1
1 1348 . 24 1 1 A 108 108 LYS N N 242 127.179 127.284 -0.105 1
1 1349 . 24 1 1 A 109 109 ALA H H 243 7.816 8.875 -1.059 1
1 1350 . 24 1 1 A 109 109 ALA HA H 243 4.604 4.537 0.067 1
1 1354 . 24 1 1 A 109 109 ALA C C 243 176.231 176.569 -0.338 1
1 1355 . 24 1 1 A 109 109 ALA CA C 243 50.505 51.349 -0.844 1
1 1356 . 24 1 1 A 109 109 ALA CB C 243 19.584 19.463 0.121 1
1 1357 . 24 1 1 A 109 109 ALA N N 243 129.619 128.492 1.127 1
1 1358 . 24 1 1 A 110 110 ASP H H 244 7.578 8.747 -1.169 1
1 1359 . 24 1 1 A 110 110 ASP HA H 244 4.424 4.581 -0.157 1
1 1362 . 24 1 1 A 110 110 ASP C C 244 175.259 174.906 0.353 1
1 1363 . 24 1 1 A 110 110 ASP CA C 244 54.489 53.079 1.410 1
1 1364 . 24 1 1 A 110 110 ASP CB C 244 42.693 42.378 0.315 1
1 1365 . 24 1 1 A 110 110 ASP N N 244 125.434 121.471 3.963 1
1 4 . 25 1 1 A 2 2 PRO HA H -4 4.403 4.542 -0.139 1
1 11 . 25 1 1 A 2 2 PRO C C -4 176.990 177.062 -0.072 1
1 12 . 25 1 1 A 2 2 PRO CA C -4 63.131 62.519 0.612 1
1 13 . 25 1 1 A 2 2 PRO CB C -4 32.342 32.454 -0.112 1
1 16 . 25 1 1 A 3 3 LEU H H -3 8.483 8.307 0.176 1
1 17 . 25 1 1 A 3 3 LEU HA H -3 4.333 4.124 0.209 1
1 27 . 25 1 1 A 3 3 LEU C C -3 177.991 176.581 1.410 1
1 28 . 25 1 1 A 3 3 LEU CA C -3 55.314 55.772 -0.458 1
1 29 . 25 1 1 A 3 3 LEU CB C -3 42.244 42.149 0.095 1
1 33 . 25 1 1 A 3 3 LEU N N -3 122.986 120.179 2.807 1
1 34 . 25 1 1 A 4 4 GLY H H -2 8.397 7.510 0.887 1
1 35 . 25 1 1 A 4 4 GLY HA2 H -2 4.024 4.010 0.014 1
1 36 . 25 1 1 A 4 4 GLY HA3 H -2 3.976 4.011 -0.035 1
1 37 . 25 1 1 A 4 4 GLY C C -2 174.360 171.535 2.825 1
1 38 . 25 1 1 A 4 4 GLY CA C -2 45.434 45.466 -0.032 1
1 39 . 25 1 1 A 4 4 GLY N N -2 110.666 107.457 3.209 1
1 56 . 25 1 1 A 7 7 SER H H 141 7.913 7.589 0.324 1
1 57 . 25 1 1 A 7 7 SER HA H 141 5.657 5.334 0.323 1
1 60 . 25 1 1 A 7 7 SER C C 141 173.753 172.477 1.276 1
1 61 . 25 1 1 A 7 7 SER CA C 141 56.758 57.783 -1.025 1
1 62 . 25 1 1 A 7 7 SER CB C 141 66.774 65.842 0.932 1
1 63 . 25 1 1 A 7 7 SER N N 141 113.824 110.594 3.230 1
1 64 . 25 1 1 A 8 8 LYS H H 142 8.656 8.471 0.185 1
1 65 . 25 1 1 A 8 8 LYS HA H 142 4.543 5.154 -0.611 1
1 74 . 25 1 1 A 8 8 LYS C C 142 174.403 174.620 -0.217 1
1 75 . 25 1 1 A 8 8 LYS CA C 142 55.578 54.530 1.048 1
1 76 . 25 1 1 A 8 8 LYS CB C 142 36.561 36.086 0.475 1
1 80 . 25 1 1 A 8 8 LYS N N 142 123.076 119.511 3.565 1
1 81 . 25 1 1 A 9 9 LYS H H 143 8.623 8.513 0.110 1
1 82 . 25 1 1 A 9 9 LYS HA H 143 4.119 4.492 -0.373 1
1 91 . 25 1 1 A 9 9 LYS C C 143 176.144 175.589 0.555 1
1 92 . 25 1 1 A 9 9 LYS CA C 143 56.683 56.236 0.447 1
1 93 . 25 1 1 A 9 9 LYS CB C 143 32.580 32.766 -0.186 1
1 97 . 25 1 1 A 9 9 LYS N N 143 129.542 123.268 6.274 1
1 98 . 25 1 1 A 10 10 ALA H H 144 8.151 8.677 -0.526 1
1 99 . 25 1 1 A 10 10 ALA HA H 144 5.208 4.890 0.318 1
1 103 . 25 1 1 A 10 10 ALA C C 144 175.577 175.077 0.500 1
1 104 . 25 1 1 A 10 10 ALA CA C 144 51.226 51.255 -0.029 1
1 105 . 25 1 1 A 10 10 ALA CB C 144 25.299 24.049 1.250 1
1 106 . 25 1 1 A 10 10 ALA N N 144 127.933 127.832 0.101 1
1 107 . 25 1 1 A 11 11 SER H H 145 8.679 8.811 -0.132 1
1 108 . 25 1 1 A 11 11 SER HA H 145 5.431 5.781 -0.350 1
1 111 . 25 1 1 A 11 11 SER C C 145 173.072 173.136 -0.064 1
1 112 . 25 1 1 A 11 11 SER CA C 145 57.772 56.950 0.822 1
1 113 . 25 1 1 A 11 11 SER CB C 145 67.301 66.110 1.191 1
1 114 . 25 1 1 A 11 11 SER N N 145 116.245 115.511 0.734 1
1 115 . 25 1 1 A 12 12 HIS H H 146 9.962 9.551 0.411 1
1 116 . 25 1 1 A 12 12 HIS HA H 146 6.332 6.021 0.311 1
1 121 . 25 1 1 A 12 12 HIS C C 146 173.006 172.454 0.552 1
1 122 . 25 1 1 A 12 12 HIS CA C 146 55.020 54.312 0.708 1
1 123 . 25 1 1 A 12 12 HIS CB C 146 37.071 33.291 3.780 1
1 126 . 25 1 1 A 12 12 HIS N N 146 119.181 118.512 0.669 1
1 127 . 25 1 1 A 13 13 ILE H H 147 8.976 8.959 0.017 1
1 128 . 25 1 1 A 13 13 ILE HA H 147 3.528 4.535 -1.007 1
1 138 . 25 1 1 A 13 13 ILE C C 147 173.010 173.897 -0.887 1
1 139 . 25 1 1 A 13 13 ILE CA C 147 61.273 59.607 1.666 1
1 140 . 25 1 1 A 13 13 ILE CB C 147 41.773 41.777 -0.004 1
1 144 . 25 1 1 A 13 13 ILE N N 147 121.873 119.342 2.531 1
1 145 . 25 1 1 A 14 14 LEU H H 148 7.627 8.905 -1.278 1
1 146 . 25 1 1 A 14 14 LEU HA H 148 4.814 5.031 -0.217 1
1 156 . 25 1 1 A 14 14 LEU C C 148 174.112 174.304 -0.192 1
1 157 . 25 1 1 A 14 14 LEU CA C 148 52.574 53.042 -0.468 1
1 158 . 25 1 1 A 14 14 LEU CB C 148 45.643 44.895 0.748 1
1 162 . 25 1 1 A 14 14 LEU N N 148 127.112 129.569 -2.457 1
1 163 . 25 1 1 A 15 15 ILE H H 149 9.524 9.204 0.320 1
1 164 . 25 1 1 A 15 15 ILE HA H 149 4.362 4.634 -0.272 1
1 174 . 25 1 1 A 15 15 ILE C C 149 175.452 175.465 -0.013 1
1 175 . 25 1 1 A 15 15 ILE CA C 149 58.516 60.753 -2.237 1
1 176 . 25 1 1 A 15 15 ILE CB C 149 36.560 39.665 -3.105 1
1 180 . 25 1 1 A 15 15 ILE N N 149 128.652 127.150 1.502 1
1 181 . 25 1 1 A 16 16 LYS H H 150 8.035 8.634 -0.599 1
1 182 . 25 1 1 A 16 16 LYS HA H 150 4.319 4.450 -0.131 1
1 191 . 25 1 1 A 16 16 LYS C C 150 175.038 176.310 -1.272 1
1 192 . 25 1 1 A 16 16 LYS CA C 150 57.817 56.692 1.125 1
1 193 . 25 1 1 A 16 16 LYS CB C 150 34.853 32.733 2.120 1
1 197 . 25 1 1 A 16 16 LYS N N 150 129.153 127.952 1.201 1
1 198 . 25 1 1 A 17 17 VAL H H 151 8.016 8.821 -0.805 1
1 199 . 25 1 1 A 17 17 VAL HA H 151 4.873 4.819 0.054 1
1 207 . 25 1 1 A 17 17 VAL C C 151 176.647 176.064 0.583 1
1 208 . 25 1 1 A 17 17 VAL CA C 151 60.088 61.864 -1.776 1
1 209 . 25 1 1 A 17 17 VAL CB C 151 34.082 32.517 1.565 1
1 212 . 25 1 1 A 17 17 VAL N N 151 121.288 124.719 -3.431 1
1 213 . 25 1 1 A 18 18 LYS H H 152 8.443 8.969 -0.526 1
1 214 . 25 1 1 A 18 18 LYS HA H 152 4.334 4.892 -0.558 1
1 223 . 25 1 1 A 18 18 LYS C C 152 176.345 175.870 0.475 1
1 224 . 25 1 1 A 18 18 LYS CA C 152 57.016 54.135 2.881 1
1 225 . 25 1 1 A 18 18 LYS CB C 152 33.222 36.775 -3.553 1
1 229 . 25 1 1 A 18 18 LYS N N 152 128.408 126.493 1.915 1
1 230 . 25 1 1 A 19 19 SER H H 153 9.067 8.825 0.242 1
1 231 . 25 1 1 A 19 19 SER HA H 153 4.457 4.596 -0.139 1
1 234 . 25 1 1 A 19 19 SER C C 153 174.236 174.910 -0.674 1
1 235 . 25 1 1 A 19 19 SER CA C 153 59.642 57.745 1.897 1
1 236 . 25 1 1 A 19 19 SER CB C 153 64.347 62.366 1.981 1
1 237 . 25 1 1 A 19 19 SER N N 153 121.522 115.125 6.397 1
1 238 . 25 1 1 A 20 20 LYS H H 154 7.961 8.451 -0.490 1
1 239 . 25 1 1 A 20 20 LYS HA H 154 4.558 3.888 0.670 1
1 244 . 25 1 1 A 20 20 LYS C C 154 177.256 178.310 -1.054 1
1 245 . 25 1 1 A 20 20 LYS CA C 154 55.249 59.595 -4.346 1
1 246 . 25 1 1 A 20 20 LYS CB C 154 34.531 32.328 2.203 1
1 248 . 25 1 1 A 20 20 LYS N N 154 120.270 125.555 -5.285 1
1 249 . 25 1 1 A 21 21 LYS HA H 155 4.003 4.146 -0.143 1
1 258 . 25 1 1 A 21 21 LYS C C 155 177.015 177.268 -0.253 1
1 259 . 25 1 1 A 21 21 LYS CA C 155 59.091 58.654 0.437 1
1 260 . 25 1 1 A 21 21 LYS CB C 155 32.394 32.344 0.050 1
1 264 . 25 1 1 A 22 22 SER H H 156 7.625 7.838 -0.213 1
1 265 . 25 1 1 A 22 22 SER HA H 156 4.293 4.566 -0.273 1
1 268 . 25 1 1 A 22 22 SER C C 156 174.843 173.686 1.157 1
1 269 . 25 1 1 A 22 22 SER CA C 156 57.966 59.560 -1.594 1
1 270 . 25 1 1 A 22 22 SER CB C 156 63.369 65.496 -2.127 1
1 271 . 25 1 1 A 22 22 SER N N 156 109.549 112.075 -2.526 1
1 272 . 25 1 1 A 23 23 ASP H H 157 7.701 7.997 -0.296 1
1 273 . 25 1 1 A 23 23 ASP HA H 157 4.548 4.893 -0.345 1
1 276 . 25 1 1 A 23 23 ASP C C 157 176.544 176.689 -0.145 1
1 277 . 25 1 1 A 23 23 ASP CA C 157 55.242 53.140 2.102 1
1 278 . 25 1 1 A 23 23 ASP CB C 157 41.103 42.473 -1.370 1
1 279 . 25 1 1 A 23 23 ASP N N 157 124.536 120.570 3.966 1
1 280 . 25 1 1 A 24 24 LYS H H 158 8.583 9.176 -0.593 1
1 281 . 25 1 1 A 24 24 LYS HA H 158 4.252 4.240 0.012 1
1 290 . 25 1 1 A 24 24 LYS C C 158 176.813 177.067 -0.254 1
1 291 . 25 1 1 A 24 24 LYS CA C 158 57.148 57.425 -0.277 1
1 292 . 25 1 1 A 24 24 LYS CB C 158 33.200 32.557 0.643 1
1 296 . 25 1 1 A 24 24 LYS N N 158 122.372 126.834 -4.462 1
1 297 . 25 1 1 A 25 25 GLU H H 159 8.001 8.259 -0.258 1
1 298 . 25 1 1 A 25 25 GLU HA H 159 4.521 4.328 0.193 1
1 303 . 25 1 1 A 25 25 GLU C C 159 175.995 176.963 -0.968 1
1 304 . 25 1 1 A 25 25 GLU CA C 159 55.727 57.942 -2.215 1
1 305 . 25 1 1 A 25 25 GLU CB C 159 31.918 30.999 0.919 1
1 307 . 25 1 1 A 25 25 GLU N N 159 118.705 119.455 -0.750 1
1 308 . 25 1 1 A 26 26 GLY H H 160 8.458 7.871 0.587 1
1 309 . 25 1 1 A 26 26 GLY HA2 H 160 3.946 4.067 -0.121 1
1 310 . 25 1 1 A 26 26 GLY HA3 H 160 3.511 4.072 -0.561 1
1 311 . 25 1 1 A 26 26 GLY C C 160 172.201 172.623 -0.422 1
1 312 . 25 1 1 A 26 26 GLY CA C 160 44.038 44.989 -0.951 1
1 313 . 25 1 1 A 26 26 GLY N N 160 107.642 108.769 -1.127 1
1 314 . 25 1 1 A 27 27 LEU H H 161 8.259 8.805 -0.546 1
1 315 . 25 1 1 A 27 27 LEU HA H 161 4.775 5.028 -0.253 1
1 325 . 25 1 1 A 27 27 LEU C C 161 177.422 175.452 1.970 1
1 326 . 25 1 1 A 27 27 LEU CA C 161 53.322 53.394 -0.072 1
1 327 . 25 1 1 A 27 27 LEU CB C 161 45.576 44.048 1.528 1
1 331 . 25 1 1 A 27 27 LEU N N 161 119.856 122.683 -2.827 1
1 332 . 25 1 1 A 28 28 ASP H H 162 8.848 8.607 0.241 1
1 333 . 25 1 1 A 28 28 ASP HA H 162 4.644 4.596 0.048 1
1 336 . 25 1 1 A 28 28 ASP C C 162 176.630 177.032 -0.402 1
1 337 . 25 1 1 A 28 28 ASP CA C 162 55.195 54.346 0.849 1
1 338 . 25 1 1 A 28 28 ASP CB C 162 41.673 42.535 -0.862 1
1 339 . 25 1 1 A 28 28 ASP N N 162 122.434 122.506 -0.072 1
1 340 . 25 1 1 A 29 29 ASP H H 163 8.720 9.137 -0.417 1
1 341 . 25 1 1 A 29 29 ASP HA H 163 4.386 4.360 0.026 1
1 344 . 25 1 1 A 29 29 ASP C C 163 176.604 177.920 -1.316 1
1 345 . 25 1 1 A 29 29 ASP CA C 163 59.690 58.495 1.195 1
1 346 . 25 1 1 A 29 29 ASP CB C 163 42.964 41.412 1.552 1
1 347 . 25 1 1 A 29 29 ASP N N 163 121.460 126.329 -4.869 1
1 348 . 25 1 1 A 30 30 LYS H H 164 8.434 7.614 0.820 1
1 349 . 25 1 1 A 30 30 LYS HA H 164 3.901 3.953 -0.052 1
1 358 . 25 1 1 A 30 30 LYS C C 164 179.479 178.935 0.544 1
1 359 . 25 1 1 A 30 30 LYS CA C 164 60.047 59.432 0.615 1
1 360 . 25 1 1 A 30 30 LYS CB C 164 32.038 32.231 -0.193 1
1 364 . 25 1 1 A 30 30 LYS N N 164 116.627 119.665 -3.038 1
1 365 . 25 1 1 A 31 31 GLU H H 165 7.755 8.461 -0.706 1
1 366 . 25 1 1 A 31 31 GLU HA H 165 3.998 4.031 -0.033 1
1 371 . 25 1 1 A 31 31 GLU C C 165 179.031 179.106 -0.075 1
1 372 . 25 1 1 A 31 31 GLU CA C 165 59.335 59.179 0.156 1
1 373 . 25 1 1 A 31 31 GLU CB C 165 29.972 29.731 0.241 1
1 375 . 25 1 1 A 31 31 GLU N N 165 120.456 119.865 0.591 1
1 376 . 25 1 1 A 32 32 ALA H H 166 9.060 8.632 0.428 1
1 377 . 25 1 1 A 32 32 ALA HA H 166 3.871 4.025 -0.154 1
1 381 . 25 1 1 A 32 32 ALA C C 166 178.029 179.027 -0.998 1
1 382 . 25 1 1 A 32 32 ALA CA C 166 54.997 55.395 -0.398 1
1 383 . 25 1 1 A 32 32 ALA CB C 166 19.727 18.332 1.395 1
1 384 . 25 1 1 A 32 32 ALA N N 166 124.406 122.329 2.077 1
1 385 . 25 1 1 A 33 33 LYS H H 167 8.228 7.655 0.573 1
1 386 . 25 1 1 A 33 33 LYS HA H 167 2.595 2.951 -0.356 1
1 395 . 25 1 1 A 33 33 LYS C C 167 177.938 178.012 -0.074 1
1 396 . 25 1 1 A 33 33 LYS CA C 167 59.573 59.224 0.349 1
1 397 . 25 1 1 A 33 33 LYS CB C 167 32.098 32.174 -0.076 1
1 401 . 25 1 1 A 33 33 LYS N N 167 119.833 118.215 1.618 1
1 402 . 25 1 1 A 34 34 GLN H H 168 7.392 7.786 -0.394 1
1 403 . 25 1 1 A 34 34 GLN HA H 168 3.943 3.939 0.004 1
1 410 . 25 1 1 A 34 34 GLN C C 168 178.323 178.333 -0.010 1
1 411 . 25 1 1 A 34 34 GLN CA C 168 58.883 59.239 -0.356 1
1 412 . 25 1 1 A 34 34 GLN CB C 168 28.485 28.082 0.403 1
1 414 . 25 1 1 A 34 34 GLN N N 168 117.208 117.940 -0.732 1
1 416 . 25 1 1 A 35 35 LYS H H 169 7.994 7.968 0.026 1
1 417 . 25 1 1 A 35 35 LYS HA H 169 4.067 3.960 0.107 1
1 426 . 25 1 1 A 35 35 LYS C C 169 178.161 178.653 -0.492 1
1 427 . 25 1 1 A 35 35 LYS CA C 169 58.437 59.227 -0.790 1
1 428 . 25 1 1 A 35 35 LYS CB C 169 31.611 32.240 -0.629 1
1 432 . 25 1 1 A 35 35 LYS N N 169 120.898 119.555 1.343 1
1 433 . 25 1 1 A 36 36 ALA H H 170 8.431 8.219 0.212 1
1 434 . 25 1 1 A 36 36 ALA HA H 170 3.738 4.010 -0.272 1
1 438 . 25 1 1 A 36 36 ALA C C 170 178.862 179.476 -0.614 1
1 439 . 25 1 1 A 36 36 ALA CA C 170 55.351 55.326 0.025 1
1 440 . 25 1 1 A 36 36 ALA CB C 170 18.295 18.243 0.052 1
1 441 . 25 1 1 A 36 36 ALA N N 170 120.641 120.324 0.317 1
1 442 . 25 1 1 A 37 37 GLU H H 171 8.412 8.113 0.299 1
1 443 . 25 1 1 A 37 37 GLU HA H 171 3.867 3.946 -0.079 1
1 448 . 25 1 1 A 37 37 GLU C C 171 179.255 179.281 -0.026 1
1 449 . 25 1 1 A 37 37 GLU CA C 171 59.543 59.545 -0.002 1
1 450 . 25 1 1 A 37 37 GLU CB C 171 29.569 29.647 -0.078 1
1 452 . 25 1 1 A 37 37 GLU N N 171 118.224 117.895 0.329 1
1 453 . 25 1 1 A 38 38 GLU H H 172 8.019 8.526 -0.507 1
1 454 . 25 1 1 A 38 38 GLU HA H 172 3.952 4.076 -0.124 1
1 459 . 25 1 1 A 38 38 GLU C C 172 180.250 178.077 2.173 1
1 460 . 25 1 1 A 38 38 GLU CA C 172 59.627 59.033 0.594 1
1 461 . 25 1 1 A 38 38 GLU CB C 172 29.368 28.236 1.132 1
1 463 . 25 1 1 A 38 38 GLU N N 172 121.250 118.513 2.737 1
1 464 . 25 1 1 A 39 39 ILE H H 173 8.174 7.188 0.986 1
1 465 . 25 1 1 A 39 39 ILE HA H 173 3.643 3.780 -0.137 1
1 475 . 25 1 1 A 39 39 ILE C C 173 177.568 178.018 -0.450 1
1 476 . 25 1 1 A 39 39 ILE CA C 173 64.869 63.937 0.932 1
1 477 . 25 1 1 A 39 39 ILE CB C 173 38.160 37.596 0.564 1
1 481 . 25 1 1 A 39 39 ILE N N 173 121.527 118.484 3.043 1
1 482 . 25 1 1 A 40 40 GLN H H 174 8.860 8.324 0.536 1
1 483 . 25 1 1 A 40 40 GLN HA H 174 3.533 3.967 -0.434 1
1 490 . 25 1 1 A 40 40 GLN C C 174 179.022 178.461 0.561 1
1 491 . 25 1 1 A 40 40 GLN CA C 174 61.316 59.294 2.022 1
1 492 . 25 1 1 A 40 40 GLN CB C 174 26.604 28.268 -1.664 1
1 494 . 25 1 1 A 40 40 GLN N N 174 121.956 121.127 0.829 1
1 496 . 25 1 1 A 41 41 LYS H H 175 7.879 8.126 -0.247 1
1 497 . 25 1 1 A 41 41 LYS HA H 175 3.777 4.128 -0.351 1
1 506 . 25 1 1 A 41 41 LYS C C 175 178.779 178.528 0.251 1
1 507 . 25 1 1 A 41 41 LYS CA C 175 59.701 58.515 1.186 1
1 508 . 25 1 1 A 41 41 LYS CB C 175 32.581 31.343 1.238 1
1 512 . 25 1 1 A 41 41 LYS N N 175 119.012 118.311 0.701 1
1 513 . 25 1 1 A 42 42 GLU H H 176 7.447 7.880 -0.433 1
1 514 . 25 1 1 A 42 42 GLU HA H 176 4.059 4.221 -0.162 1
1 519 . 25 1 1 A 42 42 GLU C C 176 180.058 178.856 1.202 1
1 520 . 25 1 1 A 42 42 GLU CA C 176 59.456 58.602 0.854 1
1 521 . 25 1 1 A 42 42 GLU CB C 176 29.923 30.186 -0.263 1
1 523 . 25 1 1 A 42 42 GLU N N 176 120.054 118.583 1.471 1
1 524 . 25 1 1 A 43 43 VAL H H 177 8.618 8.055 0.563 1
1 525 . 25 1 1 A 43 43 VAL HA H 177 3.986 3.885 0.101 1
1 533 . 25 1 1 A 43 43 VAL C C 177 176.459 177.654 -1.195 1
1 534 . 25 1 1 A 43 43 VAL CA C 177 63.923 64.863 -0.940 1
1 535 . 25 1 1 A 43 43 VAL CB C 177 31.899 31.330 0.569 1
1 538 . 25 1 1 A 43 43 VAL N N 177 114.191 117.077 -2.886 1
1 539 . 25 1 1 A 44 44 SER H H 178 8.052 8.280 -0.228 1
1 540 . 25 1 1 A 44 44 SER HA H 178 4.098 4.266 -0.168 1
1 543 . 25 1 1 A 44 44 SER C C 178 176.548 175.615 0.933 1
1 544 . 25 1 1 A 44 44 SER CA C 178 61.160 61.249 -0.089 1
1 545 . 25 1 1 A 44 44 SER CB C 178 62.959 62.621 0.338 1
1 546 . 25 1 1 A 44 44 SER N N 178 114.202 115.309 -1.107 1
1 547 . 25 1 1 A 45 45 LYS H H 179 7.083 7.994 -0.911 1
1 548 . 25 1 1 A 45 45 LYS HA H 179 4.140 4.372 -0.232 1
1 557 . 25 1 1 A 45 45 LYS C C 179 177.288 175.971 1.317 1
1 558 . 25 1 1 A 45 45 LYS CA C 179 58.469 57.716 0.753 1
1 559 . 25 1 1 A 45 45 LYS CB C 179 32.671 32.794 -0.123 1
1 563 . 25 1 1 A 45 45 LYS N N 179 120.935 117.655 3.280 1
1 564 . 25 1 1 A 46 46 ASP H H 180 7.098 7.905 -0.807 1
1 565 . 25 1 1 A 46 46 ASP HA H 180 4.917 5.002 -0.085 1
1 568 . 25 1 1 A 46 46 ASP CA C 180 51.492 51.655 -0.163 1
1 569 . 25 1 1 A 46 46 ASP CB C 180 40.595 41.338 -0.743 1
1 570 . 25 1 1 A 46 46 ASP N N 180 112.836 120.635 -7.799 1
1 571 . 25 1 1 A 47 47 PRO HA H 181 4.681 4.410 0.271 1
1 578 . 25 1 1 A 47 47 PRO C C 181 179.248 177.909 1.339 1
1 579 . 25 1 1 A 47 47 PRO CA C 181 64.718 64.570 0.148 1
1 580 . 25 1 1 A 47 47 PRO CB C 181 32.159 32.006 0.153 1
1 583 . 25 1 1 A 48 48 SER H H 182 8.248 7.851 0.397 1
1 584 . 25 1 1 A 48 48 SER HA H 182 4.378 4.316 0.062 1
1 587 . 25 1 1 A 48 48 SER C C 182 176.071 175.447 0.624 1
1 588 . 25 1 1 A 48 48 SER CA C 182 61.377 60.822 0.555 1
1 589 . 25 1 1 A 48 48 SER CB C 182 62.455 63.158 -0.703 1
1 590 . 25 1 1 A 48 48 SER N N 182 116.986 113.037 3.949 1
1 591 . 25 1 1 A 49 49 LYS H H 183 7.842 7.454 0.388 1
1 592 . 25 1 1 A 49 49 LYS HA H 183 4.482 4.293 0.189 1
1 601 . 25 1 1 A 49 49 LYS C C 183 175.605 177.683 -2.078 1
1 602 . 25 1 1 A 49 49 LYS CA C 183 55.824 57.010 -1.186 1
1 603 . 25 1 1 A 49 49 LYS CB C 183 32.834 32.643 0.191 1
1 607 . 25 1 1 A 49 49 LYS N N 183 121.698 119.746 1.952 1
1 608 . 25 1 1 A 50 50 PHE H H 184 7.634 7.680 -0.046 1
1 609 . 25 1 1 A 50 50 PHE HA H 184 3.510 4.284 -0.774 1
1 617 . 25 1 1 A 50 50 PHE C C 184 176.214 178.090 -1.876 1
1 618 . 25 1 1 A 50 50 PHE CA C 184 63.276 61.141 2.135 1
1 619 . 25 1 1 A 50 50 PHE CB C 184 40.948 38.964 1.984 1
1 623 . 25 1 1 A 50 50 PHE N N 184 120.120 121.693 -1.573 1
1 624 . 25 1 1 A 51 51 GLY H H 185 8.855 8.694 0.161 1
1 625 . 25 1 1 A 51 51 GLY HA2 H 185 3.993 3.983 0.010 1
1 626 . 25 1 1 A 51 51 GLY HA3 H 185 3.958 4.037 -0.079 1
1 627 . 25 1 1 A 51 51 GLY C C 185 175.169 175.400 -0.231 1
1 628 . 25 1 1 A 51 51 GLY CA C 185 47.475 46.442 1.033 1
1 629 . 25 1 1 A 51 51 GLY N N 185 105.550 105.950 -0.400 1
1 630 . 25 1 1 A 52 52 GLU H H 186 7.917 7.945 -0.028 1
1 631 . 25 1 1 A 52 52 GLU HA H 186 4.006 4.253 -0.247 1
1 636 . 25 1 1 A 52 52 GLU C C 186 179.499 179.082 0.417 1
1 637 . 25 1 1 A 52 52 GLU CA C 186 58.904 59.181 -0.277 1
1 638 . 25 1 1 A 52 52 GLU CB C 186 29.700 30.124 -0.424 1
1 640 . 25 1 1 A 52 52 GLU N N 186 121.929 120.080 1.849 1
1 641 . 25 1 1 A 53 53 ILE H H 187 7.936 8.135 -0.199 1
1 642 . 25 1 1 A 53 53 ILE HA H 187 3.648 3.661 -0.013 1
1 652 . 25 1 1 A 53 53 ILE C C 187 177.886 177.691 0.195 1
1 653 . 25 1 1 A 53 53 ILE CA C 187 64.366 65.171 -0.805 1
1 654 . 25 1 1 A 53 53 ILE CB C 187 36.478 37.653 -1.175 1
1 658 . 25 1 1 A 53 53 ILE N N 187 120.991 121.147 -0.156 1
1 659 . 25 1 1 A 54 54 ALA H H 188 8.895 8.574 0.321 1
1 660 . 25 1 1 A 54 54 ALA HA H 188 3.629 3.794 -0.165 1
1 664 . 25 1 1 A 54 54 ALA C C 188 179.437 179.159 0.278 1
1 665 . 25 1 1 A 54 54 ALA CA C 188 55.974 55.546 0.428 1
1 666 . 25 1 1 A 54 54 ALA CB C 188 17.591 18.380 -0.789 1
1 667 . 25 1 1 A 54 54 ALA N N 188 125.308 122.136 3.172 1
1 668 . 25 1 1 A 55 55 LYS H H 189 8.049 7.864 0.185 1
1 669 . 25 1 1 A 55 55 LYS HA H 189 4.106 3.896 0.210 1
1 678 . 25 1 1 A 55 55 LYS C C 189 178.995 178.452 0.543 1
1 679 . 25 1 1 A 55 55 LYS CA C 189 59.312 59.285 0.027 1
1 680 . 25 1 1 A 55 55 LYS CB C 189 32.647 32.061 0.586 1
1 684 . 25 1 1 A 55 55 LYS N N 189 116.835 118.327 -1.492 1
1 685 . 25 1 1 A 56 56 LYS H H 190 7.215 7.609 -0.394 1
1 686 . 25 1 1 A 56 56 LYS HA H 190 4.172 4.226 -0.054 1
1 695 . 25 1 1 A 56 56 LYS C C 190 177.897 178.055 -0.158 1
1 696 . 25 1 1 A 56 56 LYS CA C 190 58.418 58.504 -0.086 1
1 697 . 25 1 1 A 56 56 LYS CB C 190 34.652 33.233 1.419 1
1 701 . 25 1 1 A 56 56 LYS N N 190 117.170 118.070 -0.900 1
1 702 . 25 1 1 A 57 57 GLU H H 191 8.572 7.841 0.731 1
1 703 . 25 1 1 A 57 57 GLU HA H 191 4.643 4.362 0.281 1
1 708 . 25 1 1 A 57 57 GLU C C 191 177.903 176.042 1.861 1
1 709 . 25 1 1 A 57 57 GLU CA C 191 55.708 56.316 -0.608 1
1 710 . 25 1 1 A 57 57 GLU CB C 191 32.460 30.688 1.772 1
1 712 . 25 1 1 A 57 57 GLU N N 191 113.316 116.928 -3.612 1
1 713 . 25 1 1 A 58 58 SER H H 192 8.550 7.579 0.971 1
1 714 . 25 1 1 A 58 58 SER HA H 192 4.149 4.397 -0.248 1
1 717 . 25 1 1 A 58 58 SER C C 192 176.161 175.120 1.041 1
1 718 . 25 1 1 A 58 58 SER CA C 192 58.403 57.831 0.572 1
1 719 . 25 1 1 A 58 58 SER CB C 192 64.392 64.265 0.127 1
1 720 . 25 1 1 A 58 58 SER N N 192 109.861 115.673 -5.812 1
1 721 . 25 1 1 A 59 59 MET H H 193 9.533 8.939 0.594 1
1 722 . 25 1 1 A 59 59 MET HA H 193 4.457 4.493 -0.036 1
1 730 . 25 1 1 A 59 59 MET C C 193 175.204 175.928 -0.724 1
1 731 . 25 1 1 A 59 59 MET CA C 193 55.781 56.788 -1.007 1
1 732 . 25 1 1 A 59 59 MET CB C 193 32.855 33.297 -0.442 1
1 735 . 25 1 1 A 59 59 MET N N 193 124.493 123.734 0.759 1
1 736 . 25 1 1 A 60 60 ASP H H 194 7.514 7.386 0.128 1
1 737 . 25 1 1 A 60 60 ASP HA H 194 4.886 4.582 0.304 1
1 740 . 25 1 1 A 60 60 ASP C C 194 175.517 176.718 -1.201 1
1 741 . 25 1 1 A 60 60 ASP CA C 194 52.286 53.099 -0.813 1
1 742 . 25 1 1 A 60 60 ASP CB C 194 40.222 40.133 0.089 1
1 743 . 25 1 1 A 60 60 ASP N N 194 117.785 119.791 -2.006 1
1 744 . 25 1 1 A 61 61 THR H H 195 8.118 7.750 0.368 1
1 745 . 25 1 1 A 61 61 THR HA H 195 3.918 3.835 0.083 1
1 750 . 25 1 1 A 61 61 THR C C 195 176.269 177.185 -0.916 1
1 751 . 25 1 1 A 61 61 THR CA C 195 65.469 66.457 -0.988 1
1 752 . 25 1 1 A 61 61 THR CB C 195 68.741 68.530 0.211 1
1 754 . 25 1 1 A 61 61 THR N N 195 120.765 118.232 2.533 1
1 755 . 25 1 1 A 62 62 GLY H H 196 8.399 8.620 -0.221 1
1 756 . 25 1 1 A 62 62 GLY HA2 H 196 3.932 3.955 -0.023 1
1 757 . 25 1 1 A 62 62 GLY HA3 H 196 3.900 3.955 -0.055 1
1 758 . 25 1 1 A 62 62 GLY C C 196 174.948 175.022 -0.074 1
1 759 . 25 1 1 A 62 62 GLY CA C 196 46.768 46.617 0.151 1
1 760 . 25 1 1 A 62 62 GLY N N 196 108.183 108.244 -0.061 1
1 761 . 25 1 1 A 63 63 SER H H 197 7.265 8.048 -0.783 1
1 762 . 25 1 1 A 63 63 SER HA H 197 4.554 4.580 -0.026 1
1 765 . 25 1 1 A 63 63 SER C C 197 177.630 175.452 2.178 1
1 766 . 25 1 1 A 63 63 SER CA C 197 59.550 61.175 -1.625 1
1 767 . 25 1 1 A 63 63 SER CB C 197 65.504 64.218 1.286 1
1 768 . 25 1 1 A 63 63 SER N N 197 111.815 115.848 -4.033 1
1 769 . 25 1 1 A 64 64 ALA H H 198 8.675 8.591 0.084 1
1 770 . 25 1 1 A 64 64 ALA HA H 198 3.801 3.982 -0.181 1
1 774 . 25 1 1 A 64 64 ALA C C 198 178.492 179.340 -0.848 1
1 775 . 25 1 1 A 64 64 ALA CA C 198 56.794 55.341 1.453 1
1 776 . 25 1 1 A 64 64 ALA CB C 198 18.951 18.646 0.305 1
1 777 . 25 1 1 A 64 64 ALA N N 198 131.710 123.561 8.149 1
1 778 . 25 1 1 A 65 65 LYS H H 199 7.666 7.769 -0.103 1
1 779 . 25 1 1 A 65 65 LYS HA H 199 4.175 3.987 0.188 1
1 788 . 25 1 1 A 65 65 LYS C C 199 177.159 178.050 -0.891 1
1 789 . 25 1 1 A 65 65 LYS CA C 199 57.735 59.101 -1.366 1
1 790 . 25 1 1 A 65 65 LYS CB C 199 31.948 31.880 0.068 1
1 794 . 25 1 1 A 65 65 LYS N N 199 111.375 118.283 -6.908 1
1 795 . 25 1 1 A 66 66 LYS H H 200 7.545 7.438 0.107 1
1 796 . 25 1 1 A 66 66 LYS HA H 200 4.612 4.393 0.219 1
1 805 . 25 1 1 A 66 66 LYS C C 200 175.609 175.336 0.273 1
1 806 . 25 1 1 A 66 66 LYS CA C 200 54.468 56.322 -1.854 1
1 807 . 25 1 1 A 66 66 LYS CB C 200 31.525 32.435 -0.910 1
1 811 . 25 1 1 A 66 66 LYS N N 200 121.421 116.100 5.321 1
1 812 . 25 1 1 A 67 67 ASP H H 201 7.630 8.190 -0.560 1
1 813 . 25 1 1 A 67 67 ASP HA H 201 4.306 4.399 -0.093 1
1 816 . 25 1 1 A 67 67 ASP C C 201 175.025 176.390 -1.365 1
1 817 . 25 1 1 A 67 67 ASP CA C 201 56.400 55.361 1.039 1
1 818 . 25 1 1 A 67 67 ASP CB C 201 38.315 39.084 -0.769 1
1 819 . 25 1 1 A 67 67 ASP N N 201 116.216 116.640 -0.424 1
1 820 . 25 1 1 A 68 68 GLY H H 202 8.368 8.486 -0.118 1
1 821 . 25 1 1 A 68 68 GLY HA2 H 202 4.316 3.955 0.361 1
1 822 . 25 1 1 A 68 68 GLY HA3 H 202 3.731 4.051 -0.320 1
1 823 . 25 1 1 A 68 68 GLY C C 202 174.139 174.648 -0.509 1
1 824 . 25 1 1 A 68 68 GLY CA C 202 45.514 45.349 0.165 1
1 825 . 25 1 1 A 68 68 GLY N N 202 105.095 104.773 0.322 1
1 826 . 25 1 1 A 69 69 GLU H H 203 7.534 8.035 -0.501 1
1 827 . 25 1 1 A 69 69 GLU HA H 203 4.479 4.402 0.077 1
1 832 . 25 1 1 A 69 69 GLU C C 203 176.961 175.903 1.058 1
1 833 . 25 1 1 A 69 69 GLU CA C 203 58.549 56.495 2.054 1
1 834 . 25 1 1 A 69 69 GLU CB C 203 30.998 30.468 0.530 1
1 836 . 25 1 1 A 69 69 GLU N N 203 120.426 120.145 0.281 1
1 837 . 25 1 1 A 70 70 LEU H H 204 8.962 9.050 -0.088 1
1 838 . 25 1 1 A 70 70 LEU HA H 204 4.438 4.614 -0.176 1
1 848 . 25 1 1 A 70 70 LEU C C 204 178.648 177.168 1.480 1
1 849 . 25 1 1 A 70 70 LEU CA C 204 53.977 55.119 -1.142 1
1 850 . 25 1 1 A 70 70 LEU CB C 204 43.612 43.623 -0.011 1
1 854 . 25 1 1 A 70 70 LEU N N 204 122.066 123.756 -1.690 1
1 855 . 25 1 1 A 71 71 GLY H H 205 8.104 7.558 0.546 1
1 856 . 25 1 1 A 71 71 GLY HA2 H 205 4.165 3.936 0.229 1
1 857 . 25 1 1 A 71 71 GLY HA3 H 205 3.552 4.066 -0.514 1
1 858 . 25 1 1 A 71 71 GLY C C 205 173.098 173.293 -0.195 1
1 859 . 25 1 1 A 71 71 GLY CA C 205 44.723 44.931 -0.208 1
1 860 . 25 1 1 A 71 71 GLY N N 205 110.168 106.656 3.512 1
1 861 . 25 1 1 A 72 72 TYR H H 206 8.457 8.544 -0.087 1
1 862 . 25 1 1 A 72 72 TYR HA H 206 4.184 4.676 -0.492 1
1 869 . 25 1 1 A 72 72 TYR C C 206 175.975 175.461 0.514 1
1 870 . 25 1 1 A 72 72 TYR CA C 206 59.722 58.908 0.814 1
1 871 . 25 1 1 A 72 72 TYR CB C 206 38.378 38.356 0.022 1
1 874 . 25 1 1 A 72 72 TYR N N 206 120.171 122.017 -1.846 1
1 875 . 25 1 1 A 73 73 VAL H H 207 8.782 9.060 -0.278 1
1 876 . 25 1 1 A 73 73 VAL HA H 207 4.056 4.455 -0.399 1
1 884 . 25 1 1 A 73 73 VAL C C 207 174.901 175.927 -1.026 1
1 885 . 25 1 1 A 73 73 VAL CA C 207 62.202 62.666 -0.464 1
1 886 . 25 1 1 A 73 73 VAL CB C 207 33.071 32.270 0.801 1
1 889 . 25 1 1 A 73 73 VAL N N 207 128.847 125.274 3.573 1
1 890 . 25 1 1 A 74 74 LEU H H 208 8.146 8.792 -0.646 1
1 891 . 25 1 1 A 74 74 LEU HA H 208 4.944 4.447 0.497 1
1 901 . 25 1 1 A 74 74 LEU C C 208 178.400 177.521 0.879 1
1 902 . 25 1 1 A 74 74 LEU CA C 208 53.520 54.831 -1.311 1
1 903 . 25 1 1 A 74 74 LEU CB C 208 43.499 42.328 1.171 1
1 907 . 25 1 1 A 74 74 LEU N N 208 127.599 129.235 -1.636 1
1 908 . 25 1 1 A 75 75 LYS H H 209 8.403 8.524 -0.121 1
1 909 . 25 1 1 A 75 75 LYS HA H 209 3.771 3.947 -0.176 1
1 918 . 25 1 1 A 75 75 LYS C C 209 177.536 177.510 0.026 1
1 919 . 25 1 1 A 75 75 LYS CA C 209 58.385 58.989 -0.604 1
1 920 . 25 1 1 A 75 75 LYS CB C 209 32.459 32.192 0.267 1
1 924 . 25 1 1 A 75 75 LYS N N 209 123.798 123.249 0.549 1
1 925 . 25 1 1 A 76 76 GLY H H 210 9.997 9.354 0.643 1
1 926 . 25 1 1 A 76 76 GLY HA2 H 210 4.255 3.996 0.259 1
1 927 . 25 1 1 A 76 76 GLY HA3 H 210 3.791 3.997 -0.206 1
1 928 . 25 1 1 A 76 76 GLY C C 210 175.091 175.763 -0.672 1
1 929 . 25 1 1 A 76 76 GLY CA C 210 45.465 45.418 0.047 1
1 930 . 25 1 1 A 76 76 GLY N N 210 114.705 113.469 1.236 1
1 931 . 25 1 1 A 77 77 GLN H H 211 7.726 8.056 -0.330 1
1 932 . 25 1 1 A 77 77 GLN HA H 211 4.373 4.191 0.182 1
1 939 . 25 1 1 A 77 77 GLN C C 211 176.301 175.878 0.423 1
1 940 . 25 1 1 A 77 77 GLN CA C 211 57.074 57.575 -0.501 1
1 941 . 25 1 1 A 77 77 GLN CB C 211 30.798 29.309 1.489 1
1 943 . 25 1 1 A 77 77 GLN N N 211 118.702 117.953 0.749 1
1 945 . 25 1 1 A 78 78 THR H H 212 8.225 7.512 0.713 1
1 946 . 25 1 1 A 78 78 THR HA H 212 4.620 4.434 0.186 1
1 951 . 25 1 1 A 78 78 THR C C 212 173.920 174.343 -0.423 1
1 952 . 25 1 1 A 78 78 THR CA C 212 60.087 59.847 0.240 1
1 953 . 25 1 1 A 78 78 THR CB C 212 71.412 70.791 0.621 1
1 955 . 25 1 1 A 78 78 THR N N 212 111.935 111.453 0.482 1
1 956 . 25 1 1 A 79 79 ASP H H 213 8.372 8.560 -0.188 1
1 957 . 25 1 1 A 79 79 ASP HA H 213 4.470 4.587 -0.117 1
1 960 . 25 1 1 A 79 79 ASP C C 213 176.759 177.431 -0.672 1
1 961 . 25 1 1 A 79 79 ASP CA C 213 54.927 54.355 0.572 1
1 962 . 25 1 1 A 79 79 ASP CB C 213 43.859 41.647 2.212 1
1 963 . 25 1 1 A 79 79 ASP N N 213 122.093 121.453 0.640 1
1 964 . 25 1 1 A 80 80 LYS H H 214 8.740 8.808 -0.068 1
1 965 . 25 1 1 A 80 80 LYS HA H 214 4.027 4.018 0.009 1
1 974 . 25 1 1 A 80 80 LYS C C 214 178.493 178.059 0.434 1
1 975 . 25 1 1 A 80 80 LYS CA C 214 59.802 59.893 -0.091 1
1 976 . 25 1 1 A 80 80 LYS CB C 214 32.374 32.071 0.303 1
1 980 . 25 1 1 A 80 80 LYS N N 214 124.685 123.487 1.198 1
1 981 . 25 1 1 A 81 81 ASP H H 215 8.556 8.292 0.264 1
1 982 . 25 1 1 A 81 81 ASP HA H 215 4.566 4.368 0.198 1
1 985 . 25 1 1 A 81 81 ASP C C 215 178.889 178.814 0.075 1
1 986 . 25 1 1 A 81 81 ASP CA C 215 58.046 57.420 0.626 1
1 987 . 25 1 1 A 81 81 ASP CB C 215 40.872 40.384 0.488 1
1 988 . 25 1 1 A 81 81 ASP N N 215 121.413 119.388 2.025 1
1 989 . 25 1 1 A 82 82 PHE H H 216 8.205 8.350 -0.145 1
1 990 . 25 1 1 A 82 82 PHE HA H 216 3.686 4.055 -0.369 1
1 998 . 25 1 1 A 82 82 PHE C C 216 175.919 177.381 -1.462 1
1 999 . 25 1 1 A 82 82 PHE CA C 216 61.648 60.808 0.840 1
1 1000 . 25 1 1 A 82 82 PHE CB C 216 39.743 39.195 0.548 1
1 1004 . 25 1 1 A 82 82 PHE N N 216 124.401 122.635 1.766 1
1 1005 . 25 1 1 A 83 83 GLU H H 217 8.887 8.900 -0.013 1
1 1006 . 25 1 1 A 83 83 GLU HA H 217 3.704 4.137 -0.433 1
1 1011 . 25 1 1 A 83 83 GLU C C 217 177.788 178.881 -1.093 1
1 1012 . 25 1 1 A 83 83 GLU CA C 217 60.545 60.276 0.269 1
1 1013 . 25 1 1 A 83 83 GLU CB C 217 30.639 29.626 1.013 1
1 1015 . 25 1 1 A 83 83 GLU N N 217 119.421 119.073 0.348 1
1 1016 . 25 1 1 A 84 84 LYS H H 218 8.055 7.985 0.070 1
1 1017 . 25 1 1 A 84 84 LYS HA H 218 3.947 4.121 -0.174 1
1 1026 . 25 1 1 A 84 84 LYS C C 218 178.783 178.792 -0.009 1
1 1027 . 25 1 1 A 84 84 LYS CA C 218 59.327 58.995 0.332 1
1 1028 . 25 1 1 A 84 84 LYS CB C 218 32.539 32.284 0.255 1
1 1032 . 25 1 1 A 84 84 LYS N N 218 117.821 119.519 -1.698 1
1 1033 . 25 1 1 A 85 85 ALA H H 219 7.059 7.738 -0.679 1
1 1034 . 25 1 1 A 85 85 ALA HA H 219 4.040 4.050 -0.010 1
1 1038 . 25 1 1 A 85 85 ALA C C 219 179.794 180.139 -0.345 1
1 1039 . 25 1 1 A 85 85 ALA CA C 219 54.407 54.818 -0.411 1
1 1040 . 25 1 1 A 85 85 ALA CB C 219 20.130 18.132 1.998 1
1 1041 . 25 1 1 A 85 85 ALA N N 219 118.905 121.205 -2.300 1
1 1042 . 25 1 1 A 86 86 LEU H H 220 8.157 8.367 -0.210 1
1 1043 . 25 1 1 A 86 86 LEU HA H 220 3.692 3.962 -0.270 1
1 1053 . 25 1 1 A 86 86 LEU C C 220 178.330 178.602 -0.272 1
1 1054 . 25 1 1 A 86 86 LEU CA C 220 57.752 58.087 -0.335 1
1 1055 . 25 1 1 A 86 86 LEU CB C 220 41.464 41.857 -0.393 1
1 1059 . 25 1 1 A 86 86 LEU N N 220 118.606 120.428 -1.822 1
1 1060 . 25 1 1 A 87 87 PHE H H 221 8.349 8.176 0.173 1
1 1061 . 25 1 1 A 87 87 PHE HA H 221 3.861 4.485 -0.624 1
1 1069 . 25 1 1 A 87 87 PHE C C 221 176.176 177.839 -1.663 1
1 1070 . 25 1 1 A 87 87 PHE CA C 221 61.780 61.615 0.165 1
1 1071 . 25 1 1 A 87 87 PHE CB C 221 37.549 37.887 -0.338 1
1 1075 . 25 1 1 A 87 87 PHE N N 221 112.449 116.760 -4.311 1
1 1076 . 25 1 1 A 88 88 LYS H H 222 7.061 8.107 -1.046 1
1 1077 . 25 1 1 A 88 88 LYS HA H 222 4.380 4.146 0.234 1
1 1086 . 25 1 1 A 88 88 LYS C C 222 177.089 177.164 -0.075 1
1 1087 . 25 1 1 A 88 88 LYS CA C 222 56.726 58.400 -1.674 1
1 1088 . 25 1 1 A 88 88 LYS CB C 222 33.738 32.436 1.302 1
1 1092 . 25 1 1 A 88 88 LYS N N 222 118.308 121.118 -2.810 1
1 1093 . 25 1 1 A 89 89 LEU H H 223 7.270 7.295 -0.025 1
1 1094 . 25 1 1 A 89 89 LEU HA H 223 4.168 4.201 -0.033 1
1 1104 . 25 1 1 A 89 89 LEU C C 223 177.528 176.690 0.838 1
1 1105 . 25 1 1 A 89 89 LEU CA C 223 55.279 54.714 0.565 1
1 1106 . 25 1 1 A 89 89 LEU CB C 223 43.240 42.376 0.864 1
1 1110 . 25 1 1 A 89 89 LEU N N 223 121.317 122.166 -0.849 1
1 1111 . 25 1 1 A 90 90 LYS H H 224 8.788 8.227 0.561 1
1 1112 . 25 1 1 A 90 90 LYS HA H 224 4.359 4.462 -0.103 1
1 1121 . 25 1 1 A 90 90 LYS C C 224 175.839 175.855 -0.016 1
1 1122 . 25 1 1 A 90 90 LYS CA C 224 54.772 55.011 -0.239 1
1 1123 . 25 1 1 A 90 90 LYS CB C 224 33.232 33.323 -0.091 1
1 1127 . 25 1 1 A 90 90 LYS N N 224 123.558 120.421 3.137 1
1 1128 . 25 1 1 A 91 91 ASP H H 225 8.125 8.725 -0.600 1
1 1129 . 25 1 1 A 91 91 ASP HA H 225 3.958 4.163 -0.205 1
1 1132 . 25 1 1 A 91 91 ASP C C 225 177.452 177.191 0.261 1
1 1133 . 25 1 1 A 91 91 ASP CA C 225 56.642 56.269 0.373 1
1 1134 . 25 1 1 A 91 91 ASP CB C 225 40.269 40.289 -0.020 1
1 1135 . 25 1 1 A 91 91 ASP N N 225 119.419 120.678 -1.259 1
1 1136 . 25 1 1 A 92 92 GLY H H 226 8.681 8.617 0.064 1
1 1137 . 25 1 1 A 92 92 GLY HA2 H 226 4.131 3.835 0.296 1
1 1138 . 25 1 1 A 92 92 GLY HA3 H 226 3.579 3.859 -0.280 1
1 1139 . 25 1 1 A 92 92 GLY C C 226 173.614 173.904 -0.290 1
1 1140 . 25 1 1 A 92 92 GLY CA C 226 45.564 45.489 0.075 1
1 1141 . 25 1 1 A 92 92 GLY N N 226 113.802 111.659 2.143 1
1 1142 . 25 1 1 A 93 93 GLU H H 227 8.104 7.978 0.126 1
1 1143 . 25 1 1 A 93 93 GLU HA H 227 4.232 4.432 -0.200 1
1 1148 . 25 1 1 A 93 93 GLU C C 227 174.282 175.677 -1.395 1
1 1149 . 25 1 1 A 93 93 GLU CA C 227 56.651 56.181 0.470 1
1 1150 . 25 1 1 A 93 93 GLU CB C 227 32.190 31.016 1.174 1
1 1152 . 25 1 1 A 93 93 GLU N N 227 121.527 121.798 -0.271 1
1 1153 . 25 1 1 A 94 94 VAL H H 228 7.918 8.535 -0.617 1
1 1154 . 25 1 1 A 94 94 VAL HA H 228 4.857 4.772 0.085 1
1 1162 . 25 1 1 A 94 94 VAL C C 228 176.556 175.619 0.937 1
1 1163 . 25 1 1 A 94 94 VAL CA C 228 60.309 60.489 -0.180 1
1 1164 . 25 1 1 A 94 94 VAL CB C 228 33.847 35.437 -1.590 1
1 1167 . 25 1 1 A 94 94 VAL N N 228 119.768 125.906 -6.138 1
1 1168 . 25 1 1 A 95 95 SER H H 229 9.659 9.474 0.185 1
1 1169 . 25 1 1 A 95 95 SER HA H 229 4.313 4.697 -0.384 1
1 1172 . 25 1 1 A 95 95 SER C C 229 174.641 174.623 0.018 1
1 1173 . 25 1 1 A 95 95 SER CA C 229 59.208 57.802 1.406 1
1 1174 . 25 1 1 A 95 95 SER CB C 229 66.080 65.790 0.290 1
1 1175 . 25 1 1 A 95 95 SER N N 229 124.903 121.058 3.845 1
1 1176 . 25 1 1 A 96 96 GLU H H 230 8.014 8.390 -0.376 1
1 1177 . 25 1 1 A 96 96 GLU HA H 230 4.376 4.292 0.084 1
1 1182 . 25 1 1 A 96 96 GLU C C 230 176.641 175.890 0.751 1
1 1183 . 25 1 1 A 96 96 GLU CA C 230 56.236 56.117 0.119 1
1 1184 . 25 1 1 A 96 96 GLU CB C 230 30.324 30.316 0.008 1
1 1186 . 25 1 1 A 96 96 GLU N N 230 115.510 119.422 -3.912 1
1 1187 . 25 1 1 A 97 97 VAL H H 231 8.741 8.324 0.417 1
1 1188 . 25 1 1 A 97 97 VAL HA H 231 4.171 4.166 0.005 1
1 1196 . 25 1 1 A 97 97 VAL C C 231 176.684 175.835 0.849 1
1 1197 . 25 1 1 A 97 97 VAL CA C 231 65.418 63.167 2.251 1
1 1198 . 25 1 1 A 97 97 VAL CB C 231 31.218 31.478 -0.260 1
1 1201 . 25 1 1 A 97 97 VAL N N 231 121.289 120.528 0.761 1
1 1202 . 25 1 1 A 98 98 VAL H H 232 9.218 9.368 -0.150 1
1 1203 . 25 1 1 A 98 98 VAL HA H 232 4.405 4.677 -0.272 1
1 1211 . 25 1 1 A 98 98 VAL C C 232 174.258 174.481 -0.223 1
1 1212 . 25 1 1 A 98 98 VAL CA C 232 60.937 61.325 -0.388 1
1 1213 . 25 1 1 A 98 98 VAL CB C 232 35.825 34.044 1.781 1
1 1216 . 25 1 1 A 98 98 VAL N N 232 130.544 128.811 1.733 1
1 1217 . 25 1 1 A 99 99 LYS H H 233 8.800 8.657 0.143 1
1 1218 . 25 1 1 A 99 99 LYS HA H 233 4.853 5.250 -0.397 1
1 1227 . 25 1 1 A 99 99 LYS C C 233 175.274 175.090 0.184 1
1 1228 . 25 1 1 A 99 99 LYS CA C 233 55.499 54.456 1.043 1
1 1229 . 25 1 1 A 99 99 LYS CB C 233 34.452 35.849 -1.397 1
1 1233 . 25 1 1 A 99 99 LYS N N 233 130.477 126.709 3.768 1
1 1234 . 25 1 1 A 100 100 SER H H 234 9.585 9.158 0.427 1
1 1235 . 25 1 1 A 100 100 SER HA H 234 5.150 4.927 0.223 1
1 1238 . 25 1 1 A 100 100 SER C C 234 175.493 174.098 1.395 1
1 1239 . 25 1 1 A 100 100 SER CA C 234 56.927 57.349 -0.422 1
1 1240 . 25 1 1 A 100 100 SER CB C 234 67.309 67.260 0.049 1
1 1241 . 25 1 1 A 100 100 SER N N 234 125.814 122.666 3.148 1
1 1242 . 25 1 1 A 101 101 SER H H 235 8.631 8.838 -0.207 1
1 1243 . 25 1 1 A 101 101 SER HA H 235 4.106 4.091 0.015 1
1 1246 . 25 1 1 A 101 101 SER C C 235 175.385 175.201 0.184 1
1 1247 . 25 1 1 A 101 101 SER CA C 235 61.123 61.348 -0.225 1
1 1248 . 25 1 1 A 101 101 SER CB C 235 62.818 62.572 0.246 1
1 1249 . 25 1 1 A 101 101 SER N N 235 115.089 117.115 -2.026 1
1 1250 . 25 1 1 A 102 102 PHE H H 236 8.957 7.613 1.344 1
1 1251 . 25 1 1 A 102 102 PHE HA H 236 4.610 4.624 -0.014 1
1 1259 . 25 1 1 A 102 102 PHE C C 236 176.453 175.704 0.749 1
1 1260 . 25 1 1 A 102 102 PHE CA C 236 58.382 58.119 0.263 1
1 1261 . 25 1 1 A 102 102 PHE CB C 236 40.275 39.597 0.678 1
1 1263 . 25 1 1 A 102 102 PHE N N 236 119.917 117.272 2.645 1
1 1264 . 25 1 1 A 103 103 GLY H H 237 7.377 7.260 0.117 1
1 1265 . 25 1 1 A 103 103 GLY HA2 H 237 4.453 4.012 0.441 1
1 1266 . 25 1 1 A 103 103 GLY HA3 H 237 3.472 4.161 -0.689 1
1 1267 . 25 1 1 A 103 103 GLY C C 237 169.627 172.450 -2.823 1
1 1268 . 25 1 1 A 103 103 GLY CA C 237 45.384 44.279 1.105 1
1 1269 . 25 1 1 A 103 103 GLY N N 237 108.809 106.580 2.229 1
1 1270 . 25 1 1 A 104 104 TYR H H 238 8.632 8.476 0.156 1
1 1271 . 25 1 1 A 104 104 TYR HA H 238 5.322 5.367 -0.045 1
1 1278 . 25 1 1 A 104 104 TYR C C 238 175.043 174.951 0.092 1
1 1279 . 25 1 1 A 104 104 TYR CA C 238 57.627 57.767 -0.140 1
1 1280 . 25 1 1 A 104 104 TYR CB C 238 41.711 41.531 0.180 1
1 1283 . 25 1 1 A 104 104 TYR N N 238 120.030 121.719 -1.689 1
1 1284 . 25 1 1 A 105 105 HIS H H 239 10.070 9.448 0.622 1
1 1285 . 25 1 1 A 105 105 HIS HA H 239 6.046 5.622 0.424 1
1 1290 . 25 1 1 A 105 105 HIS C C 239 175.734 174.775 0.959 1
1 1291 . 25 1 1 A 105 105 HIS CA C 239 53.945 54.469 -0.524 1
1 1292 . 25 1 1 A 105 105 HIS CB C 239 32.450 34.508 -2.058 1
1 1295 . 25 1 1 A 105 105 HIS N N 239 119.504 118.686 0.818 1
1 1296 . 25 1 1 A 106 106 ILE H H 240 8.660 8.823 -0.163 1
1 1297 . 25 1 1 A 106 106 ILE HA H 240 4.120 4.913 -0.793 1
1 1307 . 25 1 1 A 106 106 ILE C C 240 174.758 175.385 -0.627 1
1 1308 . 25 1 1 A 106 106 ILE CA C 240 63.446 59.972 3.474 1
1 1309 . 25 1 1 A 106 106 ILE CB C 240 40.786 41.633 -0.847 1
1 1313 . 25 1 1 A 106 106 ILE N N 240 120.639 119.960 0.679 1
1 1314 . 25 1 1 A 107 107 ILE H H 241 9.033 9.160 -0.127 1
1 1315 . 25 1 1 A 107 107 ILE HA H 241 4.799 5.102 -0.303 1
1 1325 . 25 1 1 A 107 107 ILE C C 241 172.880 174.158 -1.278 1
1 1326 . 25 1 1 A 107 107 ILE CA C 241 60.563 59.568 0.995 1
1 1327 . 25 1 1 A 107 107 ILE CB C 241 41.652 40.588 1.064 1
1 1331 . 25 1 1 A 107 107 ILE N N 241 129.098 127.238 1.860 1
1 1332 . 25 1 1 A 108 108 LYS H H 242 8.692 9.069 -0.377 1
1 1333 . 25 1 1 A 108 108 LYS HA H 242 5.012 5.038 -0.026 1
1 1342 . 25 1 1 A 108 108 LYS C C 242 174.484 175.546 -1.062 1
1 1343 . 25 1 1 A 108 108 LYS CA C 242 54.317 54.067 0.250 1
1 1344 . 25 1 1 A 108 108 LYS CB C 242 35.619 35.536 0.083 1
1 1348 . 25 1 1 A 108 108 LYS N N 242 127.179 127.260 -0.081 1
1 1349 . 25 1 1 A 109 109 ALA H H 243 7.816 9.058 -1.242 1
1 1350 . 25 1 1 A 109 109 ALA HA H 243 4.604 4.558 0.046 1
1 1354 . 25 1 1 A 109 109 ALA C C 243 176.231 176.483 -0.252 1
1 1355 . 25 1 1 A 109 109 ALA CA C 243 50.505 51.078 -0.573 1
1 1356 . 25 1 1 A 109 109 ALA CB C 243 19.584 19.801 -0.217 1
1 1357 . 25 1 1 A 109 109 ALA N N 243 129.619 128.147 1.472 1
1 1358 . 25 1 1 A 110 110 ASP H H 244 7.578 8.743 -1.165 1
1 1359 . 25 1 1 A 110 110 ASP HA H 244 4.424 5.031 -0.607 1
1 1362 . 25 1 1 A 110 110 ASP C C 244 175.259 174.752 0.507 1
1 1363 . 25 1 1 A 110 110 ASP CA C 244 54.489 53.018 1.471 1
1 1364 . 25 1 1 A 110 110 ASP CB C 244 42.693 43.593 -0.900 1
1 1365 . 25 1 1 A 110 110 ASP N N 244 125.434 121.520 3.914 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 106 0.995 1
2 1 1 1 "RMS(OBS, PRED)" CA 107 1.027 1
3 1 1 1 "RMS(OBS, PRED)" CB 98 1.201 1
4 1 1 1 "RMS(OBS, PRED)" H 104 0.486 1
5 1 1 1 "RMS(OBS, PRED)" HA 116 0.289 1
6 1 1 1 "RMS(OBS, PRED)" N 104 2.721 1
7 1 2 1 "RMS(OBS, PRED)" C 106 0.876 1
8 1 2 1 "RMS(OBS, PRED)" CA 107 0.997 1
9 1 2 1 "RMS(OBS, PRED)" CB 98 1.119 1
10 1 2 1 "RMS(OBS, PRED)" H 104 0.500 1
11 1 2 1 "RMS(OBS, PRED)" HA 116 0.272 1
12 1 2 1 "RMS(OBS, PRED)" N 104 2.701 1
13 1 3 1 "RMS(OBS, PRED)" C 106 0.892 1
14 1 3 1 "RMS(OBS, PRED)" CA 107 1.079 1
15 1 3 1 "RMS(OBS, PRED)" CB 98 1.086 1
16 1 3 1 "RMS(OBS, PRED)" H 104 0.486 1
17 1 3 1 "RMS(OBS, PRED)" HA 116 0.291 1
18 1 3 1 "RMS(OBS, PRED)" N 104 2.894 1
19 1 4 1 "RMS(OBS, PRED)" C 106 0.918 1
20 1 4 1 "RMS(OBS, PRED)" CA 107 1.104 1
21 1 4 1 "RMS(OBS, PRED)" CB 98 1.123 1
22 1 4 1 "RMS(OBS, PRED)" H 104 0.510 1
23 1 4 1 "RMS(OBS, PRED)" HA 116 0.283 1
24 1 4 1 "RMS(OBS, PRED)" N 104 2.905 1
25 1 5 1 "RMS(OBS, PRED)" C 106 1.010 1
26 1 5 1 "RMS(OBS, PRED)" CA 107 0.994 1
27 1 5 1 "RMS(OBS, PRED)" CB 98 1.186 1
28 1 5 1 "RMS(OBS, PRED)" H 104 0.521 1
29 1 5 1 "RMS(OBS, PRED)" HA 116 0.298 1
30 1 5 1 "RMS(OBS, PRED)" N 104 2.796 1
31 1 6 1 "RMS(OBS, PRED)" C 106 0.960 1
32 1 6 1 "RMS(OBS, PRED)" CA 107 1.115 1
33 1 6 1 "RMS(OBS, PRED)" CB 98 1.080 1
34 1 6 1 "RMS(OBS, PRED)" H 104 0.490 1
35 1 6 1 "RMS(OBS, PRED)" HA 116 0.295 1
36 1 6 1 "RMS(OBS, PRED)" N 104 2.754 1
37 1 7 1 "RMS(OBS, PRED)" C 106 0.949 1
38 1 7 1 "RMS(OBS, PRED)" CA 107 0.953 1
39 1 7 1 "RMS(OBS, PRED)" CB 98 1.104 1
40 1 7 1 "RMS(OBS, PRED)" H 104 0.491 1
41 1 7 1 "RMS(OBS, PRED)" HA 116 0.282 1
42 1 7 1 "RMS(OBS, PRED)" N 104 2.872 1
43 1 8 1 "RMS(OBS, PRED)" C 106 0.860 1
44 1 8 1 "RMS(OBS, PRED)" CA 107 0.942 1
45 1 8 1 "RMS(OBS, PRED)" CB 98 1.073 1
46 1 8 1 "RMS(OBS, PRED)" H 104 0.495 1
47 1 8 1 "RMS(OBS, PRED)" HA 116 0.275 1
48 1 8 1 "RMS(OBS, PRED)" N 104 2.701 1
49 1 9 1 "RMS(OBS, PRED)" C 106 0.912 1
50 1 9 1 "RMS(OBS, PRED)" CA 107 1.064 1
51 1 9 1 "RMS(OBS, PRED)" CB 98 1.068 1
52 1 9 1 "RMS(OBS, PRED)" H 104 0.510 1
53 1 9 1 "RMS(OBS, PRED)" HA 116 0.281 1
54 1 9 1 "RMS(OBS, PRED)" N 104 2.824 1
55 1 10 1 "RMS(OBS, PRED)" C 106 0.908 1
56 1 10 1 "RMS(OBS, PRED)" CA 107 1.034 1
57 1 10 1 "RMS(OBS, PRED)" CB 98 1.102 1
58 1 10 1 "RMS(OBS, PRED)" H 104 0.494 1
59 1 10 1 "RMS(OBS, PRED)" HA 116 0.288 1
60 1 10 1 "RMS(OBS, PRED)" N 104 2.832 1
61 1 11 1 "RMS(OBS, PRED)" C 106 1.011 1
62 1 11 1 "RMS(OBS, PRED)" CA 107 1.134 1
63 1 11 1 "RMS(OBS, PRED)" CB 98 1.167 1
64 1 11 1 "RMS(OBS, PRED)" H 104 0.488 1
65 1 11 1 "RMS(OBS, PRED)" HA 116 0.291 1
66 1 11 1 "RMS(OBS, PRED)" N 104 2.908 1
67 1 12 1 "RMS(OBS, PRED)" C 106 0.903 1
68 1 12 1 "RMS(OBS, PRED)" CA 107 1.045 1
69 1 12 1 "RMS(OBS, PRED)" CB 98 1.107 1
70 1 12 1 "RMS(OBS, PRED)" H 104 0.481 1
71 1 12 1 "RMS(OBS, PRED)" HA 116 0.276 1
72 1 12 1 "RMS(OBS, PRED)" N 104 2.659 1
73 1 13 1 "RMS(OBS, PRED)" C 106 0.904 1
74 1 13 1 "RMS(OBS, PRED)" CA 107 1.025 1
75 1 13 1 "RMS(OBS, PRED)" CB 98 1.093 1
76 1 13 1 "RMS(OBS, PRED)" H 104 0.504 1
77 1 13 1 "RMS(OBS, PRED)" HA 116 0.284 1
78 1 13 1 "RMS(OBS, PRED)" N 104 2.872 1
79 1 14 1 "RMS(OBS, PRED)" C 106 0.969 1
80 1 14 1 "RMS(OBS, PRED)" CA 107 1.113 1
81 1 14 1 "RMS(OBS, PRED)" CB 98 1.092 1
82 1 14 1 "RMS(OBS, PRED)" H 104 0.495 1
83 1 14 1 "RMS(OBS, PRED)" HA 116 0.289 1
84 1 14 1 "RMS(OBS, PRED)" N 104 3.012 1
85 1 15 1 "RMS(OBS, PRED)" C 106 0.924 1
86 1 15 1 "RMS(OBS, PRED)" CA 107 1.016 1
87 1 15 1 "RMS(OBS, PRED)" CB 98 1.060 1
88 1 15 1 "RMS(OBS, PRED)" H 104 0.486 1
89 1 15 1 "RMS(OBS, PRED)" HA 116 0.272 1
90 1 15 1 "RMS(OBS, PRED)" N 104 2.757 1
91 1 16 1 "RMS(OBS, PRED)" C 106 0.930 1
92 1 16 1 "RMS(OBS, PRED)" CA 107 1.032 1
93 1 16 1 "RMS(OBS, PRED)" CB 98 1.089 1
94 1 16 1 "RMS(OBS, PRED)" H 104 0.477 1
95 1 16 1 "RMS(OBS, PRED)" HA 116 0.288 1
96 1 16 1 "RMS(OBS, PRED)" N 104 2.892 1
97 1 17 1 "RMS(OBS, PRED)" C 106 0.980 1
98 1 17 1 "RMS(OBS, PRED)" CA 107 1.148 1
99 1 17 1 "RMS(OBS, PRED)" CB 98 1.227 1
100 1 17 1 "RMS(OBS, PRED)" H 104 0.508 1
101 1 17 1 "RMS(OBS, PRED)" HA 116 0.288 1
102 1 17 1 "RMS(OBS, PRED)" N 104 2.920 1
103 1 18 1 "RMS(OBS, PRED)" C 106 0.968 1
104 1 18 1 "RMS(OBS, PRED)" CA 107 1.076 1
105 1 18 1 "RMS(OBS, PRED)" CB 98 1.102 1
106 1 18 1 "RMS(OBS, PRED)" H 104 0.490 1
107 1 18 1 "RMS(OBS, PRED)" HA 116 0.291 1
108 1 18 1 "RMS(OBS, PRED)" N 104 2.912 1
109 1 19 1 "RMS(OBS, PRED)" C 106 0.920 1
110 1 19 1 "RMS(OBS, PRED)" CA 107 1.043 1
111 1 19 1 "RMS(OBS, PRED)" CB 98 1.056 1
112 1 19 1 "RMS(OBS, PRED)" H 104 0.495 1
113 1 19 1 "RMS(OBS, PRED)" HA 116 0.288 1
114 1 19 1 "RMS(OBS, PRED)" N 104 2.782 1
115 1 20 1 "RMS(OBS, PRED)" C 106 0.922 1
116 1 20 1 "RMS(OBS, PRED)" CA 107 1.060 1
117 1 20 1 "RMS(OBS, PRED)" CB 98 1.070 1
118 1 20 1 "RMS(OBS, PRED)" H 104 0.501 1
119 1 20 1 "RMS(OBS, PRED)" HA 116 0.288 1
120 1 20 1 "RMS(OBS, PRED)" N 104 2.905 1
121 1 21 1 "RMS(OBS, PRED)" C 106 0.870 1
122 1 21 1 "RMS(OBS, PRED)" CA 107 0.989 1
123 1 21 1 "RMS(OBS, PRED)" CB 98 1.114 1
124 1 21 1 "RMS(OBS, PRED)" H 104 0.521 1
125 1 21 1 "RMS(OBS, PRED)" HA 116 0.278 1
126 1 21 1 "RMS(OBS, PRED)" N 104 2.740 1
127 1 22 1 "RMS(OBS, PRED)" C 106 0.933 1
128 1 22 1 "RMS(OBS, PRED)" CA 107 0.957 1
129 1 22 1 "RMS(OBS, PRED)" CB 98 1.049 1
130 1 22 1 "RMS(OBS, PRED)" H 104 0.480 1
131 1 22 1 "RMS(OBS, PRED)" HA 116 0.289 1
132 1 22 1 "RMS(OBS, PRED)" N 104 2.821 1
133 1 23 1 "RMS(OBS, PRED)" C 106 0.940 1
134 1 23 1 "RMS(OBS, PRED)" CA 107 1.090 1
135 1 23 1 "RMS(OBS, PRED)" CB 98 1.115 1
136 1 23 1 "RMS(OBS, PRED)" H 104 0.489 1
137 1 23 1 "RMS(OBS, PRED)" HA 116 0.286 1
138 1 23 1 "RMS(OBS, PRED)" N 104 2.787 1
139 1 24 1 "RMS(OBS, PRED)" C 106 0.930 1
140 1 24 1 "RMS(OBS, PRED)" CA 107 1.047 1
141 1 24 1 "RMS(OBS, PRED)" CB 98 1.081 1
142 1 24 1 "RMS(OBS, PRED)" H 104 0.507 1
143 1 24 1 "RMS(OBS, PRED)" HA 116 0.281 1
144 1 24 1 "RMS(OBS, PRED)" N 104 2.780 1
145 1 25 1 "RMS(OBS, PRED)" C 106 0.965 1
146 1 25 1 "RMS(OBS, PRED)" CA 107 1.132 1
147 1 25 1 "RMS(OBS, PRED)" CB 98 1.159 1
148 1 25 1 "RMS(OBS, PRED)" H 104 0.505 1
149 1 25 1 "RMS(OBS, PRED)" HA 116 0.294 1
150 1 25 1 "RMS(OBS, PRED)" N 104 2.907 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 4 . 1 1 A 2 2 PRO HA H -4 4.403 4.559 -0.156 2
1 11 . 1 1 A 2 2 PRO C C -4 176.990 176.584 0.406 2
1 12 . 1 1 A 2 2 PRO CA C -4 63.131 63.119 0.012 2
1 13 . 1 1 A 2 2 PRO CB C -4 32.342 32.420 -0.078 2
1 16 . 1 1 A 3 3 LEU H H -3 8.483 8.465 0.018 2
1 17 . 1 1 A 3 3 LEU HA H -3 4.333 4.430 -0.097 2
1 27 . 1 1 A 3 3 LEU C C -3 177.991 176.853 1.138 2
1 28 . 1 1 A 3 3 LEU CA C -3 55.314 55.123 0.191 2
1 29 . 1 1 A 3 3 LEU CB C -3 42.244 43.349 -1.105 2
1 33 . 1 1 A 3 3 LEU N N -3 122.986 120.834 2.152 2
1 34 . 1 1 A 4 4 GLY H H -2 8.397 8.339 0.058 2
1 35 . 1 1 A 4 4 GLY HA2 H -2 4.024 4.025 -0.001 2
1 36 . 1 1 A 4 4 GLY HA3 H -2 3.976 4.051 -0.075 2
1 37 . 1 1 A 4 4 GLY C C -2 174.360 173.815 0.545 2
1 38 . 1 1 A 4 4 GLY CA C -2 45.434 45.136 0.298 2
1 39 . 1 1 A 4 4 GLY N N -2 110.666 110.395 0.271 2
1 56 . 1 1 A 7 7 SER H H 141 7.913 7.853 0.060 2
1 57 . 1 1 A 7 7 SER HA H 141 5.657 5.340 0.317 2
1 60 . 1 1 A 7 7 SER C C 141 173.753 172.563 1.190 2
1 61 . 1 1 A 7 7 SER CA C 141 56.758 57.617 -0.859 2
1 62 . 1 1 A 7 7 SER CB C 141 66.774 65.941 0.833 2
1 63 . 1 1 A 7 7 SER N N 141 113.824 112.143 1.681 2
1 64 . 1 1 A 8 8 LYS H H 142 8.656 8.460 0.196 2
1 65 . 1 1 A 8 8 LYS HA H 142 4.543 5.002 -0.459 2
1 74 . 1 1 A 8 8 LYS C C 142 174.403 174.634 -0.231 2
1 75 . 1 1 A 8 8 LYS CA C 142 55.578 54.516 1.062 2
1 76 . 1 1 A 8 8 LYS CB C 142 36.561 35.879 0.682 2
1 80 . 1 1 A 8 8 LYS N N 142 123.076 120.033 3.043 2
1 81 . 1 1 A 9 9 LYS H H 143 8.623 8.428 0.195 2
1 82 . 1 1 A 9 9 LYS HA H 143 4.119 4.392 -0.273 2
1 91 . 1 1 A 9 9 LYS C C 143 176.144 175.557 0.587 2
1 92 . 1 1 A 9 9 LYS CA C 143 56.683 56.091 0.592 2
1 93 . 1 1 A 9 9 LYS CB C 143 32.580 32.618 -0.038 2
1 97 . 1 1 A 9 9 LYS N N 143 129.542 123.660 5.882 2
1 98 . 1 1 A 10 10 ALA H H 144 8.151 8.715 -0.564 2
1 99 . 1 1 A 10 10 ALA HA H 144 5.208 4.924 0.284 2
1 103 . 1 1 A 10 10 ALA C C 144 175.577 175.040 0.537 2
1 104 . 1 1 A 10 10 ALA CA C 144 51.226 51.208 0.018 2
1 105 . 1 1 A 10 10 ALA CB C 144 25.299 24.137 1.162 2
1 106 . 1 1 A 10 10 ALA N N 144 127.933 127.842 0.091 2
1 107 . 1 1 A 11 11 SER H H 145 8.679 8.801 -0.122 2
1 108 . 1 1 A 11 11 SER HA H 145 5.431 5.780 -0.349 2
1 111 . 1 1 A 11 11 SER C C 145 173.072 173.217 -0.145 2
1 112 . 1 1 A 11 11 SER CA C 145 57.772 57.032 0.740 2
1 113 . 1 1 A 11 11 SER CB C 145 67.301 66.167 1.134 2
1 114 . 1 1 A 11 11 SER N N 145 116.245 115.415 0.830 2
1 115 . 1 1 A 12 12 HIS H H 146 9.962 9.544 0.418 2
1 116 . 1 1 A 12 12 HIS HA H 146 6.332 6.045 0.287 2
1 121 . 1 1 A 12 12 HIS C C 146 173.006 172.440 0.566 2
1 122 . 1 1 A 12 12 HIS CA C 146 55.020 54.282 0.738 2
1 123 . 1 1 A 12 12 HIS CB C 146 37.071 33.469 3.602 2
1 126 . 1 1 A 12 12 HIS N N 146 119.181 118.485 0.696 2
1 127 . 1 1 A 13 13 ILE H H 147 8.976 8.965 0.011 2
1 128 . 1 1 A 13 13 ILE HA H 147 3.528 4.544 -1.016 2
1 138 . 1 1 A 13 13 ILE C C 147 173.010 173.868 -0.858 2
1 139 . 1 1 A 13 13 ILE CA C 147 61.273 59.598 1.675 2
1 140 . 1 1 A 13 13 ILE CB C 147 41.773 41.586 0.187 2
1 144 . 1 1 A 13 13 ILE N N 147 121.873 119.347 2.526 2
1 145 . 1 1 A 14 14 LEU H H 148 7.627 8.915 -1.288 2
1 146 . 1 1 A 14 14 LEU HA H 148 4.814 4.991 -0.177 2
1 156 . 1 1 A 14 14 LEU C C 148 174.112 174.344 -0.232 2
1 157 . 1 1 A 14 14 LEU CA C 148 52.574 53.041 -0.467 2
1 158 . 1 1 A 14 14 LEU CB C 148 45.643 45.092 0.551 2
1 162 . 1 1 A 14 14 LEU N N 148 127.112 129.438 -2.326 2
1 163 . 1 1 A 15 15 ILE H H 149 9.524 9.280 0.244 2
1 164 . 1 1 A 15 15 ILE HA H 149 4.362 4.651 -0.289 2
1 174 . 1 1 A 15 15 ILE C C 149 175.452 175.455 -0.003 2
1 175 . 1 1 A 15 15 ILE CA C 149 58.516 60.534 -2.018 2
1 176 . 1 1 A 15 15 ILE CB C 149 36.560 39.497 -2.937 2
1 180 . 1 1 A 15 15 ILE N N 149 128.652 127.100 1.552 2
1 181 . 1 1 A 16 16 LYS H H 150 8.035 8.513 -0.478 2
1 182 . 1 1 A 16 16 LYS HA H 150 4.319 4.461 -0.142 2
1 191 . 1 1 A 16 16 LYS C C 150 175.038 176.347 -1.309 2
1 192 . 1 1 A 16 16 LYS CA C 150 57.817 56.567 1.250 2
1 193 . 1 1 A 16 16 LYS CB C 150 34.853 32.929 1.924 2
1 197 . 1 1 A 16 16 LYS N N 150 129.153 127.884 1.269 2
1 198 . 1 1 A 17 17 VAL H H 151 8.016 8.870 -0.854 2
1 199 . 1 1 A 17 17 VAL HA H 151 4.873 4.793 0.080 2
1 207 . 1 1 A 17 17 VAL C C 151 176.647 175.423 1.224 2
1 208 . 1 1 A 17 17 VAL CA C 151 60.088 61.385 -1.297 2
1 209 . 1 1 A 17 17 VAL CB C 151 34.082 33.406 0.676 2
1 212 . 1 1 A 17 17 VAL N N 151 121.288 124.354 -3.066 2
1 213 . 1 1 A 18 18 LYS H H 152 8.443 8.845 -0.402 2
1 214 . 1 1 A 18 18 LYS HA H 152 4.334 4.663 -0.329 2
1 223 . 1 1 A 18 18 LYS C C 152 176.345 177.124 -0.779 2
1 224 . 1 1 A 18 18 LYS CA C 152 57.016 54.909 2.107 2
1 225 . 1 1 A 18 18 LYS CB C 152 33.222 34.547 -1.325 2
1 229 . 1 1 A 18 18 LYS N N 152 128.408 127.159 1.249 2
1 230 . 1 1 A 19 19 SER H H 153 9.067 8.748 0.319 2
1 231 . 1 1 A 19 19 SER HA H 153 4.457 4.440 0.017 2
1 234 . 1 1 A 19 19 SER C C 153 174.236 174.480 -0.244 2
1 235 . 1 1 A 19 19 SER CA C 153 59.642 59.692 -0.050 2
1 236 . 1 1 A 19 19 SER CB C 153 64.347 63.865 0.482 2
1 237 . 1 1 A 19 19 SER N N 153 121.522 116.567 4.955 2
1 238 . 1 1 A 20 20 LYS H H 154 7.961 7.678 0.283 2
1 239 . 1 1 A 20 20 LYS HA H 154 4.558 4.618 -0.060 2
1 244 . 1 1 A 20 20 LYS C C 154 177.256 176.582 0.674 2
1 245 . 1 1 A 20 20 LYS CA C 154 55.249 55.423 -0.174 2
1 246 . 1 1 A 20 20 LYS CB C 154 34.531 34.943 -0.412 2
1 248 . 1 1 A 20 20 LYS N N 154 120.270 120.148 0.122 2
1 249 . 1 1 A 21 21 LYS HA H 155 4.003 4.032 -0.029 2
1 258 . 1 1 A 21 21 LYS C C 155 177.015 177.956 -0.941 2
1 259 . 1 1 A 21 21 LYS CA C 155 59.091 58.903 0.188 2
1 260 . 1 1 A 21 21 LYS CB C 155 32.394 32.214 0.180 2
1 264 . 1 1 A 22 22 SER H H 156 7.625 7.790 -0.165 2
1 265 . 1 1 A 22 22 SER HA H 156 4.293 4.434 -0.141 2
1 268 . 1 1 A 22 22 SER C C 156 174.843 174.297 0.546 2
1 269 . 1 1 A 22 22 SER CA C 156 57.966 59.496 -1.530 2
1 270 . 1 1 A 22 22 SER CB C 156 63.369 63.645 -0.276 2
1 271 . 1 1 A 22 22 SER N N 156 109.549 112.950 -3.401 2
1 272 . 1 1 A 23 23 ASP H H 157 7.701 7.490 0.211 2
1 273 . 1 1 A 23 23 ASP HA H 157 4.548 4.608 -0.060 2
1 276 . 1 1 A 23 23 ASP C C 157 176.544 176.400 0.144 2
1 277 . 1 1 A 23 23 ASP CA C 157 55.242 54.361 0.881 2
1 278 . 1 1 A 23 23 ASP CB C 157 41.103 41.931 -0.828 2
1 279 . 1 1 A 23 23 ASP N N 157 124.536 121.868 2.668 2
1 280 . 1 1 A 24 24 LYS H H 158 8.583 8.770 -0.187 2
1 281 . 1 1 A 24 24 LYS HA H 158 4.252 4.272 -0.020 2
1 290 . 1 1 A 24 24 LYS C C 158 176.813 177.475 -0.662 2
1 291 . 1 1 A 24 24 LYS CA C 158 57.148 57.508 -0.360 2
1 292 . 1 1 A 24 24 LYS CB C 158 33.200 32.586 0.614 2
1 296 . 1 1 A 24 24 LYS N N 158 122.372 124.346 -1.974 2
1 297 . 1 1 A 25 25 GLU H H 159 8.001 8.096 -0.095 2
1 298 . 1 1 A 25 25 GLU HA H 159 4.521 4.276 0.245 2
1 303 . 1 1 A 25 25 GLU C C 159 175.995 176.390 -0.395 2
1 304 . 1 1 A 25 25 GLU CA C 159 55.727 57.996 -2.269 2
1 305 . 1 1 A 25 25 GLU CB C 159 31.918 30.710 1.208 2
1 307 . 1 1 A 25 25 GLU N N 159 118.705 118.719 -0.014 2
1 308 . 1 1 A 26 26 GLY H H 160 8.458 7.735 0.723 2
1 309 . 1 1 A 26 26 GLY HA2 H 160 3.946 4.065 -0.119 2
1 310 . 1 1 A 26 26 GLY HA3 H 160 3.511 4.074 -0.563 2
1 311 . 1 1 A 26 26 GLY C C 160 172.201 172.453 -0.252 2
1 312 . 1 1 A 26 26 GLY CA C 160 44.038 45.069 -1.031 2
1 313 . 1 1 A 26 26 GLY N N 160 107.642 107.888 -0.246 2
1 314 . 1 1 A 27 27 LEU H H 161 8.259 8.513 -0.254 2
1 315 . 1 1 A 27 27 LEU HA H 161 4.775 5.000 -0.225 2
1 325 . 1 1 A 27 27 LEU C C 161 177.422 175.696 1.726 2
1 326 . 1 1 A 27 27 LEU CA C 161 53.322 53.400 -0.078 2
1 327 . 1 1 A 27 27 LEU CB C 161 45.576 44.183 1.393 2
1 331 . 1 1 A 27 27 LEU N N 161 119.856 121.746 -1.890 2
1 332 . 1 1 A 28 28 ASP H H 162 8.848 8.570 0.278 2
1 333 . 1 1 A 28 28 ASP HA H 162 4.644 4.595 0.049 2
1 336 . 1 1 A 28 28 ASP C C 162 176.630 177.153 -0.523 2
1 337 . 1 1 A 28 28 ASP CA C 162 55.195 54.533 0.662 2
1 338 . 1 1 A 28 28 ASP CB C 162 41.673 42.423 -0.750 2
1 339 . 1 1 A 28 28 ASP N N 162 122.434 121.650 0.784 2
1 340 . 1 1 A 29 29 ASP H H 163 8.720 9.120 -0.400 2
1 341 . 1 1 A 29 29 ASP HA H 163 4.386 4.405 -0.019 2
1 344 . 1 1 A 29 29 ASP C C 163 176.604 178.382 -1.778 2
1 345 . 1 1 A 29 29 ASP CA C 163 59.690 57.450 2.240 2
1 346 . 1 1 A 29 29 ASP CB C 163 42.964 40.352 2.612 2
1 347 . 1 1 A 29 29 ASP N N 163 121.460 124.773 -3.313 2
1 348 . 1 1 A 30 30 LYS H H 164 8.434 7.863 0.571 2
1 349 . 1 1 A 30 30 LYS HA H 164 3.901 4.046 -0.145 2
1 358 . 1 1 A 30 30 LYS C C 164 179.479 179.147 0.332 2
1 359 . 1 1 A 30 30 LYS CA C 164 60.047 59.372 0.675 2
1 360 . 1 1 A 30 30 LYS CB C 164 32.038 32.275 -0.237 2
1 364 . 1 1 A 30 30 LYS N N 164 116.627 119.357 -2.730 2
1 365 . 1 1 A 31 31 GLU H H 165 7.755 8.293 -0.538 2
1 366 . 1 1 A 31 31 GLU HA H 165 3.998 4.009 -0.011 2
1 371 . 1 1 A 31 31 GLU C C 165 179.031 179.244 -0.213 2
1 372 . 1 1 A 31 31 GLU CA C 165 59.335 59.244 0.091 2
1 373 . 1 1 A 31 31 GLU CB C 165 29.972 29.435 0.537 2
1 375 . 1 1 A 31 31 GLU N N 165 120.456 120.030 0.426 2
1 376 . 1 1 A 32 32 ALA H H 166 9.060 8.550 0.510 2
1 377 . 1 1 A 32 32 ALA HA H 166 3.871 4.031 -0.160 2
1 381 . 1 1 A 32 32 ALA C C 166 178.029 179.045 -1.016 2
1 382 . 1 1 A 32 32 ALA CA C 166 54.997 55.398 -0.401 2
1 383 . 1 1 A 32 32 ALA CB C 166 19.727 18.439 1.288 2
1 384 . 1 1 A 32 32 ALA N N 166 124.406 122.351 2.055 2
1 385 . 1 1 A 33 33 LYS H H 167 8.228 7.718 0.510 2
1 386 . 1 1 A 33 33 LYS HA H 167 2.595 3.046 -0.451 2
1 395 . 1 1 A 33 33 LYS C C 167 177.938 178.116 -0.178 2
1 396 . 1 1 A 33 33 LYS CA C 167 59.573 59.313 0.260 2
1 397 . 1 1 A 33 33 LYS CB C 167 32.098 32.180 -0.082 2
1 401 . 1 1 A 33 33 LYS N N 167 119.833 118.233 1.600 2
1 402 . 1 1 A 34 34 GLN H H 168 7.392 7.723 -0.331 2
1 403 . 1 1 A 34 34 GLN HA H 168 3.943 3.914 0.029 2
1 410 . 1 1 A 34 34 GLN C C 168 178.323 178.432 -0.109 2
1 411 . 1 1 A 34 34 GLN CA C 168 58.883 59.334 -0.451 2
1 412 . 1 1 A 34 34 GLN CB C 168 28.485 28.115 0.370 2
1 414 . 1 1 A 34 34 GLN N N 168 117.208 117.930 -0.722 2
1 416 . 1 1 A 35 35 LYS H H 169 7.994 8.006 -0.012 2
1 417 . 1 1 A 35 35 LYS HA H 169 4.067 4.000 0.067 2
1 426 . 1 1 A 35 35 LYS C C 169 178.161 178.522 -0.361 2
1 427 . 1 1 A 35 35 LYS CA C 169 58.437 59.208 -0.771 2
1 428 . 1 1 A 35 35 LYS CB C 169 31.611 32.226 -0.615 2
1 432 . 1 1 A 35 35 LYS N N 169 120.898 119.777 1.121 2
1 433 . 1 1 A 36 36 ALA H H 170 8.431 8.284 0.147 2
1 434 . 1 1 A 36 36 ALA HA H 170 3.738 4.033 -0.295 2
1 438 . 1 1 A 36 36 ALA C C 170 178.862 179.753 -0.891 2
1 439 . 1 1 A 36 36 ALA CA C 170 55.351 55.012 0.339 2
1 440 . 1 1 A 36 36 ALA CB C 170 18.295 18.402 -0.107 2
1 441 . 1 1 A 36 36 ALA N N 170 120.641 120.180 0.461 2
1 442 . 1 1 A 37 37 GLU H H 171 8.412 8.122 0.290 2
1 443 . 1 1 A 37 37 GLU HA H 171 3.867 3.951 -0.084 2
1 448 . 1 1 A 37 37 GLU C C 171 179.255 179.074 0.181 2
1 449 . 1 1 A 37 37 GLU CA C 171 59.543 59.543 -0.000 2
1 450 . 1 1 A 37 37 GLU CB C 171 29.569 29.457 0.112 2
1 452 . 1 1 A 37 37 GLU N N 171 118.224 117.769 0.455 2
1 453 . 1 1 A 38 38 GLU H H 172 8.019 8.227 -0.208 2
1 454 . 1 1 A 38 38 GLU HA H 172 3.952 4.064 -0.112 2
1 459 . 1 1 A 38 38 GLU C C 172 180.250 178.553 1.697 2
1 460 . 1 1 A 38 38 GLU CA C 172 59.627 59.147 0.480 2
1 461 . 1 1 A 38 38 GLU CB C 172 29.368 28.971 0.397 2
1 463 . 1 1 A 38 38 GLU N N 172 121.250 118.817 2.433 2
1 464 . 1 1 A 39 39 ILE H H 173 8.174 7.505 0.669 2
1 465 . 1 1 A 39 39 ILE HA H 173 3.643 3.795 -0.152 2
1 475 . 1 1 A 39 39 ILE C C 173 177.568 177.965 -0.397 2
1 476 . 1 1 A 39 39 ILE CA C 173 64.869 63.799 1.070 2
1 477 . 1 1 A 39 39 ILE CB C 173 38.160 37.377 0.783 2
1 481 . 1 1 A 39 39 ILE N N 173 121.527 117.588 3.939 2
1 482 . 1 1 A 40 40 GLN H H 174 8.860 8.295 0.565 2
1 483 . 1 1 A 40 40 GLN HA H 174 3.533 3.987 -0.454 2
1 490 . 1 1 A 40 40 GLN C C 174 179.022 178.575 0.447 2
1 491 . 1 1 A 40 40 GLN CA C 174 61.316 59.284 2.032 2
1 492 . 1 1 A 40 40 GLN CB C 174 26.604 28.414 -1.810 2
1 494 . 1 1 A 40 40 GLN N N 174 121.956 121.088 0.868 2
1 496 . 1 1 A 41 41 LYS H H 175 7.879 7.910 -0.031 2
1 497 . 1 1 A 41 41 LYS HA H 175 3.777 4.143 -0.366 2
1 506 . 1 1 A 41 41 LYS C C 175 178.779 178.652 0.127 2
1 507 . 1 1 A 41 41 LYS CA C 175 59.701 58.868 0.833 2
1 508 . 1 1 A 41 41 LYS CB C 175 32.581 31.921 0.660 2
1 512 . 1 1 A 41 41 LYS N N 175 119.012 118.264 0.748 2
1 513 . 1 1 A 42 42 GLU H H 176 7.447 7.854 -0.407 2
1 514 . 1 1 A 42 42 GLU HA H 176 4.059 4.191 -0.132 2
1 519 . 1 1 A 42 42 GLU C C 176 180.058 178.809 1.249 2
1 520 . 1 1 A 42 42 GLU CA C 176 59.456 58.906 0.550 2
1 521 . 1 1 A 42 42 GLU CB C 176 29.923 29.888 0.035 2
1 523 . 1 1 A 42 42 GLU N N 176 120.054 119.018 1.036 2
1 524 . 1 1 A 43 43 VAL H H 177 8.618 8.036 0.582 2
1 525 . 1 1 A 43 43 VAL HA H 177 3.986 3.914 0.072 2
1 533 . 1 1 A 43 43 VAL C C 177 176.459 177.729 -1.270 2
1 534 . 1 1 A 43 43 VAL CA C 177 63.923 64.807 -0.884 2
1 535 . 1 1 A 43 43 VAL CB C 177 31.899 31.368 0.531 2
1 538 . 1 1 A 43 43 VAL N N 177 114.191 117.079 -2.888 2
1 539 . 1 1 A 44 44 SER H H 178 8.052 8.319 -0.267 2
1 540 . 1 1 A 44 44 SER HA H 178 4.098 4.275 -0.177 2
1 543 . 1 1 A 44 44 SER C C 178 176.548 176.112 0.436 2
1 544 . 1 1 A 44 44 SER CA C 178 61.160 61.321 -0.161 2
1 545 . 1 1 A 44 44 SER CB C 178 62.959 62.753 0.206 2
1 546 . 1 1 A 44 44 SER N N 178 114.202 116.222 -2.020 2
1 547 . 1 1 A 45 45 LYS H H 179 7.083 8.133 -1.050 2
1 548 . 1 1 A 45 45 LYS HA H 179 4.140 4.210 -0.070 2
1 557 . 1 1 A 45 45 LYS C C 179 177.288 176.169 1.119 2
1 558 . 1 1 A 45 45 LYS CA C 179 58.469 57.959 0.510 2
1 559 . 1 1 A 45 45 LYS CB C 179 32.671 31.767 0.904 2
1 563 . 1 1 A 45 45 LYS N N 179 120.935 117.887 3.048 2
1 564 . 1 1 A 46 46 ASP H H 180 7.098 7.820 -0.722 2
1 565 . 1 1 A 46 46 ASP HA H 180 4.917 5.002 -0.085 2
1 568 . 1 1 A 46 46 ASP CA C 180 51.492 51.555 -0.063 2
1 569 . 1 1 A 46 46 ASP CB C 180 40.595 41.377 -0.782 2
1 570 . 1 1 A 46 46 ASP N N 180 112.836 120.259 -7.423 2
1 571 . 1 1 A 47 47 PRO HA H 181 4.681 4.499 0.182 2
1 578 . 1 1 A 47 47 PRO C C 181 179.248 177.731 1.517 2
1 579 . 1 1 A 47 47 PRO CA C 181 64.718 64.399 0.319 2
1 580 . 1 1 A 47 47 PRO CB C 181 32.159 31.982 0.177 2
1 583 . 1 1 A 48 48 SER H H 182 8.248 8.102 0.146 2
1 584 . 1 1 A 48 48 SER HA H 182 4.378 4.310 0.068 2
1 587 . 1 1 A 48 48 SER C C 182 176.071 175.604 0.467 2
1 588 . 1 1 A 48 48 SER CA C 182 61.377 60.770 0.607 2
1 589 . 1 1 A 48 48 SER CB C 182 62.455 63.129 -0.674 2
1 590 . 1 1 A 48 48 SER N N 182 116.986 113.270 3.716 2
1 591 . 1 1 A 49 49 LYS H H 183 7.842 7.452 0.390 2
1 592 . 1 1 A 49 49 LYS HA H 183 4.482 4.324 0.158 2
1 601 . 1 1 A 49 49 LYS C C 183 175.605 177.601 -1.996 2
1 602 . 1 1 A 49 49 LYS CA C 183 55.824 56.814 -0.990 2
1 603 . 1 1 A 49 49 LYS CB C 183 32.834 32.671 0.163 2
1 607 . 1 1 A 49 49 LYS N N 183 121.698 119.556 2.142 2
1 608 . 1 1 A 50 50 PHE H H 184 7.634 7.863 -0.229 2
1 609 . 1 1 A 50 50 PHE HA H 184 3.510 4.224 -0.714 2
1 617 . 1 1 A 50 50 PHE C C 184 176.214 177.657 -1.443 2
1 618 . 1 1 A 50 50 PHE CA C 184 63.276 61.072 2.204 2
1 619 . 1 1 A 50 50 PHE CB C 184 40.948 39.049 1.899 2
1 623 . 1 1 A 50 50 PHE N N 184 120.120 121.605 -1.485 2
1 624 . 1 1 A 51 51 GLY H H 185 8.855 8.598 0.257 2
1 625 . 1 1 A 51 51 GLY HA2 H 185 3.993 3.885 0.108 2
1 626 . 1 1 A 51 51 GLY HA3 H 185 3.958 3.925 0.033 2
1 627 . 1 1 A 51 51 GLY C C 185 175.169 176.155 -0.986 2
1 628 . 1 1 A 51 51 GLY CA C 185 47.475 47.373 0.102 2
1 629 . 1 1 A 51 51 GLY N N 185 105.550 106.129 -0.579 2
1 630 . 1 1 A 52 52 GLU H H 186 7.917 7.894 0.023 2
1 631 . 1 1 A 52 52 GLU HA H 186 4.006 4.076 -0.070 2
1 636 . 1 1 A 52 52 GLU C C 186 179.499 179.448 0.051 2
1 637 . 1 1 A 52 52 GLU CA C 186 58.904 59.191 -0.287 2
1 638 . 1 1 A 52 52 GLU CB C 186 29.700 29.706 -0.006 2
1 640 . 1 1 A 52 52 GLU N N 186 121.929 121.402 0.527 2
1 641 . 1 1 A 53 53 ILE H H 187 7.936 8.039 -0.103 2
1 642 . 1 1 A 53 53 ILE HA H 187 3.648 3.707 -0.059 2
1 652 . 1 1 A 53 53 ILE C C 187 177.886 177.790 0.096 2
1 653 . 1 1 A 53 53 ILE CA C 187 64.366 64.801 -0.435 2
1 654 . 1 1 A 53 53 ILE CB C 187 36.478 37.443 -0.965 2
1 658 . 1 1 A 53 53 ILE N N 187 120.991 121.391 -0.400 2
1 659 . 1 1 A 54 54 ALA H H 188 8.895 8.525 0.370 2
1 660 . 1 1 A 54 54 ALA HA H 188 3.629 3.777 -0.148 2
1 664 . 1 1 A 54 54 ALA C C 188 179.437 179.244 0.193 2
1 665 . 1 1 A 54 54 ALA CA C 188 55.974 55.542 0.432 2
1 666 . 1 1 A 54 54 ALA CB C 188 17.591 18.491 -0.900 2
1 667 . 1 1 A 54 54 ALA N N 188 125.308 122.138 3.170 2
1 668 . 1 1 A 55 55 LYS H H 189 8.049 7.715 0.334 2
1 669 . 1 1 A 55 55 LYS HA H 189 4.106 3.901 0.205 2
1 678 . 1 1 A 55 55 LYS C C 189 178.995 178.176 0.819 2
1 679 . 1 1 A 55 55 LYS CA C 189 59.312 59.200 0.112 2
1 680 . 1 1 A 55 55 LYS CB C 189 32.647 31.976 0.671 2
1 684 . 1 1 A 55 55 LYS N N 189 116.835 118.363 -1.528 2
1 685 . 1 1 A 56 56 LYS H H 190 7.215 7.778 -0.563 2
1 686 . 1 1 A 56 56 LYS HA H 190 4.172 4.276 -0.104 2
1 695 . 1 1 A 56 56 LYS C C 190 177.897 178.011 -0.114 2
1 696 . 1 1 A 56 56 LYS CA C 190 58.418 58.037 0.381 2
1 697 . 1 1 A 56 56 LYS CB C 190 34.652 33.385 1.267 2
1 701 . 1 1 A 56 56 LYS N N 190 117.170 117.964 -0.794 2
1 702 . 1 1 A 57 57 GLU H H 191 8.572 7.907 0.665 2
1 703 . 1 1 A 57 57 GLU HA H 191 4.643 4.369 0.274 2
1 708 . 1 1 A 57 57 GLU C C 191 177.903 176.074 1.829 2
1 709 . 1 1 A 57 57 GLU CA C 191 55.708 56.176 -0.468 2
1 710 . 1 1 A 57 57 GLU CB C 191 32.460 30.904 1.556 2
1 712 . 1 1 A 57 57 GLU N N 191 113.316 116.901 -3.585 2
1 713 . 1 1 A 58 58 SER H H 192 8.550 7.655 0.895 2
1 714 . 1 1 A 58 58 SER HA H 192 4.149 4.382 -0.233 2
1 717 . 1 1 A 58 58 SER C C 192 176.161 175.202 0.959 2
1 718 . 1 1 A 58 58 SER CA C 192 58.403 58.071 0.332 2
1 719 . 1 1 A 58 58 SER CB C 192 64.392 64.293 0.099 2
1 720 . 1 1 A 58 58 SER N N 192 109.861 115.831 -5.970 2
1 721 . 1 1 A 59 59 MET H H 193 9.533 8.876 0.657 2
1 722 . 1 1 A 59 59 MET HA H 193 4.457 4.612 -0.155 2
1 730 . 1 1 A 59 59 MET C C 193 175.204 175.608 -0.404 2
1 731 . 1 1 A 59 59 MET CA C 193 55.781 55.247 0.534 2
1 732 . 1 1 A 59 59 MET CB C 193 32.855 32.573 0.282 2
1 735 . 1 1 A 59 59 MET N N 193 124.493 123.736 0.757 2
1 736 . 1 1 A 60 60 ASP H H 194 7.514 7.467 0.047 2
1 737 . 1 1 A 60 60 ASP HA H 194 4.886 4.604 0.282 2
1 740 . 1 1 A 60 60 ASP C C 194 175.517 176.712 -1.195 2
1 741 . 1 1 A 60 60 ASP CA C 194 52.286 53.207 -0.921 2
1 742 . 1 1 A 60 60 ASP CB C 194 40.222 40.717 -0.495 2
1 743 . 1 1 A 60 60 ASP N N 194 117.785 121.789 -4.004 2
1 744 . 1 1 A 61 61 THR H H 195 8.118 8.207 -0.089 2
1 745 . 1 1 A 61 61 THR HA H 195 3.918 3.927 -0.009 2
1 750 . 1 1 A 61 61 THR C C 195 176.269 176.948 -0.679 2
1 751 . 1 1 A 61 61 THR CA C 195 65.469 65.518 -0.049 2
1 752 . 1 1 A 61 61 THR CB C 195 68.741 68.442 0.299 2
1 754 . 1 1 A 61 61 THR N N 195 120.765 118.594 2.171 2
1 755 . 1 1 A 62 62 GLY H H 196 8.399 8.498 -0.099 2
1 756 . 1 1 A 62 62 GLY HA2 H 196 3.932 3.871 0.061 2
1 757 . 1 1 A 62 62 GLY HA3 H 196 3.900 3.873 0.027 2
1 758 . 1 1 A 62 62 GLY C C 196 174.948 176.098 -1.150 2
1 759 . 1 1 A 62 62 GLY CA C 196 46.768 47.188 -0.420 2
1 760 . 1 1 A 62 62 GLY N N 196 108.183 110.637 -2.454 2
1 761 . 1 1 A 63 63 SER H H 197 7.265 8.111 -0.846 2
1 762 . 1 1 A 63 63 SER HA H 197 4.554 4.430 0.124 2
1 765 . 1 1 A 63 63 SER C C 197 177.630 176.234 1.396 2
1 766 . 1 1 A 63 63 SER CA C 197 59.550 61.535 -1.985 2
1 767 . 1 1 A 63 63 SER CB C 197 65.504 63.524 1.980 2
1 768 . 1 1 A 63 63 SER N N 197 111.815 117.651 -5.836 2
1 769 . 1 1 A 64 64 ALA H H 198 8.675 8.434 0.241 2
1 770 . 1 1 A 64 64 ALA HA H 198 3.801 3.975 -0.174 2
1 774 . 1 1 A 64 64 ALA C C 198 178.492 179.592 -1.100 2
1 775 . 1 1 A 64 64 ALA CA C 198 56.794 55.390 1.404 2
1 776 . 1 1 A 64 64 ALA CB C 198 18.951 18.421 0.530 2
1 777 . 1 1 A 64 64 ALA N N 198 131.710 123.608 8.102 2
1 778 . 1 1 A 65 65 LYS H H 199 7.666 7.823 -0.157 2
1 779 . 1 1 A 65 65 LYS HA H 199 4.175 4.074 0.101 2
1 788 . 1 1 A 65 65 LYS C C 199 177.159 177.595 -0.436 2
1 789 . 1 1 A 65 65 LYS CA C 199 57.735 58.693 -0.958 2
1 790 . 1 1 A 65 65 LYS CB C 199 31.948 31.904 0.044 2
1 794 . 1 1 A 65 65 LYS N N 199 111.375 117.716 -6.341 2
1 795 . 1 1 A 66 66 LYS H H 200 7.545 7.516 0.029 2
1 796 . 1 1 A 66 66 LYS HA H 200 4.612 4.457 0.155 2
1 805 . 1 1 A 66 66 LYS C C 200 175.609 175.579 0.030 2
1 806 . 1 1 A 66 66 LYS CA C 200 54.468 55.845 -1.377 2
1 807 . 1 1 A 66 66 LYS CB C 200 31.525 32.621 -1.096 2
1 811 . 1 1 A 66 66 LYS N N 200 121.421 118.091 3.330 2
1 812 . 1 1 A 67 67 ASP H H 201 7.630 8.213 -0.583 2
1 813 . 1 1 A 67 67 ASP HA H 201 4.306 4.379 -0.073 2
1 816 . 1 1 A 67 67 ASP C C 201 175.025 176.329 -1.304 2
1 817 . 1 1 A 67 67 ASP CA C 201 56.400 55.369 1.031 2
1 818 . 1 1 A 67 67 ASP CB C 201 38.315 39.071 -0.756 2
1 819 . 1 1 A 67 67 ASP N N 201 116.216 116.942 -0.726 2
1 820 . 1 1 A 68 68 GLY H H 202 8.368 8.633 -0.265 2
1 821 . 1 1 A 68 68 GLY HA2 H 202 4.316 3.939 0.377 2
1 822 . 1 1 A 68 68 GLY HA3 H 202 3.731 4.019 -0.288 2
1 823 . 1 1 A 68 68 GLY C C 202 174.139 174.541 -0.402 2
1 824 . 1 1 A 68 68 GLY CA C 202 45.514 45.365 0.149 2
1 825 . 1 1 A 68 68 GLY N N 202 105.095 104.888 0.207 2
1 826 . 1 1 A 69 69 GLU H H 203 7.534 7.895 -0.361 2
1 827 . 1 1 A 69 69 GLU HA H 203 4.479 4.433 0.046 2
1 832 . 1 1 A 69 69 GLU C C 203 176.961 176.303 0.658 2
1 833 . 1 1 A 69 69 GLU CA C 203 58.549 56.684 1.865 2
1 834 . 1 1 A 69 69 GLU CB C 203 30.998 30.497 0.501 2
1 836 . 1 1 A 69 69 GLU N N 203 120.426 120.365 0.061 2
1 837 . 1 1 A 70 70 LEU H H 204 8.962 9.031 -0.069 2
1 838 . 1 1 A 70 70 LEU HA H 204 4.438 4.613 -0.175 2
1 848 . 1 1 A 70 70 LEU C C 204 178.648 177.266 1.382 2
1 849 . 1 1 A 70 70 LEU CA C 204 53.977 55.089 -1.112 2
1 850 . 1 1 A 70 70 LEU CB C 204 43.612 43.603 0.009 2
1 854 . 1 1 A 70 70 LEU N N 204 122.066 124.624 -2.558 2
1 855 . 1 1 A 71 71 GLY H H 205 8.104 7.584 0.520 2
1 856 . 1 1 A 71 71 GLY HA2 H 205 4.165 4.024 0.141 2
1 857 . 1 1 A 71 71 GLY HA3 H 205 3.552 4.119 -0.567 2
1 858 . 1 1 A 71 71 GLY C C 205 173.098 173.407 -0.309 2
1 859 . 1 1 A 71 71 GLY CA C 205 44.723 45.046 -0.323 2
1 860 . 1 1 A 71 71 GLY N N 205 110.168 106.723 3.445 2
1 861 . 1 1 A 72 72 TYR H H 206 8.457 8.620 -0.163 2
1 862 . 1 1 A 72 72 TYR HA H 206 4.184 4.746 -0.562 2
1 869 . 1 1 A 72 72 TYR C C 206 175.975 175.523 0.452 2
1 870 . 1 1 A 72 72 TYR CA C 206 59.722 58.991 0.731 2
1 871 . 1 1 A 72 72 TYR CB C 206 38.378 38.350 0.028 2
1 874 . 1 1 A 72 72 TYR N N 206 120.171 122.106 -1.935 2
1 875 . 1 1 A 73 73 VAL H H 207 8.782 9.130 -0.348 2
1 876 . 1 1 A 73 73 VAL HA H 207 4.056 4.481 -0.425 2
1 884 . 1 1 A 73 73 VAL C C 207 174.901 175.751 -0.850 2
1 885 . 1 1 A 73 73 VAL CA C 207 62.202 62.489 -0.287 2
1 886 . 1 1 A 73 73 VAL CB C 207 33.071 32.265 0.806 2
1 889 . 1 1 A 73 73 VAL N N 207 128.847 124.974 3.873 2
1 890 . 1 1 A 74 74 LEU H H 208 8.146 8.839 -0.693 2
1 891 . 1 1 A 74 74 LEU HA H 208 4.944 4.673 0.271 2
1 901 . 1 1 A 74 74 LEU C C 208 178.400 177.402 0.998 2
1 902 . 1 1 A 74 74 LEU CA C 208 53.520 54.257 -0.737 2
1 903 . 1 1 A 74 74 LEU CB C 208 43.499 42.783 0.716 2
1 907 . 1 1 A 74 74 LEU N N 208 127.599 129.188 -1.589 2
1 908 . 1 1 A 75 75 LYS H H 209 8.403 8.572 -0.169 2
1 909 . 1 1 A 75 75 LYS HA H 209 3.771 3.891 -0.120 2
1 918 . 1 1 A 75 75 LYS C C 209 177.536 177.452 0.084 2
1 919 . 1 1 A 75 75 LYS CA C 209 58.385 58.851 -0.466 2
1 920 . 1 1 A 75 75 LYS CB C 209 32.459 32.070 0.389 2
1 924 . 1 1 A 75 75 LYS N N 209 123.798 122.798 1.000 2
1 925 . 1 1 A 76 76 GLY H H 210 9.997 9.297 0.700 2
1 926 . 1 1 A 76 76 GLY HA2 H 210 4.255 4.003 0.252 2
1 927 . 1 1 A 76 76 GLY HA3 H 210 3.791 4.005 -0.214 2
1 928 . 1 1 A 76 76 GLY C C 210 175.091 175.620 -0.529 2
1 929 . 1 1 A 76 76 GLY CA C 210 45.465 45.476 -0.011 2
1 930 . 1 1 A 76 76 GLY N N 210 114.705 113.061 1.644 2
1 931 . 1 1 A 77 77 GLN H H 211 7.726 8.011 -0.285 2
1 932 . 1 1 A 77 77 GLN HA H 211 4.373 4.213 0.160 2
1 939 . 1 1 A 77 77 GLN C C 211 176.301 175.952 0.349 2
1 940 . 1 1 A 77 77 GLN CA C 211 57.074 57.305 -0.231 2
1 941 . 1 1 A 77 77 GLN CB C 211 30.798 29.338 1.460 2
1 943 . 1 1 A 77 77 GLN N N 211 118.702 118.016 0.686 2
1 945 . 1 1 A 78 78 THR H H 212 8.225 7.460 0.765 2
1 946 . 1 1 A 78 78 THR HA H 212 4.620 4.621 -0.001 2
1 951 . 1 1 A 78 78 THR C C 212 173.920 174.035 -0.115 2
1 952 . 1 1 A 78 78 THR CA C 212 60.087 59.484 0.603 2
1 953 . 1 1 A 78 78 THR CB C 212 71.412 70.996 0.416 2
1 955 . 1 1 A 78 78 THR N N 212 111.935 110.751 1.184 2
1 956 . 1 1 A 79 79 ASP H H 213 8.372 8.467 -0.095 2
1 957 . 1 1 A 79 79 ASP HA H 213 4.470 4.545 -0.075 2
1 960 . 1 1 A 79 79 ASP C C 213 176.759 177.679 -0.920 2
1 961 . 1 1 A 79 79 ASP CA C 213 54.927 54.397 0.530 2
1 962 . 1 1 A 79 79 ASP CB C 213 43.859 41.745 2.114 2
1 963 . 1 1 A 79 79 ASP N N 213 122.093 121.651 0.442 2
1 964 . 1 1 A 80 80 LYS H H 214 8.740 8.852 -0.112 2
1 965 . 1 1 A 80 80 LYS HA H 214 4.027 3.999 0.028 2
1 974 . 1 1 A 80 80 LYS C C 214 178.493 178.175 0.318 2
1 975 . 1 1 A 80 80 LYS CA C 214 59.802 59.459 0.343 2
1 976 . 1 1 A 80 80 LYS CB C 214 32.374 32.104 0.270 2
1 980 . 1 1 A 80 80 LYS N N 214 124.685 123.261 1.424 2
1 981 . 1 1 A 81 81 ASP H H 215 8.556 8.151 0.405 2
1 982 . 1 1 A 81 81 ASP HA H 215 4.566 4.395 0.171 2
1 985 . 1 1 A 81 81 ASP C C 215 178.889 178.659 0.230 2
1 986 . 1 1 A 81 81 ASP CA C 215 58.046 57.261 0.785 2
1 987 . 1 1 A 81 81 ASP CB C 215 40.872 40.584 0.288 2
1 988 . 1 1 A 81 81 ASP N N 215 121.413 119.618 1.795 2
1 989 . 1 1 A 82 82 PHE H H 216 8.205 8.296 -0.091 2
1 990 . 1 1 A 82 82 PHE HA H 216 3.686 4.075 -0.389 2
1 998 . 1 1 A 82 82 PHE C C 216 175.919 177.369 -1.450 2
1 999 . 1 1 A 82 82 PHE CA C 216 61.648 60.860 0.788 2
1 1000 . 1 1 A 82 82 PHE CB C 216 39.743 39.195 0.548 2
1 1004 . 1 1 A 82 82 PHE N N 216 124.401 122.409 1.992 2
1 1005 . 1 1 A 83 83 GLU H H 217 8.887 8.862 0.025 2
1 1006 . 1 1 A 83 83 GLU HA H 217 3.704 4.173 -0.469 2
1 1011 . 1 1 A 83 83 GLU C C 217 177.788 178.989 -1.201 2
1 1012 . 1 1 A 83 83 GLU CA C 217 60.545 60.259 0.286 2
1 1013 . 1 1 A 83 83 GLU CB C 217 30.639 29.493 1.146 2
1 1015 . 1 1 A 83 83 GLU N N 217 119.421 119.051 0.370 2
1 1016 . 1 1 A 84 84 LYS H H 218 8.055 7.920 0.135 2
1 1017 . 1 1 A 84 84 LYS HA H 218 3.947 4.124 -0.177 2
1 1026 . 1 1 A 84 84 LYS C C 218 178.783 178.633 0.150 2
1 1027 . 1 1 A 84 84 LYS CA C 218 59.327 58.856 0.471 2
1 1028 . 1 1 A 84 84 LYS CB C 218 32.539 32.205 0.334 2
1 1032 . 1 1 A 84 84 LYS N N 218 117.821 119.530 -1.709 2
1 1033 . 1 1 A 85 85 ALA H H 219 7.059 7.719 -0.660 2
1 1034 . 1 1 A 85 85 ALA HA H 219 4.040 4.077 -0.037 2
1 1038 . 1 1 A 85 85 ALA C C 219 179.794 179.949 -0.155 2
1 1039 . 1 1 A 85 85 ALA CA C 219 54.407 54.702 -0.295 2
1 1040 . 1 1 A 85 85 ALA CB C 219 20.130 18.238 1.892 2
1 1041 . 1 1 A 85 85 ALA N N 219 118.905 121.498 -2.593 2
1 1042 . 1 1 A 86 86 LEU H H 220 8.157 8.253 -0.096 2
1 1043 . 1 1 A 86 86 LEU HA H 220 3.692 3.980 -0.288 2
1 1053 . 1 1 A 86 86 LEU C C 220 178.330 178.552 -0.222 2
1 1054 . 1 1 A 86 86 LEU CA C 220 57.752 57.958 -0.206 2
1 1055 . 1 1 A 86 86 LEU CB C 220 41.464 41.863 -0.399 2
1 1059 . 1 1 A 86 86 LEU N N 220 118.606 120.345 -1.739 2
1 1060 . 1 1 A 87 87 PHE H H 221 8.349 8.232 0.117 2
1 1061 . 1 1 A 87 87 PHE HA H 221 3.861 4.471 -0.610 2
1 1069 . 1 1 A 87 87 PHE C C 221 176.176 177.688 -1.512 2
1 1070 . 1 1 A 87 87 PHE CA C 221 61.780 61.552 0.228 2
1 1071 . 1 1 A 87 87 PHE CB C 221 37.549 37.872 -0.323 2
1 1075 . 1 1 A 87 87 PHE N N 221 112.449 116.806 -4.357 2
1 1076 . 1 1 A 88 88 LYS H H 222 7.061 8.016 -0.955 2
1 1077 . 1 1 A 88 88 LYS HA H 222 4.380 4.188 0.192 2
1 1086 . 1 1 A 88 88 LYS C C 222 177.089 177.124 -0.035 2
1 1087 . 1 1 A 88 88 LYS CA C 222 56.726 58.299 -1.573 2
1 1088 . 1 1 A 88 88 LYS CB C 222 33.738 32.391 1.347 2
1 1092 . 1 1 A 88 88 LYS N N 222 118.308 119.608 -1.300 2
1 1093 . 1 1 A 89 89 LEU H H 223 7.270 7.251 0.019 2
1 1094 . 1 1 A 89 89 LEU HA H 223 4.168 4.182 -0.014 2
1 1104 . 1 1 A 89 89 LEU C C 223 177.528 176.946 0.582 2
1 1105 . 1 1 A 89 89 LEU CA C 223 55.279 54.826 0.453 2
1 1106 . 1 1 A 89 89 LEU CB C 223 43.240 42.335 0.905 2
1 1110 . 1 1 A 89 89 LEU N N 223 121.317 122.056 -0.739 2
1 1111 . 1 1 A 90 90 LYS H H 224 8.788 8.461 0.327 2
1 1112 . 1 1 A 90 90 LYS HA H 224 4.359 4.357 0.002 2
1 1121 . 1 1 A 90 90 LYS C C 224 175.839 176.072 -0.233 2
1 1122 . 1 1 A 90 90 LYS CA C 224 54.772 55.690 -0.918 2
1 1123 . 1 1 A 90 90 LYS CB C 224 33.232 33.301 -0.069 2
1 1127 . 1 1 A 90 90 LYS N N 224 123.558 122.674 0.884 2
1 1128 . 1 1 A 91 91 ASP H H 225 8.125 8.711 -0.586 2
1 1129 . 1 1 A 91 91 ASP HA H 225 3.958 4.252 -0.294 2
1 1132 . 1 1 A 91 91 ASP C C 225 177.452 176.896 0.556 2
1 1133 . 1 1 A 91 91 ASP CA C 225 56.642 55.924 0.718 2
1 1134 . 1 1 A 91 91 ASP CB C 225 40.269 40.188 0.081 2
1 1135 . 1 1 A 91 91 ASP N N 225 119.419 121.737 -2.318 2
1 1136 . 1 1 A 92 92 GLY H H 226 8.681 8.708 -0.027 2
1 1137 . 1 1 A 92 92 GLY HA2 H 226 4.131 3.856 0.275 2
1 1138 . 1 1 A 92 92 GLY HA3 H 226 3.579 3.883 -0.304 2
1 1139 . 1 1 A 92 92 GLY C C 226 173.614 173.992 -0.378 2
1 1140 . 1 1 A 92 92 GLY CA C 226 45.564 45.127 0.437 2
1 1141 . 1 1 A 92 92 GLY N N 226 113.802 111.866 1.936 2
1 1142 . 1 1 A 93 93 GLU H H 227 8.104 8.016 0.088 2
1 1143 . 1 1 A 93 93 GLU HA H 227 4.232 4.419 -0.187 2
1 1148 . 1 1 A 93 93 GLU C C 227 174.282 175.676 -1.394 2
1 1149 . 1 1 A 93 93 GLU CA C 227 56.651 56.119 0.532 2
1 1150 . 1 1 A 93 93 GLU CB C 227 32.190 31.083 1.107 2
1 1152 . 1 1 A 93 93 GLU N N 227 121.527 121.813 -0.286 2
1 1153 . 1 1 A 94 94 VAL H H 228 7.918 8.509 -0.591 2
1 1154 . 1 1 A 94 94 VAL HA H 228 4.857 4.751 0.106 2
1 1162 . 1 1 A 94 94 VAL C C 228 176.556 175.692 0.864 2
1 1163 . 1 1 A 94 94 VAL CA C 228 60.309 60.310 -0.001 2
1 1164 . 1 1 A 94 94 VAL CB C 228 33.847 35.133 -1.286 2
1 1167 . 1 1 A 94 94 VAL N N 228 119.768 124.917 -5.149 2
1 1168 . 1 1 A 95 95 SER H H 229 9.659 9.371 0.288 2
1 1169 . 1 1 A 95 95 SER HA H 229 4.313 4.680 -0.367 2
1 1172 . 1 1 A 95 95 SER C C 229 174.641 174.488 0.153 2
1 1173 . 1 1 A 95 95 SER CA C 229 59.208 57.816 1.392 2
1 1174 . 1 1 A 95 95 SER CB C 229 66.080 65.594 0.486 2
1 1175 . 1 1 A 95 95 SER N N 229 124.903 120.432 4.471 2
1 1176 . 1 1 A 96 96 GLU H H 230 8.014 8.514 -0.500 2
1 1177 . 1 1 A 96 96 GLU HA H 230 4.376 4.400 -0.024 2
1 1182 . 1 1 A 96 96 GLU C C 230 176.641 176.619 0.022 2
1 1183 . 1 1 A 96 96 GLU CA C 230 56.236 56.284 -0.048 2
1 1184 . 1 1 A 96 96 GLU CB C 230 30.324 30.645 -0.321 2
1 1186 . 1 1 A 96 96 GLU N N 230 115.510 120.334 -4.824 2
1 1187 . 1 1 A 97 97 VAL H H 231 8.741 8.330 0.411 2
1 1188 . 1 1 A 97 97 VAL HA H 231 4.171 4.166 0.005 2
1 1196 . 1 1 A 97 97 VAL C C 231 176.684 175.707 0.977 2
1 1197 . 1 1 A 97 97 VAL CA C 231 65.418 63.173 2.245 2
1 1198 . 1 1 A 97 97 VAL CB C 231 31.218 31.515 -0.297 2
1 1201 . 1 1 A 97 97 VAL N N 231 121.289 121.199 0.090 2
1 1202 . 1 1 A 98 98 VAL H H 232 9.218 9.492 -0.274 2
1 1203 . 1 1 A 98 98 VAL HA H 232 4.405 4.660 -0.255 2
1 1211 . 1 1 A 98 98 VAL C C 232 174.258 174.521 -0.263 2
1 1212 . 1 1 A 98 98 VAL CA C 232 60.937 61.256 -0.319 2
1 1213 . 1 1 A 98 98 VAL CB C 232 35.825 33.789 2.036 2
1 1216 . 1 1 A 98 98 VAL N N 232 130.544 128.849 1.695 2
1 1217 . 1 1 A 99 99 LYS H H 233 8.800 8.884 -0.084 2
1 1218 . 1 1 A 99 99 LYS HA H 233 4.853 5.123 -0.270 2
1 1227 . 1 1 A 99 99 LYS C C 233 175.274 175.198 0.076 2
1 1228 . 1 1 A 99 99 LYS CA C 233 55.499 54.992 0.507 2
1 1229 . 1 1 A 99 99 LYS CB C 233 34.452 34.646 -0.194 2
1 1233 . 1 1 A 99 99 LYS N N 233 130.477 128.234 2.243 2
1 1234 . 1 1 A 100 100 SER H H 234 9.585 8.996 0.589 2
1 1235 . 1 1 A 100 100 SER HA H 234 5.150 4.913 0.237 2
1 1238 . 1 1 A 100 100 SER C C 234 175.493 174.166 1.327 2
1 1239 . 1 1 A 100 100 SER CA C 234 56.927 57.275 -0.348 2
1 1240 . 1 1 A 100 100 SER CB C 234 67.309 67.131 0.178 2
1 1241 . 1 1 A 100 100 SER N N 234 125.814 122.591 3.223 2
1 1242 . 1 1 A 101 101 SER H H 235 8.631 8.804 -0.173 2
1 1243 . 1 1 A 101 101 SER HA H 235 4.106 4.069 0.037 2
1 1246 . 1 1 A 101 101 SER C C 235 175.385 175.352 0.033 2
1 1247 . 1 1 A 101 101 SER CA C 235 61.123 61.425 -0.302 2
1 1248 . 1 1 A 101 101 SER CB C 235 62.818 62.568 0.250 2
1 1249 . 1 1 A 101 101 SER N N 235 115.089 117.326 -2.237 2
1 1250 . 1 1 A 102 102 PHE H H 236 8.957 7.623 1.334 2
1 1251 . 1 1 A 102 102 PHE HA H 236 4.610 4.617 -0.007 2
1 1259 . 1 1 A 102 102 PHE C C 236 176.453 175.756 0.697 2
1 1260 . 1 1 A 102 102 PHE CA C 236 58.382 58.126 0.256 2
1 1261 . 1 1 A 102 102 PHE CB C 236 40.275 39.602 0.673 2
1 1263 . 1 1 A 102 102 PHE N N 236 119.917 117.651 2.266 2
1 1264 . 1 1 A 103 103 GLY H H 237 7.377 7.306 0.071 2
1 1265 . 1 1 A 103 103 GLY HA2 H 237 4.453 3.970 0.483 2
1 1266 . 1 1 A 103 103 GLY HA3 H 237 3.472 4.129 -0.657 2
1 1267 . 1 1 A 103 103 GLY C C 237 169.627 172.341 -2.714 2
1 1268 . 1 1 A 103 103 GLY CA C 237 45.384 44.606 0.778 2
1 1269 . 1 1 A 103 103 GLY N N 237 108.809 106.309 2.500 2
1 1270 . 1 1 A 104 104 TYR H H 238 8.632 8.505 0.127 2
1 1271 . 1 1 A 104 104 TYR HA H 238 5.322 5.517 -0.195 2
1 1278 . 1 1 A 104 104 TYR C C 238 175.043 175.099 -0.056 2
1 1279 . 1 1 A 104 104 TYR CA C 238 57.627 57.066 0.561 2
1 1280 . 1 1 A 104 104 TYR CB C 238 41.711 41.860 -0.149 2
1 1283 . 1 1 A 104 104 TYR N N 238 120.030 121.717 -1.687 2
1 1284 . 1 1 A 105 105 HIS H H 239 10.070 9.480 0.590 2
1 1285 . 1 1 A 105 105 HIS HA H 239 6.046 5.614 0.432 2
1 1290 . 1 1 A 105 105 HIS C C 239 175.734 174.754 0.980 2
1 1291 . 1 1 A 105 105 HIS CA C 239 53.945 54.414 -0.469 2
1 1292 . 1 1 A 105 105 HIS CB C 239 32.450 34.279 -1.829 2
1 1295 . 1 1 A 105 105 HIS N N 239 119.504 118.870 0.634 2
1 1296 . 1 1 A 106 106 ILE H H 240 8.660 8.855 -0.195 2
1 1297 . 1 1 A 106 106 ILE HA H 240 4.120 4.896 -0.776 2
1 1307 . 1 1 A 106 106 ILE C C 240 174.758 175.359 -0.601 2
1 1308 . 1 1 A 106 106 ILE CA C 240 63.446 59.948 3.498 2
1 1309 . 1 1 A 106 106 ILE CB C 240 40.786 41.581 -0.795 2
1 1313 . 1 1 A 106 106 ILE N N 240 120.639 119.969 0.670 2
1 1314 . 1 1 A 107 107 ILE H H 241 9.033 9.137 -0.104 2
1 1315 . 1 1 A 107 107 ILE HA H 241 4.799 5.107 -0.308 2
1 1325 . 1 1 A 107 107 ILE C C 241 172.880 174.090 -1.210 2
1 1326 . 1 1 A 107 107 ILE CA C 241 60.563 59.648 0.915 2
1 1327 . 1 1 A 107 107 ILE CB C 241 41.652 40.806 0.846 2
1 1331 . 1 1 A 107 107 ILE N N 241 129.098 127.110 1.988 2
1 1332 . 1 1 A 108 108 LYS H H 242 8.692 9.008 -0.316 2
1 1333 . 1 1 A 108 108 LYS HA H 242 5.012 4.989 0.023 2
1 1342 . 1 1 A 108 108 LYS C C 242 174.484 175.527 -1.043 2
1 1343 . 1 1 A 108 108 LYS CA C 242 54.317 54.012 0.305 2
1 1344 . 1 1 A 108 108 LYS CB C 242 35.619 35.400 0.219 2
1 1348 . 1 1 A 108 108 LYS N N 242 127.179 127.355 -0.176 2
1 1349 . 1 1 A 109 109 ALA H H 243 7.816 8.964 -1.148 2
1 1350 . 1 1 A 109 109 ALA HA H 243 4.604 4.607 -0.003 2
1 1354 . 1 1 A 109 109 ALA C C 243 176.231 176.295 -0.064 2
1 1355 . 1 1 A 109 109 ALA CA C 243 50.505 51.207 -0.702 2
1 1356 . 1 1 A 109 109 ALA CB C 243 19.584 19.784 -0.200 2
1 1357 . 1 1 A 109 109 ALA N N 243 129.619 128.122 1.497 2
1 1358 . 1 1 A 110 110 ASP H H 244 7.578 8.646 -1.068 2
1 1359 . 1 1 A 110 110 ASP HA H 244 4.424 4.993 -0.569 2
1 1362 . 1 1 A 110 110 ASP C C 244 175.259 175.275 -0.016 2
1 1363 . 1 1 A 110 110 ASP CA C 244 54.489 52.617 1.872 2
1 1364 . 1 1 A 110 110 ASP CB C 244 42.693 43.555 -0.862 2
1 1365 . 1 1 A 110 110 ASP N N 244 125.434 121.940 3.494 2
stop_
save_