data_15777_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15777
_Entry.PDB_ID 2K3T
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 4 . 1 1 1 A 2 2 ALA HA H -2 4.374 4.080 0.294 1
1 8 . 1 1 1 A 2 2 ALA C C -2 177.865 178.592 -0.727 1
1 9 . 1 1 1 A 2 2 ALA CA C -2 52.670 53.986 -1.316 1
1 10 . 1 1 1 A 2 2 ALA CB C -2 19.508 18.636 0.872 1
1 32 . 1 1 1 A 5 5 ASP H H 2428 8.300 8.981 -0.681 1
1 33 . 1 1 1 A 5 5 ASP HA H 2428 5.082 5.331 -0.249 1
1 36 . 1 1 1 A 5 5 ASP CA C 2428 51.517 50.884 0.633 1
1 37 . 1 1 1 A 5 5 ASP CB C 2428 42.244 43.904 -1.660 1
1 38 . 1 1 1 A 5 5 ASP N N 2428 122.879 120.335 2.544 1
1 39 . 1 1 1 A 6 6 PRO HA H 2429 4.340 4.429 -0.089 1
1 46 . 1 1 1 A 6 6 PRO C C 2429 178.266 177.769 0.497 1
1 47 . 1 1 1 A 6 6 PRO CA C 2429 64.494 64.357 0.137 1
1 48 . 1 1 1 A 6 6 PRO CB C 2429 31.841 31.977 -0.136 1
1 51 . 1 1 1 A 7 7 GLY H H 2430 8.686 8.544 0.142 1
1 52 . 1 1 1 A 7 7 GLY HA2 H 2430 4.116 3.840 0.276 1
1 53 . 1 1 1 A 7 7 GLY HA3 H 2430 3.868 3.841 0.027 1
1 54 . 1 1 1 A 7 7 GLY C C 2430 174.567 175.796 -1.229 1
1 55 . 1 1 1 A 7 7 GLY CA C 2430 46.038 46.577 -0.539 1
1 56 . 1 1 1 A 7 7 GLY N N 2430 107.655 107.064 0.591 1
1 57 . 1 1 1 A 8 8 LEU H H 2431 7.692 7.330 0.362 1
1 58 . 1 1 1 A 8 8 LEU HA H 2431 4.507 4.339 0.168 1
1 68 . 1 1 1 A 8 8 LEU C C 2431 176.876 177.602 -0.726 1
1 69 . 1 1 1 A 8 8 LEU CA C 2431 54.307 57.436 -3.129 1
1 70 . 1 1 1 A 8 8 LEU CB C 2431 42.879 42.666 0.213 1
1 74 . 1 1 1 A 8 8 LEU N N 2431 120.022 120.446 -0.424 1
1 75 . 1 1 1 A 9 9 VAL H H 2432 7.378 7.501 -0.123 1
1 76 . 1 1 1 A 9 9 VAL HA H 2432 4.154 3.901 0.253 1
1 84 . 1 1 1 A 9 9 VAL C C 2432 174.703 175.566 -0.863 1
1 85 . 1 1 1 A 9 9 VAL CA C 2432 62.387 63.305 -0.918 1
1 86 . 1 1 1 A 9 9 VAL CB C 2432 32.519 31.478 1.041 1
1 89 . 1 1 1 A 9 9 VAL N N 2432 123.902 119.424 4.478 1
1 90 . 1 1 1 A 10 10 SER H H 2433 8.201 8.539 -0.338 1
1 91 . 1 1 1 A 10 10 SER HA H 2433 5.136 4.892 0.244 1
1 94 . 1 1 1 A 10 10 SER CA C 2433 56.554 55.604 0.950 1
1 95 . 1 1 1 A 10 10 SER CB C 2433 66.763 65.146 1.617 1
1 96 . 1 1 1 A 10 10 SER N N 2433 121.921 121.681 0.240 1
1 97 . 1 1 1 A 11 11 ALA H H 2434 8.670 8.341 0.329 1
1 98 . 1 1 1 A 11 11 ALA HA H 2434 5.632 5.378 0.254 1
1 102 . 1 1 1 A 11 11 ALA C C 2434 175.459 174.683 0.776 1
1 103 . 1 1 1 A 11 11 ALA CA C 2434 50.575 50.617 -0.042 1
1 104 . 1 1 1 A 11 11 ALA CB C 2434 23.111 23.439 -0.328 1
1 105 . 1 1 1 A 11 11 ALA N N 2434 124.828 123.620 1.208 1
1 106 . 1 1 1 A 12 12 TYR H H 2435 8.609 8.748 -0.139 1
1 107 . 1 1 1 A 12 12 TYR HA H 2435 4.879 5.047 -0.168 1
1 114 . 1 1 1 A 12 12 TYR C C 2435 173.645 174.696 -1.051 1
1 115 . 1 1 1 A 12 12 TYR CA C 2435 56.268 56.851 -0.583 1
1 116 . 1 1 1 A 12 12 TYR CB C 2435 39.522 42.310 -2.788 1
1 119 . 1 1 1 A 12 12 TYR N N 2435 118.305 119.259 -0.954 1
1 120 . 1 1 1 A 13 13 GLY H H 2436 8.655 8.596 0.059 1
1 121 . 1 1 1 A 13 13 GLY HA2 H 2436 4.943 4.248 0.695 1
1 122 . 1 1 1 A 13 13 GLY HA3 H 2436 4.028 4.294 -0.266 1
1 123 . 1 1 1 A 13 13 GLY C C 2436 175.334 175.134 0.200 1
1 124 . 1 1 1 A 13 13 GLY CA C 2436 44.389 44.246 0.143 1
1 125 . 1 1 1 A 13 13 GLY N N 2436 110.710 110.446 0.264 1
1 126 . 1 1 1 A 14 14 ALA H H 2437 8.939 8.684 0.255 1
1 127 . 1 1 1 A 14 14 ALA HA H 2437 4.276 4.070 0.206 1
1 131 . 1 1 1 A 14 14 ALA C C 2437 180.524 179.086 1.438 1
1 132 . 1 1 1 A 14 14 ALA CA C 2437 55.551 55.066 0.485 1
1 133 . 1 1 1 A 14 14 ALA CB C 2437 18.411 18.327 0.084 1
1 134 . 1 1 1 A 14 14 ALA N N 2437 126.973 123.795 3.178 1
1 135 . 1 1 1 A 15 15 GLY H H 2438 8.933 8.731 0.202 1
1 136 . 1 1 1 A 15 15 GLY HA2 H 2438 4.531 3.941 0.590 1
1 137 . 1 1 1 A 15 15 GLY HA3 H 2438 3.576 4.165 -0.589 1
1 138 . 1 1 1 A 15 15 GLY C C 2438 174.323 175.548 -1.225 1
1 139 . 1 1 1 A 15 15 GLY CA C 2438 46.855 47.039 -0.184 1
1 140 . 1 1 1 A 15 15 GLY N N 2438 104.803 105.634 -0.831 1
1 141 . 1 1 1 A 16 16 LEU H H 2439 7.529 7.597 -0.068 1
1 142 . 1 1 1 A 16 16 LEU HA H 2439 3.768 3.837 -0.069 1
1 152 . 1 1 1 A 16 16 LEU C C 2439 176.388 178.794 -2.406 1
1 153 . 1 1 1 A 16 16 LEU CA C 2439 56.137 57.249 -1.112 1
1 154 . 1 1 1 A 16 16 LEU CB C 2439 41.621 41.148 0.473 1
1 158 . 1 1 1 A 16 16 LEU N N 2439 119.633 122.323 -2.690 1
1 159 . 1 1 1 A 17 17 GLU H H 2440 7.505 7.811 -0.306 1
1 160 . 1 1 1 A 17 17 GLU HA H 2440 4.663 4.370 0.293 1
1 165 . 1 1 1 A 17 17 GLU C C 2440 178.126 177.243 0.883 1
1 166 . 1 1 1 A 17 17 GLU CA C 2440 56.447 56.533 -0.086 1
1 167 . 1 1 1 A 17 17 GLU CB C 2440 31.485 30.554 0.931 1
1 169 . 1 1 1 A 17 17 GLU N N 2440 114.368 115.929 -1.561 1
1 170 . 1 1 1 A 18 18 GLY H H 2441 7.921 7.464 0.457 1
1 171 . 1 1 1 A 18 18 GLY HA2 H 2441 4.889 4.110 0.779 1
1 172 . 1 1 1 A 18 18 GLY HA3 H 2441 3.707 4.130 -0.423 1
1 173 . 1 1 1 A 18 18 GLY C C 2441 170.965 172.250 -1.285 1
1 174 . 1 1 1 A 18 18 GLY CA C 2441 45.549 44.291 1.258 1
1 175 . 1 1 1 A 18 18 GLY N N 2441 109.165 106.786 2.379 1
1 176 . 1 1 1 A 19 19 GLY H H 2442 7.540 7.978 -0.438 1
1 177 . 1 1 1 A 19 19 GLY HA2 H 2442 4.086 4.263 -0.177 1
1 178 . 1 1 1 A 19 19 GLY HA3 H 2442 4.086 4.295 -0.209 1
1 179 . 1 1 1 A 19 19 GLY C C 2442 171.051 171.649 -0.598 1
1 180 . 1 1 1 A 19 19 GLY CA C 2442 44.937 45.928 -0.991 1
1 181 . 1 1 1 A 19 19 GLY N N 2442 105.460 108.825 -3.365 1
1 182 . 1 1 1 A 20 20 VAL H H 2443 8.899 8.537 0.362 1
1 183 . 1 1 1 A 20 20 VAL HA H 2443 5.062 5.004 0.058 1
1 191 . 1 1 1 A 20 20 VAL C C 2443 176.623 175.175 1.448 1
1 192 . 1 1 1 A 20 20 VAL CA C 2443 60.197 60.211 -0.014 1
1 193 . 1 1 1 A 20 20 VAL CB C 2443 35.107 35.582 -0.475 1
1 196 . 1 1 1 A 20 20 VAL N N 2443 122.753 121.417 1.336 1
1 197 . 1 1 1 A 21 21 THR H H 2444 8.630 8.591 0.039 1
1 198 . 1 1 1 A 21 21 THR HA H 2444 3.773 4.256 -0.483 1
1 203 . 1 1 1 A 21 21 THR C C 2444 175.646 174.940 0.706 1
1 204 . 1 1 1 A 21 21 THR CA C 2444 62.732 63.234 -0.502 1
1 205 . 1 1 1 A 21 21 THR CB C 2444 68.925 68.512 0.413 1
1 207 . 1 1 1 A 21 21 THR N N 2444 118.179 117.450 0.729 1
1 208 . 1 1 1 A 22 22 GLY H H 2445 8.736 8.859 -0.123 1
1 209 . 1 1 1 A 22 22 GLY HA2 H 2445 3.412 3.988 -0.576 1
1 210 . 1 1 1 A 22 22 GLY HA3 H 2445 4.061 3.990 0.071 1
1 211 . 1 1 1 A 22 22 GLY C C 2445 172.973 173.491 -0.518 1
1 212 . 1 1 1 A 22 22 GLY CA C 2445 45.577 45.274 0.303 1
1 213 . 1 1 1 A 22 22 GLY N N 2445 107.888 113.969 -6.081 1
1 214 . 1 1 1 A 23 23 ASN H H 2446 7.877 7.736 0.141 1
1 215 . 1 1 1 A 23 23 ASN HA H 2446 5.253 5.009 0.244 1
1 220 . 1 1 1 A 23 23 ASN CA C 2446 49.740 50.530 -0.790 1
1 221 . 1 1 1 A 23 23 ASN CB C 2446 40.198 39.495 0.703 1
1 222 . 1 1 1 A 23 23 ASN N N 2446 120.684 120.954 -0.270 1
1 224 . 1 1 1 A 24 24 PRO HA H 2447 4.525 4.553 -0.028 1
1 231 . 1 1 1 A 24 24 PRO CA C 2447 62.766 62.256 0.510 1
1 232 . 1 1 1 A 24 24 PRO CB C 2447 31.732 32.108 -0.376 1
1 235 . 1 1 1 A 25 25 ALA H H 2448 9.178 8.394 0.784 1
1 236 . 1 1 1 A 25 25 ALA HA H 2448 4.614 4.836 -0.222 1
1 240 . 1 1 1 A 25 25 ALA C C 2448 175.503 175.403 0.100 1
1 241 . 1 1 1 A 25 25 ALA CA C 2448 50.526 50.300 0.226 1
1 242 . 1 1 1 A 25 25 ALA CB C 2448 20.458 20.936 -0.478 1
1 243 . 1 1 1 A 25 25 ALA N N 2448 132.079 124.827 7.252 1
1 244 . 1 1 1 A 26 26 GLU H H 2449 8.813 9.077 -0.264 1
1 245 . 1 1 1 A 26 26 GLU HA H 2449 5.830 5.335 0.495 1
1 250 . 1 1 1 A 26 26 GLU C C 2449 176.272 175.105 1.167 1
1 251 . 1 1 1 A 26 26 GLU CA C 2449 54.376 54.962 -0.586 1
1 252 . 1 1 1 A 26 26 GLU CB C 2449 35.463 33.258 2.205 1
1 254 . 1 1 1 A 26 26 GLU N N 2449 120.079 123.590 -3.511 1
1 255 . 1 1 1 A 27 27 PHE H H 2450 8.782 8.923 -0.141 1
1 256 . 1 1 1 A 27 27 PHE HA H 2450 5.021 5.323 -0.302 1
1 264 . 1 1 1 A 27 27 PHE C C 2450 171.205 172.138 -0.933 1
1 265 . 1 1 1 A 27 27 PHE CA C 2450 56.852 56.084 0.768 1
1 266 . 1 1 1 A 27 27 PHE CB C 2450 41.080 41.871 -0.791 1
1 270 . 1 1 1 A 27 27 PHE N N 2450 118.670 121.554 -2.884 1
1 271 . 1 1 1 A 28 28 VAL H H 2451 8.961 9.276 -0.315 1
1 272 . 1 1 1 A 28 28 VAL HA H 2451 4.761 4.947 -0.186 1
1 280 . 1 1 1 A 28 28 VAL C C 2451 174.673 173.817 0.856 1
1 281 . 1 1 1 A 28 28 VAL CA C 2451 60.619 59.350 1.269 1
1 282 . 1 1 1 A 28 28 VAL CB C 2451 35.484 34.882 0.602 1
1 285 . 1 1 1 A 28 28 VAL N N 2451 121.552 120.000 1.552 1
1 286 . 1 1 1 A 29 29 VAL H H 2452 9.294 9.247 0.047 1
1 287 . 1 1 1 A 29 29 VAL HA H 2452 4.363 4.470 -0.107 1
1 295 . 1 1 1 A 29 29 VAL C C 2452 174.218 174.869 -0.651 1
1 296 . 1 1 1 A 29 29 VAL CA C 2452 61.526 62.325 -0.799 1
1 297 . 1 1 1 A 29 29 VAL CB C 2452 32.666 31.375 1.291 1
1 300 . 1 1 1 A 29 29 VAL N N 2452 125.585 127.849 -2.264 1
1 301 . 1 1 1 A 30 30 ASN H H 2453 9.465 9.082 0.383 1
1 302 . 1 1 1 A 30 30 ASN HA H 2453 5.096 5.190 -0.094 1
1 307 . 1 1 1 A 30 30 ASN C C 2453 176.216 176.248 -0.032 1
1 308 . 1 1 1 A 30 30 ASN CA C 2453 52.011 52.419 -0.408 1
1 309 . 1 1 1 A 30 30 ASN CB C 2453 39.057 39.247 -0.190 1
1 310 . 1 1 1 A 30 30 ASN N N 2453 127.724 127.050 0.674 1
1 312 . 1 1 1 A 31 31 THR H H 2454 8.915 8.540 0.375 1
1 313 . 1 1 1 A 31 31 THR HA H 2454 4.342 4.473 -0.131 1
1 318 . 1 1 1 A 31 31 THR C C 2454 176.816 176.336 0.480 1
1 319 . 1 1 1 A 31 31 THR CA C 2454 61.117 61.816 -0.699 1
1 320 . 1 1 1 A 31 31 THR CB C 2454 68.209 69.569 -1.360 1
1 322 . 1 1 1 A 31 31 THR N N 2454 117.783 116.984 0.799 1
1 323 . 1 1 1 A 32 32 SER H H 2455 8.454 7.926 0.528 1
1 324 . 1 1 1 A 32 32 SER HA H 2455 4.155 4.221 -0.066 1
1 327 . 1 1 1 A 32 32 SER C C 2455 175.458 175.795 -0.337 1
1 328 . 1 1 1 A 32 32 SER CA C 2455 62.148 62.377 -0.229 1
1 329 . 1 1 1 A 32 32 SER CB C 2455 63.476 63.026 0.450 1
1 330 . 1 1 1 A 32 32 SER N N 2455 121.781 119.244 2.537 1
1 331 . 1 1 1 A 33 33 ASN H H 2456 8.845 8.068 0.777 1
1 332 . 1 1 1 A 33 33 ASN HA H 2456 5.064 4.575 0.489 1
1 337 . 1 1 1 A 33 33 ASN C C 2456 174.674 176.110 -1.436 1
1 338 . 1 1 1 A 33 33 ASN CA C 2456 53.067 55.194 -2.127 1
1 339 . 1 1 1 A 33 33 ASN CB C 2456 39.632 38.929 0.703 1
1 340 . 1 1 1 A 33 33 ASN N N 2456 120.176 119.081 1.095 1
1 342 . 1 1 1 A 34 34 ALA H H 2457 7.714 7.911 -0.197 1
1 343 . 1 1 1 A 34 34 ALA HA H 2457 4.482 4.466 0.016 1
1 347 . 1 1 1 A 34 34 ALA C C 2457 177.582 178.311 -0.729 1
1 348 . 1 1 1 A 34 34 ALA CA C 2457 52.521 52.502 0.019 1
1 349 . 1 1 1 A 34 34 ALA CB C 2457 22.252 20.567 1.685 1
1 350 . 1 1 1 A 34 34 ALA N N 2457 123.065 119.469 3.596 1
1 351 . 1 1 1 A 35 35 GLY H H 2458 8.195 8.292 -0.097 1
1 352 . 1 1 1 A 35 35 GLY HA2 H 2458 4.246 4.087 0.159 1
1 353 . 1 1 1 A 35 35 GLY HA3 H 2458 3.902 4.103 -0.201 1
1 354 . 1 1 1 A 35 35 GLY C C 2458 173.360 173.328 0.032 1
1 355 . 1 1 1 A 35 35 GLY CA C 2458 44.486 46.010 -1.524 1
1 356 . 1 1 1 A 35 35 GLY N N 2458 108.472 105.392 3.080 1
1 357 . 1 1 1 A 36 36 ALA H H 2459 8.430 8.352 0.078 1
1 358 . 1 1 1 A 36 36 ALA HA H 2459 4.472 5.265 -0.793 1
1 362 . 1 1 1 A 36 36 ALA C C 2459 176.968 176.035 0.933 1
1 363 . 1 1 1 A 36 36 ALA CA C 2459 52.695 51.486 1.209 1
1 364 . 1 1 1 A 36 36 ALA CB C 2459 19.360 23.467 -4.107 1
1 365 . 1 1 1 A 36 36 ALA N N 2459 126.012 125.239 0.773 1
1 366 . 1 1 1 A 37 37 GLY H H 2460 7.781 8.537 -0.756 1
1 367 . 1 1 1 A 37 37 GLY HA2 H 2460 3.856 3.822 0.034 1
1 368 . 1 1 1 A 37 37 GLY HA3 H 2460 3.164 4.054 -0.890 1
1 369 . 1 1 1 A 37 37 GLY C C 2460 170.730 172.016 -1.286 1
1 370 . 1 1 1 A 37 37 GLY CA C 2460 44.747 45.169 -0.422 1
1 371 . 1 1 1 A 37 37 GLY N N 2460 109.493 105.662 3.831 1
1 372 . 1 1 1 A 38 38 ALA H H 2461 8.055 8.011 0.044 1
1 373 . 1 1 1 A 38 38 ALA HA H 2461 4.389 4.637 -0.248 1
1 377 . 1 1 1 A 38 38 ALA C C 2461 176.609 176.502 0.107 1
1 378 . 1 1 1 A 38 38 ALA CA C 2461 51.419 51.867 -0.448 1
1 379 . 1 1 1 A 38 38 ALA CB C 2461 19.665 19.459 0.206 1
1 380 . 1 1 1 A 38 38 ALA N N 2461 121.997 122.634 -0.637 1
1 381 . 1 1 1 A 39 39 LEU H H 2462 8.597 8.655 -0.058 1
1 382 . 1 1 1 A 39 39 LEU HA H 2462 5.022 5.256 -0.234 1
1 392 . 1 1 1 A 39 39 LEU C C 2462 175.883 174.052 1.831 1
1 393 . 1 1 1 A 39 39 LEU CA C 2462 53.907 53.523 0.384 1
1 394 . 1 1 1 A 39 39 LEU CB C 2462 44.576 46.521 -1.945 1
1 398 . 1 1 1 A 39 39 LEU N N 2462 126.664 123.219 3.445 1
1 399 . 1 1 1 A 40 40 SER H H 2463 8.898 9.487 -0.589 1
1 400 . 1 1 1 A 40 40 SER HA H 2463 4.732 5.496 -0.764 1
1 403 . 1 1 1 A 40 40 SER C C 2463 172.984 172.429 0.555 1
1 404 . 1 1 1 A 40 40 SER CA C 2463 56.730 56.317 0.413 1
1 405 . 1 1 1 A 40 40 SER CB C 2463 64.648 66.695 -2.047 1
1 406 . 1 1 1 A 40 40 SER N N 2463 122.932 120.640 2.292 1
1 407 . 1 1 1 A 41 41 VAL H H 2464 8.538 8.551 -0.013 1
1 408 . 1 1 1 A 41 41 VAL HA H 2464 5.131 4.852 0.279 1
1 416 . 1 1 1 A 41 41 VAL C C 2464 174.812 173.582 1.230 1
1 417 . 1 1 1 A 41 41 VAL CA C 2464 60.784 60.603 0.181 1
1 418 . 1 1 1 A 41 41 VAL CB C 2464 34.262 34.855 -0.593 1
1 420 . 1 1 1 A 41 41 VAL N N 2464 129.161 122.599 6.562 1
1 421 . 1 1 1 A 42 42 THR H H 2465 8.807 8.978 -0.171 1
1 422 . 1 1 1 A 42 42 THR HA H 2465 4.573 5.061 -0.488 1
1 427 . 1 1 1 A 42 42 THR CA C 2465 60.408 61.523 -1.115 1
1 428 . 1 1 1 A 42 42 THR CB C 2465 71.764 72.684 -0.920 1
1 430 . 1 1 1 A 42 42 THR N N 2465 120.898 122.701 -1.803 1
1 431 . 1 1 1 A 43 43 ILE H H 2466 8.648 8.846 -0.198 1
1 432 . 1 1 1 A 43 43 ILE HA H 2466 4.854 5.169 -0.315 1
1 442 . 1 1 1 A 43 43 ILE C C 2466 174.073 174.547 -0.474 1
1 443 . 1 1 1 A 43 43 ILE CA C 2466 61.184 60.092 1.092 1
1 444 . 1 1 1 A 43 43 ILE CB C 2466 39.516 40.235 -0.719 1
1 448 . 1 1 1 A 43 43 ILE N N 2466 124.810 126.810 -2.000 1
1 449 . 1 1 1 A 44 44 ASP H H 2467 8.821 8.990 -0.169 1
1 450 . 1 1 1 A 44 44 ASP HA H 2467 5.217 5.600 -0.383 1
1 453 . 1 1 1 A 44 44 ASP C C 2467 175.002 175.283 -0.281 1
1 454 . 1 1 1 A 44 44 ASP CA C 2467 52.998 52.672 0.326 1
1 455 . 1 1 1 A 44 44 ASP CB C 2467 44.728 44.795 -0.067 1
1 456 . 1 1 1 A 44 44 ASP N N 2467 129.093 127.214 1.879 1
1 457 . 1 1 1 A 45 45 GLY H H 2468 8.535 8.346 0.189 1
1 458 . 1 1 1 A 45 45 GLY HA2 H 2468 3.954 3.652 0.302 1
1 459 . 1 1 1 A 45 45 GLY HA3 H 2468 3.561 4.061 -0.500 1
1 460 . 1 1 1 A 45 45 GLY CA C 2468 45.659 45.397 0.262 1
1 461 . 1 1 1 A 45 45 GLY N N 2468 112.751 111.492 1.259 1
1 462 . 1 1 1 A 46 46 PRO HA H 2469 4.318 4.333 -0.015 1
1 469 . 1 1 1 A 46 46 PRO C C 2469 176.086 176.058 0.028 1
1 470 . 1 1 1 A 46 46 PRO CA C 2469 64.198 63.916 0.282 1
1 471 . 1 1 1 A 46 46 PRO CB C 2469 32.348 31.837 0.511 1
1 474 . 1 1 1 A 47 47 SER H H 2470 7.106 7.438 -0.332 1
1 475 . 1 1 1 A 47 47 SER HA H 2470 4.632 4.624 0.008 1
1 478 . 1 1 1 A 47 47 SER C C 2470 172.969 173.084 -0.115 1
1 479 . 1 1 1 A 47 47 SER CA C 2470 57.106 56.383 0.723 1
1 480 . 1 1 1 A 47 47 SER CB C 2470 66.262 65.299 0.963 1
1 481 . 1 1 1 A 47 47 SER N N 2470 110.556 111.707 -1.151 1
1 482 . 1 1 1 A 48 48 LYS H H 2471 8.534 8.336 0.198 1
1 483 . 1 1 1 A 48 48 LYS HA H 2471 4.486 4.646 -0.160 1
1 492 . 1 1 1 A 48 48 LYS C C 2471 177.231 176.091 1.140 1
1 493 . 1 1 1 A 48 48 LYS CA C 2471 56.620 56.526 0.094 1
1 494 . 1 1 1 A 48 48 LYS CB C 2471 32.379 34.003 -1.624 1
1 498 . 1 1 1 A 48 48 LYS N N 2471 124.055 122.276 1.779 1
1 499 . 1 1 1 A 49 49 VAL H H 2472 8.497 8.748 -0.251 1
1 500 . 1 1 1 A 49 49 VAL HA H 2472 4.552 4.932 -0.380 1
1 508 . 1 1 1 A 49 49 VAL C C 2472 175.292 174.128 1.164 1
1 509 . 1 1 1 A 49 49 VAL CA C 2472 60.142 58.879 1.263 1
1 510 . 1 1 1 A 49 49 VAL CB C 2472 33.464 35.650 -2.186 1
1 513 . 1 1 1 A 49 49 VAL N N 2472 121.233 118.012 3.221 1
1 514 . 1 1 1 A 50 50 LYS H H 2473 8.190 8.222 -0.032 1
1 515 . 1 1 1 A 50 50 LYS HA H 2473 4.522 4.886 -0.364 1
1 518 . 1 1 1 A 50 50 LYS CA C 2473 55.952 55.366 0.586 1
1 519 . 1 1 1 A 50 50 LYS CB C 2473 32.896 33.566 -0.670 1
1 520 . 1 1 1 A 50 50 LYS N N 2473 126.082 122.699 3.383 1
1 521 . 1 1 1 A 51 51 MET H H 2474 8.818 8.991 -0.173 1
1 522 . 1 1 1 A 51 51 MET HA H 2474 5.324 5.439 -0.115 1
1 530 . 1 1 1 A 51 51 MET C C 2474 173.933 174.473 -0.540 1
1 531 . 1 1 1 A 51 51 MET CA C 2474 54.848 54.130 0.718 1
1 532 . 1 1 1 A 51 51 MET CB C 2474 37.043 34.681 2.362 1
1 535 . 1 1 1 A 51 51 MET N N 2474 126.911 123.436 3.475 1
1 536 . 1 1 1 A 52 52 ASP H H 2475 9.095 9.422 -0.327 1
1 537 . 1 1 1 A 52 52 ASP HA H 2475 4.947 5.118 -0.171 1
1 540 . 1 1 1 A 52 52 ASP C C 2475 173.923 174.439 -0.516 1
1 541 . 1 1 1 A 52 52 ASP CA C 2475 53.487 52.812 0.675 1
1 542 . 1 1 1 A 52 52 ASP CB C 2475 44.765 41.840 2.925 1
1 543 . 1 1 1 A 52 52 ASP N N 2475 125.526 124.695 0.831 1
1 544 . 1 1 1 A 53 53 CYS H H 2476 8.606 9.061 -0.455 1
1 545 . 1 1 1 A 53 53 CYS HA H 2476 5.145 5.296 -0.151 1
1 548 . 1 1 1 A 53 53 CYS C C 2476 173.330 174.177 -0.847 1
1 549 . 1 1 1 A 53 53 CYS CA C 2476 57.452 57.496 -0.044 1
1 550 . 1 1 1 A 53 53 CYS CB C 2476 28.108 29.350 -1.242 1
1 551 . 1 1 1 A 53 53 CYS N N 2476 124.317 127.113 -2.796 1
1 552 . 1 1 1 A 54 54 GLN H H 2477 8.978 8.959 0.019 1
1 553 . 1 1 1 A 54 54 GLN HA H 2477 4.884 4.886 -0.002 1
1 560 . 1 1 1 A 54 54 GLN C C 2477 174.854 175.357 -0.503 1
1 561 . 1 1 1 A 54 54 GLN CA C 2477 53.891 54.599 -0.708 1
1 562 . 1 1 1 A 54 54 GLN CB C 2477 32.837 32.533 0.304 1
1 564 . 1 1 1 A 54 54 GLN N N 2477 127.074 125.896 1.178 1
1 566 . 1 1 1 A 55 55 GLU H H 2478 9.065 8.732 0.333 1
1 567 . 1 1 1 A 55 55 GLU HA H 2478 4.280 4.339 -0.059 1
1 572 . 1 1 1 A 55 55 GLU C C 2478 175.383 176.007 -0.624 1
1 573 . 1 1 1 A 55 55 GLU CA C 2478 57.516 56.196 1.320 1
1 574 . 1 1 1 A 55 55 GLU CB C 2478 30.346 30.231 0.115 1
1 576 . 1 1 1 A 55 55 GLU N N 2478 125.186 121.889 3.297 1
1 577 . 1 1 1 A 56 56 CYS H H 2479 8.407 8.527 -0.120 1
1 578 . 1 1 1 A 56 56 CYS HA H 2479 5.056 4.555 0.501 1
1 581 . 1 1 1 A 56 56 CYS CA C 2479 55.858 56.948 -1.090 1
1 582 . 1 1 1 A 56 56 CYS CB C 2479 28.676 30.010 -1.334 1
1 583 . 1 1 1 A 56 56 CYS N N 2479 121.499 117.108 4.391 1
1 584 . 1 1 1 A 57 57 PRO HA H 2480 4.159 4.298 -0.139 1
1 591 . 1 1 1 A 57 57 PRO C C 2480 177.964 177.660 0.304 1
1 592 . 1 1 1 A 57 57 PRO CA C 2480 66.877 64.625 2.252 1
1 593 . 1 1 1 A 57 57 PRO CB C 2480 31.709 32.020 -0.311 1
1 596 . 1 1 1 A 58 58 GLU H H 2481 8.900 8.089 0.811 1
1 597 . 1 1 1 A 58 58 GLU HA H 2481 4.201 4.374 -0.173 1
1 602 . 1 1 1 A 58 58 GLU C C 2481 175.129 176.572 -1.443 1
1 603 . 1 1 1 A 58 58 GLU CA C 2481 57.883 56.956 0.927 1
1 604 . 1 1 1 A 58 58 GLU CB C 2481 29.991 29.977 0.014 1
1 606 . 1 1 1 A 58 58 GLU N N 2481 115.316 117.897 -2.581 1
1 607 . 1 1 1 A 59 59 GLY H H 2482 7.527 7.492 0.035 1
1 608 . 1 1 1 A 59 59 GLY HA2 H 2482 4.935 4.009 0.926 1
1 609 . 1 1 1 A 59 59 GLY HA3 H 2482 3.381 4.097 -0.716 1
1 610 . 1 1 1 A 59 59 GLY CA C 2482 47.809 44.630 3.179 1
1 611 . 1 1 1 A 59 59 GLY N N 2482 110.079 108.125 1.954 1
1 612 . 1 1 1 A 60 60 TYR H H 2483 8.990 8.650 0.340 1
1 613 . 1 1 1 A 60 60 TYR HA H 2483 5.157 5.235 -0.078 1
1 618 . 1 1 1 A 60 60 TYR C C 2483 175.096 174.465 0.631 1
1 619 . 1 1 1 A 60 60 TYR CA C 2483 57.375 56.713 0.662 1
1 620 . 1 1 1 A 60 60 TYR CB C 2483 43.153 40.428 2.725 1
1 622 . 1 1 1 A 60 60 TYR N N 2483 125.900 122.117 3.783 1
1 623 . 1 1 1 A 61 61 ARG H H 2484 9.557 8.732 0.825 1
1 624 . 1 1 1 A 61 61 ARG HA H 2484 4.858 4.476 0.382 1
1 631 . 1 1 1 A 61 61 ARG CA C 2484 55.016 56.274 -1.258 1
1 632 . 1 1 1 A 61 61 ARG CB C 2484 32.128 31.035 1.093 1
1 635 . 1 1 1 A 61 61 ARG N N 2484 124.847 125.920 -1.073 1
1 636 . 1 1 1 A 62 62 VAL H H 2485 9.046 8.761 0.285 1
1 637 . 1 1 1 A 62 62 VAL HA H 2485 4.675 4.675 0.000 1
1 645 . 1 1 1 A 62 62 VAL C C 2485 173.837 174.741 -0.904 1
1 646 . 1 1 1 A 62 62 VAL CA C 2485 60.752 61.032 -0.280 1
1 647 . 1 1 1 A 62 62 VAL CB C 2485 32.459 33.917 -1.458 1
1 650 . 1 1 1 A 62 62 VAL N N 2485 132.205 125.626 6.579 1
1 651 . 1 1 1 A 63 63 THR H H 2486 8.474 8.817 -0.343 1
1 652 . 1 1 1 A 63 63 THR HA H 2486 5.392 5.137 0.255 1
1 657 . 1 1 1 A 63 63 THR C C 2486 173.675 173.231 0.444 1
1 658 . 1 1 1 A 63 63 THR CA C 2486 60.008 62.311 -2.303 1
1 659 . 1 1 1 A 63 63 THR CB C 2486 71.035 70.433 0.602 1
1 661 . 1 1 1 A 63 63 THR N N 2486 121.216 123.128 -1.912 1
1 662 . 1 1 1 A 64 64 TYR H H 2487 9.409 9.104 0.305 1
1 663 . 1 1 1 A 64 64 TYR HA H 2487 5.617 5.852 -0.235 1
1 670 . 1 1 1 A 64 64 TYR C C 2487 172.847 173.163 -0.316 1
1 671 . 1 1 1 A 64 64 TYR CA C 2487 55.557 55.733 -0.176 1
1 672 . 1 1 1 A 64 64 TYR CB C 2487 41.968 42.085 -0.117 1
1 675 . 1 1 1 A 64 64 TYR N N 2487 124.061 123.027 1.034 1
1 676 . 1 1 1 A 65 65 THR H H 2488 8.145 8.836 -0.691 1
1 677 . 1 1 1 A 65 65 THR HA H 2488 4.959 4.601 0.358 1
1 682 . 1 1 1 A 65 65 THR CA C 2488 58.532 58.921 -0.389 1
1 683 . 1 1 1 A 65 65 THR CB C 2488 70.141 70.956 -0.815 1
1 685 . 1 1 1 A 65 65 THR N N 2488 117.924 116.405 1.519 1
1 686 . 1 1 1 A 66 66 PRO HA H 2489 4.602 4.865 -0.263 1
1 693 . 1 1 1 A 66 66 PRO C C 2489 176.647 176.661 -0.014 1
1 694 . 1 1 1 A 66 66 PRO CA C 2489 61.442 62.258 -0.816 1
1 695 . 1 1 1 A 66 66 PRO CB C 2489 32.715 33.002 -0.287 1
1 698 . 1 1 1 A 67 67 MET H H 2490 8.832 8.054 0.778 1
1 699 . 1 1 1 A 67 67 MET HA H 2490 4.880 4.808 0.072 1
1 707 . 1 1 1 A 67 67 MET C C 2490 174.121 175.805 -1.684 1
1 708 . 1 1 1 A 67 67 MET CA C 2490 53.848 54.690 -0.842 1
1 709 . 1 1 1 A 67 67 MET CB C 2490 33.727 34.024 -0.297 1
1 712 . 1 1 1 A 67 67 MET N N 2490 119.212 117.277 1.935 1
1 713 . 1 1 1 A 68 68 ALA H H 2491 7.086 7.502 -0.416 1
1 714 . 1 1 1 A 68 68 ALA HA H 2491 4.851 4.826 0.025 1
1 718 . 1 1 1 A 68 68 ALA CA C 2491 49.222 49.747 -0.525 1
1 719 . 1 1 1 A 68 68 ALA CB C 2491 20.600 22.078 -1.478 1
1 720 . 1 1 1 A 68 68 ALA N N 2491 120.363 121.134 -0.771 1
1 721 . 1 1 1 A 69 69 PRO HA H 2492 4.263 4.786 -0.523 1
1 728 . 1 1 1 A 69 69 PRO C C 2492 174.370 176.216 -1.846 1
1 729 . 1 1 1 A 69 69 PRO CA C 2492 62.555 62.889 -0.334 1
1 730 . 1 1 1 A 69 69 PRO CB C 2492 32.752 33.073 -0.321 1
1 733 . 1 1 1 A 70 70 GLY H H 2493 8.858 8.397 0.461 1
1 734 . 1 1 1 A 70 70 GLY HA2 H 2493 4.544 4.075 0.469 1
1 735 . 1 1 1 A 70 70 GLY HA3 H 2493 3.849 4.121 -0.272 1
1 736 . 1 1 1 A 70 70 GLY C C 2493 172.182 172.015 0.167 1
1 737 . 1 1 1 A 70 70 GLY CA C 2493 44.356 44.412 -0.056 1
1 738 . 1 1 1 A 70 70 GLY N N 2493 106.539 108.255 -1.716 1
1 739 . 1 1 1 A 71 71 SER H H 2494 8.490 8.389 0.101 1
1 740 . 1 1 1 A 71 71 SER HA H 2494 5.280 5.779 -0.499 1
1 743 . 1 1 1 A 71 71 SER C C 2494 173.512 172.461 1.051 1
1 744 . 1 1 1 A 71 71 SER CA C 2494 57.674 56.176 1.498 1
1 745 . 1 1 1 A 71 71 SER CB C 2494 63.799 66.267 -2.468 1
1 746 . 1 1 1 A 71 71 SER N N 2494 117.964 115.676 2.288 1
1 747 . 1 1 1 A 72 72 TYR H H 2495 9.320 9.585 -0.265 1
1 748 . 1 1 1 A 72 72 TYR HA H 2495 4.960 5.197 -0.237 1
1 755 . 1 1 1 A 72 72 TYR C C 2495 173.979 175.264 -1.285 1
1 756 . 1 1 1 A 72 72 TYR CA C 2495 56.384 56.379 0.005 1
1 757 . 1 1 1 A 72 72 TYR CB C 2495 40.247 41.081 -0.834 1
1 760 . 1 1 1 A 72 72 TYR N N 2495 126.442 121.831 4.611 1
1 761 . 1 1 1 A 73 73 LEU H H 2496 9.019 9.130 -0.111 1
1 762 . 1 1 1 A 73 73 LEU HA H 2496 5.209 4.910 0.299 1
1 772 . 1 1 1 A 73 73 LEU C C 2496 177.015 176.080 0.935 1
1 773 . 1 1 1 A 73 73 LEU CA C 2496 53.393 54.088 -0.695 1
1 774 . 1 1 1 A 73 73 LEU CB C 2496 43.918 42.086 1.832 1
1 778 . 1 1 1 A 73 73 LEU N N 2496 125.439 124.162 1.277 1
1 779 . 1 1 1 A 74 74 ILE H H 2497 9.921 9.508 0.413 1
1 780 . 1 1 1 A 74 74 ILE HA H 2497 5.128 4.570 0.558 1
1 790 . 1 1 1 A 74 74 ILE C C 2497 175.730 175.112 0.618 1
1 791 . 1 1 1 A 74 74 ILE CA C 2497 60.930 60.684 0.246 1
1 792 . 1 1 1 A 74 74 ILE CB C 2497 39.488 37.194 2.294 1
1 796 . 1 1 1 A 74 74 ILE N N 2497 132.185 126.541 5.644 1
1 797 . 1 1 1 A 75 75 SER H H 2498 9.284 8.961 0.323 1
1 798 . 1 1 1 A 75 75 SER HA H 2498 5.111 5.147 -0.036 1
1 801 . 1 1 1 A 75 75 SER C C 2498 173.449 174.118 -0.669 1
1 802 . 1 1 1 A 75 75 SER CA C 2498 58.260 58.084 0.176 1
1 803 . 1 1 1 A 75 75 SER CB C 2498 63.956 64.335 -0.379 1
1 804 . 1 1 1 A 75 75 SER N N 2498 125.384 125.197 0.187 1
1 805 . 1 1 1 A 76 76 ILE H H 2499 9.861 9.169 0.692 1
1 806 . 1 1 1 A 76 76 ILE HA H 2499 4.814 4.931 -0.117 1
1 816 . 1 1 1 A 76 76 ILE CA C 2499 61.034 60.584 0.450 1
1 817 . 1 1 1 A 76 76 ILE CB C 2499 40.387 40.762 -0.375 1
1 821 . 1 1 1 A 76 76 ILE N N 2499 129.414 127.362 2.052 1
1 822 . 1 1 1 A 77 77 LYS H H 2500 8.827 9.067 -0.240 1
1 823 . 1 1 1 A 77 77 LYS HA H 2500 5.254 5.313 -0.059 1
1 832 . 1 1 1 A 77 77 LYS C C 2500 175.245 174.111 1.134 1
1 833 . 1 1 1 A 77 77 LYS CA C 2500 54.388 54.995 -0.607 1
1 834 . 1 1 1 A 77 77 LYS CB C 2500 36.127 34.960 1.167 1
1 838 . 1 1 1 A 77 77 LYS N N 2500 126.922 126.901 0.021 1
1 839 . 1 1 1 A 78 78 TYR H H 2501 8.408 8.700 -0.292 1
1 840 . 1 1 1 A 78 78 TYR HA H 2501 5.479 5.123 0.356 1
1 847 . 1 1 1 A 78 78 TYR C C 2501 174.792 175.741 -0.949 1
1 848 . 1 1 1 A 78 78 TYR CA C 2501 56.837 56.886 -0.049 1
1 849 . 1 1 1 A 78 78 TYR CB C 2501 44.008 41.543 2.465 1
1 852 . 1 1 1 A 78 78 TYR N N 2501 122.282 125.421 -3.139 1
1 853 . 1 1 1 A 79 79 GLY H H 2502 8.196 8.718 -0.522 1
1 854 . 1 1 1 A 79 79 GLY HA2 H 2502 4.040 3.721 0.319 1
1 855 . 1 1 1 A 79 79 GLY HA3 H 2502 3.465 3.837 -0.372 1
1 856 . 1 1 1 A 79 79 GLY C C 2502 173.932 173.499 0.433 1
1 857 . 1 1 1 A 79 79 GLY CA C 2502 45.741 45.680 0.061 1
1 858 . 1 1 1 A 79 79 GLY N N 2502 113.451 114.322 -0.871 1
1 859 . 1 1 1 A 80 80 GLY H H 2503 7.589 7.869 -0.280 1
1 860 . 1 1 1 A 80 80 GLY HA2 H 2503 4.490 4.068 0.422 1
1 861 . 1 1 1 A 80 80 GLY HA3 H 2503 3.555 4.177 -0.622 1
1 862 . 1 1 1 A 80 80 GLY CA C 2503 43.540 44.543 -1.003 1
1 863 . 1 1 1 A 80 80 GLY N N 2503 107.293 107.425 -0.132 1
1 864 . 1 1 1 A 81 81 PRO HA H 2504 4.320 4.362 -0.042 1
1 871 . 1 1 1 A 81 81 PRO C C 2504 175.311 175.132 0.179 1
1 872 . 1 1 1 A 81 81 PRO CA C 2504 62.722 63.391 -0.669 1
1 873 . 1 1 1 A 81 81 PRO CB C 2504 29.297 31.092 -1.795 1
1 876 . 1 1 1 A 82 82 TYR H H 2505 7.778 7.387 0.391 1
1 877 . 1 1 1 A 82 82 TYR HA H 2505 4.791 4.964 -0.173 1
1 884 . 1 1 1 A 82 82 TYR C C 2505 175.086 175.635 -0.549 1
1 885 . 1 1 1 A 82 82 TYR CA C 2505 56.111 56.499 -0.388 1
1 886 . 1 1 1 A 82 82 TYR CB C 2505 39.483 41.483 -2.000 1
1 889 . 1 1 1 A 82 82 TYR N N 2505 123.973 120.832 3.141 1
1 890 . 1 1 1 A 83 83 HIS H H 2506 8.625 8.959 -0.334 1
1 891 . 1 1 1 A 83 83 HIS HA H 2506 4.583 4.959 -0.376 1
1 896 . 1 1 1 A 83 83 HIS C C 2506 178.161 175.916 2.245 1
1 897 . 1 1 1 A 83 83 HIS CA C 2506 58.241 57.487 0.754 1
1 898 . 1 1 1 A 83 83 HIS CB C 2506 33.132 30.599 2.533 1
1 901 . 1 1 1 A 83 83 HIS N N 2506 124.092 121.446 2.646 1
1 902 . 1 1 1 A 84 84 ILE H H 2507 8.327 8.622 -0.295 1
1 903 . 1 1 1 A 84 84 ILE HA H 2507 4.553 4.468 0.085 1
1 913 . 1 1 1 A 84 84 ILE C C 2507 176.523 176.253 0.270 1
1 914 . 1 1 1 A 84 84 ILE CA C 2507 60.791 60.074 0.717 1
1 915 . 1 1 1 A 84 84 ILE CB C 2507 39.162 39.377 -0.215 1
1 919 . 1 1 1 A 84 84 ILE N N 2507 117.355 120.045 -2.690 1
1 920 . 1 1 1 A 85 85 GLY H H 2508 9.130 8.470 0.660 1
1 921 . 1 1 1 A 85 85 GLY HA2 H 2508 3.883 3.749 0.134 1
1 922 . 1 1 1 A 85 85 GLY HA3 H 2508 3.800 3.769 0.031 1
1 923 . 1 1 1 A 85 85 GLY C C 2508 174.438 175.378 -0.940 1
1 924 . 1 1 1 A 85 85 GLY CA C 2508 47.673 46.807 0.866 1
1 925 . 1 1 1 A 85 85 GLY N N 2508 111.346 109.533 1.813 1
1 926 . 1 1 1 A 86 86 GLY H H 2509 8.236 8.404 -0.168 1
1 927 . 1 1 1 A 86 86 GLY HA2 H 2509 3.893 3.854 0.039 1
1 928 . 1 1 1 A 86 86 GLY HA3 H 2509 3.161 3.875 -0.714 1
1 929 . 1 1 1 A 86 86 GLY C C 2509 171.837 173.476 -1.639 1
1 930 . 1 1 1 A 86 86 GLY CA C 2509 44.844 45.174 -0.330 1
1 931 . 1 1 1 A 86 86 GLY N N 2509 115.594 116.867 -1.273 1
1 932 . 1 1 1 A 87 87 SER H H 2510 7.385 7.868 -0.483 1
1 933 . 1 1 1 A 87 87 SER HA H 2510 4.217 4.010 0.207 1
1 936 . 1 1 1 A 87 87 SER CA C 2510 54.783 55.201 -0.418 1
1 937 . 1 1 1 A 87 87 SER CB C 2510 62.683 64.109 -1.426 1
1 938 . 1 1 1 A 87 87 SER N N 2510 112.859 116.756 -3.897 1
1 939 . 1 1 1 A 88 88 PRO HA H 2511 5.532 4.801 0.731 1
1 946 . 1 1 1 A 88 88 PRO C C 2511 175.870 175.552 0.318 1
1 947 . 1 1 1 A 88 88 PRO CA C 2511 62.379 62.226 0.153 1
1 948 . 1 1 1 A 88 88 PRO CB C 2511 33.639 32.414 1.225 1
1 951 . 1 1 1 A 89 89 PHE H H 2512 9.359 8.396 0.963 1
1 952 . 1 1 1 A 89 89 PHE HA H 2512 4.467 4.834 -0.367 1
1 960 . 1 1 1 A 89 89 PHE C C 2512 175.152 175.249 -0.097 1
1 961 . 1 1 1 A 89 89 PHE CA C 2512 57.401 57.331 0.070 1
1 962 . 1 1 1 A 89 89 PHE CB C 2512 40.843 40.599 0.244 1
1 966 . 1 1 1 A 89 89 PHE N N 2512 124.789 120.149 4.640 1
1 967 . 1 1 1 A 90 90 LYS H H 2513 8.772 8.617 0.155 1
1 968 . 1 1 1 A 90 90 LYS HA H 2513 4.941 4.751 0.190 1
1 973 . 1 1 1 A 90 90 LYS C C 2513 174.183 175.619 -1.436 1
1 974 . 1 1 1 A 90 90 LYS CA C 2513 55.749 55.674 0.075 1
1 975 . 1 1 1 A 90 90 LYS CB C 2513 32.817 32.795 0.022 1
1 978 . 1 1 1 A 90 90 LYS N N 2513 125.133 122.014 3.119 1
1 979 . 1 1 1 A 91 91 ALA H H 2514 9.158 9.177 -0.019 1
1 980 . 1 1 1 A 91 91 ALA HA H 2514 4.510 5.129 -0.619 1
1 984 . 1 1 1 A 91 91 ALA C C 2514 176.561 176.570 -0.009 1
1 985 . 1 1 1 A 91 91 ALA CA C 2514 50.528 50.854 -0.326 1
1 986 . 1 1 1 A 91 91 ALA CB C 2514 20.653 20.578 0.075 1
1 987 . 1 1 1 A 91 91 ALA N N 2514 131.989 128.591 3.398 1
1 988 . 1 1 1 A 92 92 LYS H H 2515 8.186 8.986 -0.800 1
1 989 . 1 1 1 A 92 92 LYS HA H 2515 4.926 5.044 -0.118 1
1 998 . 1 1 1 A 92 92 LYS C C 2515 175.177 175.865 -0.688 1
1 999 . 1 1 1 A 92 92 LYS CA C 2515 55.725 55.393 0.332 1
1 1000 . 1 1 1 A 92 92 LYS CB C 2515 33.765 34.689 -0.924 1
1 1004 . 1 1 1 A 92 92 LYS N N 2515 124.887 123.084 1.803 1
1 1005 . 1 1 1 A 93 93 VAL H H 2516 9.362 9.124 0.238 1
1 1006 . 1 1 1 A 93 93 VAL HA H 2516 5.161 5.220 -0.059 1
1 1014 . 1 1 1 A 93 93 VAL C C 2516 176.988 175.624 1.364 1
1 1015 . 1 1 1 A 93 93 VAL CA C 2516 60.523 60.978 -0.455 1
1 1016 . 1 1 1 A 93 93 VAL CB C 2516 33.291 35.739 -2.448 1
1 1019 . 1 1 1 A 93 93 VAL N N 2516 129.943 123.307 6.636 1
1 1020 . 1 1 1 A 94 94 THR H H 2517 8.614 8.456 0.158 1
1 1021 . 1 1 1 A 94 94 THR HA H 2517 4.902 4.861 0.041 1
1 1026 . 1 1 1 A 94 94 THR C C 2517 172.759 173.407 -0.648 1
1 1027 . 1 1 1 A 94 94 THR CA C 2517 60.121 59.819 0.302 1
1 1028 . 1 1 1 A 94 94 THR CB C 2517 71.072 71.435 -0.363 1
1 1030 . 1 1 1 A 94 94 THR N N 2517 122.032 116.407 5.625 1
1 1031 . 1 1 1 A 95 95 GLY H H 2518 8.280 8.406 -0.126 1
1 1032 . 1 1 1 A 95 95 GLY HA2 H 2518 3.852 4.133 -0.281 1
1 1033 . 1 1 1 A 95 95 GLY HA3 H 2518 4.846 4.137 0.709 1
1 1034 . 1 1 1 A 95 95 GLY CA C 2518 43.955 44.472 -0.517 1
1 1035 . 1 1 1 A 95 95 GLY N N 2518 107.949 108.469 -0.520 1
1 1036 . 1 1 1 A 96 96 PRO HA H 2519 4.449 4.644 -0.195 1
1 1043 . 1 1 1 A 96 96 PRO C C 2519 176.892 176.033 0.859 1
1 1044 . 1 1 1 A 96 96 PRO CA C 2519 62.062 62.720 -0.658 1
1 1045 . 1 1 1 A 96 96 PRO CB C 2519 32.286 32.328 -0.042 1
1 1048 . 1 1 1 A 97 97 ARG H H 2520 8.651 8.579 0.072 1
1 1049 . 1 1 1 A 97 97 ARG HA H 2520 4.348 4.604 -0.256 1
1 1056 . 1 1 1 A 97 97 ARG C C 2520 176.236 175.918 0.318 1
1 1057 . 1 1 1 A 97 97 ARG CA C 2520 57.587 55.899 1.688 1
1 1058 . 1 1 1 A 97 97 ARG CB C 2520 30.472 31.290 -0.818 1
1 1061 . 1 1 1 A 97 97 ARG N N 2520 120.781 121.892 -1.111 1
1 1062 . 1 1 1 A 98 98 LEU H H 2521 8.545 9.113 -0.568 1
1 1063 . 1 1 1 A 98 98 LEU HA H 2521 4.577 4.482 0.095 1
1 1073 . 1 1 1 A 98 98 LEU C C 2521 175.880 176.609 -0.729 1
1 1074 . 1 1 1 A 98 98 LEU CA C 2521 55.068 55.317 -0.249 1
1 1075 . 1 1 1 A 98 98 LEU CB C 2521 43.082 42.844 0.238 1
1 1079 . 1 1 1 A 98 98 LEU N N 2521 128.715 128.216 0.499 1
1 4 . 2 1 1 A 2 2 ALA HA H -2 4.374 4.429 -0.055 1
1 8 . 2 1 1 A 2 2 ALA C C -2 177.865 178.075 -0.210 1
1 9 . 2 1 1 A 2 2 ALA CA C -2 52.670 51.707 0.963 1
1 10 . 2 1 1 A 2 2 ALA CB C -2 19.508 19.729 -0.221 1
1 32 . 2 1 1 A 5 5 ASP H H 2428 8.300 8.730 -0.430 1
1 33 . 2 1 1 A 5 5 ASP HA H 2428 5.082 5.262 -0.180 1
1 36 . 2 1 1 A 5 5 ASP CA C 2428 51.517 51.115 0.402 1
1 37 . 2 1 1 A 5 5 ASP CB C 2428 42.244 43.662 -1.418 1
1 38 . 2 1 1 A 5 5 ASP N N 2428 122.879 124.444 -1.565 1
1 39 . 2 1 1 A 6 6 PRO HA H 2429 4.340 4.409 -0.069 1
1 46 . 2 1 1 A 6 6 PRO C C 2429 178.266 178.067 0.199 1
1 47 . 2 1 1 A 6 6 PRO CA C 2429 64.494 64.566 -0.072 1
1 48 . 2 1 1 A 6 6 PRO CB C 2429 31.841 32.025 -0.184 1
1 51 . 2 1 1 A 7 7 GLY H H 2430 8.686 8.497 0.189 1
1 52 . 2 1 1 A 7 7 GLY HA2 H 2430 4.116 3.808 0.308 1
1 53 . 2 1 1 A 7 7 GLY HA3 H 2430 3.868 3.810 0.058 1
1 54 . 2 1 1 A 7 7 GLY C C 2430 174.567 175.548 -0.981 1
1 55 . 2 1 1 A 7 7 GLY CA C 2430 46.038 46.623 -0.585 1
1 56 . 2 1 1 A 7 7 GLY N N 2430 107.655 106.753 0.902 1
1 57 . 2 1 1 A 8 8 LEU H H 2431 7.692 7.395 0.297 1
1 58 . 2 1 1 A 8 8 LEU HA H 2431 4.507 4.391 0.116 1
1 68 . 2 1 1 A 8 8 LEU C C 2431 176.876 177.483 -0.607 1
1 69 . 2 1 1 A 8 8 LEU CA C 2431 54.307 56.501 -2.194 1
1 70 . 2 1 1 A 8 8 LEU CB C 2431 42.879 42.937 -0.058 1
1 74 . 2 1 1 A 8 8 LEU N N 2431 120.022 119.980 0.042 1
1 75 . 2 1 1 A 9 9 VAL H H 2432 7.378 7.361 0.017 1
1 76 . 2 1 1 A 9 9 VAL HA H 2432 4.154 3.858 0.296 1
1 84 . 2 1 1 A 9 9 VAL C C 2432 174.703 175.657 -0.954 1
1 85 . 2 1 1 A 9 9 VAL CA C 2432 62.387 62.968 -0.581 1
1 86 . 2 1 1 A 9 9 VAL CB C 2432 32.519 31.469 1.050 1
1 89 . 2 1 1 A 9 9 VAL N N 2432 123.902 119.342 4.560 1
1 90 . 2 1 1 A 10 10 SER H H 2433 8.201 8.367 -0.166 1
1 91 . 2 1 1 A 10 10 SER HA H 2433 5.136 5.168 -0.032 1
1 94 . 2 1 1 A 10 10 SER CA C 2433 56.554 57.377 -0.823 1
1 95 . 2 1 1 A 10 10 SER CB C 2433 66.763 66.225 0.538 1
1 96 . 2 1 1 A 10 10 SER N N 2433 121.921 122.215 -0.294 1
1 97 . 2 1 1 A 11 11 ALA H H 2434 8.670 8.516 0.154 1
1 98 . 2 1 1 A 11 11 ALA HA H 2434 5.632 5.368 0.264 1
1 102 . 2 1 1 A 11 11 ALA C C 2434 175.459 175.880 -0.421 1
1 103 . 2 1 1 A 11 11 ALA CA C 2434 50.575 50.482 0.093 1
1 104 . 2 1 1 A 11 11 ALA CB C 2434 23.111 21.425 1.686 1
1 105 . 2 1 1 A 11 11 ALA N N 2434 124.828 125.906 -1.078 1
1 106 . 2 1 1 A 12 12 TYR H H 2435 8.609 8.887 -0.278 1
1 107 . 2 1 1 A 12 12 TYR HA H 2435 4.879 5.137 -0.258 1
1 114 . 2 1 1 A 12 12 TYR C C 2435 173.645 174.607 -0.962 1
1 115 . 2 1 1 A 12 12 TYR CA C 2435 56.268 56.912 -0.644 1
1 116 . 2 1 1 A 12 12 TYR CB C 2435 39.522 42.471 -2.949 1
1 119 . 2 1 1 A 12 12 TYR N N 2435 118.305 119.734 -1.429 1
1 120 . 2 1 1 A 13 13 GLY H H 2436 8.655 8.475 0.180 1
1 121 . 2 1 1 A 13 13 GLY HA2 H 2436 4.943 4.282 0.661 1
1 122 . 2 1 1 A 13 13 GLY HA3 H 2436 4.028 4.319 -0.291 1
1 123 . 2 1 1 A 13 13 GLY C C 2436 175.334 174.904 0.430 1
1 124 . 2 1 1 A 13 13 GLY CA C 2436 44.389 44.469 -0.080 1
1 125 . 2 1 1 A 13 13 GLY N N 2436 110.710 110.327 0.383 1
1 126 . 2 1 1 A 14 14 ALA H H 2437 8.939 8.807 0.132 1
1 127 . 2 1 1 A 14 14 ALA HA H 2437 4.276 4.091 0.185 1
1 131 . 2 1 1 A 14 14 ALA C C 2437 180.524 179.065 1.459 1
1 132 . 2 1 1 A 14 14 ALA CA C 2437 55.551 55.081 0.470 1
1 133 . 2 1 1 A 14 14 ALA CB C 2437 18.411 18.404 0.007 1
1 134 . 2 1 1 A 14 14 ALA N N 2437 126.973 123.824 3.149 1
1 135 . 2 1 1 A 15 15 GLY H H 2438 8.933 8.652 0.281 1
1 136 . 2 1 1 A 15 15 GLY HA2 H 2438 4.531 3.995 0.536 1
1 137 . 2 1 1 A 15 15 GLY HA3 H 2438 3.576 4.163 -0.587 1
1 138 . 2 1 1 A 15 15 GLY C C 2438 174.323 175.466 -1.143 1
1 139 . 2 1 1 A 15 15 GLY CA C 2438 46.855 46.705 0.150 1
1 140 . 2 1 1 A 15 15 GLY N N 2438 104.803 105.559 -0.756 1
1 141 . 2 1 1 A 16 16 LEU H H 2439 7.529 7.617 -0.088 1
1 142 . 2 1 1 A 16 16 LEU HA H 2439 3.768 3.898 -0.130 1
1 152 . 2 1 1 A 16 16 LEU C C 2439 176.388 178.683 -2.295 1
1 153 . 2 1 1 A 16 16 LEU CA C 2439 56.137 57.197 -1.060 1
1 154 . 2 1 1 A 16 16 LEU CB C 2439 41.621 41.210 0.411 1
1 158 . 2 1 1 A 16 16 LEU N N 2439 119.633 121.835 -2.202 1
1 159 . 2 1 1 A 17 17 GLU H H 2440 7.505 8.036 -0.531 1
1 160 . 2 1 1 A 17 17 GLU HA H 2440 4.663 4.387 0.276 1
1 165 . 2 1 1 A 17 17 GLU C C 2440 178.126 176.573 1.553 1
1 166 . 2 1 1 A 17 17 GLU CA C 2440 56.447 56.691 -0.244 1
1 167 . 2 1 1 A 17 17 GLU CB C 2440 31.485 30.946 0.539 1
1 169 . 2 1 1 A 17 17 GLU N N 2440 114.368 116.079 -1.711 1
1 170 . 2 1 1 A 18 18 GLY H H 2441 7.921 7.197 0.724 1
1 171 . 2 1 1 A 18 18 GLY HA2 H 2441 4.889 4.190 0.699 1
1 172 . 2 1 1 A 18 18 GLY HA3 H 2441 3.707 4.224 -0.517 1
1 173 . 2 1 1 A 18 18 GLY C C 2441 170.965 171.482 -0.517 1
1 174 . 2 1 1 A 18 18 GLY CA C 2441 45.549 45.362 0.187 1
1 175 . 2 1 1 A 18 18 GLY N N 2441 109.165 105.357 3.808 1
1 176 . 2 1 1 A 19 19 GLY H H 2442 7.540 8.293 -0.753 1
1 177 . 2 1 1 A 19 19 GLY HA2 H 2442 4.086 4.204 -0.118 1
1 178 . 2 1 1 A 19 19 GLY HA3 H 2442 4.086 4.240 -0.154 1
1 179 . 2 1 1 A 19 19 GLY C C 2442 171.051 171.527 -0.476 1
1 180 . 2 1 1 A 19 19 GLY CA C 2442 44.937 46.214 -1.277 1
1 181 . 2 1 1 A 19 19 GLY N N 2442 105.460 108.471 -3.011 1
1 182 . 2 1 1 A 20 20 VAL H H 2443 8.899 8.228 0.671 1
1 183 . 2 1 1 A 20 20 VAL HA H 2443 5.062 5.064 -0.002 1
1 191 . 2 1 1 A 20 20 VAL C C 2443 176.623 175.373 1.250 1
1 192 . 2 1 1 A 20 20 VAL CA C 2443 60.197 60.371 -0.174 1
1 193 . 2 1 1 A 20 20 VAL CB C 2443 35.107 34.876 0.231 1
1 196 . 2 1 1 A 20 20 VAL N N 2443 122.753 119.514 3.239 1
1 197 . 2 1 1 A 21 21 THR H H 2444 8.630 8.517 0.113 1
1 198 . 2 1 1 A 21 21 THR HA H 2444 3.773 4.220 -0.447 1
1 203 . 2 1 1 A 21 21 THR C C 2444 175.646 174.937 0.709 1
1 204 . 2 1 1 A 21 21 THR CA C 2444 62.732 63.219 -0.487 1
1 205 . 2 1 1 A 21 21 THR CB C 2444 68.925 68.504 0.421 1
1 207 . 2 1 1 A 21 21 THR N N 2444 118.179 119.742 -1.563 1
1 208 . 2 1 1 A 22 22 GLY H H 2445 8.736 8.775 -0.039 1
1 209 . 2 1 1 A 22 22 GLY HA2 H 2445 3.412 3.985 -0.573 1
1 210 . 2 1 1 A 22 22 GLY HA3 H 2445 4.061 3.987 0.074 1
1 211 . 2 1 1 A 22 22 GLY C C 2445 172.973 173.587 -0.614 1
1 212 . 2 1 1 A 22 22 GLY CA C 2445 45.577 45.215 0.362 1
1 213 . 2 1 1 A 22 22 GLY N N 2445 107.888 113.983 -6.095 1
1 214 . 2 1 1 A 23 23 ASN H H 2446 7.877 7.761 0.116 1
1 215 . 2 1 1 A 23 23 ASN HA H 2446 5.253 5.088 0.165 1
1 220 . 2 1 1 A 23 23 ASN CA C 2446 49.740 50.156 -0.416 1
1 221 . 2 1 1 A 23 23 ASN CB C 2446 40.198 39.175 1.023 1
1 222 . 2 1 1 A 23 23 ASN N N 2446 120.684 119.645 1.039 1
1 224 . 2 1 1 A 24 24 PRO HA H 2447 4.525 4.638 -0.113 1
1 231 . 2 1 1 A 24 24 PRO CA C 2447 62.766 62.431 0.335 1
1 232 . 2 1 1 A 24 24 PRO CB C 2447 31.732 32.597 -0.865 1
1 235 . 2 1 1 A 25 25 ALA H H 2448 9.178 8.238 0.940 1
1 236 . 2 1 1 A 25 25 ALA HA H 2448 4.614 4.868 -0.254 1
1 240 . 2 1 1 A 25 25 ALA C C 2448 175.503 175.560 -0.057 1
1 241 . 2 1 1 A 25 25 ALA CA C 2448 50.526 50.494 0.032 1
1 242 . 2 1 1 A 25 25 ALA CB C 2448 20.458 21.934 -1.476 1
1 243 . 2 1 1 A 25 25 ALA N N 2448 132.079 122.549 9.530 1
1 244 . 2 1 1 A 26 26 GLU H H 2449 8.813 9.029 -0.216 1
1 245 . 2 1 1 A 26 26 GLU HA H 2449 5.830 5.306 0.524 1
1 250 . 2 1 1 A 26 26 GLU C C 2449 176.272 174.691 1.581 1
1 251 . 2 1 1 A 26 26 GLU CA C 2449 54.376 54.583 -0.207 1
1 252 . 2 1 1 A 26 26 GLU CB C 2449 35.463 33.788 1.675 1
1 254 . 2 1 1 A 26 26 GLU N N 2449 120.079 119.959 0.120 1
1 255 . 2 1 1 A 27 27 PHE H H 2450 8.782 8.794 -0.012 1
1 256 . 2 1 1 A 27 27 PHE HA H 2450 5.021 5.089 -0.068 1
1 264 . 2 1 1 A 27 27 PHE C C 2450 171.205 171.978 -0.773 1
1 265 . 2 1 1 A 27 27 PHE CA C 2450 56.852 56.386 0.466 1
1 266 . 2 1 1 A 27 27 PHE CB C 2450 41.080 41.236 -0.156 1
1 270 . 2 1 1 A 27 27 PHE N N 2450 118.670 117.066 1.604 1
1 271 . 2 1 1 A 28 28 VAL H H 2451 8.961 9.197 -0.236 1
1 272 . 2 1 1 A 28 28 VAL HA H 2451 4.761 4.711 0.050 1
1 280 . 2 1 1 A 28 28 VAL C C 2451 174.673 175.333 -0.660 1
1 281 . 2 1 1 A 28 28 VAL CA C 2451 60.619 61.259 -0.640 1
1 282 . 2 1 1 A 28 28 VAL CB C 2451 35.484 34.066 1.418 1
1 285 . 2 1 1 A 28 28 VAL N N 2451 121.552 120.575 0.977 1
1 286 . 2 1 1 A 29 29 VAL H H 2452 9.294 9.477 -0.183 1
1 287 . 2 1 1 A 29 29 VAL HA H 2452 4.363 4.486 -0.123 1
1 295 . 2 1 1 A 29 29 VAL C C 2452 174.218 175.146 -0.928 1
1 296 . 2 1 1 A 29 29 VAL CA C 2452 61.526 62.560 -1.034 1
1 297 . 2 1 1 A 29 29 VAL CB C 2452 32.666 31.106 1.560 1
1 300 . 2 1 1 A 29 29 VAL N N 2452 125.585 128.571 -2.986 1
1 301 . 2 1 1 A 30 30 ASN H H 2453 9.465 9.151 0.314 1
1 302 . 2 1 1 A 30 30 ASN HA H 2453 5.096 5.121 -0.025 1
1 307 . 2 1 1 A 30 30 ASN C C 2453 176.216 176.411 -0.195 1
1 308 . 2 1 1 A 30 30 ASN CA C 2453 52.011 53.086 -1.075 1
1 309 . 2 1 1 A 30 30 ASN CB C 2453 39.057 38.861 0.196 1
1 310 . 2 1 1 A 30 30 ASN N N 2453 127.724 126.922 0.802 1
1 312 . 2 1 1 A 31 31 THR H H 2454 8.915 8.450 0.465 1
1 313 . 2 1 1 A 31 31 THR HA H 2454 4.342 4.498 -0.156 1
1 318 . 2 1 1 A 31 31 THR C C 2454 176.816 176.175 0.641 1
1 319 . 2 1 1 A 31 31 THR CA C 2454 61.117 61.731 -0.614 1
1 320 . 2 1 1 A 31 31 THR CB C 2454 68.209 69.589 -1.380 1
1 322 . 2 1 1 A 31 31 THR N N 2454 117.783 116.672 1.111 1
1 323 . 2 1 1 A 32 32 SER H H 2455 8.454 7.912 0.542 1
1 324 . 2 1 1 A 32 32 SER HA H 2455 4.155 4.247 -0.092 1
1 327 . 2 1 1 A 32 32 SER C C 2455 175.458 175.305 0.153 1
1 328 . 2 1 1 A 32 32 SER CA C 2455 62.148 62.326 -0.178 1
1 329 . 2 1 1 A 32 32 SER CB C 2455 63.476 63.057 0.419 1
1 330 . 2 1 1 A 32 32 SER N N 2455 121.781 119.235 2.546 1
1 331 . 2 1 1 A 33 33 ASN H H 2456 8.845 8.040 0.805 1
1 332 . 2 1 1 A 33 33 ASN HA H 2456 5.064 4.561 0.503 1
1 337 . 2 1 1 A 33 33 ASN C C 2456 174.674 176.435 -1.761 1
1 338 . 2 1 1 A 33 33 ASN CA C 2456 53.067 54.886 -1.819 1
1 339 . 2 1 1 A 33 33 ASN CB C 2456 39.632 38.795 0.837 1
1 340 . 2 1 1 A 33 33 ASN N N 2456 120.176 117.995 2.181 1
1 342 . 2 1 1 A 34 34 ALA H H 2457 7.714 7.998 -0.284 1
1 343 . 2 1 1 A 34 34 ALA HA H 2457 4.482 4.543 -0.061 1
1 347 . 2 1 1 A 34 34 ALA C C 2457 177.582 178.641 -1.059 1
1 348 . 2 1 1 A 34 34 ALA CA C 2457 52.521 52.106 0.415 1
1 349 . 2 1 1 A 34 34 ALA CB C 2457 22.252 21.047 1.205 1
1 350 . 2 1 1 A 34 34 ALA N N 2457 123.065 118.841 4.224 1
1 351 . 2 1 1 A 35 35 GLY H H 2458 8.195 9.269 -1.074 1
1 352 . 2 1 1 A 35 35 GLY HA2 H 2458 4.246 3.949 0.297 1
1 353 . 2 1 1 A 35 35 GLY HA3 H 2458 3.902 3.966 -0.064 1
1 354 . 2 1 1 A 35 35 GLY C C 2458 173.360 173.668 -0.308 1
1 355 . 2 1 1 A 35 35 GLY CA C 2458 44.486 46.916 -2.430 1
1 356 . 2 1 1 A 35 35 GLY N N 2458 108.472 107.172 1.300 1
1 357 . 2 1 1 A 36 36 ALA H H 2459 8.430 7.924 0.506 1
1 358 . 2 1 1 A 36 36 ALA HA H 2459 4.472 4.968 -0.496 1
1 362 . 2 1 1 A 36 36 ALA C C 2459 176.968 175.934 1.034 1
1 363 . 2 1 1 A 36 36 ALA CA C 2459 52.695 51.548 1.147 1
1 364 . 2 1 1 A 36 36 ALA CB C 2459 19.360 22.775 -3.415 1
1 365 . 2 1 1 A 36 36 ALA N N 2459 126.012 124.329 1.683 1
1 366 . 2 1 1 A 37 37 GLY H H 2460 7.781 8.520 -0.739 1
1 367 . 2 1 1 A 37 37 GLY HA2 H 2460 3.856 3.936 -0.080 1
1 368 . 2 1 1 A 37 37 GLY HA3 H 2460 3.164 4.096 -0.932 1
1 369 . 2 1 1 A 37 37 GLY C C 2460 170.730 171.938 -1.208 1
1 370 . 2 1 1 A 37 37 GLY CA C 2460 44.747 45.380 -0.633 1
1 371 . 2 1 1 A 37 37 GLY N N 2460 109.493 105.862 3.631 1
1 372 . 2 1 1 A 38 38 ALA H H 2461 8.055 7.984 0.071 1
1 373 . 2 1 1 A 38 38 ALA HA H 2461 4.389 4.697 -0.308 1
1 377 . 2 1 1 A 38 38 ALA C C 2461 176.609 176.478 0.131 1
1 378 . 2 1 1 A 38 38 ALA CA C 2461 51.419 51.757 -0.338 1
1 379 . 2 1 1 A 38 38 ALA CB C 2461 19.665 19.371 0.294 1
1 380 . 2 1 1 A 38 38 ALA N N 2461 121.997 122.661 -0.664 1
1 381 . 2 1 1 A 39 39 LEU H H 2462 8.597 8.530 0.067 1
1 382 . 2 1 1 A 39 39 LEU HA H 2462 5.022 5.273 -0.251 1
1 392 . 2 1 1 A 39 39 LEU C C 2462 175.883 175.146 0.737 1
1 393 . 2 1 1 A 39 39 LEU CA C 2462 53.907 53.469 0.438 1
1 394 . 2 1 1 A 39 39 LEU CB C 2462 44.576 45.775 -1.199 1
1 398 . 2 1 1 A 39 39 LEU N N 2462 126.664 123.165 3.499 1
1 399 . 2 1 1 A 40 40 SER H H 2463 8.898 9.297 -0.399 1
1 400 . 2 1 1 A 40 40 SER HA H 2463 4.732 4.548 0.184 1
1 403 . 2 1 1 A 40 40 SER C C 2463 172.984 173.839 -0.855 1
1 404 . 2 1 1 A 40 40 SER CA C 2463 56.730 59.312 -2.582 1
1 405 . 2 1 1 A 40 40 SER CB C 2463 64.648 63.552 1.096 1
1 406 . 2 1 1 A 40 40 SER N N 2463 122.932 121.674 1.258 1
1 407 . 2 1 1 A 41 41 VAL H H 2464 8.538 8.162 0.376 1
1 408 . 2 1 1 A 41 41 VAL HA H 2464 5.131 4.497 0.634 1
1 416 . 2 1 1 A 41 41 VAL C C 2464 174.812 174.522 0.290 1
1 417 . 2 1 1 A 41 41 VAL CA C 2464 60.784 62.843 -2.059 1
1 418 . 2 1 1 A 41 41 VAL CB C 2464 34.262 30.578 3.684 1
1 420 . 2 1 1 A 41 41 VAL N N 2464 129.161 118.156 11.005 1
1 421 . 2 1 1 A 42 42 THR H H 2465 8.807 8.871 -0.064 1
1 422 . 2 1 1 A 42 42 THR HA H 2465 4.573 5.172 -0.599 1
1 427 . 2 1 1 A 42 42 THR CA C 2465 60.408 61.486 -1.078 1
1 428 . 2 1 1 A 42 42 THR CB C 2465 71.764 72.292 -0.528 1
1 430 . 2 1 1 A 42 42 THR N N 2465 120.898 120.717 0.181 1
1 431 . 2 1 1 A 43 43 ILE H H 2466 8.648 8.917 -0.269 1
1 432 . 2 1 1 A 43 43 ILE HA H 2466 4.854 4.727 0.127 1
1 442 . 2 1 1 A 43 43 ILE C C 2466 174.073 174.076 -0.003 1
1 443 . 2 1 1 A 43 43 ILE CA C 2466 61.184 60.477 0.707 1
1 444 . 2 1 1 A 43 43 ILE CB C 2466 39.516 40.139 -0.623 1
1 448 . 2 1 1 A 43 43 ILE N N 2466 124.810 126.238 -1.428 1
1 449 . 2 1 1 A 44 44 ASP H H 2467 8.821 9.202 -0.381 1
1 450 . 2 1 1 A 44 44 ASP HA H 2467 5.217 5.363 -0.146 1
1 453 . 2 1 1 A 44 44 ASP C C 2467 175.002 175.203 -0.201 1
1 454 . 2 1 1 A 44 44 ASP CA C 2467 52.998 52.854 0.144 1
1 455 . 2 1 1 A 44 44 ASP CB C 2467 44.728 42.790 1.938 1
1 456 . 2 1 1 A 44 44 ASP N N 2467 129.093 129.256 -0.163 1
1 457 . 2 1 1 A 45 45 GLY H H 2468 8.535 8.216 0.319 1
1 458 . 2 1 1 A 45 45 GLY HA2 H 2468 3.954 3.719 0.235 1
1 459 . 2 1 1 A 45 45 GLY HA3 H 2468 3.561 3.973 -0.412 1
1 460 . 2 1 1 A 45 45 GLY CA C 2468 45.659 44.852 0.807 1
1 461 . 2 1 1 A 45 45 GLY N N 2468 112.751 109.738 3.013 1
1 462 . 2 1 1 A 46 46 PRO HA H 2469 4.318 4.372 -0.054 1
1 469 . 2 1 1 A 46 46 PRO C C 2469 176.086 176.142 -0.056 1
1 470 . 2 1 1 A 46 46 PRO CA C 2469 64.198 63.814 0.384 1
1 471 . 2 1 1 A 46 46 PRO CB C 2469 32.348 31.884 0.464 1
1 474 . 2 1 1 A 47 47 SER H H 2470 7.106 7.604 -0.498 1
1 475 . 2 1 1 A 47 47 SER HA H 2470 4.632 4.838 -0.206 1
1 478 . 2 1 1 A 47 47 SER C C 2470 172.969 173.303 -0.334 1
1 479 . 2 1 1 A 47 47 SER CA C 2470 57.106 57.434 -0.328 1
1 480 . 2 1 1 A 47 47 SER CB C 2470 66.262 67.397 -1.135 1
1 481 . 2 1 1 A 47 47 SER N N 2470 110.556 114.156 -3.600 1
1 482 . 2 1 1 A 48 48 LYS H H 2471 8.534 8.260 0.274 1
1 483 . 2 1 1 A 48 48 LYS HA H 2471 4.486 4.581 -0.095 1
1 492 . 2 1 1 A 48 48 LYS C C 2471 177.231 176.319 0.912 1
1 493 . 2 1 1 A 48 48 LYS CA C 2471 56.620 56.841 -0.221 1
1 494 . 2 1 1 A 48 48 LYS CB C 2471 32.379 33.669 -1.290 1
1 498 . 2 1 1 A 48 48 LYS N N 2471 124.055 122.126 1.929 1
1 499 . 2 1 1 A 49 49 VAL H H 2472 8.497 8.765 -0.268 1
1 500 . 2 1 1 A 49 49 VAL HA H 2472 4.552 4.895 -0.343 1
1 508 . 2 1 1 A 49 49 VAL C C 2472 175.292 174.251 1.041 1
1 509 . 2 1 1 A 49 49 VAL CA C 2472 60.142 59.184 0.958 1
1 510 . 2 1 1 A 49 49 VAL CB C 2472 33.464 35.520 -2.056 1
1 513 . 2 1 1 A 49 49 VAL N N 2472 121.233 118.040 3.193 1
1 514 . 2 1 1 A 50 50 LYS H H 2473 8.190 8.239 -0.049 1
1 515 . 2 1 1 A 50 50 LYS HA H 2473 4.522 4.492 0.030 1
1 518 . 2 1 1 A 50 50 LYS CA C 2473 55.952 55.416 0.536 1
1 519 . 2 1 1 A 50 50 LYS CB C 2473 32.896 31.225 1.671 1
1 520 . 2 1 1 A 50 50 LYS N N 2473 126.082 123.083 2.999 1
1 521 . 2 1 1 A 51 51 MET H H 2474 8.818 7.710 1.108 1
1 522 . 2 1 1 A 51 51 MET HA H 2474 5.324 4.802 0.522 1
1 530 . 2 1 1 A 51 51 MET C C 2474 173.933 175.341 -1.408 1
1 531 . 2 1 1 A 51 51 MET CA C 2474 54.848 55.267 -0.419 1
1 532 . 2 1 1 A 51 51 MET CB C 2474 37.043 32.169 4.874 1
1 535 . 2 1 1 A 51 51 MET N N 2474 126.911 123.344 3.567 1
1 536 . 2 1 1 A 52 52 ASP H H 2475 9.095 9.005 0.090 1
1 537 . 2 1 1 A 52 52 ASP HA H 2475 4.947 5.349 -0.402 1
1 540 . 2 1 1 A 52 52 ASP C C 2475 173.923 174.047 -0.124 1
1 541 . 2 1 1 A 52 52 ASP CA C 2475 53.487 52.718 0.769 1
1 542 . 2 1 1 A 52 52 ASP CB C 2475 44.765 44.421 0.344 1
1 543 . 2 1 1 A 52 52 ASP N N 2475 125.526 122.587 2.939 1
1 544 . 2 1 1 A 53 53 CYS H H 2476 8.606 9.046 -0.440 1
1 545 . 2 1 1 A 53 53 CYS HA H 2476 5.145 5.431 -0.286 1
1 548 . 2 1 1 A 53 53 CYS C C 2476 173.330 173.074 0.256 1
1 549 . 2 1 1 A 53 53 CYS CA C 2476 57.452 57.450 0.002 1
1 550 . 2 1 1 A 53 53 CYS CB C 2476 28.108 30.293 -2.185 1
1 551 . 2 1 1 A 53 53 CYS N N 2476 124.317 125.666 -1.349 1
1 552 . 2 1 1 A 54 54 GLN H H 2477 8.978 8.710 0.268 1
1 553 . 2 1 1 A 54 54 GLN HA H 2477 4.884 4.863 0.021 1
1 560 . 2 1 1 A 54 54 GLN C C 2477 174.854 175.205 -0.351 1
1 561 . 2 1 1 A 54 54 GLN CA C 2477 53.891 54.447 -0.556 1
1 562 . 2 1 1 A 54 54 GLN CB C 2477 32.837 32.996 -0.159 1
1 564 . 2 1 1 A 54 54 GLN N N 2477 127.074 126.193 0.881 1
1 566 . 2 1 1 A 55 55 GLU H H 2478 9.065 8.674 0.391 1
1 567 . 2 1 1 A 55 55 GLU HA H 2478 4.280 4.470 -0.190 1
1 572 . 2 1 1 A 55 55 GLU C C 2478 175.383 176.122 -0.739 1
1 573 . 2 1 1 A 55 55 GLU CA C 2478 57.516 56.281 1.235 1
1 574 . 2 1 1 A 55 55 GLU CB C 2478 30.346 30.365 -0.019 1
1 576 . 2 1 1 A 55 55 GLU N N 2478 125.186 119.949 5.237 1
1 577 . 2 1 1 A 56 56 CYS H H 2479 8.407 8.694 -0.287 1
1 578 . 2 1 1 A 56 56 CYS HA H 2479 5.056 4.630 0.426 1
1 581 . 2 1 1 A 56 56 CYS CA C 2479 55.858 56.920 -1.062 1
1 582 . 2 1 1 A 56 56 CYS CB C 2479 28.676 30.349 -1.673 1
1 583 . 2 1 1 A 56 56 CYS N N 2479 121.499 117.092 4.407 1
1 584 . 2 1 1 A 57 57 PRO HA H 2480 4.159 4.306 -0.147 1
1 591 . 2 1 1 A 57 57 PRO C C 2480 177.964 177.577 0.387 1
1 592 . 2 1 1 A 57 57 PRO CA C 2480 66.877 64.705 2.172 1
1 593 . 2 1 1 A 57 57 PRO CB C 2480 31.709 31.979 -0.270 1
1 596 . 2 1 1 A 58 58 GLU H H 2481 8.900 8.124 0.776 1
1 597 . 2 1 1 A 58 58 GLU HA H 2481 4.201 4.473 -0.272 1
1 602 . 2 1 1 A 58 58 GLU C C 2481 175.129 176.431 -1.302 1
1 603 . 2 1 1 A 58 58 GLU CA C 2481 57.883 56.425 1.458 1
1 604 . 2 1 1 A 58 58 GLU CB C 2481 29.991 30.419 -0.428 1
1 606 . 2 1 1 A 58 58 GLU N N 2481 115.316 117.716 -2.400 1
1 607 . 2 1 1 A 59 59 GLY H H 2482 7.527 7.300 0.227 1
1 608 . 2 1 1 A 59 59 GLY HA2 H 2482 4.935 4.022 0.913 1
1 609 . 2 1 1 A 59 59 GLY HA3 H 2482 3.381 4.141 -0.760 1
1 610 . 2 1 1 A 59 59 GLY CA C 2482 47.809 44.480 3.329 1
1 611 . 2 1 1 A 59 59 GLY N N 2482 110.079 107.489 2.590 1
1 612 . 2 1 1 A 60 60 TYR H H 2483 8.990 8.485 0.505 1
1 613 . 2 1 1 A 60 60 TYR HA H 2483 5.157 4.907 0.250 1
1 618 . 2 1 1 A 60 60 TYR C C 2483 175.096 174.548 0.548 1
1 619 . 2 1 1 A 60 60 TYR CA C 2483 57.375 57.478 -0.103 1
1 620 . 2 1 1 A 60 60 TYR CB C 2483 43.153 40.206 2.947 1
1 622 . 2 1 1 A 60 60 TYR N N 2483 125.900 122.038 3.862 1
1 623 . 2 1 1 A 61 61 ARG H H 2484 9.557 9.031 0.526 1
1 624 . 2 1 1 A 61 61 ARG HA H 2484 4.858 4.773 0.085 1
1 631 . 2 1 1 A 61 61 ARG CA C 2484 55.016 55.444 -0.428 1
1 632 . 2 1 1 A 61 61 ARG CB C 2484 32.128 31.472 0.656 1
1 635 . 2 1 1 A 61 61 ARG N N 2484 124.847 125.826 -0.979 1
1 636 . 2 1 1 A 62 62 VAL H H 2485 9.046 8.952 0.094 1
1 637 . 2 1 1 A 62 62 VAL HA H 2485 4.675 4.797 -0.122 1
1 645 . 2 1 1 A 62 62 VAL C C 2485 173.837 174.730 -0.893 1
1 646 . 2 1 1 A 62 62 VAL CA C 2485 60.752 60.925 -0.173 1
1 647 . 2 1 1 A 62 62 VAL CB C 2485 32.459 33.552 -1.093 1
1 650 . 2 1 1 A 62 62 VAL N N 2485 132.205 126.019 6.186 1
1 651 . 2 1 1 A 63 63 THR H H 2486 8.474 8.899 -0.425 1
1 652 . 2 1 1 A 63 63 THR HA H 2486 5.392 5.261 0.131 1
1 657 . 2 1 1 A 63 63 THR C C 2486 173.675 173.738 -0.063 1
1 658 . 2 1 1 A 63 63 THR CA C 2486 60.008 61.295 -1.287 1
1 659 . 2 1 1 A 63 63 THR CB C 2486 71.035 71.103 -0.068 1
1 661 . 2 1 1 A 63 63 THR N N 2486 121.216 123.339 -2.123 1
1 662 . 2 1 1 A 64 64 TYR H H 2487 9.409 9.070 0.339 1
1 663 . 2 1 1 A 64 64 TYR HA H 2487 5.617 5.573 0.044 1
1 670 . 2 1 1 A 64 64 TYR C C 2487 172.847 172.621 0.226 1
1 671 . 2 1 1 A 64 64 TYR CA C 2487 55.557 55.788 -0.231 1
1 672 . 2 1 1 A 64 64 TYR CB C 2487 41.968 41.920 0.048 1
1 675 . 2 1 1 A 64 64 TYR N N 2487 124.061 122.015 2.046 1
1 676 . 2 1 1 A 65 65 THR H H 2488 8.145 8.909 -0.764 1
1 677 . 2 1 1 A 65 65 THR HA H 2488 4.959 4.590 0.369 1
1 682 . 2 1 1 A 65 65 THR CA C 2488 58.532 58.897 -0.365 1
1 683 . 2 1 1 A 65 65 THR CB C 2488 70.141 70.440 -0.299 1
1 685 . 2 1 1 A 65 65 THR N N 2488 117.924 116.905 1.019 1
1 686 . 2 1 1 A 66 66 PRO HA H 2489 4.602 4.818 -0.216 1
1 693 . 2 1 1 A 66 66 PRO C C 2489 176.647 176.469 0.178 1
1 694 . 2 1 1 A 66 66 PRO CA C 2489 61.442 62.180 -0.738 1
1 695 . 2 1 1 A 66 66 PRO CB C 2489 32.715 32.569 0.146 1
1 698 . 2 1 1 A 67 67 MET H H 2490 8.832 8.483 0.349 1
1 699 . 2 1 1 A 67 67 MET HA H 2490 4.880 4.694 0.186 1
1 707 . 2 1 1 A 67 67 MET C C 2490 174.121 175.926 -1.805 1
1 708 . 2 1 1 A 67 67 MET CA C 2490 53.848 54.870 -1.022 1
1 709 . 2 1 1 A 67 67 MET CB C 2490 33.727 33.852 -0.125 1
1 712 . 2 1 1 A 67 67 MET N N 2490 119.212 117.693 1.519 1
1 713 . 2 1 1 A 68 68 ALA H H 2491 7.086 7.455 -0.369 1
1 714 . 2 1 1 A 68 68 ALA HA H 2491 4.851 4.843 0.008 1
1 718 . 2 1 1 A 68 68 ALA CA C 2491 49.222 49.972 -0.750 1
1 719 . 2 1 1 A 68 68 ALA CB C 2491 20.600 21.974 -1.374 1
1 720 . 2 1 1 A 68 68 ALA N N 2491 120.363 120.455 -0.092 1
1 721 . 2 1 1 A 69 69 PRO HA H 2492 4.263 4.710 -0.447 1
1 728 . 2 1 1 A 69 69 PRO C C 2492 174.370 176.142 -1.772 1
1 729 . 2 1 1 A 69 69 PRO CA C 2492 62.555 63.493 -0.938 1
1 730 . 2 1 1 A 69 69 PRO CB C 2492 32.752 32.965 -0.213 1
1 733 . 2 1 1 A 70 70 GLY H H 2493 8.858 8.291 0.567 1
1 734 . 2 1 1 A 70 70 GLY HA2 H 2493 4.544 4.079 0.465 1
1 735 . 2 1 1 A 70 70 GLY HA3 H 2493 3.849 4.126 -0.277 1
1 736 . 2 1 1 A 70 70 GLY C C 2493 172.182 172.272 -0.090 1
1 737 . 2 1 1 A 70 70 GLY CA C 2493 44.356 44.351 0.005 1
1 738 . 2 1 1 A 70 70 GLY N N 2493 106.539 108.643 -2.104 1
1 739 . 2 1 1 A 71 71 SER H H 2494 8.490 8.310 0.180 1
1 740 . 2 1 1 A 71 71 SER HA H 2494 5.280 5.192 0.088 1
1 743 . 2 1 1 A 71 71 SER C C 2494 173.512 173.527 -0.015 1
1 744 . 2 1 1 A 71 71 SER CA C 2494 57.674 58.733 -1.059 1
1 745 . 2 1 1 A 71 71 SER CB C 2494 63.799 64.033 -0.234 1
1 746 . 2 1 1 A 71 71 SER N N 2494 117.964 117.282 0.682 1
1 747 . 2 1 1 A 72 72 TYR H H 2495 9.320 9.656 -0.336 1
1 748 . 2 1 1 A 72 72 TYR HA H 2495 4.960 5.400 -0.440 1
1 755 . 2 1 1 A 72 72 TYR C C 2495 173.979 174.785 -0.806 1
1 756 . 2 1 1 A 72 72 TYR CA C 2495 56.384 56.994 -0.610 1
1 757 . 2 1 1 A 72 72 TYR CB C 2495 40.247 40.357 -0.110 1
1 760 . 2 1 1 A 72 72 TYR N N 2495 126.442 126.243 0.199 1
1 761 . 2 1 1 A 73 73 LEU H H 2496 9.019 9.020 -0.001 1
1 762 . 2 1 1 A 73 73 LEU HA H 2496 5.209 5.022 0.187 1
1 772 . 2 1 1 A 73 73 LEU C C 2496 177.015 174.800 2.215 1
1 773 . 2 1 1 A 73 73 LEU CA C 2496 53.393 53.969 -0.576 1
1 774 . 2 1 1 A 73 73 LEU CB C 2496 43.918 44.142 -0.224 1
1 778 . 2 1 1 A 73 73 LEU N N 2496 125.439 125.886 -0.447 1
1 779 . 2 1 1 A 74 74 ILE H H 2497 9.921 9.638 0.283 1
1 780 . 2 1 1 A 74 74 ILE HA H 2497 5.128 4.644 0.484 1
1 790 . 2 1 1 A 74 74 ILE C C 2497 175.730 175.219 0.511 1
1 791 . 2 1 1 A 74 74 ILE CA C 2497 60.930 60.463 0.467 1
1 792 . 2 1 1 A 74 74 ILE CB C 2497 39.488 37.359 2.129 1
1 796 . 2 1 1 A 74 74 ILE N N 2497 132.185 130.125 2.060 1
1 797 . 2 1 1 A 75 75 SER H H 2498 9.284 9.129 0.155 1
1 798 . 2 1 1 A 75 75 SER HA H 2498 5.111 4.896 0.215 1
1 801 . 2 1 1 A 75 75 SER C C 2498 173.449 173.599 -0.150 1
1 802 . 2 1 1 A 75 75 SER CA C 2498 58.260 58.197 0.063 1
1 803 . 2 1 1 A 75 75 SER CB C 2498 63.956 61.640 2.316 1
1 804 . 2 1 1 A 75 75 SER N N 2498 125.384 125.334 0.050 1
1 805 . 2 1 1 A 76 76 ILE H H 2499 9.861 8.512 1.349 1
1 806 . 2 1 1 A 76 76 ILE HA H 2499 4.814 4.515 0.299 1
1 816 . 2 1 1 A 76 76 ILE CA C 2499 61.034 61.478 -0.444 1
1 817 . 2 1 1 A 76 76 ILE CB C 2499 40.387 37.361 3.026 1
1 821 . 2 1 1 A 76 76 ILE N N 2499 129.414 126.500 2.914 1
1 822 . 2 1 1 A 77 77 LYS H H 2500 8.827 8.850 -0.023 1
1 823 . 2 1 1 A 77 77 LYS HA H 2500 5.254 5.390 -0.136 1
1 832 . 2 1 1 A 77 77 LYS C C 2500 175.245 174.852 0.393 1
1 833 . 2 1 1 A 77 77 LYS CA C 2500 54.388 54.795 -0.407 1
1 834 . 2 1 1 A 77 77 LYS CB C 2500 36.127 35.743 0.384 1
1 838 . 2 1 1 A 77 77 LYS N N 2500 126.922 127.185 -0.263 1
1 839 . 2 1 1 A 78 78 TYR H H 2501 8.408 8.764 -0.356 1
1 840 . 2 1 1 A 78 78 TYR HA H 2501 5.479 5.028 0.451 1
1 847 . 2 1 1 A 78 78 TYR C C 2501 174.792 175.606 -0.814 1
1 848 . 2 1 1 A 78 78 TYR CA C 2501 56.837 57.281 -0.444 1
1 849 . 2 1 1 A 78 78 TYR CB C 2501 44.008 41.963 2.045 1
1 852 . 2 1 1 A 78 78 TYR N N 2501 122.282 124.508 -2.226 1
1 853 . 2 1 1 A 79 79 GLY H H 2502 8.196 8.711 -0.515 1
1 854 . 2 1 1 A 79 79 GLY HA2 H 2502 4.040 3.659 0.381 1
1 855 . 2 1 1 A 79 79 GLY HA3 H 2502 3.465 3.811 -0.346 1
1 856 . 2 1 1 A 79 79 GLY C C 2502 173.932 173.504 0.428 1
1 857 . 2 1 1 A 79 79 GLY CA C 2502 45.741 45.755 -0.014 1
1 858 . 2 1 1 A 79 79 GLY N N 2502 113.451 113.784 -0.333 1
1 859 . 2 1 1 A 80 80 GLY H H 2503 7.589 8.037 -0.448 1
1 860 . 2 1 1 A 80 80 GLY HA2 H 2503 4.490 4.084 0.406 1
1 861 . 2 1 1 A 80 80 GLY HA3 H 2503 3.555 4.163 -0.608 1
1 862 . 2 1 1 A 80 80 GLY CA C 2503 43.540 44.458 -0.918 1
1 863 . 2 1 1 A 80 80 GLY N N 2503 107.293 107.759 -0.466 1
1 864 . 2 1 1 A 81 81 PRO HA H 2504 4.320 4.365 -0.045 1
1 871 . 2 1 1 A 81 81 PRO C C 2504 175.311 175.426 -0.115 1
1 872 . 2 1 1 A 81 81 PRO CA C 2504 62.722 63.499 -0.777 1
1 873 . 2 1 1 A 81 81 PRO CB C 2504 29.297 31.960 -2.663 1
1 876 . 2 1 1 A 82 82 TYR H H 2505 7.778 7.363 0.415 1
1 877 . 2 1 1 A 82 82 TYR HA H 2505 4.791 4.940 -0.149 1
1 884 . 2 1 1 A 82 82 TYR C C 2505 175.086 175.900 -0.814 1
1 885 . 2 1 1 A 82 82 TYR CA C 2505 56.111 57.216 -1.105 1
1 886 . 2 1 1 A 82 82 TYR CB C 2505 39.483 40.477 -0.994 1
1 889 . 2 1 1 A 82 82 TYR N N 2505 123.973 120.681 3.292 1
1 890 . 2 1 1 A 83 83 HIS H H 2506 8.625 8.990 -0.365 1
1 891 . 2 1 1 A 83 83 HIS HA H 2506 4.583 4.902 -0.319 1
1 896 . 2 1 1 A 83 83 HIS C C 2506 178.161 176.007 2.154 1
1 897 . 2 1 1 A 83 83 HIS CA C 2506 58.241 56.864 1.377 1
1 898 . 2 1 1 A 83 83 HIS CB C 2506 33.132 30.436 2.696 1
1 901 . 2 1 1 A 83 83 HIS N N 2506 124.092 121.222 2.870 1
1 902 . 2 1 1 A 84 84 ILE H H 2507 8.327 8.637 -0.310 1
1 903 . 2 1 1 A 84 84 ILE HA H 2507 4.553 4.294 0.259 1
1 913 . 2 1 1 A 84 84 ILE C C 2507 176.523 176.197 0.326 1
1 914 . 2 1 1 A 84 84 ILE CA C 2507 60.791 60.162 0.629 1
1 915 . 2 1 1 A 84 84 ILE CB C 2507 39.162 39.790 -0.628 1
1 919 . 2 1 1 A 84 84 ILE N N 2507 117.355 119.692 -2.337 1
1 920 . 2 1 1 A 85 85 GLY H H 2508 9.130 8.512 0.618 1
1 921 . 2 1 1 A 85 85 GLY HA2 H 2508 3.883 3.706 0.177 1
1 922 . 2 1 1 A 85 85 GLY HA3 H 2508 3.800 3.727 0.073 1
1 923 . 2 1 1 A 85 85 GLY C C 2508 174.438 175.449 -1.011 1
1 924 . 2 1 1 A 85 85 GLY CA C 2508 47.673 46.695 0.978 1
1 925 . 2 1 1 A 85 85 GLY N N 2508 111.346 109.658 1.688 1
1 926 . 2 1 1 A 86 86 GLY H H 2509 8.236 8.156 0.080 1
1 927 . 2 1 1 A 86 86 GLY HA2 H 2509 3.893 3.844 0.049 1
1 928 . 2 1 1 A 86 86 GLY HA3 H 2509 3.161 3.856 -0.695 1
1 929 . 2 1 1 A 86 86 GLY C C 2509 171.837 172.953 -1.116 1
1 930 . 2 1 1 A 86 86 GLY CA C 2509 44.844 45.310 -0.466 1
1 931 . 2 1 1 A 86 86 GLY N N 2509 115.594 117.783 -2.189 1
1 932 . 2 1 1 A 87 87 SER H H 2510 7.385 7.740 -0.355 1
1 933 . 2 1 1 A 87 87 SER HA H 2510 4.217 4.165 0.052 1
1 936 . 2 1 1 A 87 87 SER CA C 2510 54.783 55.186 -0.403 1
1 937 . 2 1 1 A 87 87 SER CB C 2510 62.683 64.034 -1.351 1
1 938 . 2 1 1 A 87 87 SER N N 2510 112.859 116.402 -3.543 1
1 939 . 2 1 1 A 88 88 PRO HA H 2511 5.532 4.726 0.806 1
1 946 . 2 1 1 A 88 88 PRO C C 2511 175.870 175.499 0.371 1
1 947 . 2 1 1 A 88 88 PRO CA C 2511 62.379 62.262 0.117 1
1 948 . 2 1 1 A 88 88 PRO CB C 2511 33.639 32.420 1.219 1
1 951 . 2 1 1 A 89 89 PHE H H 2512 9.359 8.770 0.589 1
1 952 . 2 1 1 A 89 89 PHE HA H 2512 4.467 4.824 -0.357 1
1 960 . 2 1 1 A 89 89 PHE C C 2512 175.152 174.697 0.455 1
1 961 . 2 1 1 A 89 89 PHE CA C 2512 57.401 57.440 -0.039 1
1 962 . 2 1 1 A 89 89 PHE CB C 2512 40.843 40.667 0.176 1
1 966 . 2 1 1 A 89 89 PHE N N 2512 124.789 119.816 4.973 1
1 967 . 2 1 1 A 90 90 LYS H H 2513 8.772 8.910 -0.138 1
1 968 . 2 1 1 A 90 90 LYS HA H 2513 4.941 4.738 0.203 1
1 973 . 2 1 1 A 90 90 LYS C C 2513 174.183 174.683 -0.500 1
1 974 . 2 1 1 A 90 90 LYS CA C 2513 55.749 55.683 0.066 1
1 975 . 2 1 1 A 90 90 LYS CB C 2513 32.817 33.404 -0.587 1
1 978 . 2 1 1 A 90 90 LYS N N 2513 125.133 124.588 0.545 1
1 979 . 2 1 1 A 91 91 ALA H H 2514 9.158 9.078 0.080 1
1 980 . 2 1 1 A 91 91 ALA HA H 2514 4.510 4.811 -0.301 1
1 984 . 2 1 1 A 91 91 ALA C C 2514 176.561 176.248 0.313 1
1 985 . 2 1 1 A 91 91 ALA CA C 2514 50.528 51.504 -0.976 1
1 986 . 2 1 1 A 91 91 ALA CB C 2514 20.653 20.115 0.538 1
1 987 . 2 1 1 A 91 91 ALA N N 2514 131.989 130.113 1.876 1
1 988 . 2 1 1 A 92 92 LYS H H 2515 8.186 9.077 -0.891 1
1 989 . 2 1 1 A 92 92 LYS HA H 2515 4.926 4.735 0.191 1
1 998 . 2 1 1 A 92 92 LYS C C 2515 175.177 175.197 -0.020 1
1 999 . 2 1 1 A 92 92 LYS CA C 2515 55.725 55.439 0.286 1
1 1000 . 2 1 1 A 92 92 LYS CB C 2515 33.765 32.452 1.313 1
1 1004 . 2 1 1 A 92 92 LYS N N 2515 124.887 123.824 1.063 1
1 1005 . 2 1 1 A 93 93 VAL H H 2516 9.362 8.980 0.382 1
1 1006 . 2 1 1 A 93 93 VAL HA H 2516 5.161 4.815 0.346 1
1 1014 . 2 1 1 A 93 93 VAL C C 2516 176.988 175.607 1.381 1
1 1015 . 2 1 1 A 93 93 VAL CA C 2516 60.523 61.809 -1.286 1
1 1016 . 2 1 1 A 93 93 VAL CB C 2516 33.291 32.794 0.497 1
1 1019 . 2 1 1 A 93 93 VAL N N 2516 129.943 125.449 4.494 1
1 1020 . 2 1 1 A 94 94 THR H H 2517 8.614 8.715 -0.101 1
1 1021 . 2 1 1 A 94 94 THR HA H 2517 4.902 4.870 0.032 1
1 1026 . 2 1 1 A 94 94 THR C C 2517 172.759 173.389 -0.630 1
1 1027 . 2 1 1 A 94 94 THR CA C 2517 60.121 59.829 0.292 1
1 1028 . 2 1 1 A 94 94 THR CB C 2517 71.072 71.425 -0.353 1
1 1030 . 2 1 1 A 94 94 THR N N 2517 122.032 117.033 4.999 1
1 1031 . 2 1 1 A 95 95 GLY H H 2518 8.280 8.410 -0.130 1
1 1032 . 2 1 1 A 95 95 GLY HA2 H 2518 3.852 4.133 -0.281 1
1 1033 . 2 1 1 A 95 95 GLY HA3 H 2518 4.846 4.135 0.711 1
1 1034 . 2 1 1 A 95 95 GLY CA C 2518 43.955 44.555 -0.600 1
1 1035 . 2 1 1 A 95 95 GLY N N 2518 107.949 108.485 -0.536 1
1 1036 . 2 1 1 A 96 96 PRO HA H 2519 4.449 4.627 -0.178 1
1 1043 . 2 1 1 A 96 96 PRO C C 2519 176.892 176.534 0.358 1
1 1044 . 2 1 1 A 96 96 PRO CA C 2519 62.062 62.752 -0.690 1
1 1045 . 2 1 1 A 96 96 PRO CB C 2519 32.286 32.072 0.214 1
1 1048 . 2 1 1 A 97 97 ARG H H 2520 8.651 8.506 0.145 1
1 1049 . 2 1 1 A 97 97 ARG HA H 2520 4.348 4.354 -0.006 1
1 1056 . 2 1 1 A 97 97 ARG C C 2520 176.236 176.291 -0.055 1
1 1057 . 2 1 1 A 97 97 ARG CA C 2520 57.587 56.507 1.080 1
1 1058 . 2 1 1 A 97 97 ARG CB C 2520 30.472 30.622 -0.150 1
1 1061 . 2 1 1 A 97 97 ARG N N 2520 120.781 122.086 -1.305 1
1 1062 . 2 1 1 A 98 98 LEU H H 2521 8.545 8.822 -0.277 1
1 1063 . 2 1 1 A 98 98 LEU HA H 2521 4.577 4.288 0.289 1
1 1073 . 2 1 1 A 98 98 LEU C C 2521 175.880 178.342 -2.462 1
1 1074 . 2 1 1 A 98 98 LEU CA C 2521 55.068 56.837 -1.769 1
1 1075 . 2 1 1 A 98 98 LEU CB C 2521 43.082 42.123 0.959 1
1 1079 . 2 1 1 A 98 98 LEU N N 2521 128.715 127.898 0.817 1
1 4 . 3 1 1 A 2 2 ALA HA H -2 4.374 4.464 -0.090 1
1 8 . 3 1 1 A 2 2 ALA C C -2 177.865 177.924 -0.059 1
1 9 . 3 1 1 A 2 2 ALA CA C -2 52.670 51.639 1.031 1
1 10 . 3 1 1 A 2 2 ALA CB C -2 19.508 19.630 -0.122 1
1 32 . 3 1 1 A 5 5 ASP H H 2428 8.300 8.502 -0.202 1
1 33 . 3 1 1 A 5 5 ASP HA H 2428 5.082 5.333 -0.251 1
1 36 . 3 1 1 A 5 5 ASP CA C 2428 51.517 50.790 0.727 1
1 37 . 3 1 1 A 5 5 ASP CB C 2428 42.244 44.031 -1.787 1
1 38 . 3 1 1 A 5 5 ASP N N 2428 122.879 119.626 3.253 1
1 39 . 3 1 1 A 6 6 PRO HA H 2429 4.340 4.419 -0.079 1
1 46 . 3 1 1 A 6 6 PRO C C 2429 178.266 177.835 0.431 1
1 47 . 3 1 1 A 6 6 PRO CA C 2429 64.494 64.437 0.057 1
1 48 . 3 1 1 A 6 6 PRO CB C 2429 31.841 31.994 -0.153 1
1 51 . 3 1 1 A 7 7 GLY H H 2430 8.686 8.504 0.182 1
1 52 . 3 1 1 A 7 7 GLY HA2 H 2430 4.116 3.880 0.236 1
1 53 . 3 1 1 A 7 7 GLY HA3 H 2430 3.868 3.881 -0.013 1
1 54 . 3 1 1 A 7 7 GLY C C 2430 174.567 175.621 -1.054 1
1 55 . 3 1 1 A 7 7 GLY CA C 2430 46.038 46.577 -0.539 1
1 56 . 3 1 1 A 7 7 GLY N N 2430 107.655 107.042 0.613 1
1 57 . 3 1 1 A 8 8 LEU H H 2431 7.692 7.406 0.286 1
1 58 . 3 1 1 A 8 8 LEU HA H 2431 4.507 4.394 0.113 1
1 68 . 3 1 1 A 8 8 LEU C C 2431 176.876 177.564 -0.688 1
1 69 . 3 1 1 A 8 8 LEU CA C 2431 54.307 56.525 -2.218 1
1 70 . 3 1 1 A 8 8 LEU CB C 2431 42.879 42.849 0.030 1
1 74 . 3 1 1 A 8 8 LEU N N 2431 120.022 119.974 0.048 1
1 75 . 3 1 1 A 9 9 VAL H H 2432 7.378 7.477 -0.099 1
1 76 . 3 1 1 A 9 9 VAL HA H 2432 4.154 3.876 0.278 1
1 84 . 3 1 1 A 9 9 VAL C C 2432 174.703 175.524 -0.821 1
1 85 . 3 1 1 A 9 9 VAL CA C 2432 62.387 63.277 -0.890 1
1 86 . 3 1 1 A 9 9 VAL CB C 2432 32.519 31.423 1.096 1
1 89 . 3 1 1 A 9 9 VAL N N 2432 123.902 119.333 4.569 1
1 90 . 3 1 1 A 10 10 SER H H 2433 8.201 8.626 -0.425 1
1 91 . 3 1 1 A 10 10 SER HA H 2433 5.136 4.972 0.164 1
1 94 . 3 1 1 A 10 10 SER CA C 2433 56.554 55.678 0.876 1
1 95 . 3 1 1 A 10 10 SER CB C 2433 66.763 65.321 1.442 1
1 96 . 3 1 1 A 10 10 SER N N 2433 121.921 122.024 -0.103 1
1 97 . 3 1 1 A 11 11 ALA H H 2434 8.670 8.397 0.273 1
1 98 . 3 1 1 A 11 11 ALA HA H 2434 5.632 5.351 0.281 1
1 102 . 3 1 1 A 11 11 ALA C C 2434 175.459 174.772 0.687 1
1 103 . 3 1 1 A 11 11 ALA CA C 2434 50.575 50.511 0.064 1
1 104 . 3 1 1 A 11 11 ALA CB C 2434 23.111 23.252 -0.141 1
1 105 . 3 1 1 A 11 11 ALA N N 2434 124.828 123.671 1.157 1
1 106 . 3 1 1 A 12 12 TYR H H 2435 8.609 8.775 -0.166 1
1 107 . 3 1 1 A 12 12 TYR HA H 2435 4.879 5.060 -0.181 1
1 114 . 3 1 1 A 12 12 TYR C C 2435 173.645 174.754 -1.109 1
1 115 . 3 1 1 A 12 12 TYR CA C 2435 56.268 56.593 -0.325 1
1 116 . 3 1 1 A 12 12 TYR CB C 2435 39.522 42.325 -2.803 1
1 119 . 3 1 1 A 12 12 TYR N N 2435 118.305 119.681 -1.376 1
1 120 . 3 1 1 A 13 13 GLY H H 2436 8.655 8.623 0.032 1
1 121 . 3 1 1 A 13 13 GLY HA2 H 2436 4.943 4.236 0.707 1
1 122 . 3 1 1 A 13 13 GLY HA3 H 2436 4.028 4.275 -0.247 1
1 123 . 3 1 1 A 13 13 GLY C C 2436 175.334 175.183 0.151 1
1 124 . 3 1 1 A 13 13 GLY CA C 2436 44.389 44.385 0.004 1
1 125 . 3 1 1 A 13 13 GLY N N 2436 110.710 110.424 0.286 1
1 126 . 3 1 1 A 14 14 ALA H H 2437 8.939 8.675 0.264 1
1 127 . 3 1 1 A 14 14 ALA HA H 2437 4.276 4.066 0.210 1
1 131 . 3 1 1 A 14 14 ALA C C 2437 180.524 179.040 1.484 1
1 132 . 3 1 1 A 14 14 ALA CA C 2437 55.551 55.033 0.518 1
1 133 . 3 1 1 A 14 14 ALA CB C 2437 18.411 18.368 0.043 1
1 134 . 3 1 1 A 14 14 ALA N N 2437 126.973 123.935 3.038 1
1 135 . 3 1 1 A 15 15 GLY H H 2438 8.933 8.641 0.292 1
1 136 . 3 1 1 A 15 15 GLY HA2 H 2438 4.531 3.951 0.580 1
1 137 . 3 1 1 A 15 15 GLY HA3 H 2438 3.576 4.153 -0.577 1
1 138 . 3 1 1 A 15 15 GLY C C 2438 174.323 175.493 -1.170 1
1 139 . 3 1 1 A 15 15 GLY CA C 2438 46.855 46.828 0.027 1
1 140 . 3 1 1 A 15 15 GLY N N 2438 104.803 105.766 -0.963 1
1 141 . 3 1 1 A 16 16 LEU H H 2439 7.529 7.475 0.054 1
1 142 . 3 1 1 A 16 16 LEU HA H 2439 3.768 3.758 0.010 1
1 152 . 3 1 1 A 16 16 LEU C C 2439 176.388 178.095 -1.707 1
1 153 . 3 1 1 A 16 16 LEU CA C 2439 56.137 57.150 -1.013 1
1 154 . 3 1 1 A 16 16 LEU CB C 2439 41.621 41.022 0.599 1
1 158 . 3 1 1 A 16 16 LEU N N 2439 119.633 122.228 -2.595 1
1 159 . 3 1 1 A 17 17 GLU H H 2440 7.505 7.982 -0.477 1
1 160 . 3 1 1 A 17 17 GLU HA H 2440 4.663 4.437 0.226 1
1 165 . 3 1 1 A 17 17 GLU C C 2440 178.126 177.358 0.768 1
1 166 . 3 1 1 A 17 17 GLU CA C 2440 56.447 56.404 0.043 1
1 167 . 3 1 1 A 17 17 GLU CB C 2440 31.485 30.689 0.796 1
1 169 . 3 1 1 A 17 17 GLU N N 2440 114.368 116.191 -1.823 1
1 170 . 3 1 1 A 18 18 GLY H H 2441 7.921 7.652 0.269 1
1 171 . 3 1 1 A 18 18 GLY HA2 H 2441 4.889 4.099 0.790 1
1 172 . 3 1 1 A 18 18 GLY HA3 H 2441 3.707 4.113 -0.406 1
1 173 . 3 1 1 A 18 18 GLY C C 2441 170.965 172.730 -1.765 1
1 174 . 3 1 1 A 18 18 GLY CA C 2441 45.549 44.602 0.947 1
1 175 . 3 1 1 A 18 18 GLY N N 2441 109.165 107.706 1.459 1
1 176 . 3 1 1 A 19 19 GLY H H 2442 7.540 7.872 -0.332 1
1 177 . 3 1 1 A 19 19 GLY HA2 H 2442 4.086 4.210 -0.124 1
1 178 . 3 1 1 A 19 19 GLY HA3 H 2442 4.086 4.239 -0.153 1
1 179 . 3 1 1 A 19 19 GLY C C 2442 171.051 171.931 -0.880 1
1 180 . 3 1 1 A 19 19 GLY CA C 2442 44.937 45.366 -0.429 1
1 181 . 3 1 1 A 19 19 GLY N N 2442 105.460 107.533 -2.073 1
1 182 . 3 1 1 A 20 20 VAL H H 2443 8.899 8.254 0.645 1
1 183 . 3 1 1 A 20 20 VAL HA H 2443 5.062 4.990 0.072 1
1 191 . 3 1 1 A 20 20 VAL C C 2443 176.623 175.410 1.213 1
1 192 . 3 1 1 A 20 20 VAL CA C 2443 60.197 60.388 -0.191 1
1 193 . 3 1 1 A 20 20 VAL CB C 2443 35.107 34.498 0.609 1
1 196 . 3 1 1 A 20 20 VAL N N 2443 122.753 121.861 0.892 1
1 197 . 3 1 1 A 21 21 THR H H 2444 8.630 8.541 0.089 1
1 198 . 3 1 1 A 21 21 THR HA H 2444 3.773 4.161 -0.388 1
1 203 . 3 1 1 A 21 21 THR C C 2444 175.646 174.915 0.731 1
1 204 . 3 1 1 A 21 21 THR CA C 2444 62.732 62.679 0.053 1
1 205 . 3 1 1 A 21 21 THR CB C 2444 68.925 68.664 0.261 1
1 207 . 3 1 1 A 21 21 THR N N 2444 118.179 119.131 -0.952 1
1 208 . 3 1 1 A 22 22 GLY H H 2445 8.736 8.871 -0.135 1
1 209 . 3 1 1 A 22 22 GLY HA2 H 2445 3.412 3.985 -0.573 1
1 210 . 3 1 1 A 22 22 GLY HA3 H 2445 4.061 3.987 0.074 1
1 211 . 3 1 1 A 22 22 GLY C C 2445 172.973 173.589 -0.616 1
1 212 . 3 1 1 A 22 22 GLY CA C 2445 45.577 45.273 0.304 1
1 213 . 3 1 1 A 22 22 GLY N N 2445 107.888 113.860 -5.972 1
1 214 . 3 1 1 A 23 23 ASN H H 2446 7.877 7.688 0.189 1
1 215 . 3 1 1 A 23 23 ASN HA H 2446 5.253 5.097 0.156 1
1 220 . 3 1 1 A 23 23 ASN CA C 2446 49.740 49.953 -0.213 1
1 221 . 3 1 1 A 23 23 ASN CB C 2446 40.198 39.157 1.041 1
1 222 . 3 1 1 A 23 23 ASN N N 2446 120.684 119.769 0.915 1
1 224 . 3 1 1 A 24 24 PRO HA H 2447 4.525 4.585 -0.060 1
1 231 . 3 1 1 A 24 24 PRO CA C 2447 62.766 62.347 0.419 1
1 232 . 3 1 1 A 24 24 PRO CB C 2447 31.732 32.064 -0.332 1
1 235 . 3 1 1 A 25 25 ALA H H 2448 9.178 8.325 0.853 1
1 236 . 3 1 1 A 25 25 ALA HA H 2448 4.614 4.759 -0.145 1
1 240 . 3 1 1 A 25 25 ALA C C 2448 175.503 175.600 -0.097 1
1 241 . 3 1 1 A 25 25 ALA CA C 2448 50.526 50.679 -0.153 1
1 242 . 3 1 1 A 25 25 ALA CB C 2448 20.458 20.167 0.291 1
1 243 . 3 1 1 A 25 25 ALA N N 2448 132.079 125.586 6.493 1
1 244 . 3 1 1 A 26 26 GLU H H 2449 8.813 9.082 -0.269 1
1 245 . 3 1 1 A 26 26 GLU HA H 2449 5.830 5.135 0.695 1
1 250 . 3 1 1 A 26 26 GLU C C 2449 176.272 175.545 0.727 1
1 251 . 3 1 1 A 26 26 GLU CA C 2449 54.376 55.244 -0.868 1
1 252 . 3 1 1 A 26 26 GLU CB C 2449 35.463 32.877 2.586 1
1 254 . 3 1 1 A 26 26 GLU N N 2449 120.079 123.994 -3.915 1
1 255 . 3 1 1 A 27 27 PHE H H 2450 8.782 8.873 -0.091 1
1 256 . 3 1 1 A 27 27 PHE HA H 2450 5.021 5.358 -0.337 1
1 264 . 3 1 1 A 27 27 PHE C C 2450 171.205 172.059 -0.854 1
1 265 . 3 1 1 A 27 27 PHE CA C 2450 56.852 56.055 0.797 1
1 266 . 3 1 1 A 27 27 PHE CB C 2450 41.080 42.080 -1.000 1
1 270 . 3 1 1 A 27 27 PHE N N 2450 118.670 121.880 -3.210 1
1 271 . 3 1 1 A 28 28 VAL H H 2451 8.961 9.345 -0.384 1
1 272 . 3 1 1 A 28 28 VAL HA H 2451 4.761 4.954 -0.193 1
1 280 . 3 1 1 A 28 28 VAL C C 2451 174.673 173.897 0.776 1
1 281 . 3 1 1 A 28 28 VAL CA C 2451 60.619 59.657 0.962 1
1 282 . 3 1 1 A 28 28 VAL CB C 2451 35.484 35.457 0.027 1
1 285 . 3 1 1 A 28 28 VAL N N 2451 121.552 119.903 1.649 1
1 286 . 3 1 1 A 29 29 VAL H H 2452 9.294 9.263 0.031 1
1 287 . 3 1 1 A 29 29 VAL HA H 2452 4.363 4.543 -0.180 1
1 295 . 3 1 1 A 29 29 VAL C C 2452 174.218 174.835 -0.617 1
1 296 . 3 1 1 A 29 29 VAL CA C 2452 61.526 62.058 -0.532 1
1 297 . 3 1 1 A 29 29 VAL CB C 2452 32.666 31.298 1.368 1
1 300 . 3 1 1 A 29 29 VAL N N 2452 125.585 128.258 -2.673 1
1 301 . 3 1 1 A 30 30 ASN H H 2453 9.465 9.067 0.398 1
1 302 . 3 1 1 A 30 30 ASN HA H 2453 5.096 5.104 -0.008 1
1 307 . 3 1 1 A 30 30 ASN C C 2453 176.216 176.260 -0.044 1
1 308 . 3 1 1 A 30 30 ASN CA C 2453 52.011 52.442 -0.431 1
1 309 . 3 1 1 A 30 30 ASN CB C 2453 39.057 39.149 -0.092 1
1 310 . 3 1 1 A 30 30 ASN N N 2453 127.724 127.173 0.551 1
1 312 . 3 1 1 A 31 31 THR H H 2454 8.915 8.483 0.432 1
1 313 . 3 1 1 A 31 31 THR HA H 2454 4.342 4.554 -0.212 1
1 318 . 3 1 1 A 31 31 THR C C 2454 176.816 176.029 0.787 1
1 319 . 3 1 1 A 31 31 THR CA C 2454 61.117 61.654 -0.537 1
1 320 . 3 1 1 A 31 31 THR CB C 2454 68.209 69.506 -1.297 1
1 322 . 3 1 1 A 31 31 THR N N 2454 117.783 116.838 0.945 1
1 323 . 3 1 1 A 32 32 SER H H 2455 8.454 7.906 0.548 1
1 324 . 3 1 1 A 32 32 SER HA H 2455 4.155 4.294 -0.139 1
1 327 . 3 1 1 A 32 32 SER C C 2455 175.458 175.072 0.386 1
1 328 . 3 1 1 A 32 32 SER CA C 2455 62.148 62.295 -0.147 1
1 329 . 3 1 1 A 32 32 SER CB C 2455 63.476 63.120 0.356 1
1 330 . 3 1 1 A 32 32 SER N N 2455 121.781 119.031 2.750 1
1 331 . 3 1 1 A 33 33 ASN H H 2456 8.845 7.956 0.889 1
1 332 . 3 1 1 A 33 33 ASN HA H 2456 5.064 4.595 0.469 1
1 337 . 3 1 1 A 33 33 ASN C C 2456 174.674 175.970 -1.296 1
1 338 . 3 1 1 A 33 33 ASN CA C 2456 53.067 54.404 -1.337 1
1 339 . 3 1 1 A 33 33 ASN CB C 2456 39.632 38.965 0.667 1
1 340 . 3 1 1 A 33 33 ASN N N 2456 120.176 117.812 2.364 1
1 342 . 3 1 1 A 34 34 ALA H H 2457 7.714 7.893 -0.179 1
1 343 . 3 1 1 A 34 34 ALA HA H 2457 4.482 4.465 0.017 1
1 347 . 3 1 1 A 34 34 ALA C C 2457 177.582 178.358 -0.776 1
1 348 . 3 1 1 A 34 34 ALA CA C 2457 52.521 52.401 0.120 1
1 349 . 3 1 1 A 34 34 ALA CB C 2457 22.252 20.689 1.563 1
1 350 . 3 1 1 A 34 34 ALA N N 2457 123.065 120.325 2.740 1
1 351 . 3 1 1 A 35 35 GLY H H 2458 8.195 8.079 0.116 1
1 352 . 3 1 1 A 35 35 GLY HA2 H 2458 4.246 4.139 0.107 1
1 353 . 3 1 1 A 35 35 GLY HA3 H 2458 3.902 4.152 -0.250 1
1 354 . 3 1 1 A 35 35 GLY C C 2458 173.360 174.006 -0.646 1
1 355 . 3 1 1 A 35 35 GLY CA C 2458 44.486 44.818 -0.332 1
1 356 . 3 1 1 A 35 35 GLY N N 2458 108.472 105.161 3.311 1
1 357 . 3 1 1 A 36 36 ALA H H 2459 8.430 8.172 0.258 1
1 358 . 3 1 1 A 36 36 ALA HA H 2459 4.472 4.584 -0.112 1
1 362 . 3 1 1 A 36 36 ALA C C 2459 176.968 177.587 -0.619 1
1 363 . 3 1 1 A 36 36 ALA CA C 2459 52.695 52.593 0.102 1
1 364 . 3 1 1 A 36 36 ALA CB C 2459 19.360 19.899 -0.539 1
1 365 . 3 1 1 A 36 36 ALA N N 2459 126.012 124.332 1.680 1
1 366 . 3 1 1 A 37 37 GLY H H 2460 7.781 8.418 -0.637 1
1 367 . 3 1 1 A 37 37 GLY HA2 H 2460 3.856 4.067 -0.211 1
1 368 . 3 1 1 A 37 37 GLY HA3 H 2460 3.164 4.087 -0.923 1
1 369 . 3 1 1 A 37 37 GLY C C 2460 170.730 171.717 -0.987 1
1 370 . 3 1 1 A 37 37 GLY CA C 2460 44.747 45.418 -0.671 1
1 371 . 3 1 1 A 37 37 GLY N N 2460 109.493 107.401 2.092 1
1 372 . 3 1 1 A 38 38 ALA H H 2461 8.055 7.950 0.105 1
1 373 . 3 1 1 A 38 38 ALA HA H 2461 4.389 4.782 -0.393 1
1 377 . 3 1 1 A 38 38 ALA C C 2461 176.609 176.205 0.404 1
1 378 . 3 1 1 A 38 38 ALA CA C 2461 51.419 51.393 0.026 1
1 379 . 3 1 1 A 38 38 ALA CB C 2461 19.665 19.969 -0.304 1
1 380 . 3 1 1 A 38 38 ALA N N 2461 121.997 123.176 -1.179 1
1 381 . 3 1 1 A 39 39 LEU H H 2462 8.597 8.535 0.062 1
1 382 . 3 1 1 A 39 39 LEU HA H 2462 5.022 5.097 -0.075 1
1 392 . 3 1 1 A 39 39 LEU C C 2462 175.883 175.230 0.653 1
1 393 . 3 1 1 A 39 39 LEU CA C 2462 53.907 53.268 0.639 1
1 394 . 3 1 1 A 39 39 LEU CB C 2462 44.576 45.058 -0.482 1
1 398 . 3 1 1 A 39 39 LEU N N 2462 126.664 124.037 2.627 1
1 399 . 3 1 1 A 40 40 SER H H 2463 8.898 9.118 -0.220 1
1 400 . 3 1 1 A 40 40 SER HA H 2463 4.732 4.724 0.008 1
1 403 . 3 1 1 A 40 40 SER C C 2463 172.984 172.804 0.180 1
1 404 . 3 1 1 A 40 40 SER CA C 2463 56.730 57.026 -0.296 1
1 405 . 3 1 1 A 40 40 SER CB C 2463 64.648 64.322 0.326 1
1 406 . 3 1 1 A 40 40 SER N N 2463 122.932 121.898 1.034 1
1 407 . 3 1 1 A 41 41 VAL H H 2464 8.538 7.384 1.154 1
1 408 . 3 1 1 A 41 41 VAL HA H 2464 5.131 4.142 0.989 1
1 416 . 3 1 1 A 41 41 VAL C C 2464 174.812 174.725 0.087 1
1 417 . 3 1 1 A 41 41 VAL CA C 2464 60.784 62.861 -2.077 1
1 418 . 3 1 1 A 41 41 VAL CB C 2464 34.262 32.245 2.017 1
1 420 . 3 1 1 A 41 41 VAL N N 2464 129.161 123.391 5.770 1
1 421 . 3 1 1 A 42 42 THR H H 2465 8.807 8.888 -0.081 1
1 422 . 3 1 1 A 42 42 THR HA H 2465 4.573 5.066 -0.493 1
1 427 . 3 1 1 A 42 42 THR CA C 2465 60.408 61.360 -0.952 1
1 428 . 3 1 1 A 42 42 THR CB C 2465 71.764 72.262 -0.498 1
1 430 . 3 1 1 A 42 42 THR N N 2465 120.898 124.424 -3.526 1
1 431 . 3 1 1 A 43 43 ILE H H 2466 8.648 8.915 -0.267 1
1 432 . 3 1 1 A 43 43 ILE HA H 2466 4.854 4.804 0.050 1
1 442 . 3 1 1 A 43 43 ILE C C 2466 174.073 173.955 0.118 1
1 443 . 3 1 1 A 43 43 ILE CA C 2466 61.184 60.082 1.102 1
1 444 . 3 1 1 A 43 43 ILE CB C 2466 39.516 40.605 -1.089 1
1 448 . 3 1 1 A 43 43 ILE N N 2466 124.810 125.836 -1.026 1
1 449 . 3 1 1 A 44 44 ASP H H 2467 8.821 9.108 -0.287 1
1 450 . 3 1 1 A 44 44 ASP HA H 2467 5.217 5.425 -0.208 1
1 453 . 3 1 1 A 44 44 ASP C C 2467 175.002 175.343 -0.341 1
1 454 . 3 1 1 A 44 44 ASP CA C 2467 52.998 52.568 0.430 1
1 455 . 3 1 1 A 44 44 ASP CB C 2467 44.728 43.400 1.328 1
1 456 . 3 1 1 A 44 44 ASP N N 2467 129.093 128.593 0.500 1
1 457 . 3 1 1 A 45 45 GLY H H 2468 8.535 8.200 0.335 1
1 458 . 3 1 1 A 45 45 GLY HA2 H 2468 3.954 3.713 0.241 1
1 459 . 3 1 1 A 45 45 GLY HA3 H 2468 3.561 3.932 -0.371 1
1 460 . 3 1 1 A 45 45 GLY CA C 2468 45.659 45.094 0.565 1
1 461 . 3 1 1 A 45 45 GLY N N 2468 112.751 109.782 2.969 1
1 462 . 3 1 1 A 46 46 PRO HA H 2469 4.318 4.350 -0.032 1
1 469 . 3 1 1 A 46 46 PRO C C 2469 176.086 176.165 -0.079 1
1 470 . 3 1 1 A 46 46 PRO CA C 2469 64.198 63.875 0.323 1
1 471 . 3 1 1 A 46 46 PRO CB C 2469 32.348 31.903 0.445 1
1 474 . 3 1 1 A 47 47 SER H H 2470 7.106 7.652 -0.546 1
1 475 . 3 1 1 A 47 47 SER HA H 2470 4.632 4.845 -0.213 1
1 478 . 3 1 1 A 47 47 SER C C 2470 172.969 173.141 -0.172 1
1 479 . 3 1 1 A 47 47 SER CA C 2470 57.106 57.357 -0.251 1
1 480 . 3 1 1 A 47 47 SER CB C 2470 66.262 67.426 -1.164 1
1 481 . 3 1 1 A 47 47 SER N N 2470 110.556 114.158 -3.602 1
1 482 . 3 1 1 A 48 48 LYS H H 2471 8.534 8.299 0.235 1
1 483 . 3 1 1 A 48 48 LYS HA H 2471 4.486 4.529 -0.043 1
1 492 . 3 1 1 A 48 48 LYS C C 2471 177.231 176.386 0.845 1
1 493 . 3 1 1 A 48 48 LYS CA C 2471 56.620 56.924 -0.304 1
1 494 . 3 1 1 A 48 48 LYS CB C 2471 32.379 33.535 -1.156 1
1 498 . 3 1 1 A 48 48 LYS N N 2471 124.055 122.116 1.939 1
1 499 . 3 1 1 A 49 49 VAL H H 2472 8.497 8.757 -0.260 1
1 500 . 3 1 1 A 49 49 VAL HA H 2472 4.552 4.939 -0.387 1
1 508 . 3 1 1 A 49 49 VAL C C 2472 175.292 174.351 0.941 1
1 509 . 3 1 1 A 49 49 VAL CA C 2472 60.142 59.389 0.753 1
1 510 . 3 1 1 A 49 49 VAL CB C 2472 33.464 34.928 -1.464 1
1 513 . 3 1 1 A 49 49 VAL N N 2472 121.233 118.973 2.260 1
1 514 . 3 1 1 A 50 50 LYS H H 2473 8.190 8.469 -0.279 1
1 515 . 3 1 1 A 50 50 LYS HA H 2473 4.522 4.623 -0.101 1
1 518 . 3 1 1 A 50 50 LYS CA C 2473 55.952 55.765 0.187 1
1 519 . 3 1 1 A 50 50 LYS CB C 2473 32.896 31.955 0.941 1
1 520 . 3 1 1 A 50 50 LYS N N 2473 126.082 122.671 3.411 1
1 521 . 3 1 1 A 51 51 MET H H 2474 8.818 9.131 -0.313 1
1 522 . 3 1 1 A 51 51 MET HA H 2474 5.324 5.085 0.239 1
1 530 . 3 1 1 A 51 51 MET C C 2474 173.933 175.016 -1.083 1
1 531 . 3 1 1 A 51 51 MET CA C 2474 54.848 54.860 -0.012 1
1 532 . 3 1 1 A 51 51 MET CB C 2474 37.043 34.078 2.965 1
1 535 . 3 1 1 A 51 51 MET N N 2474 126.911 124.971 1.940 1
1 536 . 3 1 1 A 52 52 ASP H H 2475 9.095 9.300 -0.205 1
1 537 . 3 1 1 A 52 52 ASP HA H 2475 4.947 5.013 -0.066 1
1 540 . 3 1 1 A 52 52 ASP C C 2475 173.923 174.355 -0.432 1
1 541 . 3 1 1 A 52 52 ASP CA C 2475 53.487 52.965 0.522 1
1 542 . 3 1 1 A 52 52 ASP CB C 2475 44.765 41.132 3.633 1
1 543 . 3 1 1 A 52 52 ASP N N 2475 125.526 126.011 -0.485 1
1 544 . 3 1 1 A 53 53 CYS H H 2476 8.606 9.012 -0.406 1
1 545 . 3 1 1 A 53 53 CYS HA H 2476 5.145 5.072 0.073 1
1 548 . 3 1 1 A 53 53 CYS C C 2476 173.330 174.281 -0.951 1
1 549 . 3 1 1 A 53 53 CYS CA C 2476 57.452 58.020 -0.568 1
1 550 . 3 1 1 A 53 53 CYS CB C 2476 28.108 29.020 -0.912 1
1 551 . 3 1 1 A 53 53 CYS N N 2476 124.317 125.357 -1.040 1
1 552 . 3 1 1 A 54 54 GLN H H 2477 8.978 9.076 -0.098 1
1 553 . 3 1 1 A 54 54 GLN HA H 2477 4.884 4.912 -0.028 1
1 560 . 3 1 1 A 54 54 GLN C C 2477 174.854 174.261 0.593 1
1 561 . 3 1 1 A 54 54 GLN CA C 2477 53.891 54.498 -0.607 1
1 562 . 3 1 1 A 54 54 GLN CB C 2477 32.837 32.482 0.355 1
1 564 . 3 1 1 A 54 54 GLN N N 2477 127.074 125.705 1.369 1
1 566 . 3 1 1 A 55 55 GLU H H 2478 9.065 8.835 0.230 1
1 567 . 3 1 1 A 55 55 GLU HA H 2478 4.280 4.578 -0.298 1
1 572 . 3 1 1 A 55 55 GLU C C 2478 175.383 175.687 -0.304 1
1 573 . 3 1 1 A 55 55 GLU CA C 2478 57.516 56.576 0.940 1
1 574 . 3 1 1 A 55 55 GLU CB C 2478 30.346 30.708 -0.362 1
1 576 . 3 1 1 A 55 55 GLU N N 2478 125.186 123.169 2.017 1
1 577 . 3 1 1 A 56 56 CYS H H 2479 8.407 8.469 -0.062 1
1 578 . 3 1 1 A 56 56 CYS HA H 2479 5.056 4.625 0.431 1
1 581 . 3 1 1 A 56 56 CYS CA C 2479 55.858 56.788 -0.930 1
1 582 . 3 1 1 A 56 56 CYS CB C 2479 28.676 30.254 -1.578 1
1 583 . 3 1 1 A 56 56 CYS N N 2479 121.499 122.789 -1.290 1
1 584 . 3 1 1 A 57 57 PRO HA H 2480 4.159 4.372 -0.213 1
1 591 . 3 1 1 A 57 57 PRO C C 2480 177.964 177.612 0.352 1
1 592 . 3 1 1 A 57 57 PRO CA C 2480 66.877 64.434 2.443 1
1 593 . 3 1 1 A 57 57 PRO CB C 2480 31.709 31.815 -0.106 1
1 596 . 3 1 1 A 58 58 GLU H H 2481 8.900 8.134 0.766 1
1 597 . 3 1 1 A 58 58 GLU HA H 2481 4.201 4.308 -0.107 1
1 602 . 3 1 1 A 58 58 GLU C C 2481 175.129 176.417 -1.288 1
1 603 . 3 1 1 A 58 58 GLU CA C 2481 57.883 57.218 0.665 1
1 604 . 3 1 1 A 58 58 GLU CB C 2481 29.991 30.046 -0.055 1
1 606 . 3 1 1 A 58 58 GLU N N 2481 115.316 118.446 -3.130 1
1 607 . 3 1 1 A 59 59 GLY H H 2482 7.527 7.472 0.055 1
1 608 . 3 1 1 A 59 59 GLY HA2 H 2482 4.935 3.934 1.001 1
1 609 . 3 1 1 A 59 59 GLY HA3 H 2482 3.381 4.042 -0.661 1
1 610 . 3 1 1 A 59 59 GLY CA C 2482 47.809 44.508 3.301 1
1 611 . 3 1 1 A 59 59 GLY N N 2482 110.079 107.686 2.393 1
1 612 . 3 1 1 A 60 60 TYR H H 2483 8.990 8.554 0.436 1
1 613 . 3 1 1 A 60 60 TYR HA H 2483 5.157 5.143 0.014 1
1 618 . 3 1 1 A 60 60 TYR C C 2483 175.096 174.571 0.525 1
1 619 . 3 1 1 A 60 60 TYR CA C 2483 57.375 56.888 0.487 1
1 620 . 3 1 1 A 60 60 TYR CB C 2483 43.153 40.197 2.956 1
1 622 . 3 1 1 A 60 60 TYR N N 2483 125.900 122.131 3.769 1
1 623 . 3 1 1 A 61 61 ARG H H 2484 9.557 8.836 0.721 1
1 624 . 3 1 1 A 61 61 ARG HA H 2484 4.858 4.609 0.249 1
1 631 . 3 1 1 A 61 61 ARG CA C 2484 55.016 55.708 -0.692 1
1 632 . 3 1 1 A 61 61 ARG CB C 2484 32.128 31.302 0.826 1
1 635 . 3 1 1 A 61 61 ARG N N 2484 124.847 126.008 -1.161 1
1 636 . 3 1 1 A 62 62 VAL H H 2485 9.046 9.035 0.011 1
1 637 . 3 1 1 A 62 62 VAL HA H 2485 4.675 4.581 0.094 1
1 645 . 3 1 1 A 62 62 VAL C C 2485 173.837 174.755 -0.918 1
1 646 . 3 1 1 A 62 62 VAL CA C 2485 60.752 60.880 -0.128 1
1 647 . 3 1 1 A 62 62 VAL CB C 2485 32.459 32.909 -0.450 1
1 650 . 3 1 1 A 62 62 VAL N N 2485 132.205 126.353 5.852 1
1 651 . 3 1 1 A 63 63 THR H H 2486 8.474 8.694 -0.220 1
1 652 . 3 1 1 A 63 63 THR HA H 2486 5.392 5.188 0.204 1
1 657 . 3 1 1 A 63 63 THR C C 2486 173.675 173.591 0.084 1
1 658 . 3 1 1 A 63 63 THR CA C 2486 60.008 62.183 -2.175 1
1 659 . 3 1 1 A 63 63 THR CB C 2486 71.035 70.522 0.513 1
1 661 . 3 1 1 A 63 63 THR N N 2486 121.216 122.832 -1.616 1
1 662 . 3 1 1 A 64 64 TYR H H 2487 9.409 8.898 0.511 1
1 663 . 3 1 1 A 64 64 TYR HA H 2487 5.617 5.547 0.070 1
1 670 . 3 1 1 A 64 64 TYR C C 2487 172.847 172.585 0.262 1
1 671 . 3 1 1 A 64 64 TYR CA C 2487 55.557 55.723 -0.166 1
1 672 . 3 1 1 A 64 64 TYR CB C 2487 41.968 41.892 0.076 1
1 675 . 3 1 1 A 64 64 TYR N N 2487 124.061 121.878 2.183 1
1 676 . 3 1 1 A 65 65 THR H H 2488 8.145 8.824 -0.679 1
1 677 . 3 1 1 A 65 65 THR HA H 2488 4.959 4.615 0.344 1
1 682 . 3 1 1 A 65 65 THR CA C 2488 58.532 59.013 -0.481 1
1 683 . 3 1 1 A 65 65 THR CB C 2488 70.141 69.977 0.164 1
1 685 . 3 1 1 A 65 65 THR N N 2488 117.924 117.015 0.909 1
1 686 . 3 1 1 A 66 66 PRO HA H 2489 4.602 4.825 -0.223 1
1 693 . 3 1 1 A 66 66 PRO C C 2489 176.647 176.563 0.084 1
1 694 . 3 1 1 A 66 66 PRO CA C 2489 61.442 62.262 -0.820 1
1 695 . 3 1 1 A 66 66 PRO CB C 2489 32.715 32.920 -0.205 1
1 698 . 3 1 1 A 67 67 MET H H 2490 8.832 8.210 0.622 1
1 699 . 3 1 1 A 67 67 MET HA H 2490 4.880 4.804 0.076 1
1 707 . 3 1 1 A 67 67 MET C C 2490 174.121 175.822 -1.701 1
1 708 . 3 1 1 A 67 67 MET CA C 2490 53.848 54.660 -0.812 1
1 709 . 3 1 1 A 67 67 MET CB C 2490 33.727 34.081 -0.354 1
1 712 . 3 1 1 A 67 67 MET N N 2490 119.212 117.643 1.569 1
1 713 . 3 1 1 A 68 68 ALA H H 2491 7.086 7.384 -0.298 1
1 714 . 3 1 1 A 68 68 ALA HA H 2491 4.851 4.852 -0.001 1
1 718 . 3 1 1 A 68 68 ALA CA C 2491 49.222 50.042 -0.820 1
1 719 . 3 1 1 A 68 68 ALA CB C 2491 20.600 22.450 -1.850 1
1 720 . 3 1 1 A 68 68 ALA N N 2491 120.363 120.848 -0.485 1
1 721 . 3 1 1 A 69 69 PRO HA H 2492 4.263 4.810 -0.547 1
1 728 . 3 1 1 A 69 69 PRO C C 2492 174.370 176.398 -2.028 1
1 729 . 3 1 1 A 69 69 PRO CA C 2492 62.555 62.910 -0.355 1
1 730 . 3 1 1 A 69 69 PRO CB C 2492 32.752 32.832 -0.080 1
1 733 . 3 1 1 A 70 70 GLY H H 2493 8.858 8.310 0.548 1
1 734 . 3 1 1 A 70 70 GLY HA2 H 2493 4.544 4.106 0.438 1
1 735 . 3 1 1 A 70 70 GLY HA3 H 2493 3.849 4.160 -0.311 1
1 736 . 3 1 1 A 70 70 GLY C C 2493 172.182 173.301 -1.119 1
1 737 . 3 1 1 A 70 70 GLY CA C 2493 44.356 44.416 -0.060 1
1 738 . 3 1 1 A 70 70 GLY N N 2493 106.539 107.420 -0.881 1
1 739 . 3 1 1 A 71 71 SER H H 2494 8.490 8.361 0.129 1
1 740 . 3 1 1 A 71 71 SER HA H 2494 5.280 5.029 0.251 1
1 743 . 3 1 1 A 71 71 SER C C 2494 173.512 173.199 0.313 1
1 744 . 3 1 1 A 71 71 SER CA C 2494 57.674 57.492 0.182 1
1 745 . 3 1 1 A 71 71 SER CB C 2494 63.799 64.491 -0.692 1
1 746 . 3 1 1 A 71 71 SER N N 2494 117.964 113.083 4.881 1
1 747 . 3 1 1 A 72 72 TYR H H 2495 9.320 9.456 -0.136 1
1 748 . 3 1 1 A 72 72 TYR HA H 2495 4.960 5.319 -0.359 1
1 755 . 3 1 1 A 72 72 TYR C C 2495 173.979 174.816 -0.837 1
1 756 . 3 1 1 A 72 72 TYR CA C 2495 56.384 57.087 -0.703 1
1 757 . 3 1 1 A 72 72 TYR CB C 2495 40.247 39.922 0.325 1
1 760 . 3 1 1 A 72 72 TYR N N 2495 126.442 124.616 1.826 1
1 761 . 3 1 1 A 73 73 LEU H H 2496 9.019 8.993 0.026 1
1 762 . 3 1 1 A 73 73 LEU HA H 2496 5.209 4.845 0.364 1
1 772 . 3 1 1 A 73 73 LEU C C 2496 177.015 174.842 2.173 1
1 773 . 3 1 1 A 73 73 LEU CA C 2496 53.393 54.240 -0.847 1
1 774 . 3 1 1 A 73 73 LEU CB C 2496 43.918 43.337 0.581 1
1 778 . 3 1 1 A 73 73 LEU N N 2496 125.439 126.554 -1.115 1
1 779 . 3 1 1 A 74 74 ILE H H 2497 9.921 9.356 0.565 1
1 780 . 3 1 1 A 74 74 ILE HA H 2497 5.128 4.606 0.522 1
1 790 . 3 1 1 A 74 74 ILE C C 2497 175.730 175.232 0.498 1
1 791 . 3 1 1 A 74 74 ILE CA C 2497 60.930 60.542 0.388 1
1 792 . 3 1 1 A 74 74 ILE CB C 2497 39.488 37.496 1.992 1
1 796 . 3 1 1 A 74 74 ILE N N 2497 132.185 129.448 2.737 1
1 797 . 3 1 1 A 75 75 SER H H 2498 9.284 9.148 0.136 1
1 798 . 3 1 1 A 75 75 SER HA H 2498 5.111 5.125 -0.014 1
1 801 . 3 1 1 A 75 75 SER C C 2498 173.449 173.384 0.065 1
1 802 . 3 1 1 A 75 75 SER CA C 2498 58.260 58.234 0.026 1
1 803 . 3 1 1 A 75 75 SER CB C 2498 63.956 62.954 1.002 1
1 804 . 3 1 1 A 75 75 SER N N 2498 125.384 125.137 0.247 1
1 805 . 3 1 1 A 76 76 ILE H H 2499 9.861 9.020 0.841 1
1 806 . 3 1 1 A 76 76 ILE HA H 2499 4.814 4.711 0.103 1
1 816 . 3 1 1 A 76 76 ILE CA C 2499 61.034 60.988 0.046 1
1 817 . 3 1 1 A 76 76 ILE CB C 2499 40.387 37.225 3.162 1
1 821 . 3 1 1 A 76 76 ILE N N 2499 129.414 127.733 1.681 1
1 822 . 3 1 1 A 77 77 LYS H H 2500 8.827 9.071 -0.244 1
1 823 . 3 1 1 A 77 77 LYS HA H 2500 5.254 5.158 0.096 1
1 832 . 3 1 1 A 77 77 LYS C C 2500 175.245 175.632 -0.387 1
1 833 . 3 1 1 A 77 77 LYS CA C 2500 54.388 55.033 -0.645 1
1 834 . 3 1 1 A 77 77 LYS CB C 2500 36.127 34.985 1.142 1
1 838 . 3 1 1 A 77 77 LYS N N 2500 126.922 127.008 -0.086 1
1 839 . 3 1 1 A 78 78 TYR H H 2501 8.408 9.019 -0.611 1
1 840 . 3 1 1 A 78 78 TYR HA H 2501 5.479 5.021 0.458 1
1 847 . 3 1 1 A 78 78 TYR C C 2501 174.792 175.586 -0.794 1
1 848 . 3 1 1 A 78 78 TYR CA C 2501 56.837 57.336 -0.499 1
1 849 . 3 1 1 A 78 78 TYR CB C 2501 44.008 42.155 1.853 1
1 852 . 3 1 1 A 78 78 TYR N N 2501 122.282 124.453 -2.171 1
1 853 . 3 1 1 A 79 79 GLY H H 2502 8.196 8.479 -0.283 1
1 854 . 3 1 1 A 79 79 GLY HA2 H 2502 4.040 3.635 0.405 1
1 855 . 3 1 1 A 79 79 GLY HA3 H 2502 3.465 3.808 -0.343 1
1 856 . 3 1 1 A 79 79 GLY C C 2502 173.932 173.652 0.280 1
1 857 . 3 1 1 A 79 79 GLY CA C 2502 45.741 45.944 -0.203 1
1 858 . 3 1 1 A 79 79 GLY N N 2502 113.451 114.152 -0.701 1
1 859 . 3 1 1 A 80 80 GLY H H 2503 7.589 8.229 -0.640 1
1 860 . 3 1 1 A 80 80 GLY HA2 H 2503 4.490 4.015 0.475 1
1 861 . 3 1 1 A 80 80 GLY HA3 H 2503 3.555 4.103 -0.548 1
1 862 . 3 1 1 A 80 80 GLY CA C 2503 43.540 43.944 -0.404 1
1 863 . 3 1 1 A 80 80 GLY N N 2503 107.293 107.335 -0.042 1
1 864 . 3 1 1 A 81 81 PRO HA H 2504 4.320 4.325 -0.005 1
1 871 . 3 1 1 A 81 81 PRO C C 2504 175.311 175.314 -0.003 1
1 872 . 3 1 1 A 81 81 PRO CA C 2504 62.722 63.533 -0.811 1
1 873 . 3 1 1 A 81 81 PRO CB C 2504 29.297 31.773 -2.476 1
1 876 . 3 1 1 A 82 82 TYR H H 2505 7.778 7.369 0.409 1
1 877 . 3 1 1 A 82 82 TYR HA H 2505 4.791 4.991 -0.200 1
1 884 . 3 1 1 A 82 82 TYR C C 2505 175.086 175.877 -0.791 1
1 885 . 3 1 1 A 82 82 TYR CA C 2505 56.111 56.715 -0.604 1
1 886 . 3 1 1 A 82 82 TYR CB C 2505 39.483 40.956 -1.473 1
1 889 . 3 1 1 A 82 82 TYR N N 2505 123.973 120.866 3.107 1
1 890 . 3 1 1 A 83 83 HIS H H 2506 8.625 9.058 -0.433 1
1 891 . 3 1 1 A 83 83 HIS HA H 2506 4.583 4.898 -0.315 1
1 896 . 3 1 1 A 83 83 HIS C C 2506 178.161 175.991 2.170 1
1 897 . 3 1 1 A 83 83 HIS CA C 2506 58.241 57.311 0.930 1
1 898 . 3 1 1 A 83 83 HIS CB C 2506 33.132 30.470 2.662 1
1 901 . 3 1 1 A 83 83 HIS N N 2506 124.092 121.447 2.645 1
1 902 . 3 1 1 A 84 84 ILE H H 2507 8.327 8.693 -0.366 1
1 903 . 3 1 1 A 84 84 ILE HA H 2507 4.553 4.463 0.090 1
1 913 . 3 1 1 A 84 84 ILE C C 2507 176.523 176.199 0.324 1
1 914 . 3 1 1 A 84 84 ILE CA C 2507 60.791 60.030 0.761 1
1 915 . 3 1 1 A 84 84 ILE CB C 2507 39.162 39.728 -0.566 1
1 919 . 3 1 1 A 84 84 ILE N N 2507 117.355 119.590 -2.235 1
1 920 . 3 1 1 A 85 85 GLY H H 2508 9.130 8.299 0.831 1
1 921 . 3 1 1 A 85 85 GLY HA2 H 2508 3.883 3.764 0.119 1
1 922 . 3 1 1 A 85 85 GLY HA3 H 2508 3.800 3.773 0.027 1
1 923 . 3 1 1 A 85 85 GLY C C 2508 174.438 175.452 -1.014 1
1 924 . 3 1 1 A 85 85 GLY CA C 2508 47.673 46.803 0.870 1
1 925 . 3 1 1 A 85 85 GLY N N 2508 111.346 109.603 1.743 1
1 926 . 3 1 1 A 86 86 GLY H H 2509 8.236 8.455 -0.219 1
1 927 . 3 1 1 A 86 86 GLY HA2 H 2509 3.893 3.882 0.011 1
1 928 . 3 1 1 A 86 86 GLY HA3 H 2509 3.161 3.948 -0.787 1
1 929 . 3 1 1 A 86 86 GLY C C 2509 171.837 173.680 -1.843 1
1 930 . 3 1 1 A 86 86 GLY CA C 2509 44.844 45.239 -0.395 1
1 931 . 3 1 1 A 86 86 GLY N N 2509 115.594 116.748 -1.154 1
1 932 . 3 1 1 A 87 87 SER H H 2510 7.385 7.983 -0.598 1
1 933 . 3 1 1 A 87 87 SER HA H 2510 4.217 4.188 0.029 1
1 936 . 3 1 1 A 87 87 SER CA C 2510 54.783 55.398 -0.615 1
1 937 . 3 1 1 A 87 87 SER CB C 2510 62.683 63.932 -1.249 1
1 938 . 3 1 1 A 87 87 SER N N 2510 112.859 116.682 -3.823 1
1 939 . 3 1 1 A 88 88 PRO HA H 2511 5.532 4.823 0.709 1
1 946 . 3 1 1 A 88 88 PRO C C 2511 175.870 175.198 0.672 1
1 947 . 3 1 1 A 88 88 PRO CA C 2511 62.379 62.161 0.218 1
1 948 . 3 1 1 A 88 88 PRO CB C 2511 33.639 32.184 1.455 1
1 951 . 3 1 1 A 89 89 PHE H H 2512 9.359 8.462 0.897 1
1 952 . 3 1 1 A 89 89 PHE HA H 2512 4.467 4.770 -0.303 1
1 960 . 3 1 1 A 89 89 PHE C C 2512 175.152 175.966 -0.814 1
1 961 . 3 1 1 A 89 89 PHE CA C 2512 57.401 56.986 0.415 1
1 962 . 3 1 1 A 89 89 PHE CB C 2512 40.843 41.351 -0.508 1
1 966 . 3 1 1 A 89 89 PHE N N 2512 124.789 119.828 4.961 1
1 967 . 3 1 1 A 90 90 LYS H H 2513 8.772 8.606 0.166 1
1 968 . 3 1 1 A 90 90 LYS HA H 2513 4.941 4.394 0.547 1
1 973 . 3 1 1 A 90 90 LYS C C 2513 174.183 175.997 -1.814 1
1 974 . 3 1 1 A 90 90 LYS CA C 2513 55.749 56.788 -1.039 1
1 975 . 3 1 1 A 90 90 LYS CB C 2513 32.817 32.078 0.739 1
1 978 . 3 1 1 A 90 90 LYS N N 2513 125.133 121.166 3.967 1
1 979 . 3 1 1 A 91 91 ALA H H 2514 9.158 7.942 1.216 1
1 980 . 3 1 1 A 91 91 ALA HA H 2514 4.510 4.052 0.458 1
1 984 . 3 1 1 A 91 91 ALA C C 2514 176.561 176.770 -0.209 1
1 985 . 3 1 1 A 91 91 ALA CA C 2514 50.528 52.860 -2.332 1
1 986 . 3 1 1 A 91 91 ALA CB C 2514 20.653 17.862 2.791 1
1 987 . 3 1 1 A 91 91 ALA N N 2514 131.989 121.701 10.288 1
1 988 . 3 1 1 A 92 92 LYS H H 2515 8.186 8.397 -0.211 1
1 989 . 3 1 1 A 92 92 LYS HA H 2515 4.926 4.749 0.177 1
1 998 . 3 1 1 A 92 92 LYS C C 2515 175.177 175.628 -0.451 1
1 999 . 3 1 1 A 92 92 LYS CA C 2515 55.725 56.215 -0.490 1
1 1000 . 3 1 1 A 92 92 LYS CB C 2515 33.765 33.213 0.552 1
1 1004 . 3 1 1 A 92 92 LYS N N 2515 124.887 123.153 1.734 1
1 1005 . 3 1 1 A 93 93 VAL H H 2516 9.362 9.391 -0.029 1
1 1006 . 3 1 1 A 93 93 VAL HA H 2516 5.161 5.135 0.026 1
1 1014 . 3 1 1 A 93 93 VAL C C 2516 176.988 175.139 1.849 1
1 1015 . 3 1 1 A 93 93 VAL CA C 2516 60.523 61.220 -0.697 1
1 1016 . 3 1 1 A 93 93 VAL CB C 2516 33.291 34.171 -0.880 1
1 1019 . 3 1 1 A 93 93 VAL N N 2516 129.943 125.535 4.408 1
1 1020 . 3 1 1 A 94 94 THR H H 2517 8.614 8.922 -0.308 1
1 1021 . 3 1 1 A 94 94 THR HA H 2517 4.902 4.865 0.037 1
1 1026 . 3 1 1 A 94 94 THR C C 2517 172.759 173.018 -0.259 1
1 1027 . 3 1 1 A 94 94 THR CA C 2517 60.121 59.915 0.206 1
1 1028 . 3 1 1 A 94 94 THR CB C 2517 71.072 71.601 -0.529 1
1 1030 . 3 1 1 A 94 94 THR N N 2517 122.032 116.029 6.003 1
1 1031 . 3 1 1 A 95 95 GLY H H 2518 8.280 8.435 -0.155 1
1 1032 . 3 1 1 A 95 95 GLY HA2 H 2518 3.852 4.135 -0.283 1
1 1033 . 3 1 1 A 95 95 GLY HA3 H 2518 4.846 4.138 0.708 1
1 1034 . 3 1 1 A 95 95 GLY CA C 2518 43.955 44.224 -0.269 1
1 1035 . 3 1 1 A 95 95 GLY N N 2518 107.949 108.215 -0.266 1
1 1036 . 3 1 1 A 96 96 PRO HA H 2519 4.449 4.648 -0.199 1
1 1043 . 3 1 1 A 96 96 PRO C C 2519 176.892 175.925 0.967 1
1 1044 . 3 1 1 A 96 96 PRO CA C 2519 62.062 62.541 -0.479 1
1 1045 . 3 1 1 A 96 96 PRO CB C 2519 32.286 33.393 -1.107 1
1 1048 . 3 1 1 A 97 97 ARG H H 2520 8.651 8.343 0.308 1
1 1049 . 3 1 1 A 97 97 ARG HA H 2520 4.348 5.023 -0.675 1
1 1056 . 3 1 1 A 97 97 ARG C C 2520 176.236 176.403 -0.167 1
1 1057 . 3 1 1 A 97 97 ARG CA C 2520 57.587 54.516 3.071 1
1 1058 . 3 1 1 A 97 97 ARG CB C 2520 30.472 33.559 -3.087 1
1 1061 . 3 1 1 A 97 97 ARG N N 2520 120.781 118.102 2.679 1
1 1062 . 3 1 1 A 98 98 LEU H H 2521 8.545 8.891 -0.346 1
1 1063 . 3 1 1 A 98 98 LEU HA H 2521 4.577 4.340 0.237 1
1 1073 . 3 1 1 A 98 98 LEU C C 2521 175.880 176.931 -1.051 1
1 1074 . 3 1 1 A 98 98 LEU CA C 2521 55.068 55.662 -0.594 1
1 1075 . 3 1 1 A 98 98 LEU CB C 2521 43.082 42.570 0.512 1
1 1079 . 3 1 1 A 98 98 LEU N N 2521 128.715 121.146 7.569 1
1 4 . 4 1 1 A 2 2 ALA HA H -2 4.374 4.442 -0.068 1
1 8 . 4 1 1 A 2 2 ALA C C -2 177.865 177.472 0.393 1
1 9 . 4 1 1 A 2 2 ALA CA C -2 52.670 51.809 0.861 1
1 10 . 4 1 1 A 2 2 ALA CB C -2 19.508 19.937 -0.429 1
1 32 . 4 1 1 A 5 5 ASP H H 2428 8.300 8.705 -0.405 1
1 33 . 4 1 1 A 5 5 ASP HA H 2428 5.082 5.224 -0.142 1
1 36 . 4 1 1 A 5 5 ASP CA C 2428 51.517 50.678 0.839 1
1 37 . 4 1 1 A 5 5 ASP CB C 2428 42.244 42.610 -0.366 1
1 38 . 4 1 1 A 5 5 ASP N N 2428 122.879 121.245 1.634 1
1 39 . 4 1 1 A 6 6 PRO HA H 2429 4.340 4.457 -0.117 1
1 46 . 4 1 1 A 6 6 PRO C C 2429 178.266 178.190 0.076 1
1 47 . 4 1 1 A 6 6 PRO CA C 2429 64.494 64.475 0.019 1
1 48 . 4 1 1 A 6 6 PRO CB C 2429 31.841 32.014 -0.173 1
1 51 . 4 1 1 A 7 7 GLY H H 2430 8.686 8.609 0.077 1
1 52 . 4 1 1 A 7 7 GLY HA2 H 2430 4.116 3.832 0.284 1
1 53 . 4 1 1 A 7 7 GLY HA3 H 2430 3.868 3.836 0.032 1
1 54 . 4 1 1 A 7 7 GLY C C 2430 174.567 175.667 -1.100 1
1 55 . 4 1 1 A 7 7 GLY CA C 2430 46.038 46.584 -0.546 1
1 56 . 4 1 1 A 7 7 GLY N N 2430 107.655 106.854 0.801 1
1 57 . 4 1 1 A 8 8 LEU H H 2431 7.692 7.448 0.244 1
1 58 . 4 1 1 A 8 8 LEU HA H 2431 4.507 4.379 0.128 1
1 68 . 4 1 1 A 8 8 LEU C C 2431 176.876 177.571 -0.695 1
1 69 . 4 1 1 A 8 8 LEU CA C 2431 54.307 57.195 -2.888 1
1 70 . 4 1 1 A 8 8 LEU CB C 2431 42.879 42.564 0.315 1
1 74 . 4 1 1 A 8 8 LEU N N 2431 120.022 120.252 -0.230 1
1 75 . 4 1 1 A 9 9 VAL H H 2432 7.378 7.341 0.037 1
1 76 . 4 1 1 A 9 9 VAL HA H 2432 4.154 3.877 0.277 1
1 84 . 4 1 1 A 9 9 VAL C C 2432 174.703 175.831 -1.128 1
1 85 . 4 1 1 A 9 9 VAL CA C 2432 62.387 63.391 -1.004 1
1 86 . 4 1 1 A 9 9 VAL CB C 2432 32.519 31.493 1.026 1
1 89 . 4 1 1 A 9 9 VAL N N 2432 123.902 119.610 4.292 1
1 90 . 4 1 1 A 10 10 SER H H 2433 8.201 8.472 -0.271 1
1 91 . 4 1 1 A 10 10 SER HA H 2433 5.136 5.304 -0.168 1
1 94 . 4 1 1 A 10 10 SER CA C 2433 56.554 57.667 -1.113 1
1 95 . 4 1 1 A 10 10 SER CB C 2433 66.763 66.609 0.154 1
1 96 . 4 1 1 A 10 10 SER N N 2433 121.921 123.429 -1.508 1
1 97 . 4 1 1 A 11 11 ALA H H 2434 8.670 8.664 0.006 1
1 98 . 4 1 1 A 11 11 ALA HA H 2434 5.632 5.424 0.208 1
1 102 . 4 1 1 A 11 11 ALA C C 2434 175.459 174.927 0.532 1
1 103 . 4 1 1 A 11 11 ALA CA C 2434 50.575 49.949 0.626 1
1 104 . 4 1 1 A 11 11 ALA CB C 2434 23.111 22.689 0.422 1
1 105 . 4 1 1 A 11 11 ALA N N 2434 124.828 124.070 0.758 1
1 106 . 4 1 1 A 12 12 TYR H H 2435 8.609 8.760 -0.151 1
1 107 . 4 1 1 A 12 12 TYR HA H 2435 4.879 4.995 -0.116 1
1 114 . 4 1 1 A 12 12 TYR C C 2435 173.645 174.736 -1.091 1
1 115 . 4 1 1 A 12 12 TYR CA C 2435 56.268 56.509 -0.241 1
1 116 . 4 1 1 A 12 12 TYR CB C 2435 39.522 42.499 -2.977 1
1 119 . 4 1 1 A 12 12 TYR N N 2435 118.305 118.309 -0.004 1
1 120 . 4 1 1 A 13 13 GLY H H 2436 8.655 8.644 0.011 1
1 121 . 4 1 1 A 13 13 GLY HA2 H 2436 4.943 4.231 0.712 1
1 122 . 4 1 1 A 13 13 GLY HA3 H 2436 4.028 4.266 -0.238 1
1 123 . 4 1 1 A 13 13 GLY C C 2436 175.334 175.203 0.131 1
1 124 . 4 1 1 A 13 13 GLY CA C 2436 44.389 44.425 -0.036 1
1 125 . 4 1 1 A 13 13 GLY N N 2436 110.710 110.347 0.363 1
1 126 . 4 1 1 A 14 14 ALA H H 2437 8.939 8.682 0.257 1
1 127 . 4 1 1 A 14 14 ALA HA H 2437 4.276 4.076 0.200 1
1 131 . 4 1 1 A 14 14 ALA C C 2437 180.524 179.128 1.396 1
1 132 . 4 1 1 A 14 14 ALA CA C 2437 55.551 55.038 0.513 1
1 133 . 4 1 1 A 14 14 ALA CB C 2437 18.411 18.403 0.008 1
1 134 . 4 1 1 A 14 14 ALA N N 2437 126.973 123.946 3.027 1
1 135 . 4 1 1 A 15 15 GLY H H 2438 8.933 8.683 0.250 1
1 136 . 4 1 1 A 15 15 GLY HA2 H 2438 4.531 3.965 0.566 1
1 137 . 4 1 1 A 15 15 GLY HA3 H 2438 3.576 4.159 -0.583 1
1 138 . 4 1 1 A 15 15 GLY C C 2438 174.323 175.601 -1.278 1
1 139 . 4 1 1 A 15 15 GLY CA C 2438 46.855 46.845 0.010 1
1 140 . 4 1 1 A 15 15 GLY N N 2438 104.803 105.560 -0.757 1
1 141 . 4 1 1 A 16 16 LEU H H 2439 7.529 7.567 -0.038 1
1 142 . 4 1 1 A 16 16 LEU HA H 2439 3.768 3.830 -0.062 1
1 152 . 4 1 1 A 16 16 LEU C C 2439 176.388 178.245 -1.857 1
1 153 . 4 1 1 A 16 16 LEU CA C 2439 56.137 57.335 -1.198 1
1 154 . 4 1 1 A 16 16 LEU CB C 2439 41.621 41.169 0.452 1
1 158 . 4 1 1 A 16 16 LEU N N 2439 119.633 122.229 -2.596 1
1 159 . 4 1 1 A 17 17 GLU H H 2440 7.505 7.931 -0.426 1
1 160 . 4 1 1 A 17 17 GLU HA H 2440 4.663 4.431 0.232 1
1 165 . 4 1 1 A 17 17 GLU C C 2440 178.126 177.346 0.780 1
1 166 . 4 1 1 A 17 17 GLU CA C 2440 56.447 56.440 0.007 1
1 167 . 4 1 1 A 17 17 GLU CB C 2440 31.485 30.678 0.807 1
1 169 . 4 1 1 A 17 17 GLU N N 2440 114.368 116.192 -1.824 1
1 170 . 4 1 1 A 18 18 GLY H H 2441 7.921 7.388 0.533 1
1 171 . 4 1 1 A 18 18 GLY HA2 H 2441 4.889 4.116 0.773 1
1 172 . 4 1 1 A 18 18 GLY HA3 H 2441 3.707 4.125 -0.418 1
1 173 . 4 1 1 A 18 18 GLY C C 2441 170.965 172.310 -1.345 1
1 174 . 4 1 1 A 18 18 GLY CA C 2441 45.549 44.337 1.212 1
1 175 . 4 1 1 A 18 18 GLY N N 2441 109.165 107.575 1.590 1
1 176 . 4 1 1 A 19 19 GLY H H 2442 7.540 7.926 -0.386 1
1 177 . 4 1 1 A 19 19 GLY HA2 H 2442 4.086 4.208 -0.122 1
1 178 . 4 1 1 A 19 19 GLY HA3 H 2442 4.086 4.236 -0.150 1
1 179 . 4 1 1 A 19 19 GLY C C 2442 171.051 171.858 -0.807 1
1 180 . 4 1 1 A 19 19 GLY CA C 2442 44.937 45.546 -0.609 1
1 181 . 4 1 1 A 19 19 GLY N N 2442 105.460 108.375 -2.915 1
1 182 . 4 1 1 A 20 20 VAL H H 2443 8.899 8.307 0.592 1
1 183 . 4 1 1 A 20 20 VAL HA H 2443 5.062 5.077 -0.015 1
1 191 . 4 1 1 A 20 20 VAL C C 2443 176.623 175.221 1.402 1
1 192 . 4 1 1 A 20 20 VAL CA C 2443 60.197 60.254 -0.057 1
1 193 . 4 1 1 A 20 20 VAL CB C 2443 35.107 35.100 0.007 1
1 196 . 4 1 1 A 20 20 VAL N N 2443 122.753 121.827 0.926 1
1 197 . 4 1 1 A 21 21 THR H H 2444 8.630 8.574 0.056 1
1 198 . 4 1 1 A 21 21 THR HA H 2444 3.773 4.149 -0.376 1
1 203 . 4 1 1 A 21 21 THR C C 2444 175.646 174.918 0.728 1
1 204 . 4 1 1 A 21 21 THR CA C 2444 62.732 63.228 -0.496 1
1 205 . 4 1 1 A 21 21 THR CB C 2444 68.925 68.455 0.470 1
1 207 . 4 1 1 A 21 21 THR N N 2444 118.179 119.393 -1.214 1
1 208 . 4 1 1 A 22 22 GLY H H 2445 8.736 8.895 -0.159 1
1 209 . 4 1 1 A 22 22 GLY HA2 H 2445 3.412 3.996 -0.584 1
1 210 . 4 1 1 A 22 22 GLY HA3 H 2445 4.061 3.997 0.064 1
1 211 . 4 1 1 A 22 22 GLY C C 2445 172.973 173.564 -0.591 1
1 212 . 4 1 1 A 22 22 GLY CA C 2445 45.577 45.198 0.379 1
1 213 . 4 1 1 A 22 22 GLY N N 2445 107.888 114.049 -6.161 1
1 214 . 4 1 1 A 23 23 ASN H H 2446 7.877 7.765 0.112 1
1 215 . 4 1 1 A 23 23 ASN HA H 2446 5.253 5.111 0.142 1
1 220 . 4 1 1 A 23 23 ASN CA C 2446 49.740 49.853 -0.113 1
1 221 . 4 1 1 A 23 23 ASN CB C 2446 40.198 39.240 0.958 1
1 222 . 4 1 1 A 23 23 ASN N N 2446 120.684 119.768 0.916 1
1 224 . 4 1 1 A 24 24 PRO HA H 2447 4.525 4.492 0.033 1
1 231 . 4 1 1 A 24 24 PRO CA C 2447 62.766 62.407 0.359 1
1 232 . 4 1 1 A 24 24 PRO CB C 2447 31.732 32.238 -0.506 1
1 235 . 4 1 1 A 25 25 ALA H H 2448 9.178 8.320 0.858 1
1 236 . 4 1 1 A 25 25 ALA HA H 2448 4.614 4.776 -0.162 1
1 240 . 4 1 1 A 25 25 ALA C C 2448 175.503 175.688 -0.185 1
1 241 . 4 1 1 A 25 25 ALA CA C 2448 50.526 50.753 -0.227 1
1 242 . 4 1 1 A 25 25 ALA CB C 2448 20.458 19.973 0.485 1
1 243 . 4 1 1 A 25 25 ALA N N 2448 132.079 125.222 6.857 1
1 244 . 4 1 1 A 26 26 GLU H H 2449 8.813 9.091 -0.278 1
1 245 . 4 1 1 A 26 26 GLU HA H 2449 5.830 5.178 0.652 1
1 250 . 4 1 1 A 26 26 GLU C C 2449 176.272 175.329 0.943 1
1 251 . 4 1 1 A 26 26 GLU CA C 2449 54.376 54.985 -0.609 1
1 252 . 4 1 1 A 26 26 GLU CB C 2449 35.463 32.909 2.554 1
1 254 . 4 1 1 A 26 26 GLU N N 2449 120.079 123.720 -3.641 1
1 255 . 4 1 1 A 27 27 PHE H H 2450 8.782 8.870 -0.088 1
1 256 . 4 1 1 A 27 27 PHE HA H 2450 5.021 5.328 -0.307 1
1 264 . 4 1 1 A 27 27 PHE C C 2450 171.205 172.159 -0.954 1
1 265 . 4 1 1 A 27 27 PHE CA C 2450 56.852 56.091 0.761 1
1 266 . 4 1 1 A 27 27 PHE CB C 2450 41.080 41.982 -0.902 1
1 270 . 4 1 1 A 27 27 PHE N N 2450 118.670 121.792 -3.122 1
1 271 . 4 1 1 A 28 28 VAL H H 2451 8.961 9.384 -0.423 1
1 272 . 4 1 1 A 28 28 VAL HA H 2451 4.761 5.036 -0.275 1
1 280 . 4 1 1 A 28 28 VAL C C 2451 174.673 173.763 0.910 1
1 281 . 4 1 1 A 28 28 VAL CA C 2451 60.619 59.920 0.699 1
1 282 . 4 1 1 A 28 28 VAL CB C 2451 35.484 35.274 0.210 1
1 285 . 4 1 1 A 28 28 VAL N N 2451 121.552 119.970 1.582 1
1 286 . 4 1 1 A 29 29 VAL H H 2452 9.294 9.331 -0.037 1
1 287 . 4 1 1 A 29 29 VAL HA H 2452 4.363 4.528 -0.165 1
1 295 . 4 1 1 A 29 29 VAL C C 2452 174.218 174.711 -0.493 1
1 296 . 4 1 1 A 29 29 VAL CA C 2452 61.526 61.807 -0.281 1
1 297 . 4 1 1 A 29 29 VAL CB C 2452 32.666 31.483 1.183 1
1 300 . 4 1 1 A 29 29 VAL N N 2452 125.585 128.570 -2.985 1
1 301 . 4 1 1 A 30 30 ASN H H 2453 9.465 9.142 0.323 1
1 302 . 4 1 1 A 30 30 ASN HA H 2453 5.096 5.130 -0.034 1
1 307 . 4 1 1 A 30 30 ASN C C 2453 176.216 176.301 -0.085 1
1 308 . 4 1 1 A 30 30 ASN CA C 2453 52.011 52.398 -0.387 1
1 309 . 4 1 1 A 30 30 ASN CB C 2453 39.057 38.750 0.307 1
1 310 . 4 1 1 A 30 30 ASN N N 2453 127.724 127.098 0.626 1
1 312 . 4 1 1 A 31 31 THR H H 2454 8.915 8.610 0.305 1
1 313 . 4 1 1 A 31 31 THR HA H 2454 4.342 4.435 -0.093 1
1 318 . 4 1 1 A 31 31 THR C C 2454 176.816 176.511 0.305 1
1 319 . 4 1 1 A 31 31 THR CA C 2454 61.117 62.643 -1.526 1
1 320 . 4 1 1 A 31 31 THR CB C 2454 68.209 69.410 -1.201 1
1 322 . 4 1 1 A 31 31 THR N N 2454 117.783 117.367 0.416 1
1 323 . 4 1 1 A 32 32 SER H H 2455 8.454 7.935 0.519 1
1 324 . 4 1 1 A 32 32 SER HA H 2455 4.155 4.249 -0.094 1
1 327 . 4 1 1 A 32 32 SER C C 2455 175.458 175.880 -0.422 1
1 328 . 4 1 1 A 32 32 SER CA C 2455 62.148 62.395 -0.247 1
1 329 . 4 1 1 A 32 32 SER CB C 2455 63.476 63.054 0.422 1
1 330 . 4 1 1 A 32 32 SER N N 2455 121.781 119.310 2.471 1
1 331 . 4 1 1 A 33 33 ASN H H 2456 8.845 8.269 0.576 1
1 332 . 4 1 1 A 33 33 ASN HA H 2456 5.064 4.583 0.481 1
1 337 . 4 1 1 A 33 33 ASN C C 2456 174.674 176.609 -1.935 1
1 338 . 4 1 1 A 33 33 ASN CA C 2456 53.067 55.191 -2.124 1
1 339 . 4 1 1 A 33 33 ASN CB C 2456 39.632 38.944 0.688 1
1 340 . 4 1 1 A 33 33 ASN N N 2456 120.176 119.039 1.137 1
1 342 . 4 1 1 A 34 34 ALA H H 2457 7.714 8.026 -0.312 1
1 343 . 4 1 1 A 34 34 ALA HA H 2457 4.482 4.557 -0.075 1
1 347 . 4 1 1 A 34 34 ALA C C 2457 177.582 178.267 -0.685 1
1 348 . 4 1 1 A 34 34 ALA CA C 2457 52.521 52.120 0.401 1
1 349 . 4 1 1 A 34 34 ALA CB C 2457 22.252 20.996 1.256 1
1 350 . 4 1 1 A 34 34 ALA N N 2457 123.065 119.062 4.003 1
1 351 . 4 1 1 A 35 35 GLY H H 2458 8.195 8.563 -0.368 1
1 352 . 4 1 1 A 35 35 GLY HA2 H 2458 4.246 4.060 0.186 1
1 353 . 4 1 1 A 35 35 GLY HA3 H 2458 3.902 4.076 -0.174 1
1 354 . 4 1 1 A 35 35 GLY C C 2458 173.360 173.327 0.033 1
1 355 . 4 1 1 A 35 35 GLY CA C 2458 44.486 46.479 -1.993 1
1 356 . 4 1 1 A 35 35 GLY N N 2458 108.472 106.328 2.144 1
1 357 . 4 1 1 A 36 36 ALA H H 2459 8.430 8.205 0.225 1
1 358 . 4 1 1 A 36 36 ALA HA H 2459 4.472 5.207 -0.735 1
1 362 . 4 1 1 A 36 36 ALA C C 2459 176.968 176.092 0.876 1
1 363 . 4 1 1 A 36 36 ALA CA C 2459 52.695 51.528 1.167 1
1 364 . 4 1 1 A 36 36 ALA CB C 2459 19.360 22.961 -3.601 1
1 365 . 4 1 1 A 36 36 ALA N N 2459 126.012 125.196 0.816 1
1 366 . 4 1 1 A 37 37 GLY H H 2460 7.781 8.616 -0.835 1
1 367 . 4 1 1 A 37 37 GLY HA2 H 2460 3.856 3.938 -0.082 1
1 368 . 4 1 1 A 37 37 GLY HA3 H 2460 3.164 4.105 -0.941 1
1 369 . 4 1 1 A 37 37 GLY C C 2460 170.730 171.770 -1.040 1
1 370 . 4 1 1 A 37 37 GLY CA C 2460 44.747 45.768 -1.021 1
1 371 . 4 1 1 A 37 37 GLY N N 2460 109.493 105.889 3.604 1
1 372 . 4 1 1 A 38 38 ALA H H 2461 8.055 7.999 0.056 1
1 373 . 4 1 1 A 38 38 ALA HA H 2461 4.389 4.501 -0.112 1
1 377 . 4 1 1 A 38 38 ALA C C 2461 176.609 176.399 0.210 1
1 378 . 4 1 1 A 38 38 ALA CA C 2461 51.419 51.901 -0.482 1
1 379 . 4 1 1 A 38 38 ALA CB C 2461 19.665 19.070 0.595 1
1 380 . 4 1 1 A 38 38 ALA N N 2461 121.997 123.019 -1.022 1
1 381 . 4 1 1 A 39 39 LEU H H 2462 8.597 8.589 0.008 1
1 382 . 4 1 1 A 39 39 LEU HA H 2462 5.022 5.230 -0.208 1
1 392 . 4 1 1 A 39 39 LEU C C 2462 175.883 175.835 0.048 1
1 393 . 4 1 1 A 39 39 LEU CA C 2462 53.907 53.343 0.564 1
1 394 . 4 1 1 A 39 39 LEU CB C 2462 44.576 44.569 0.007 1
1 398 . 4 1 1 A 39 39 LEU N N 2462 126.664 125.283 1.381 1
1 399 . 4 1 1 A 40 40 SER H H 2463 8.898 9.277 -0.379 1
1 400 . 4 1 1 A 40 40 SER HA H 2463 4.732 4.538 0.194 1
1 403 . 4 1 1 A 40 40 SER C C 2463 172.984 174.136 -1.152 1
1 404 . 4 1 1 A 40 40 SER CA C 2463 56.730 59.659 -2.929 1
1 405 . 4 1 1 A 40 40 SER CB C 2463 64.648 63.791 0.857 1
1 406 . 4 1 1 A 40 40 SER N N 2463 122.932 121.913 1.019 1
1 407 . 4 1 1 A 41 41 VAL H H 2464 8.538 7.778 0.760 1
1 408 . 4 1 1 A 41 41 VAL HA H 2464 5.131 4.496 0.635 1
1 416 . 4 1 1 A 41 41 VAL C C 2464 174.812 174.439 0.373 1
1 417 . 4 1 1 A 41 41 VAL CA C 2464 60.784 62.936 -2.152 1
1 418 . 4 1 1 A 41 41 VAL CB C 2464 34.262 30.620 3.642 1
1 420 . 4 1 1 A 41 41 VAL N N 2464 129.161 117.768 11.393 1
1 421 . 4 1 1 A 42 42 THR H H 2465 8.807 8.931 -0.124 1
1 422 . 4 1 1 A 42 42 THR HA H 2465 4.573 5.160 -0.587 1
1 427 . 4 1 1 A 42 42 THR CA C 2465 60.408 61.537 -1.129 1
1 428 . 4 1 1 A 42 42 THR CB C 2465 71.764 71.160 0.604 1
1 430 . 4 1 1 A 42 42 THR N N 2465 120.898 120.770 0.128 1
1 431 . 4 1 1 A 43 43 ILE H H 2466 8.648 9.052 -0.404 1
1 432 . 4 1 1 A 43 43 ILE HA H 2466 4.854 4.771 0.083 1
1 442 . 4 1 1 A 43 43 ILE C C 2466 174.073 174.130 -0.057 1
1 443 . 4 1 1 A 43 43 ILE CA C 2466 61.184 60.372 0.812 1
1 444 . 4 1 1 A 43 43 ILE CB C 2466 39.516 39.661 -0.145 1
1 448 . 4 1 1 A 43 43 ILE N N 2466 124.810 127.416 -2.606 1
1 449 . 4 1 1 A 44 44 ASP H H 2467 8.821 9.179 -0.358 1
1 450 . 4 1 1 A 44 44 ASP HA H 2467 5.217 5.539 -0.322 1
1 453 . 4 1 1 A 44 44 ASP C C 2467 175.002 175.202 -0.200 1
1 454 . 4 1 1 A 44 44 ASP CA C 2467 52.998 52.302 0.696 1
1 455 . 4 1 1 A 44 44 ASP CB C 2467 44.728 44.186 0.542 1
1 456 . 4 1 1 A 44 44 ASP N N 2467 129.093 128.783 0.310 1
1 457 . 4 1 1 A 45 45 GLY H H 2468 8.535 8.284 0.251 1
1 458 . 4 1 1 A 45 45 GLY HA2 H 2468 3.954 3.931 0.023 1
1 459 . 4 1 1 A 45 45 GLY HA3 H 2468 3.561 4.088 -0.527 1
1 460 . 4 1 1 A 45 45 GLY CA C 2468 45.659 44.607 1.052 1
1 461 . 4 1 1 A 45 45 GLY N N 2468 112.751 109.871 2.880 1
1 462 . 4 1 1 A 46 46 PRO HA H 2469 4.318 4.418 -0.100 1
1 469 . 4 1 1 A 46 46 PRO C C 2469 176.086 175.524 0.562 1
1 470 . 4 1 1 A 46 46 PRO CA C 2469 64.198 64.012 0.186 1
1 471 . 4 1 1 A 46 46 PRO CB C 2469 32.348 31.744 0.604 1
1 474 . 4 1 1 A 47 47 SER H H 2470 7.106 7.375 -0.269 1
1 475 . 4 1 1 A 47 47 SER HA H 2470 4.632 4.877 -0.245 1
1 478 . 4 1 1 A 47 47 SER C C 2470 172.969 172.760 0.209 1
1 479 . 4 1 1 A 47 47 SER CA C 2470 57.106 57.411 -0.305 1
1 480 . 4 1 1 A 47 47 SER CB C 2470 66.262 65.659 0.603 1
1 481 . 4 1 1 A 47 47 SER N N 2470 110.556 109.361 1.195 1
1 482 . 4 1 1 A 48 48 LYS H H 2471 8.534 8.318 0.216 1
1 483 . 4 1 1 A 48 48 LYS HA H 2471 4.486 4.485 0.001 1
1 492 . 4 1 1 A 48 48 LYS C C 2471 177.231 176.561 0.670 1
1 493 . 4 1 1 A 48 48 LYS CA C 2471 56.620 55.498 1.122 1
1 494 . 4 1 1 A 48 48 LYS CB C 2471 32.379 31.627 0.752 1
1 498 . 4 1 1 A 48 48 LYS N N 2471 124.055 122.627 1.428 1
1 499 . 4 1 1 A 49 49 VAL H H 2472 8.497 8.040 0.457 1
1 500 . 4 1 1 A 49 49 VAL HA H 2472 4.552 4.046 0.506 1
1 508 . 4 1 1 A 49 49 VAL C C 2472 175.292 175.789 -0.497 1
1 509 . 4 1 1 A 49 49 VAL CA C 2472 60.142 62.395 -2.253 1
1 510 . 4 1 1 A 49 49 VAL CB C 2472 33.464 32.456 1.008 1
1 513 . 4 1 1 A 49 49 VAL N N 2472 121.233 124.088 -2.855 1
1 514 . 4 1 1 A 50 50 LYS H H 2473 8.190 8.101 0.089 1
1 515 . 4 1 1 A 50 50 LYS HA H 2473 4.522 4.574 -0.052 1
1 518 . 4 1 1 A 50 50 LYS CA C 2473 55.952 56.193 -0.241 1
1 519 . 4 1 1 A 50 50 LYS CB C 2473 32.896 32.910 -0.014 1
1 520 . 4 1 1 A 50 50 LYS N N 2473 126.082 124.592 1.490 1
1 521 . 4 1 1 A 51 51 MET H H 2474 8.818 8.991 -0.173 1
1 522 . 4 1 1 A 51 51 MET HA H 2474 5.324 5.263 0.061 1
1 530 . 4 1 1 A 51 51 MET C C 2474 173.933 173.330 0.603 1
1 531 . 4 1 1 A 51 51 MET CA C 2474 54.848 54.267 0.581 1
1 532 . 4 1 1 A 51 51 MET CB C 2474 37.043 35.972 1.071 1
1 535 . 4 1 1 A 51 51 MET N N 2474 126.911 124.703 2.208 1
1 536 . 4 1 1 A 52 52 ASP H H 2475 9.095 9.055 0.040 1
1 537 . 4 1 1 A 52 52 ASP HA H 2475 4.947 5.484 -0.537 1
1 540 . 4 1 1 A 52 52 ASP C C 2475 173.923 174.338 -0.415 1
1 541 . 4 1 1 A 52 52 ASP CA C 2475 53.487 52.755 0.732 1
1 542 . 4 1 1 A 52 52 ASP CB C 2475 44.765 45.426 -0.661 1
1 543 . 4 1 1 A 52 52 ASP N N 2475 125.526 124.806 0.720 1
1 544 . 4 1 1 A 53 53 CYS H H 2476 8.606 8.728 -0.122 1
1 545 . 4 1 1 A 53 53 CYS HA H 2476 5.145 5.250 -0.105 1
1 548 . 4 1 1 A 53 53 CYS C C 2476 173.330 172.914 0.416 1
1 549 . 4 1 1 A 53 53 CYS CA C 2476 57.452 57.981 -0.529 1
1 550 . 4 1 1 A 53 53 CYS CB C 2476 28.108 31.494 -3.386 1
1 551 . 4 1 1 A 53 53 CYS N N 2476 124.317 119.090 5.227 1
1 552 . 4 1 1 A 54 54 GLN H H 2477 8.978 8.960 0.018 1
1 553 . 4 1 1 A 54 54 GLN HA H 2477 4.884 4.796 0.088 1
1 560 . 4 1 1 A 54 54 GLN C C 2477 174.854 174.638 0.216 1
1 561 . 4 1 1 A 54 54 GLN CA C 2477 53.891 55.091 -1.200 1
1 562 . 4 1 1 A 54 54 GLN CB C 2477 32.837 32.618 0.219 1
1 564 . 4 1 1 A 54 54 GLN N N 2477 127.074 124.618 2.456 1
1 566 . 4 1 1 A 55 55 GLU H H 2478 9.065 8.795 0.270 1
1 567 . 4 1 1 A 55 55 GLU HA H 2478 4.280 4.632 -0.352 1
1 572 . 4 1 1 A 55 55 GLU C C 2478 175.383 175.965 -0.582 1
1 573 . 4 1 1 A 55 55 GLU CA C 2478 57.516 56.120 1.396 1
1 574 . 4 1 1 A 55 55 GLU CB C 2478 30.346 30.370 -0.024 1
1 576 . 4 1 1 A 55 55 GLU N N 2478 125.186 123.747 1.439 1
1 577 . 4 1 1 A 56 56 CYS H H 2479 8.407 8.599 -0.192 1
1 578 . 4 1 1 A 56 56 CYS HA H 2479 5.056 4.587 0.469 1
1 581 . 4 1 1 A 56 56 CYS CA C 2479 55.858 56.950 -1.092 1
1 582 . 4 1 1 A 56 56 CYS CB C 2479 28.676 30.247 -1.571 1
1 583 . 4 1 1 A 56 56 CYS N N 2479 121.499 117.297 4.202 1
1 584 . 4 1 1 A 57 57 PRO HA H 2480 4.159 4.289 -0.130 1
1 591 . 4 1 1 A 57 57 PRO C C 2480 177.964 177.650 0.314 1
1 592 . 4 1 1 A 57 57 PRO CA C 2480 66.877 64.623 2.254 1
1 593 . 4 1 1 A 57 57 PRO CB C 2480 31.709 31.993 -0.284 1
1 596 . 4 1 1 A 58 58 GLU H H 2481 8.900 7.994 0.906 1
1 597 . 4 1 1 A 58 58 GLU HA H 2481 4.201 4.394 -0.193 1
1 602 . 4 1 1 A 58 58 GLU C C 2481 175.129 176.427 -1.298 1
1 603 . 4 1 1 A 58 58 GLU CA C 2481 57.883 56.446 1.437 1
1 604 . 4 1 1 A 58 58 GLU CB C 2481 29.991 30.122 -0.131 1
1 606 . 4 1 1 A 58 58 GLU N N 2481 115.316 117.913 -2.597 1
1 607 . 4 1 1 A 59 59 GLY H H 2482 7.527 7.492 0.035 1
1 608 . 4 1 1 A 59 59 GLY HA2 H 2482 4.935 3.931 1.004 1
1 609 . 4 1 1 A 59 59 GLY HA3 H 2482 3.381 4.044 -0.663 1
1 610 . 4 1 1 A 59 59 GLY CA C 2482 47.809 44.404 3.405 1
1 611 . 4 1 1 A 59 59 GLY N N 2482 110.079 108.153 1.926 1
1 612 . 4 1 1 A 60 60 TYR H H 2483 8.990 8.643 0.347 1
1 613 . 4 1 1 A 60 60 TYR HA H 2483 5.157 5.081 0.076 1
1 618 . 4 1 1 A 60 60 TYR C C 2483 175.096 174.575 0.521 1
1 619 . 4 1 1 A 60 60 TYR CA C 2483 57.375 56.980 0.395 1
1 620 . 4 1 1 A 60 60 TYR CB C 2483 43.153 40.351 2.802 1
1 622 . 4 1 1 A 60 60 TYR N N 2483 125.900 122.017 3.883 1
1 623 . 4 1 1 A 61 61 ARG H H 2484 9.557 8.871 0.686 1
1 624 . 4 1 1 A 61 61 ARG HA H 2484 4.858 4.621 0.237 1
1 631 . 4 1 1 A 61 61 ARG CA C 2484 55.016 55.757 -0.741 1
1 632 . 4 1 1 A 61 61 ARG CB C 2484 32.128 31.299 0.829 1
1 635 . 4 1 1 A 61 61 ARG N N 2484 124.847 126.149 -1.302 1
1 636 . 4 1 1 A 62 62 VAL H H 2485 9.046 8.908 0.138 1
1 637 . 4 1 1 A 62 62 VAL HA H 2485 4.675 4.703 -0.028 1
1 645 . 4 1 1 A 62 62 VAL C C 2485 173.837 174.698 -0.861 1
1 646 . 4 1 1 A 62 62 VAL CA C 2485 60.752 60.879 -0.127 1
1 647 . 4 1 1 A 62 62 VAL CB C 2485 32.459 33.763 -1.304 1
1 650 . 4 1 1 A 62 62 VAL N N 2485 132.205 126.363 5.842 1
1 651 . 4 1 1 A 63 63 THR H H 2486 8.474 8.740 -0.266 1
1 652 . 4 1 1 A 63 63 THR HA H 2486 5.392 5.334 0.058 1
1 657 . 4 1 1 A 63 63 THR C C 2486 173.675 173.514 0.161 1
1 658 . 4 1 1 A 63 63 THR CA C 2486 60.008 61.084 -1.076 1
1 659 . 4 1 1 A 63 63 THR CB C 2486 71.035 71.699 -0.664 1
1 661 . 4 1 1 A 63 63 THR N N 2486 121.216 122.606 -1.390 1
1 662 . 4 1 1 A 64 64 TYR H H 2487 9.409 8.855 0.554 1
1 663 . 4 1 1 A 64 64 TYR HA H 2487 5.617 5.652 -0.035 1
1 670 . 4 1 1 A 64 64 TYR C C 2487 172.847 172.724 0.123 1
1 671 . 4 1 1 A 64 64 TYR CA C 2487 55.557 55.666 -0.109 1
1 672 . 4 1 1 A 64 64 TYR CB C 2487 41.968 42.098 -0.130 1
1 675 . 4 1 1 A 64 64 TYR N N 2487 124.061 122.247 1.814 1
1 676 . 4 1 1 A 65 65 THR H H 2488 8.145 9.085 -0.940 1
1 677 . 4 1 1 A 65 65 THR HA H 2488 4.959 4.624 0.335 1
1 682 . 4 1 1 A 65 65 THR CA C 2488 58.532 59.161 -0.629 1
1 683 . 4 1 1 A 65 65 THR CB C 2488 70.141 70.200 -0.059 1
1 685 . 4 1 1 A 65 65 THR N N 2488 117.924 116.874 1.050 1
1 686 . 4 1 1 A 66 66 PRO HA H 2489 4.602 4.735 -0.133 1
1 693 . 4 1 1 A 66 66 PRO C C 2489 176.647 176.736 -0.089 1
1 694 . 4 1 1 A 66 66 PRO CA C 2489 61.442 62.379 -0.937 1
1 695 . 4 1 1 A 66 66 PRO CB C 2489 32.715 32.749 -0.034 1
1 698 . 4 1 1 A 67 67 MET H H 2490 8.832 8.078 0.754 1
1 699 . 4 1 1 A 67 67 MET HA H 2490 4.880 4.814 0.066 1
1 707 . 4 1 1 A 67 67 MET C C 2490 174.121 175.658 -1.537 1
1 708 . 4 1 1 A 67 67 MET CA C 2490 53.848 54.667 -0.819 1
1 709 . 4 1 1 A 67 67 MET CB C 2490 33.727 33.888 -0.161 1
1 712 . 4 1 1 A 67 67 MET N N 2490 119.212 117.757 1.455 1
1 713 . 4 1 1 A 68 68 ALA H H 2491 7.086 7.496 -0.410 1
1 714 . 4 1 1 A 68 68 ALA HA H 2491 4.851 4.859 -0.008 1
1 718 . 4 1 1 A 68 68 ALA CA C 2491 49.222 49.843 -0.621 1
1 719 . 4 1 1 A 68 68 ALA CB C 2491 20.600 22.148 -1.548 1
1 720 . 4 1 1 A 68 68 ALA N N 2491 120.363 121.546 -1.183 1
1 721 . 4 1 1 A 69 69 PRO HA H 2492 4.263 4.740 -0.477 1
1 728 . 4 1 1 A 69 69 PRO C C 2492 174.370 176.282 -1.912 1
1 729 . 4 1 1 A 69 69 PRO CA C 2492 62.555 62.905 -0.350 1
1 730 . 4 1 1 A 69 69 PRO CB C 2492 32.752 33.131 -0.379 1
1 733 . 4 1 1 A 70 70 GLY H H 2493 8.858 8.275 0.583 1
1 734 . 4 1 1 A 70 70 GLY HA2 H 2493 4.544 4.056 0.488 1
1 735 . 4 1 1 A 70 70 GLY HA3 H 2493 3.849 4.109 -0.260 1
1 736 . 4 1 1 A 70 70 GLY C C 2493 172.182 171.369 0.813 1
1 737 . 4 1 1 A 70 70 GLY CA C 2493 44.356 44.389 -0.033 1
1 738 . 4 1 1 A 70 70 GLY N N 2493 106.539 108.179 -1.640 1
1 739 . 4 1 1 A 71 71 SER H H 2494 8.490 8.372 0.118 1
1 740 . 4 1 1 A 71 71 SER HA H 2494 5.280 5.641 -0.361 1
1 743 . 4 1 1 A 71 71 SER C C 2494 173.512 172.477 1.035 1
1 744 . 4 1 1 A 71 71 SER CA C 2494 57.674 56.482 1.192 1
1 745 . 4 1 1 A 71 71 SER CB C 2494 63.799 65.066 -1.267 1
1 746 . 4 1 1 A 71 71 SER N N 2494 117.964 116.027 1.937 1
1 747 . 4 1 1 A 72 72 TYR H H 2495 9.320 9.508 -0.188 1
1 748 . 4 1 1 A 72 72 TYR HA H 2495 4.960 5.307 -0.347 1
1 755 . 4 1 1 A 72 72 TYR C C 2495 173.979 174.819 -0.840 1
1 756 . 4 1 1 A 72 72 TYR CA C 2495 56.384 56.672 -0.288 1
1 757 . 4 1 1 A 72 72 TYR CB C 2495 40.247 40.422 -0.175 1
1 760 . 4 1 1 A 72 72 TYR N N 2495 126.442 126.097 0.345 1
1 761 . 4 1 1 A 73 73 LEU H H 2496 9.019 8.941 0.078 1
1 762 . 4 1 1 A 73 73 LEU HA H 2496 5.209 4.879 0.330 1
1 772 . 4 1 1 A 73 73 LEU C C 2496 177.015 174.797 2.218 1
1 773 . 4 1 1 A 73 73 LEU CA C 2496 53.393 54.196 -0.803 1
1 774 . 4 1 1 A 73 73 LEU CB C 2496 43.918 43.347 0.571 1
1 778 . 4 1 1 A 73 73 LEU N N 2496 125.439 125.881 -0.442 1
1 779 . 4 1 1 A 74 74 ILE H H 2497 9.921 9.755 0.166 1
1 780 . 4 1 1 A 74 74 ILE HA H 2497 5.128 4.704 0.424 1
1 790 . 4 1 1 A 74 74 ILE C C 2497 175.730 174.967 0.763 1
1 791 . 4 1 1 A 74 74 ILE CA C 2497 60.930 60.289 0.641 1
1 792 . 4 1 1 A 74 74 ILE CB C 2497 39.488 37.584 1.904 1
1 796 . 4 1 1 A 74 74 ILE N N 2497 132.185 129.885 2.300 1
1 797 . 4 1 1 A 75 75 SER H H 2498 9.284 9.041 0.243 1
1 798 . 4 1 1 A 75 75 SER HA H 2498 5.111 5.016 0.095 1
1 801 . 4 1 1 A 75 75 SER C C 2498 173.449 173.384 0.065 1
1 802 . 4 1 1 A 75 75 SER CA C 2498 58.260 58.275 -0.015 1
1 803 . 4 1 1 A 75 75 SER CB C 2498 63.956 63.117 0.839 1
1 804 . 4 1 1 A 75 75 SER N N 2498 125.384 124.796 0.588 1
1 805 . 4 1 1 A 76 76 ILE H H 2499 9.861 8.961 0.900 1
1 806 . 4 1 1 A 76 76 ILE HA H 2499 4.814 4.654 0.160 1
1 816 . 4 1 1 A 76 76 ILE CA C 2499 61.034 61.102 -0.068 1
1 817 . 4 1 1 A 76 76 ILE CB C 2499 40.387 36.981 3.406 1
1 821 . 4 1 1 A 76 76 ILE N N 2499 129.414 127.372 2.042 1
1 822 . 4 1 1 A 77 77 LYS H H 2500 8.827 9.017 -0.190 1
1 823 . 4 1 1 A 77 77 LYS HA H 2500 5.254 5.164 0.090 1
1 832 . 4 1 1 A 77 77 LYS C C 2500 175.245 175.614 -0.369 1
1 833 . 4 1 1 A 77 77 LYS CA C 2500 54.388 55.005 -0.617 1
1 834 . 4 1 1 A 77 77 LYS CB C 2500 36.127 34.734 1.393 1
1 838 . 4 1 1 A 77 77 LYS N N 2500 126.922 127.303 -0.381 1
1 839 . 4 1 1 A 78 78 TYR H H 2501 8.408 9.110 -0.702 1
1 840 . 4 1 1 A 78 78 TYR HA H 2501 5.479 5.011 0.468 1
1 847 . 4 1 1 A 78 78 TYR C C 2501 174.792 175.566 -0.774 1
1 848 . 4 1 1 A 78 78 TYR CA C 2501 56.837 57.406 -0.569 1
1 849 . 4 1 1 A 78 78 TYR CB C 2501 44.008 42.326 1.682 1
1 852 . 4 1 1 A 78 78 TYR N N 2501 122.282 124.598 -2.316 1
1 853 . 4 1 1 A 79 79 GLY H H 2502 8.196 8.457 -0.261 1
1 854 . 4 1 1 A 79 79 GLY HA2 H 2502 4.040 3.596 0.444 1
1 855 . 4 1 1 A 79 79 GLY HA3 H 2502 3.465 3.773 -0.308 1
1 856 . 4 1 1 A 79 79 GLY C C 2502 173.932 173.767 0.165 1
1 857 . 4 1 1 A 79 79 GLY CA C 2502 45.741 46.147 -0.406 1
1 858 . 4 1 1 A 79 79 GLY N N 2502 113.451 113.618 -0.167 1
1 859 . 4 1 1 A 80 80 GLY H H 2503 7.589 8.347 -0.758 1
1 860 . 4 1 1 A 80 80 GLY HA2 H 2503 4.490 3.972 0.518 1
1 861 . 4 1 1 A 80 80 GLY HA3 H 2503 3.555 4.056 -0.501 1
1 862 . 4 1 1 A 80 80 GLY CA C 2503 43.540 44.105 -0.565 1
1 863 . 4 1 1 A 80 80 GLY N N 2503 107.293 107.248 0.045 1
1 864 . 4 1 1 A 81 81 PRO HA H 2504 4.320 4.339 -0.019 1
1 871 . 4 1 1 A 81 81 PRO C C 2504 175.311 175.392 -0.081 1
1 872 . 4 1 1 A 81 81 PRO CA C 2504 62.722 63.536 -0.814 1
1 873 . 4 1 1 A 81 81 PRO CB C 2504 29.297 31.893 -2.596 1
1 876 . 4 1 1 A 82 82 TYR H H 2505 7.778 7.344 0.434 1
1 877 . 4 1 1 A 82 82 TYR HA H 2505 4.791 4.991 -0.200 1
1 884 . 4 1 1 A 82 82 TYR C C 2505 175.086 175.913 -0.827 1
1 885 . 4 1 1 A 82 82 TYR CA C 2505 56.111 57.073 -0.962 1
1 886 . 4 1 1 A 82 82 TYR CB C 2505 39.483 40.445 -0.962 1
1 889 . 4 1 1 A 82 82 TYR N N 2505 123.973 121.164 2.809 1
1 890 . 4 1 1 A 83 83 HIS H H 2506 8.625 9.029 -0.404 1
1 891 . 4 1 1 A 83 83 HIS HA H 2506 4.583 4.858 -0.275 1
1 896 . 4 1 1 A 83 83 HIS C C 2506 178.161 176.085 2.076 1
1 897 . 4 1 1 A 83 83 HIS CA C 2506 58.241 57.723 0.518 1
1 898 . 4 1 1 A 83 83 HIS CB C 2506 33.132 30.581 2.551 1
1 901 . 4 1 1 A 83 83 HIS N N 2506 124.092 121.856 2.236 1
1 902 . 4 1 1 A 84 84 ILE H H 2507 8.327 8.603 -0.276 1
1 903 . 4 1 1 A 84 84 ILE HA H 2507 4.553 4.465 0.088 1
1 913 . 4 1 1 A 84 84 ILE C C 2507 176.523 176.278 0.245 1
1 914 . 4 1 1 A 84 84 ILE CA C 2507 60.791 60.164 0.627 1
1 915 . 4 1 1 A 84 84 ILE CB C 2507 39.162 39.696 -0.534 1
1 919 . 4 1 1 A 84 84 ILE N N 2507 117.355 120.134 -2.779 1
1 920 . 4 1 1 A 85 85 GLY H H 2508 9.130 8.397 0.733 1
1 921 . 4 1 1 A 85 85 GLY HA2 H 2508 3.883 3.718 0.165 1
1 922 . 4 1 1 A 85 85 GLY HA3 H 2508 3.800 3.735 0.065 1
1 923 . 4 1 1 A 85 85 GLY C C 2508 174.438 175.434 -0.996 1
1 924 . 4 1 1 A 85 85 GLY CA C 2508 47.673 46.738 0.935 1
1 925 . 4 1 1 A 85 85 GLY N N 2508 111.346 109.633 1.713 1
1 926 . 4 1 1 A 86 86 GLY H H 2509 8.236 8.232 0.004 1
1 927 . 4 1 1 A 86 86 GLY HA2 H 2509 3.893 3.907 -0.014 1
1 928 . 4 1 1 A 86 86 GLY HA3 H 2509 3.161 3.936 -0.775 1
1 929 . 4 1 1 A 86 86 GLY C C 2509 171.837 173.495 -1.658 1
1 930 . 4 1 1 A 86 86 GLY CA C 2509 44.844 45.329 -0.485 1
1 931 . 4 1 1 A 86 86 GLY N N 2509 115.594 117.799 -2.205 1
1 932 . 4 1 1 A 87 87 SER H H 2510 7.385 7.822 -0.437 1
1 933 . 4 1 1 A 87 87 SER HA H 2510 4.217 4.101 0.116 1
1 936 . 4 1 1 A 87 87 SER CA C 2510 54.783 55.312 -0.529 1
1 937 . 4 1 1 A 87 87 SER CB C 2510 62.683 64.109 -1.426 1
1 938 . 4 1 1 A 87 87 SER N N 2510 112.859 116.843 -3.984 1
1 939 . 4 1 1 A 88 88 PRO HA H 2511 5.532 4.782 0.750 1
1 946 . 4 1 1 A 88 88 PRO C C 2511 175.870 175.496 0.374 1
1 947 . 4 1 1 A 88 88 PRO CA C 2511 62.379 62.295 0.084 1
1 948 . 4 1 1 A 88 88 PRO CB C 2511 33.639 32.437 1.202 1
1 951 . 4 1 1 A 89 89 PHE H H 2512 9.359 8.856 0.503 1
1 952 . 4 1 1 A 89 89 PHE HA H 2512 4.467 4.839 -0.372 1
1 960 . 4 1 1 A 89 89 PHE C C 2512 175.152 175.196 -0.044 1
1 961 . 4 1 1 A 89 89 PHE CA C 2512 57.401 57.300 0.101 1
1 962 . 4 1 1 A 89 89 PHE CB C 2512 40.843 40.731 0.112 1
1 966 . 4 1 1 A 89 89 PHE N N 2512 124.789 119.630 5.159 1
1 967 . 4 1 1 A 90 90 LYS H H 2513 8.772 8.909 -0.137 1
1 968 . 4 1 1 A 90 90 LYS HA H 2513 4.941 4.859 0.082 1
1 973 . 4 1 1 A 90 90 LYS C C 2513 174.183 175.344 -1.161 1
1 974 . 4 1 1 A 90 90 LYS CA C 2513 55.749 55.453 0.296 1
1 975 . 4 1 1 A 90 90 LYS CB C 2513 32.817 33.497 -0.680 1
1 978 . 4 1 1 A 90 90 LYS N N 2513 125.133 121.836 3.297 1
1 979 . 4 1 1 A 91 91 ALA H H 2514 9.158 9.357 -0.199 1
1 980 . 4 1 1 A 91 91 ALA HA H 2514 4.510 5.024 -0.514 1
1 984 . 4 1 1 A 91 91 ALA C C 2514 176.561 176.070 0.491 1
1 985 . 4 1 1 A 91 91 ALA CA C 2514 50.528 50.744 -0.216 1
1 986 . 4 1 1 A 91 91 ALA CB C 2514 20.653 20.450 0.203 1
1 987 . 4 1 1 A 91 91 ALA N N 2514 131.989 127.699 4.290 1
1 988 . 4 1 1 A 92 92 LYS H H 2515 8.186 8.871 -0.685 1
1 989 . 4 1 1 A 92 92 LYS HA H 2515 4.926 4.873 0.053 1
1 998 . 4 1 1 A 92 92 LYS C C 2515 175.177 175.956 -0.779 1
1 999 . 4 1 1 A 92 92 LYS CA C 2515 55.725 56.124 -0.399 1
1 1000 . 4 1 1 A 92 92 LYS CB C 2515 33.765 33.223 0.542 1
1 1004 . 4 1 1 A 92 92 LYS N N 2515 124.887 123.745 1.142 1
1 1005 . 4 1 1 A 93 93 VAL H H 2516 9.362 9.295 0.067 1
1 1006 . 4 1 1 A 93 93 VAL HA H 2516 5.161 5.181 -0.020 1
1 1014 . 4 1 1 A 93 93 VAL C C 2516 176.988 175.575 1.413 1
1 1015 . 4 1 1 A 93 93 VAL CA C 2516 60.523 61.202 -0.679 1
1 1016 . 4 1 1 A 93 93 VAL CB C 2516 33.291 34.773 -1.482 1
1 1019 . 4 1 1 A 93 93 VAL N N 2516 129.943 124.499 5.444 1
1 1020 . 4 1 1 A 94 94 THR H H 2517 8.614 8.657 -0.043 1
1 1021 . 4 1 1 A 94 94 THR HA H 2517 4.902 4.883 0.019 1
1 1026 . 4 1 1 A 94 94 THR C C 2517 172.759 173.322 -0.563 1
1 1027 . 4 1 1 A 94 94 THR CA C 2517 60.121 59.822 0.299 1
1 1028 . 4 1 1 A 94 94 THR CB C 2517 71.072 71.551 -0.479 1
1 1030 . 4 1 1 A 94 94 THR N N 2517 122.032 116.657 5.375 1
1 1031 . 4 1 1 A 95 95 GLY H H 2518 8.280 8.429 -0.149 1
1 1032 . 4 1 1 A 95 95 GLY HA2 H 2518 3.852 4.142 -0.290 1
1 1033 . 4 1 1 A 95 95 GLY HA3 H 2518 4.846 4.146 0.700 1
1 1034 . 4 1 1 A 95 95 GLY CA C 2518 43.955 44.529 -0.574 1
1 1035 . 4 1 1 A 95 95 GLY N N 2518 107.949 108.268 -0.319 1
1 1036 . 4 1 1 A 96 96 PRO HA H 2519 4.449 4.635 -0.186 1
1 1043 . 4 1 1 A 96 96 PRO C C 2519 176.892 176.618 0.274 1
1 1044 . 4 1 1 A 96 96 PRO CA C 2519 62.062 62.781 -0.719 1
1 1045 . 4 1 1 A 96 96 PRO CB C 2519 32.286 32.106 0.180 1
1 1048 . 4 1 1 A 97 97 ARG H H 2520 8.651 8.520 0.131 1
1 1049 . 4 1 1 A 97 97 ARG HA H 2520 4.348 4.334 0.014 1
1 1056 . 4 1 1 A 97 97 ARG C C 2520 176.236 177.031 -0.795 1
1 1057 . 4 1 1 A 97 97 ARG CA C 2520 57.587 56.516 1.071 1
1 1058 . 4 1 1 A 97 97 ARG CB C 2520 30.472 30.700 -0.228 1
1 1061 . 4 1 1 A 97 97 ARG N N 2520 120.781 122.066 -1.285 1
1 1062 . 4 1 1 A 98 98 LEU H H 2521 8.545 8.811 -0.266 1
1 1063 . 4 1 1 A 98 98 LEU HA H 2521 4.577 4.081 0.496 1
1 1073 . 4 1 1 A 98 98 LEU C C 2521 175.880 178.636 -2.756 1
1 1074 . 4 1 1 A 98 98 LEU CA C 2521 55.068 57.341 -2.273 1
1 1075 . 4 1 1 A 98 98 LEU CB C 2521 43.082 41.534 1.548 1
1 1079 . 4 1 1 A 98 98 LEU N N 2521 128.715 126.746 1.969 1
1 4 . 5 1 1 A 2 2 ALA HA H -2 4.374 4.427 -0.053 1
1 8 . 5 1 1 A 2 2 ALA C C -2 177.865 177.866 -0.001 1
1 9 . 5 1 1 A 2 2 ALA CA C -2 52.670 52.124 0.546 1
1 10 . 5 1 1 A 2 2 ALA CB C -2 19.508 19.139 0.369 1
1 32 . 5 1 1 A 5 5 ASP H H 2428 8.300 8.860 -0.560 1
1 33 . 5 1 1 A 5 5 ASP HA H 2428 5.082 5.267 -0.185 1
1 36 . 5 1 1 A 5 5 ASP CA C 2428 51.517 50.968 0.549 1
1 37 . 5 1 1 A 5 5 ASP CB C 2428 42.244 44.586 -2.342 1
1 38 . 5 1 1 A 5 5 ASP N N 2428 122.879 120.174 2.705 1
1 39 . 5 1 1 A 6 6 PRO HA H 2429 4.340 4.382 -0.042 1
1 46 . 5 1 1 A 6 6 PRO C C 2429 178.266 177.682 0.584 1
1 47 . 5 1 1 A 6 6 PRO CA C 2429 64.494 64.266 0.228 1
1 48 . 5 1 1 A 6 6 PRO CB C 2429 31.841 31.988 -0.147 1
1 51 . 5 1 1 A 7 7 GLY H H 2430 8.686 8.564 0.122 1
1 52 . 5 1 1 A 7 7 GLY HA2 H 2430 4.116 3.886 0.230 1
1 53 . 5 1 1 A 7 7 GLY HA3 H 2430 3.868 3.890 -0.022 1
1 54 . 5 1 1 A 7 7 GLY C C 2430 174.567 175.409 -0.842 1
1 55 . 5 1 1 A 7 7 GLY CA C 2430 46.038 46.536 -0.498 1
1 56 . 5 1 1 A 7 7 GLY N N 2430 107.655 107.152 0.503 1
1 57 . 5 1 1 A 8 8 LEU H H 2431 7.692 7.480 0.212 1
1 58 . 5 1 1 A 8 8 LEU HA H 2431 4.507 4.391 0.116 1
1 68 . 5 1 1 A 8 8 LEU C C 2431 176.876 177.428 -0.552 1
1 69 . 5 1 1 A 8 8 LEU CA C 2431 54.307 56.135 -1.828 1
1 70 . 5 1 1 A 8 8 LEU CB C 2431 42.879 42.808 0.071 1
1 74 . 5 1 1 A 8 8 LEU N N 2431 120.022 119.737 0.285 1
1 75 . 5 1 1 A 9 9 VAL H H 2432 7.378 7.579 -0.201 1
1 76 . 5 1 1 A 9 9 VAL HA H 2432 4.154 3.916 0.238 1
1 84 . 5 1 1 A 9 9 VAL C C 2432 174.703 175.675 -0.972 1
1 85 . 5 1 1 A 9 9 VAL CA C 2432 62.387 63.075 -0.688 1
1 86 . 5 1 1 A 9 9 VAL CB C 2432 32.519 31.445 1.074 1
1 89 . 5 1 1 A 9 9 VAL N N 2432 123.902 119.427 4.475 1
1 90 . 5 1 1 A 10 10 SER H H 2433 8.201 8.730 -0.529 1
1 91 . 5 1 1 A 10 10 SER HA H 2433 5.136 5.319 -0.183 1
1 94 . 5 1 1 A 10 10 SER CA C 2433 56.554 57.168 -0.614 1
1 95 . 5 1 1 A 10 10 SER CB C 2433 66.763 66.941 -0.178 1
1 96 . 5 1 1 A 10 10 SER N N 2433 121.921 122.946 -1.025 1
1 97 . 5 1 1 A 11 11 ALA H H 2434 8.670 8.146 0.524 1
1 98 . 5 1 1 A 11 11 ALA HA H 2434 5.632 5.167 0.465 1
1 102 . 5 1 1 A 11 11 ALA C C 2434 175.459 174.623 0.836 1
1 103 . 5 1 1 A 11 11 ALA CA C 2434 50.575 50.733 -0.158 1
1 104 . 5 1 1 A 11 11 ALA CB C 2434 23.111 23.130 -0.019 1
1 105 . 5 1 1 A 11 11 ALA N N 2434 124.828 122.365 2.463 1
1 106 . 5 1 1 A 12 12 TYR H H 2435 8.609 8.647 -0.038 1
1 107 . 5 1 1 A 12 12 TYR HA H 2435 4.879 5.094 -0.215 1
1 114 . 5 1 1 A 12 12 TYR C C 2435 173.645 174.523 -0.878 1
1 115 . 5 1 1 A 12 12 TYR CA C 2435 56.268 56.735 -0.467 1
1 116 . 5 1 1 A 12 12 TYR CB C 2435 39.522 42.541 -3.019 1
1 119 . 5 1 1 A 12 12 TYR N N 2435 118.305 119.382 -1.077 1
1 120 . 5 1 1 A 13 13 GLY H H 2436 8.655 8.480 0.175 1
1 121 . 5 1 1 A 13 13 GLY HA2 H 2436 4.943 4.287 0.656 1
1 122 . 5 1 1 A 13 13 GLY HA3 H 2436 4.028 4.338 -0.310 1
1 123 . 5 1 1 A 13 13 GLY C C 2436 175.334 174.991 0.343 1
1 124 . 5 1 1 A 13 13 GLY CA C 2436 44.389 44.386 0.003 1
1 125 . 5 1 1 A 13 13 GLY N N 2436 110.710 110.286 0.424 1
1 126 . 5 1 1 A 14 14 ALA H H 2437 8.939 8.750 0.189 1
1 127 . 5 1 1 A 14 14 ALA HA H 2437 4.276 4.087 0.189 1
1 131 . 5 1 1 A 14 14 ALA C C 2437 180.524 179.298 1.226 1
1 132 . 5 1 1 A 14 14 ALA CA C 2437 55.551 55.085 0.466 1
1 133 . 5 1 1 A 14 14 ALA CB C 2437 18.411 18.441 -0.030 1
1 134 . 5 1 1 A 14 14 ALA N N 2437 126.973 123.691 3.282 1
1 135 . 5 1 1 A 15 15 GLY H H 2438 8.933 8.794 0.139 1
1 136 . 5 1 1 A 15 15 GLY HA2 H 2438 4.531 3.951 0.580 1
1 137 . 5 1 1 A 15 15 GLY HA3 H 2438 3.576 4.206 -0.630 1
1 138 . 5 1 1 A 15 15 GLY C C 2438 174.323 175.542 -1.219 1
1 139 . 5 1 1 A 15 15 GLY CA C 2438 46.855 47.054 -0.199 1
1 140 . 5 1 1 A 15 15 GLY N N 2438 104.803 105.328 -0.525 1
1 141 . 5 1 1 A 16 16 LEU H H 2439 7.529 7.626 -0.097 1
1 142 . 5 1 1 A 16 16 LEU HA H 2439 3.768 3.840 -0.072 1
1 152 . 5 1 1 A 16 16 LEU C C 2439 176.388 178.694 -2.306 1
1 153 . 5 1 1 A 16 16 LEU CA C 2439 56.137 57.267 -1.130 1
1 154 . 5 1 1 A 16 16 LEU CB C 2439 41.621 41.247 0.374 1
1 158 . 5 1 1 A 16 16 LEU N N 2439 119.633 122.201 -2.568 1
1 159 . 5 1 1 A 17 17 GLU H H 2440 7.505 7.882 -0.377 1
1 160 . 5 1 1 A 17 17 GLU HA H 2440 4.663 4.357 0.306 1
1 165 . 5 1 1 A 17 17 GLU C C 2440 178.126 177.413 0.713 1
1 166 . 5 1 1 A 17 17 GLU CA C 2440 56.447 56.620 -0.173 1
1 167 . 5 1 1 A 17 17 GLU CB C 2440 31.485 30.679 0.806 1
1 169 . 5 1 1 A 17 17 GLU N N 2440 114.368 116.111 -1.743 1
1 170 . 5 1 1 A 18 18 GLY H H 2441 7.921 7.482 0.439 1
1 171 . 5 1 1 A 18 18 GLY HA2 H 2441 4.889 4.103 0.786 1
1 172 . 5 1 1 A 18 18 GLY HA3 H 2441 3.707 4.128 -0.421 1
1 173 . 5 1 1 A 18 18 GLY C C 2441 170.965 172.371 -1.406 1
1 174 . 5 1 1 A 18 18 GLY CA C 2441 45.549 44.074 1.475 1
1 175 . 5 1 1 A 18 18 GLY N N 2441 109.165 106.604 2.561 1
1 176 . 5 1 1 A 19 19 GLY H H 2442 7.540 7.808 -0.268 1
1 177 . 5 1 1 A 19 19 GLY HA2 H 2442 4.086 4.203 -0.117 1
1 178 . 5 1 1 A 19 19 GLY HA3 H 2442 4.086 4.233 -0.147 1
1 179 . 5 1 1 A 19 19 GLY C C 2442 171.051 171.580 -0.529 1
1 180 . 5 1 1 A 19 19 GLY CA C 2442 44.937 46.173 -1.236 1
1 181 . 5 1 1 A 19 19 GLY N N 2442 105.460 108.177 -2.717 1
1 182 . 5 1 1 A 20 20 VAL H H 2443 8.899 8.301 0.598 1
1 183 . 5 1 1 A 20 20 VAL HA H 2443 5.062 4.741 0.321 1
1 191 . 5 1 1 A 20 20 VAL C C 2443 176.623 175.835 0.788 1
1 192 . 5 1 1 A 20 20 VAL CA C 2443 60.197 61.688 -1.491 1
1 193 . 5 1 1 A 20 20 VAL CB C 2443 35.107 33.242 1.865 1
1 196 . 5 1 1 A 20 20 VAL N N 2443 122.753 121.212 1.541 1
1 197 . 5 1 1 A 21 21 THR H H 2444 8.630 8.621 0.009 1
1 198 . 5 1 1 A 21 21 THR HA H 2444 3.773 4.292 -0.519 1
1 203 . 5 1 1 A 21 21 THR C C 2444 175.646 174.859 0.787 1
1 204 . 5 1 1 A 21 21 THR CA C 2444 62.732 62.212 0.520 1
1 205 . 5 1 1 A 21 21 THR CB C 2444 68.925 69.261 -0.336 1
1 207 . 5 1 1 A 21 21 THR N N 2444 118.179 119.249 -1.070 1
1 208 . 5 1 1 A 22 22 GLY H H 2445 8.736 8.847 -0.111 1
1 209 . 5 1 1 A 22 22 GLY HA2 H 2445 3.412 3.917 -0.505 1
1 210 . 5 1 1 A 22 22 GLY HA3 H 2445 4.061 3.918 0.143 1
1 211 . 5 1 1 A 22 22 GLY C C 2445 172.973 173.366 -0.393 1
1 212 . 5 1 1 A 22 22 GLY CA C 2445 45.577 45.570 0.007 1
1 213 . 5 1 1 A 22 22 GLY N N 2445 107.888 112.950 -5.062 1
1 214 . 5 1 1 A 23 23 ASN H H 2446 7.877 7.496 0.381 1
1 215 . 5 1 1 A 23 23 ASN HA H 2446 5.253 5.196 0.057 1
1 220 . 5 1 1 A 23 23 ASN CA C 2446 49.740 49.737 0.003 1
1 221 . 5 1 1 A 23 23 ASN CB C 2446 40.198 40.235 -0.037 1
1 222 . 5 1 1 A 23 23 ASN N N 2446 120.684 119.123 1.561 1
1 224 . 5 1 1 A 24 24 PRO HA H 2447 4.525 4.830 -0.305 1
1 231 . 5 1 1 A 24 24 PRO CA C 2447 62.766 62.460 0.306 1
1 232 . 5 1 1 A 24 24 PRO CB C 2447 31.732 32.464 -0.732 1
1 235 . 5 1 1 A 25 25 ALA H H 2448 9.178 8.117 1.061 1
1 236 . 5 1 1 A 25 25 ALA HA H 2448 4.614 4.914 -0.300 1
1 240 . 5 1 1 A 25 25 ALA C C 2448 175.503 175.640 -0.137 1
1 241 . 5 1 1 A 25 25 ALA CA C 2448 50.526 50.391 0.135 1
1 242 . 5 1 1 A 25 25 ALA CB C 2448 20.458 22.764 -2.306 1
1 243 . 5 1 1 A 25 25 ALA N N 2448 132.079 121.174 10.905 1
1 244 . 5 1 1 A 26 26 GLU H H 2449 8.813 8.999 -0.186 1
1 245 . 5 1 1 A 26 26 GLU HA H 2449 5.830 5.299 0.531 1
1 250 . 5 1 1 A 26 26 GLU C C 2449 176.272 174.681 1.591 1
1 251 . 5 1 1 A 26 26 GLU CA C 2449 54.376 54.453 -0.077 1
1 252 . 5 1 1 A 26 26 GLU CB C 2449 35.463 33.950 1.513 1
1 254 . 5 1 1 A 26 26 GLU N N 2449 120.079 118.733 1.346 1
1 255 . 5 1 1 A 27 27 PHE H H 2450 8.782 9.002 -0.220 1
1 256 . 5 1 1 A 27 27 PHE HA H 2450 5.021 5.160 -0.139 1
1 264 . 5 1 1 A 27 27 PHE C C 2450 171.205 172.366 -1.161 1
1 265 . 5 1 1 A 27 27 PHE CA C 2450 56.852 56.230 0.622 1
1 266 . 5 1 1 A 27 27 PHE CB C 2450 41.080 40.946 0.134 1
1 270 . 5 1 1 A 27 27 PHE N N 2450 118.670 116.783 1.887 1
1 271 . 5 1 1 A 28 28 VAL H H 2451 8.961 9.000 -0.039 1
1 272 . 5 1 1 A 28 28 VAL HA H 2451 4.761 4.697 0.064 1
1 280 . 5 1 1 A 28 28 VAL C C 2451 174.673 175.443 -0.770 1
1 281 . 5 1 1 A 28 28 VAL CA C 2451 60.619 60.739 -0.120 1
1 282 . 5 1 1 A 28 28 VAL CB C 2451 35.484 34.858 0.626 1
1 285 . 5 1 1 A 28 28 VAL N N 2451 121.552 119.393 2.159 1
1 286 . 5 1 1 A 29 29 VAL H H 2452 9.294 9.181 0.113 1
1 287 . 5 1 1 A 29 29 VAL HA H 2452 4.363 4.317 0.046 1
1 295 . 5 1 1 A 29 29 VAL C C 2452 174.218 175.175 -0.957 1
1 296 . 5 1 1 A 29 29 VAL CA C 2452 61.526 62.670 -1.144 1
1 297 . 5 1 1 A 29 29 VAL CB C 2452 32.666 31.116 1.550 1
1 300 . 5 1 1 A 29 29 VAL N N 2452 125.585 128.239 -2.654 1
1 301 . 5 1 1 A 30 30 ASN H H 2453 9.465 8.932 0.533 1
1 302 . 5 1 1 A 30 30 ASN HA H 2453 5.096 5.045 0.051 1
1 307 . 5 1 1 A 30 30 ASN C C 2453 176.216 176.070 0.146 1
1 308 . 5 1 1 A 30 30 ASN CA C 2453 52.011 52.814 -0.803 1
1 309 . 5 1 1 A 30 30 ASN CB C 2453 39.057 38.559 0.498 1
1 310 . 5 1 1 A 30 30 ASN N N 2453 127.724 127.116 0.608 1
1 312 . 5 1 1 A 31 31 THR H H 2454 8.915 8.414 0.501 1
1 313 . 5 1 1 A 31 31 THR HA H 2454 4.342 4.407 -0.065 1
1 318 . 5 1 1 A 31 31 THR C C 2454 176.816 175.642 1.174 1
1 319 . 5 1 1 A 31 31 THR CA C 2454 61.117 61.849 -0.732 1
1 320 . 5 1 1 A 31 31 THR CB C 2454 68.209 69.869 -1.660 1
1 322 . 5 1 1 A 31 31 THR N N 2454 117.783 116.612 1.171 1
1 323 . 5 1 1 A 32 32 SER H H 2455 8.454 8.520 -0.066 1
1 324 . 5 1 1 A 32 32 SER HA H 2455 4.155 4.255 -0.100 1
1 327 . 5 1 1 A 32 32 SER C C 2455 175.458 176.160 -0.702 1
1 328 . 5 1 1 A 32 32 SER CA C 2455 62.148 61.154 0.994 1
1 329 . 5 1 1 A 32 32 SER CB C 2455 63.476 62.854 0.622 1
1 330 . 5 1 1 A 32 32 SER N N 2455 121.781 118.146 3.635 1
1 331 . 5 1 1 A 33 33 ASN H H 2456 8.845 8.255 0.590 1
1 332 . 5 1 1 A 33 33 ASN HA H 2456 5.064 4.577 0.487 1
1 337 . 5 1 1 A 33 33 ASN C C 2456 174.674 175.995 -1.321 1
1 338 . 5 1 1 A 33 33 ASN CA C 2456 53.067 54.996 -1.929 1
1 339 . 5 1 1 A 33 33 ASN CB C 2456 39.632 38.333 1.299 1
1 340 . 5 1 1 A 33 33 ASN N N 2456 120.176 119.502 0.674 1
1 342 . 5 1 1 A 34 34 ALA H H 2457 7.714 7.897 -0.183 1
1 343 . 5 1 1 A 34 34 ALA HA H 2457 4.482 4.521 -0.039 1
1 347 . 5 1 1 A 34 34 ALA C C 2457 177.582 177.706 -0.124 1
1 348 . 5 1 1 A 34 34 ALA CA C 2457 52.521 53.044 -0.523 1
1 349 . 5 1 1 A 34 34 ALA CB C 2457 22.252 21.182 1.070 1
1 350 . 5 1 1 A 34 34 ALA N N 2457 123.065 120.229 2.836 1
1 351 . 5 1 1 A 35 35 GLY H H 2458 8.195 7.811 0.384 1
1 352 . 5 1 1 A 35 35 GLY HA2 H 2458 4.246 4.126 0.120 1
1 353 . 5 1 1 A 35 35 GLY HA3 H 2458 3.902 4.146 -0.244 1
1 354 . 5 1 1 A 35 35 GLY C C 2458 173.360 172.816 0.544 1
1 355 . 5 1 1 A 35 35 GLY CA C 2458 44.486 43.972 0.514 1
1 356 . 5 1 1 A 35 35 GLY N N 2458 108.472 103.118 5.354 1
1 357 . 5 1 1 A 36 36 ALA H H 2459 8.430 8.393 0.037 1
1 358 . 5 1 1 A 36 36 ALA HA H 2459 4.472 4.801 -0.329 1
1 362 . 5 1 1 A 36 36 ALA C C 2459 176.968 177.463 -0.495 1
1 363 . 5 1 1 A 36 36 ALA CA C 2459 52.695 51.796 0.899 1
1 364 . 5 1 1 A 36 36 ALA CB C 2459 19.360 20.035 -0.675 1
1 365 . 5 1 1 A 36 36 ALA N N 2459 126.012 123.207 2.805 1
1 366 . 5 1 1 A 37 37 GLY H H 2460 7.781 8.383 -0.602 1
1 367 . 5 1 1 A 37 37 GLY HA2 H 2460 3.856 4.009 -0.153 1
1 368 . 5 1 1 A 37 37 GLY HA3 H 2460 3.164 4.095 -0.931 1
1 369 . 5 1 1 A 37 37 GLY C C 2460 170.730 171.610 -0.880 1
1 370 . 5 1 1 A 37 37 GLY CA C 2460 44.747 45.225 -0.478 1
1 371 . 5 1 1 A 37 37 GLY N N 2460 109.493 107.521 1.972 1
1 372 . 5 1 1 A 38 38 ALA H H 2461 8.055 7.958 0.097 1
1 373 . 5 1 1 A 38 38 ALA HA H 2461 4.389 4.581 -0.192 1
1 377 . 5 1 1 A 38 38 ALA C C 2461 176.609 176.276 0.333 1
1 378 . 5 1 1 A 38 38 ALA CA C 2461 51.419 51.302 0.117 1
1 379 . 5 1 1 A 38 38 ALA CB C 2461 19.665 19.804 -0.139 1
1 380 . 5 1 1 A 38 38 ALA N N 2461 121.997 122.787 -0.790 1
1 381 . 5 1 1 A 39 39 LEU H H 2462 8.597 8.537 0.060 1
1 382 . 5 1 1 A 39 39 LEU HA H 2462 5.022 5.066 -0.044 1
1 392 . 5 1 1 A 39 39 LEU C C 2462 175.883 175.419 0.464 1
1 393 . 5 1 1 A 39 39 LEU CA C 2462 53.907 53.446 0.461 1
1 394 . 5 1 1 A 39 39 LEU CB C 2462 44.576 44.811 -0.235 1
1 398 . 5 1 1 A 39 39 LEU N N 2462 126.664 124.808 1.856 1
1 399 . 5 1 1 A 40 40 SER H H 2463 8.898 9.067 -0.169 1
1 400 . 5 1 1 A 40 40 SER HA H 2463 4.732 4.744 -0.012 1
1 403 . 5 1 1 A 40 40 SER C C 2463 172.984 172.826 0.158 1
1 404 . 5 1 1 A 40 40 SER CA C 2463 56.730 57.060 -0.330 1
1 405 . 5 1 1 A 40 40 SER CB C 2463 64.648 64.263 0.385 1
1 406 . 5 1 1 A 40 40 SER N N 2463 122.932 121.863 1.069 1
1 407 . 5 1 1 A 41 41 VAL H H 2464 8.538 7.505 1.033 1
1 408 . 5 1 1 A 41 41 VAL HA H 2464 5.131 4.201 0.930 1
1 416 . 5 1 1 A 41 41 VAL C C 2464 174.812 174.727 0.085 1
1 417 . 5 1 1 A 41 41 VAL CA C 2464 60.784 62.876 -2.092 1
1 418 . 5 1 1 A 41 41 VAL CB C 2464 34.262 32.136 2.126 1
1 420 . 5 1 1 A 41 41 VAL N N 2464 129.161 123.417 5.744 1
1 421 . 5 1 1 A 42 42 THR H H 2465 8.807 8.903 -0.096 1
1 422 . 5 1 1 A 42 42 THR HA H 2465 4.573 5.134 -0.561 1
1 427 . 5 1 1 A 42 42 THR CA C 2465 60.408 61.351 -0.943 1
1 428 . 5 1 1 A 42 42 THR CB C 2465 71.764 72.381 -0.617 1
1 430 . 5 1 1 A 42 42 THR N N 2465 120.898 124.386 -3.488 1
1 431 . 5 1 1 A 43 43 ILE H H 2466 8.648 8.730 -0.082 1
1 432 . 5 1 1 A 43 43 ILE HA H 2466 4.854 5.111 -0.257 1
1 442 . 5 1 1 A 43 43 ILE C C 2466 174.073 174.337 -0.264 1
1 443 . 5 1 1 A 43 43 ILE CA C 2466 61.184 59.648 1.536 1
1 444 . 5 1 1 A 43 43 ILE CB C 2466 39.516 40.642 -1.126 1
1 448 . 5 1 1 A 43 43 ILE N N 2466 124.810 125.691 -0.881 1
1 449 . 5 1 1 A 44 44 ASP H H 2467 8.821 8.944 -0.123 1
1 450 . 5 1 1 A 44 44 ASP HA H 2467 5.217 5.665 -0.448 1
1 453 . 5 1 1 A 44 44 ASP C C 2467 175.002 174.977 0.025 1
1 454 . 5 1 1 A 44 44 ASP CA C 2467 52.998 53.016 -0.018 1
1 455 . 5 1 1 A 44 44 ASP CB C 2467 44.728 45.236 -0.508 1
1 456 . 5 1 1 A 44 44 ASP N N 2467 129.093 127.307 1.786 1
1 457 . 5 1 1 A 45 45 GLY H H 2468 8.535 8.327 0.208 1
1 458 . 5 1 1 A 45 45 GLY HA2 H 2468 3.954 3.693 0.261 1
1 459 . 5 1 1 A 45 45 GLY HA3 H 2468 3.561 4.043 -0.482 1
1 460 . 5 1 1 A 45 45 GLY CA C 2468 45.659 45.257 0.402 1
1 461 . 5 1 1 A 45 45 GLY N N 2468 112.751 109.788 2.963 1
1 462 . 5 1 1 A 46 46 PRO HA H 2469 4.318 4.315 0.003 1
1 469 . 5 1 1 A 46 46 PRO C C 2469 176.086 176.091 -0.005 1
1 470 . 5 1 1 A 46 46 PRO CA C 2469 64.198 63.875 0.323 1
1 471 . 5 1 1 A 46 46 PRO CB C 2469 32.348 31.840 0.508 1
1 474 . 5 1 1 A 47 47 SER H H 2470 7.106 7.458 -0.352 1
1 475 . 5 1 1 A 47 47 SER HA H 2470 4.632 4.623 0.009 1
1 478 . 5 1 1 A 47 47 SER C C 2470 172.969 173.068 -0.099 1
1 479 . 5 1 1 A 47 47 SER CA C 2470 57.106 56.103 1.003 1
1 480 . 5 1 1 A 47 47 SER CB C 2470 66.262 65.008 1.254 1
1 481 . 5 1 1 A 47 47 SER N N 2470 110.556 111.967 -1.411 1
1 482 . 5 1 1 A 48 48 LYS H H 2471 8.534 8.329 0.205 1
1 483 . 5 1 1 A 48 48 LYS HA H 2471 4.486 4.671 -0.185 1
1 492 . 5 1 1 A 48 48 LYS C C 2471 177.231 175.918 1.313 1
1 493 . 5 1 1 A 48 48 LYS CA C 2471 56.620 56.328 0.292 1
1 494 . 5 1 1 A 48 48 LYS CB C 2471 32.379 34.042 -1.663 1
1 498 . 5 1 1 A 48 48 LYS N N 2471 124.055 122.055 2.000 1
1 499 . 5 1 1 A 49 49 VAL H H 2472 8.497 8.659 -0.162 1
1 500 . 5 1 1 A 49 49 VAL HA H 2472 4.552 4.864 -0.312 1
1 508 . 5 1 1 A 49 49 VAL C C 2472 175.292 174.252 1.040 1
1 509 . 5 1 1 A 49 49 VAL CA C 2472 60.142 58.927 1.215 1
1 510 . 5 1 1 A 49 49 VAL CB C 2472 33.464 35.594 -2.130 1
1 513 . 5 1 1 A 49 49 VAL N N 2472 121.233 118.010 3.223 1
1 514 . 5 1 1 A 50 50 LYS H H 2473 8.190 8.410 -0.220 1
1 515 . 5 1 1 A 50 50 LYS HA H 2473 4.522 4.527 -0.005 1
1 518 . 5 1 1 A 50 50 LYS CA C 2473 55.952 56.196 -0.244 1
1 519 . 5 1 1 A 50 50 LYS CB C 2473 32.896 33.112 -0.216 1
1 520 . 5 1 1 A 50 50 LYS N N 2473 126.082 124.450 1.632 1
1 521 . 5 1 1 A 51 51 MET H H 2474 8.818 9.033 -0.215 1
1 522 . 5 1 1 A 51 51 MET HA H 2474 5.324 5.312 0.012 1
1 530 . 5 1 1 A 51 51 MET C C 2474 173.933 174.508 -0.575 1
1 531 . 5 1 1 A 51 51 MET CA C 2474 54.848 53.932 0.916 1
1 532 . 5 1 1 A 51 51 MET CB C 2474 37.043 35.822 1.221 1
1 535 . 5 1 1 A 51 51 MET N N 2474 126.911 127.754 -0.843 1
1 536 . 5 1 1 A 52 52 ASP H H 2475 9.095 8.909 0.186 1
1 537 . 5 1 1 A 52 52 ASP HA H 2475 4.947 5.469 -0.522 1
1 540 . 5 1 1 A 52 52 ASP C C 2475 173.923 174.495 -0.572 1
1 541 . 5 1 1 A 52 52 ASP CA C 2475 53.487 52.856 0.631 1
1 542 . 5 1 1 A 52 52 ASP CB C 2475 44.765 45.685 -0.920 1
1 543 . 5 1 1 A 52 52 ASP N N 2475 125.526 124.737 0.789 1
1 544 . 5 1 1 A 53 53 CYS H H 2476 8.606 8.817 -0.211 1
1 545 . 5 1 1 A 53 53 CYS HA H 2476 5.145 5.184 -0.039 1
1 548 . 5 1 1 A 53 53 CYS C C 2476 173.330 173.150 0.180 1
1 549 . 5 1 1 A 53 53 CYS CA C 2476 57.452 56.782 0.670 1
1 550 . 5 1 1 A 53 53 CYS CB C 2476 28.108 31.571 -3.463 1
1 551 . 5 1 1 A 53 53 CYS N N 2476 124.317 116.784 7.533 1
1 552 . 5 1 1 A 54 54 GLN H H 2477 8.978 8.802 0.176 1
1 553 . 5 1 1 A 54 54 GLN HA H 2477 4.884 4.994 -0.110 1
1 560 . 5 1 1 A 54 54 GLN C C 2477 174.854 173.552 1.302 1
1 561 . 5 1 1 A 54 54 GLN CA C 2477 53.891 54.612 -0.721 1
1 562 . 5 1 1 A 54 54 GLN CB C 2477 32.837 31.724 1.113 1
1 564 . 5 1 1 A 54 54 GLN N N 2477 127.074 118.180 8.894 1
1 566 . 5 1 1 A 55 55 GLU H H 2478 9.065 8.680 0.385 1
1 567 . 5 1 1 A 55 55 GLU HA H 2478 4.280 4.613 -0.333 1
1 572 . 5 1 1 A 55 55 GLU C C 2478 175.383 175.601 -0.218 1
1 573 . 5 1 1 A 55 55 GLU CA C 2478 57.516 56.502 1.014 1
1 574 . 5 1 1 A 55 55 GLU CB C 2478 30.346 30.775 -0.429 1
1 576 . 5 1 1 A 55 55 GLU N N 2478 125.186 121.645 3.541 1
1 577 . 5 1 1 A 56 56 CYS H H 2479 8.407 8.315 0.092 1
1 578 . 5 1 1 A 56 56 CYS HA H 2479 5.056 4.899 0.157 1
1 581 . 5 1 1 A 56 56 CYS CA C 2479 55.858 56.851 -0.993 1
1 582 . 5 1 1 A 56 56 CYS CB C 2479 28.676 30.625 -1.949 1
1 583 . 5 1 1 A 56 56 CYS N N 2479 121.499 124.598 -3.099 1
1 584 . 5 1 1 A 57 57 PRO HA H 2480 4.159 4.232 -0.073 1
1 591 . 5 1 1 A 57 57 PRO C C 2480 177.964 177.811 0.153 1
1 592 . 5 1 1 A 57 57 PRO CA C 2480 66.877 65.001 1.876 1
1 593 . 5 1 1 A 57 57 PRO CB C 2480 31.709 31.813 -0.104 1
1 596 . 5 1 1 A 58 58 GLU H H 2481 8.900 8.210 0.690 1
1 597 . 5 1 1 A 58 58 GLU HA H 2481 4.201 4.296 -0.095 1
1 602 . 5 1 1 A 58 58 GLU C C 2481 175.129 176.582 -1.453 1
1 603 . 5 1 1 A 58 58 GLU CA C 2481 57.883 57.327 0.556 1
1 604 . 5 1 1 A 58 58 GLU CB C 2481 29.991 30.244 -0.253 1
1 606 . 5 1 1 A 58 58 GLU N N 2481 115.316 117.715 -2.399 1
1 607 . 5 1 1 A 59 59 GLY H H 2482 7.527 7.219 0.308 1
1 608 . 5 1 1 A 59 59 GLY HA2 H 2482 4.935 3.921 1.014 1
1 609 . 5 1 1 A 59 59 GLY HA3 H 2482 3.381 4.031 -0.650 1
1 610 . 5 1 1 A 59 59 GLY CA C 2482 47.809 43.926 3.883 1
1 611 . 5 1 1 A 59 59 GLY N N 2482 110.079 107.578 2.501 1
1 612 . 5 1 1 A 60 60 TYR H H 2483 8.990 8.100 0.890 1
1 613 . 5 1 1 A 60 60 TYR HA H 2483 5.157 4.728 0.429 1
1 618 . 5 1 1 A 60 60 TYR C C 2483 175.096 175.135 -0.039 1
1 619 . 5 1 1 A 60 60 TYR CA C 2483 57.375 59.135 -1.760 1
1 620 . 5 1 1 A 60 60 TYR CB C 2483 43.153 38.436 4.717 1
1 622 . 5 1 1 A 60 60 TYR N N 2483 125.900 121.205 4.695 1
1 623 . 5 1 1 A 61 61 ARG H H 2484 9.557 8.818 0.739 1
1 624 . 5 1 1 A 61 61 ARG HA H 2484 4.858 4.579 0.279 1
1 631 . 5 1 1 A 61 61 ARG CA C 2484 55.016 55.769 -0.753 1
1 632 . 5 1 1 A 61 61 ARG CB C 2484 32.128 31.314 0.814 1
1 635 . 5 1 1 A 61 61 ARG N N 2484 124.847 126.293 -1.446 1
1 636 . 5 1 1 A 62 62 VAL H H 2485 9.046 8.838 0.208 1
1 637 . 5 1 1 A 62 62 VAL HA H 2485 4.675 4.726 -0.051 1
1 645 . 5 1 1 A 62 62 VAL C C 2485 173.837 174.897 -1.060 1
1 646 . 5 1 1 A 62 62 VAL CA C 2485 60.752 60.776 -0.024 1
1 647 . 5 1 1 A 62 62 VAL CB C 2485 32.459 34.531 -2.072 1
1 650 . 5 1 1 A 62 62 VAL N N 2485 132.205 125.853 6.352 1
1 651 . 5 1 1 A 63 63 THR H H 2486 8.474 8.963 -0.489 1
1 652 . 5 1 1 A 63 63 THR HA H 2486 5.392 5.287 0.105 1
1 657 . 5 1 1 A 63 63 THR C C 2486 173.675 173.505 0.170 1
1 658 . 5 1 1 A 63 63 THR CA C 2486 60.008 61.185 -1.177 1
1 659 . 5 1 1 A 63 63 THR CB C 2486 71.035 71.697 -0.662 1
1 661 . 5 1 1 A 63 63 THR N N 2486 121.216 122.921 -1.705 1
1 662 . 5 1 1 A 64 64 TYR H H 2487 9.409 8.980 0.429 1
1 663 . 5 1 1 A 64 64 TYR HA H 2487 5.617 5.595 0.022 1
1 670 . 5 1 1 A 64 64 TYR C C 2487 172.847 172.686 0.161 1
1 671 . 5 1 1 A 64 64 TYR CA C 2487 55.557 55.794 -0.237 1
1 672 . 5 1 1 A 64 64 TYR CB C 2487 41.968 41.956 0.012 1
1 675 . 5 1 1 A 64 64 TYR N N 2487 124.061 122.344 1.717 1
1 676 . 5 1 1 A 65 65 THR H H 2488 8.145 9.026 -0.881 1
1 677 . 5 1 1 A 65 65 THR HA H 2488 4.959 4.660 0.299 1
1 682 . 5 1 1 A 65 65 THR CA C 2488 58.532 58.991 -0.459 1
1 683 . 5 1 1 A 65 65 THR CB C 2488 70.141 70.116 0.025 1
1 685 . 5 1 1 A 65 65 THR N N 2488 117.924 117.112 0.812 1
1 686 . 5 1 1 A 66 66 PRO HA H 2489 4.602 4.869 -0.267 1
1 693 . 5 1 1 A 66 66 PRO C C 2489 176.647 176.556 0.091 1
1 694 . 5 1 1 A 66 66 PRO CA C 2489 61.442 62.346 -0.904 1
1 695 . 5 1 1 A 66 66 PRO CB C 2489 32.715 33.242 -0.527 1
1 698 . 5 1 1 A 67 67 MET H H 2490 8.832 8.225 0.607 1
1 699 . 5 1 1 A 67 67 MET HA H 2490 4.880 4.814 0.066 1
1 707 . 5 1 1 A 67 67 MET C C 2490 174.121 176.101 -1.980 1
1 708 . 5 1 1 A 67 67 MET CA C 2490 53.848 54.717 -0.869 1
1 709 . 5 1 1 A 67 67 MET CB C 2490 33.727 34.094 -0.367 1
1 712 . 5 1 1 A 67 67 MET N N 2490 119.212 117.602 1.610 1
1 713 . 5 1 1 A 68 68 ALA H H 2491 7.086 7.446 -0.360 1
1 714 . 5 1 1 A 68 68 ALA HA H 2491 4.851 4.824 0.027 1
1 718 . 5 1 1 A 68 68 ALA CA C 2491 49.222 49.739 -0.517 1
1 719 . 5 1 1 A 68 68 ALA CB C 2491 20.600 21.947 -1.347 1
1 720 . 5 1 1 A 68 68 ALA N N 2491 120.363 121.190 -0.827 1
1 721 . 5 1 1 A 69 69 PRO HA H 2492 4.263 4.731 -0.468 1
1 728 . 5 1 1 A 69 69 PRO C C 2492 174.370 176.217 -1.847 1
1 729 . 5 1 1 A 69 69 PRO CA C 2492 62.555 62.960 -0.405 1
1 730 . 5 1 1 A 69 69 PRO CB C 2492 32.752 32.997 -0.245 1
1 733 . 5 1 1 A 70 70 GLY H H 2493 8.858 8.317 0.541 1
1 734 . 5 1 1 A 70 70 GLY HA2 H 2493 4.544 4.070 0.474 1
1 735 . 5 1 1 A 70 70 GLY HA3 H 2493 3.849 4.117 -0.268 1
1 736 . 5 1 1 A 70 70 GLY C C 2493 172.182 172.357 -0.175 1
1 737 . 5 1 1 A 70 70 GLY CA C 2493 44.356 44.416 -0.060 1
1 738 . 5 1 1 A 70 70 GLY N N 2493 106.539 108.105 -1.566 1
1 739 . 5 1 1 A 71 71 SER H H 2494 8.490 8.233 0.257 1
1 740 . 5 1 1 A 71 71 SER HA H 2494 5.280 5.422 -0.142 1
1 743 . 5 1 1 A 71 71 SER C C 2494 173.512 173.140 0.372 1
1 744 . 5 1 1 A 71 71 SER CA C 2494 57.674 57.881 -0.207 1
1 745 . 5 1 1 A 71 71 SER CB C 2494 63.799 65.106 -1.307 1
1 746 . 5 1 1 A 71 71 SER N N 2494 117.964 117.244 0.720 1
1 747 . 5 1 1 A 72 72 TYR H H 2495 9.320 9.551 -0.231 1
1 748 . 5 1 1 A 72 72 TYR HA H 2495 4.960 5.298 -0.338 1
1 755 . 5 1 1 A 72 72 TYR C C 2495 173.979 175.182 -1.203 1
1 756 . 5 1 1 A 72 72 TYR CA C 2495 56.384 56.899 -0.515 1
1 757 . 5 1 1 A 72 72 TYR CB C 2495 40.247 40.300 -0.053 1
1 760 . 5 1 1 A 72 72 TYR N N 2495 126.442 125.527 0.915 1
1 761 . 5 1 1 A 73 73 LEU H H 2496 9.019 9.075 -0.056 1
1 762 . 5 1 1 A 73 73 LEU HA H 2496 5.209 5.038 0.171 1
1 772 . 5 1 1 A 73 73 LEU C C 2496 177.015 175.905 1.110 1
1 773 . 5 1 1 A 73 73 LEU CA C 2496 53.393 53.667 -0.274 1
1 774 . 5 1 1 A 73 73 LEU CB C 2496 43.918 42.365 1.553 1
1 778 . 5 1 1 A 73 73 LEU N N 2496 125.439 124.114 1.325 1
1 779 . 5 1 1 A 74 74 ILE H H 2497 9.921 9.525 0.396 1
1 780 . 5 1 1 A 74 74 ILE HA H 2497 5.128 4.652 0.476 1
1 790 . 5 1 1 A 74 74 ILE C C 2497 175.730 174.974 0.756 1
1 791 . 5 1 1 A 74 74 ILE CA C 2497 60.930 60.415 0.515 1
1 792 . 5 1 1 A 74 74 ILE CB C 2497 39.488 37.682 1.806 1
1 796 . 5 1 1 A 74 74 ILE N N 2497 132.185 126.564 5.621 1
1 797 . 5 1 1 A 75 75 SER H H 2498 9.284 9.053 0.231 1
1 798 . 5 1 1 A 75 75 SER HA H 2498 5.111 5.048 0.063 1
1 801 . 5 1 1 A 75 75 SER C C 2498 173.449 173.524 -0.075 1
1 802 . 5 1 1 A 75 75 SER CA C 2498 58.260 58.325 -0.065 1
1 803 . 5 1 1 A 75 75 SER CB C 2498 63.956 62.971 0.985 1
1 804 . 5 1 1 A 75 75 SER N N 2498 125.384 124.818 0.566 1
1 805 . 5 1 1 A 76 76 ILE H H 2499 9.861 9.043 0.818 1
1 806 . 5 1 1 A 76 76 ILE HA H 2499 4.814 4.723 0.091 1
1 816 . 5 1 1 A 76 76 ILE CA C 2499 61.034 60.867 0.167 1
1 817 . 5 1 1 A 76 76 ILE CB C 2499 40.387 37.441 2.946 1
1 821 . 5 1 1 A 76 76 ILE N N 2499 129.414 127.377 2.037 1
1 822 . 5 1 1 A 77 77 LYS H H 2500 8.827 9.033 -0.206 1
1 823 . 5 1 1 A 77 77 LYS HA H 2500 5.254 5.175 0.079 1
1 832 . 5 1 1 A 77 77 LYS C C 2500 175.245 175.727 -0.482 1
1 833 . 5 1 1 A 77 77 LYS CA C 2500 54.388 54.676 -0.288 1
1 834 . 5 1 1 A 77 77 LYS CB C 2500 36.127 35.391 0.736 1
1 838 . 5 1 1 A 77 77 LYS N N 2500 126.922 127.362 -0.440 1
1 839 . 5 1 1 A 78 78 TYR H H 2501 8.408 8.884 -0.476 1
1 840 . 5 1 1 A 78 78 TYR HA H 2501 5.479 5.001 0.478 1
1 847 . 5 1 1 A 78 78 TYR C C 2501 174.792 175.482 -0.690 1
1 848 . 5 1 1 A 78 78 TYR CA C 2501 56.837 57.499 -0.662 1
1 849 . 5 1 1 A 78 78 TYR CB C 2501 44.008 42.221 1.787 1
1 852 . 5 1 1 A 78 78 TYR N N 2501 122.282 124.290 -2.008 1
1 853 . 5 1 1 A 79 79 GLY H H 2502 8.196 8.631 -0.435 1
1 854 . 5 1 1 A 79 79 GLY HA2 H 2502 4.040 3.679 0.361 1
1 855 . 5 1 1 A 79 79 GLY HA3 H 2502 3.465 3.855 -0.390 1
1 856 . 5 1 1 A 79 79 GLY C C 2502 173.932 173.577 0.355 1
1 857 . 5 1 1 A 79 79 GLY CA C 2502 45.741 45.861 -0.120 1
1 858 . 5 1 1 A 79 79 GLY N N 2502 113.451 114.258 -0.807 1
1 859 . 5 1 1 A 80 80 GLY H H 2503 7.589 8.096 -0.507 1
1 860 . 5 1 1 A 80 80 GLY HA2 H 2503 4.490 4.038 0.452 1
1 861 . 5 1 1 A 80 80 GLY HA3 H 2503 3.555 4.121 -0.566 1
1 862 . 5 1 1 A 80 80 GLY CA C 2503 43.540 44.294 -0.754 1
1 863 . 5 1 1 A 80 80 GLY N N 2503 107.293 107.482 -0.189 1
1 864 . 5 1 1 A 81 81 PRO HA H 2504 4.320 4.341 -0.021 1
1 871 . 5 1 1 A 81 81 PRO C C 2504 175.311 175.351 -0.040 1
1 872 . 5 1 1 A 81 81 PRO CA C 2504 62.722 63.503 -0.781 1
1 873 . 5 1 1 A 81 81 PRO CB C 2504 29.297 32.051 -2.754 1
1 876 . 5 1 1 A 82 82 TYR H H 2505 7.778 7.370 0.408 1
1 877 . 5 1 1 A 82 82 TYR HA H 2505 4.791 4.979 -0.188 1
1 884 . 5 1 1 A 82 82 TYR C C 2505 175.086 175.984 -0.898 1
1 885 . 5 1 1 A 82 82 TYR CA C 2505 56.111 56.636 -0.525 1
1 886 . 5 1 1 A 82 82 TYR CB C 2505 39.483 40.765 -1.282 1
1 889 . 5 1 1 A 82 82 TYR N N 2505 123.973 120.807 3.166 1
1 890 . 5 1 1 A 83 83 HIS H H 2506 8.625 9.051 -0.426 1
1 891 . 5 1 1 A 83 83 HIS HA H 2506 4.583 4.901 -0.318 1
1 896 . 5 1 1 A 83 83 HIS C C 2506 178.161 175.776 2.385 1
1 897 . 5 1 1 A 83 83 HIS CA C 2506 58.241 57.194 1.047 1
1 898 . 5 1 1 A 83 83 HIS CB C 2506 33.132 30.796 2.336 1
1 901 . 5 1 1 A 83 83 HIS N N 2506 124.092 121.628 2.464 1
1 902 . 5 1 1 A 84 84 ILE H H 2507 8.327 8.707 -0.380 1
1 903 . 5 1 1 A 84 84 ILE HA H 2507 4.553 4.496 0.057 1
1 913 . 5 1 1 A 84 84 ILE C C 2507 176.523 176.539 -0.016 1
1 914 . 5 1 1 A 84 84 ILE CA C 2507 60.791 60.412 0.379 1
1 915 . 5 1 1 A 84 84 ILE CB C 2507 39.162 39.576 -0.414 1
1 919 . 5 1 1 A 84 84 ILE N N 2507 117.355 119.738 -2.383 1
1 920 . 5 1 1 A 85 85 GLY H H 2508 9.130 8.694 0.436 1
1 921 . 5 1 1 A 85 85 GLY HA2 H 2508 3.883 3.869 0.014 1
1 922 . 5 1 1 A 85 85 GLY HA3 H 2508 3.800 3.906 -0.106 1
1 923 . 5 1 1 A 85 85 GLY C C 2508 174.438 174.983 -0.545 1
1 924 . 5 1 1 A 85 85 GLY CA C 2508 47.673 47.242 0.431 1
1 925 . 5 1 1 A 85 85 GLY N N 2508 111.346 112.818 -1.472 1
1 926 . 5 1 1 A 86 86 GLY H H 2509 8.236 9.039 -0.803 1
1 927 . 5 1 1 A 86 86 GLY HA2 H 2509 3.893 3.670 0.223 1
1 928 . 5 1 1 A 86 86 GLY HA3 H 2509 3.161 3.764 -0.603 1
1 929 . 5 1 1 A 86 86 GLY C C 2509 171.837 173.296 -1.459 1
1 930 . 5 1 1 A 86 86 GLY CA C 2509 44.844 44.868 -0.024 1
1 931 . 5 1 1 A 86 86 GLY N N 2509 115.594 115.571 0.023 1
1 932 . 5 1 1 A 87 87 SER H H 2510 7.385 7.754 -0.369 1
1 933 . 5 1 1 A 87 87 SER HA H 2510 4.217 4.076 0.141 1
1 936 . 5 1 1 A 87 87 SER CA C 2510 54.783 55.478 -0.695 1
1 937 . 5 1 1 A 87 87 SER CB C 2510 62.683 63.664 -0.981 1
1 938 . 5 1 1 A 87 87 SER N N 2510 112.859 116.234 -3.375 1
1 939 . 5 1 1 A 88 88 PRO HA H 2511 5.532 4.778 0.754 1
1 946 . 5 1 1 A 88 88 PRO C C 2511 175.870 175.832 0.038 1
1 947 . 5 1 1 A 88 88 PRO CA C 2511 62.379 62.302 0.077 1
1 948 . 5 1 1 A 88 88 PRO CB C 2511 33.639 32.510 1.129 1
1 951 . 5 1 1 A 89 89 PHE H H 2512 9.359 8.620 0.739 1
1 952 . 5 1 1 A 89 89 PHE HA H 2512 4.467 4.875 -0.408 1
1 960 . 5 1 1 A 89 89 PHE C C 2512 175.152 174.816 0.336 1
1 961 . 5 1 1 A 89 89 PHE CA C 2512 57.401 57.434 -0.033 1
1 962 . 5 1 1 A 89 89 PHE CB C 2512 40.843 40.614 0.229 1
1 966 . 5 1 1 A 89 89 PHE N N 2512 124.789 120.414 4.375 1
1 967 . 5 1 1 A 90 90 LYS H H 2513 8.772 8.777 -0.005 1
1 968 . 5 1 1 A 90 90 LYS HA H 2513 4.941 4.681 0.260 1
1 973 . 5 1 1 A 90 90 LYS C C 2513 174.183 174.916 -0.733 1
1 974 . 5 1 1 A 90 90 LYS CA C 2513 55.749 55.610 0.139 1
1 975 . 5 1 1 A 90 90 LYS CB C 2513 32.817 32.697 0.120 1
1 978 . 5 1 1 A 90 90 LYS N N 2513 125.133 124.545 0.588 1
1 979 . 5 1 1 A 91 91 ALA H H 2514 9.158 8.539 0.619 1
1 980 . 5 1 1 A 91 91 ALA HA H 2514 4.510 4.752 -0.242 1
1 984 . 5 1 1 A 91 91 ALA C C 2514 176.561 176.817 -0.256 1
1 985 . 5 1 1 A 91 91 ALA CA C 2514 50.528 52.048 -1.520 1
1 986 . 5 1 1 A 91 91 ALA CB C 2514 20.653 19.757 0.896 1
1 987 . 5 1 1 A 91 91 ALA N N 2514 131.989 129.849 2.140 1
1 988 . 5 1 1 A 92 92 LYS H H 2515 8.186 8.960 -0.774 1
1 989 . 5 1 1 A 92 92 LYS HA H 2515 4.926 4.939 -0.013 1
1 998 . 5 1 1 A 92 92 LYS C C 2515 175.177 175.637 -0.460 1
1 999 . 5 1 1 A 92 92 LYS CA C 2515 55.725 55.409 0.316 1
1 1000 . 5 1 1 A 92 92 LYS CB C 2515 33.765 33.675 0.090 1
1 1004 . 5 1 1 A 92 92 LYS N N 2515 124.887 123.579 1.308 1
1 1005 . 5 1 1 A 93 93 VAL H H 2516 9.362 9.378 -0.016 1
1 1006 . 5 1 1 A 93 93 VAL HA H 2516 5.161 5.263 -0.102 1
1 1014 . 5 1 1 A 93 93 VAL C C 2516 176.988 175.257 1.731 1
1 1015 . 5 1 1 A 93 93 VAL CA C 2516 60.523 61.290 -0.767 1
1 1016 . 5 1 1 A 93 93 VAL CB C 2516 33.291 34.567 -1.276 1
1 1019 . 5 1 1 A 93 93 VAL N N 2516 129.943 124.795 5.148 1
1 1020 . 5 1 1 A 94 94 THR H H 2517 8.614 8.739 -0.125 1
1 1021 . 5 1 1 A 94 94 THR HA H 2517 4.902 4.856 0.046 1
1 1026 . 5 1 1 A 94 94 THR C C 2517 172.759 173.400 -0.641 1
1 1027 . 5 1 1 A 94 94 THR CA C 2517 60.121 59.908 0.213 1
1 1028 . 5 1 1 A 94 94 THR CB C 2517 71.072 71.535 -0.463 1
1 1030 . 5 1 1 A 94 94 THR N N 2517 122.032 116.450 5.582 1
1 1031 . 5 1 1 A 95 95 GLY H H 2518 8.280 8.413 -0.133 1
1 1032 . 5 1 1 A 95 95 GLY HA2 H 2518 3.852 4.134 -0.282 1
1 1033 . 5 1 1 A 95 95 GLY HA3 H 2518 4.846 4.139 0.707 1
1 1034 . 5 1 1 A 95 95 GLY CA C 2518 43.955 44.496 -0.541 1
1 1035 . 5 1 1 A 95 95 GLY N N 2518 107.949 108.446 -0.497 1
1 1036 . 5 1 1 A 96 96 PRO HA H 2519 4.449 4.638 -0.189 1
1 1043 . 5 1 1 A 96 96 PRO C C 2519 176.892 176.306 0.586 1
1 1044 . 5 1 1 A 96 96 PRO CA C 2519 62.062 62.713 -0.651 1
1 1045 . 5 1 1 A 96 96 PRO CB C 2519 32.286 32.077 0.209 1
1 1048 . 5 1 1 A 97 97 ARG H H 2520 8.651 8.536 0.115 1
1 1049 . 5 1 1 A 97 97 ARG HA H 2520 4.348 4.544 -0.196 1
1 1056 . 5 1 1 A 97 97 ARG C C 2520 176.236 176.004 0.232 1
1 1057 . 5 1 1 A 97 97 ARG CA C 2520 57.587 56.209 1.378 1
1 1058 . 5 1 1 A 97 97 ARG CB C 2520 30.472 30.584 -0.112 1
1 1061 . 5 1 1 A 97 97 ARG N N 2520 120.781 121.971 -1.190 1
1 1062 . 5 1 1 A 98 98 LEU H H 2521 8.545 8.950 -0.405 1
1 1063 . 5 1 1 A 98 98 LEU HA H 2521 4.577 4.264 0.313 1
1 1073 . 5 1 1 A 98 98 LEU C C 2521 175.880 178.343 -2.463 1
1 1074 . 5 1 1 A 98 98 LEU CA C 2521 55.068 56.236 -1.168 1
1 1075 . 5 1 1 A 98 98 LEU CB C 2521 43.082 42.351 0.731 1
1 1079 . 5 1 1 A 98 98 LEU N N 2521 128.715 127.667 1.048 1
1 4 . 6 1 1 A 2 2 ALA HA H -2 4.374 4.412 -0.038 1
1 8 . 6 1 1 A 2 2 ALA C C -2 177.865 177.187 0.678 1
1 9 . 6 1 1 A 2 2 ALA CA C -2 52.670 52.140 0.530 1
1 10 . 6 1 1 A 2 2 ALA CB C -2 19.508 20.244 -0.736 1
1 32 . 6 1 1 A 5 5 ASP H H 2428 8.300 9.071 -0.771 1
1 33 . 6 1 1 A 5 5 ASP HA H 2428 5.082 5.240 -0.158 1
1 36 . 6 1 1 A 5 5 ASP CA C 2428 51.517 51.039 0.478 1
1 37 . 6 1 1 A 5 5 ASP CB C 2428 42.244 41.391 0.853 1
1 38 . 6 1 1 A 5 5 ASP N N 2428 122.879 121.746 1.133 1
1 39 . 6 1 1 A 6 6 PRO HA H 2429 4.340 4.433 -0.093 1
1 46 . 6 1 1 A 6 6 PRO C C 2429 178.266 178.240 0.026 1
1 47 . 6 1 1 A 6 6 PRO CA C 2429 64.494 64.361 0.133 1
1 48 . 6 1 1 A 6 6 PRO CB C 2429 31.841 31.966 -0.125 1
1 51 . 6 1 1 A 7 7 GLY H H 2430 8.686 8.509 0.177 1
1 52 . 6 1 1 A 7 7 GLY HA2 H 2430 4.116 3.814 0.302 1
1 53 . 6 1 1 A 7 7 GLY HA3 H 2430 3.868 3.816 0.052 1
1 54 . 6 1 1 A 7 7 GLY C C 2430 174.567 175.457 -0.890 1
1 55 . 6 1 1 A 7 7 GLY CA C 2430 46.038 46.630 -0.592 1
1 56 . 6 1 1 A 7 7 GLY N N 2430 107.655 107.210 0.445 1
1 57 . 6 1 1 A 8 8 LEU H H 2431 7.692 7.410 0.282 1
1 58 . 6 1 1 A 8 8 LEU HA H 2431 4.507 4.400 0.107 1
1 68 . 6 1 1 A 8 8 LEU C C 2431 176.876 177.431 -0.555 1
1 69 . 6 1 1 A 8 8 LEU CA C 2431 54.307 56.396 -2.089 1
1 70 . 6 1 1 A 8 8 LEU CB C 2431 42.879 42.855 0.024 1
1 74 . 6 1 1 A 8 8 LEU N N 2431 120.022 120.057 -0.035 1
1 75 . 6 1 1 A 9 9 VAL H H 2432 7.378 7.341 0.037 1
1 76 . 6 1 1 A 9 9 VAL HA H 2432 4.154 3.914 0.240 1
1 84 . 6 1 1 A 9 9 VAL C C 2432 174.703 175.676 -0.973 1
1 85 . 6 1 1 A 9 9 VAL CA C 2432 62.387 63.169 -0.782 1
1 86 . 6 1 1 A 9 9 VAL CB C 2432 32.519 31.487 1.032 1
1 89 . 6 1 1 A 9 9 VAL N N 2432 123.902 119.706 4.196 1
1 90 . 6 1 1 A 10 10 SER H H 2433 8.201 8.359 -0.158 1
1 91 . 6 1 1 A 10 10 SER HA H 2433 5.136 5.090 0.046 1
1 94 . 6 1 1 A 10 10 SER CA C 2433 56.554 57.331 -0.777 1
1 95 . 6 1 1 A 10 10 SER CB C 2433 66.763 66.181 0.582 1
1 96 . 6 1 1 A 10 10 SER N N 2433 121.921 123.581 -1.660 1
1 97 . 6 1 1 A 11 11 ALA H H 2434 8.670 8.560 0.110 1
1 98 . 6 1 1 A 11 11 ALA HA H 2434 5.632 5.235 0.397 1
1 102 . 6 1 1 A 11 11 ALA C C 2434 175.459 176.058 -0.599 1
1 103 . 6 1 1 A 11 11 ALA CA C 2434 50.575 50.682 -0.107 1
1 104 . 6 1 1 A 11 11 ALA CB C 2434 23.111 21.112 1.999 1
1 105 . 6 1 1 A 11 11 ALA N N 2434 124.828 126.065 -1.237 1
1 106 . 6 1 1 A 12 12 TYR H H 2435 8.609 8.947 -0.338 1
1 107 . 6 1 1 A 12 12 TYR HA H 2435 4.879 5.193 -0.314 1
1 114 . 6 1 1 A 12 12 TYR C C 2435 173.645 174.553 -0.908 1
1 115 . 6 1 1 A 12 12 TYR CA C 2435 56.268 56.825 -0.557 1
1 116 . 6 1 1 A 12 12 TYR CB C 2435 39.522 42.374 -2.852 1
1 119 . 6 1 1 A 12 12 TYR N N 2435 118.305 119.323 -1.018 1
1 120 . 6 1 1 A 13 13 GLY H H 2436 8.655 8.581 0.074 1
1 121 . 6 1 1 A 13 13 GLY HA2 H 2436 4.943 4.303 0.640 1
1 122 . 6 1 1 A 13 13 GLY HA3 H 2436 4.028 4.344 -0.316 1
1 123 . 6 1 1 A 13 13 GLY C C 2436 175.334 174.892 0.442 1
1 124 . 6 1 1 A 13 13 GLY CA C 2436 44.389 44.538 -0.149 1
1 125 . 6 1 1 A 13 13 GLY N N 2436 110.710 110.339 0.371 1
1 126 . 6 1 1 A 14 14 ALA H H 2437 8.939 8.813 0.126 1
1 127 . 6 1 1 A 14 14 ALA HA H 2437 4.276 4.096 0.180 1
1 131 . 6 1 1 A 14 14 ALA C C 2437 180.524 178.908 1.616 1
1 132 . 6 1 1 A 14 14 ALA CA C 2437 55.551 55.078 0.473 1
1 133 . 6 1 1 A 14 14 ALA CB C 2437 18.411 18.383 0.028 1
1 134 . 6 1 1 A 14 14 ALA N N 2437 126.973 123.848 3.125 1
1 135 . 6 1 1 A 15 15 GLY H H 2438 8.933 8.712 0.221 1
1 136 . 6 1 1 A 15 15 GLY HA2 H 2438 4.531 4.002 0.529 1
1 137 . 6 1 1 A 15 15 GLY HA3 H 2438 3.576 4.165 -0.589 1
1 138 . 6 1 1 A 15 15 GLY C C 2438 174.323 175.517 -1.194 1
1 139 . 6 1 1 A 15 15 GLY CA C 2438 46.855 46.628 0.227 1
1 140 . 6 1 1 A 15 15 GLY N N 2438 104.803 105.805 -1.002 1
1 141 . 6 1 1 A 16 16 LEU H H 2439 7.529 7.602 -0.073 1
1 142 . 6 1 1 A 16 16 LEU HA H 2439 3.768 3.903 -0.135 1
1 152 . 6 1 1 A 16 16 LEU C C 2439 176.388 178.913 -2.525 1
1 153 . 6 1 1 A 16 16 LEU CA C 2439 56.137 57.336 -1.199 1
1 154 . 6 1 1 A 16 16 LEU CB C 2439 41.621 41.173 0.448 1
1 158 . 6 1 1 A 16 16 LEU N N 2439 119.633 121.868 -2.235 1
1 159 . 6 1 1 A 17 17 GLU H H 2440 7.505 7.923 -0.418 1
1 160 . 6 1 1 A 17 17 GLU HA H 2440 4.663 4.271 0.392 1
1 165 . 6 1 1 A 17 17 GLU C C 2440 178.126 176.666 1.460 1
1 166 . 6 1 1 A 17 17 GLU CA C 2440 56.447 56.928 -0.481 1
1 167 . 6 1 1 A 17 17 GLU CB C 2440 31.485 30.784 0.701 1
1 169 . 6 1 1 A 17 17 GLU N N 2440 114.368 116.280 -1.912 1
1 170 . 6 1 1 A 18 18 GLY H H 2441 7.921 7.223 0.698 1
1 171 . 6 1 1 A 18 18 GLY HA2 H 2441 4.889 4.198 0.691 1
1 172 . 6 1 1 A 18 18 GLY HA3 H 2441 3.707 4.239 -0.532 1
1 173 . 6 1 1 A 18 18 GLY C C 2441 170.965 171.603 -0.638 1
1 174 . 6 1 1 A 18 18 GLY CA C 2441 45.549 45.405 0.144 1
1 175 . 6 1 1 A 18 18 GLY N N 2441 109.165 105.353 3.812 1
1 176 . 6 1 1 A 19 19 GLY H H 2442 7.540 8.287 -0.747 1
1 177 . 6 1 1 A 19 19 GLY HA2 H 2442 4.086 4.222 -0.136 1
1 178 . 6 1 1 A 19 19 GLY HA3 H 2442 4.086 4.248 -0.162 1
1 179 . 6 1 1 A 19 19 GLY C C 2442 171.051 171.766 -0.715 1
1 180 . 6 1 1 A 19 19 GLY CA C 2442 44.937 45.710 -0.773 1
1 181 . 6 1 1 A 19 19 GLY N N 2442 105.460 107.821 -2.361 1
1 182 . 6 1 1 A 20 20 VAL H H 2443 8.899 8.248 0.651 1
1 183 . 6 1 1 A 20 20 VAL HA H 2443 5.062 4.991 0.071 1
1 191 . 6 1 1 A 20 20 VAL C C 2443 176.623 175.128 1.495 1
1 192 . 6 1 1 A 20 20 VAL CA C 2443 60.197 60.333 -0.136 1
1 193 . 6 1 1 A 20 20 VAL CB C 2443 35.107 35.309 -0.202 1
1 196 . 6 1 1 A 20 20 VAL N N 2443 122.753 120.071 2.682 1
1 197 . 6 1 1 A 21 21 THR H H 2444 8.630 8.647 -0.017 1
1 198 . 6 1 1 A 21 21 THR HA H 2444 3.773 4.168 -0.395 1
1 203 . 6 1 1 A 21 21 THR C C 2444 175.646 174.967 0.679 1
1 204 . 6 1 1 A 21 21 THR CA C 2444 62.732 63.230 -0.498 1
1 205 . 6 1 1 A 21 21 THR CB C 2444 68.925 68.585 0.340 1
1 207 . 6 1 1 A 21 21 THR N N 2444 118.179 119.072 -0.893 1
1 208 . 6 1 1 A 22 22 GLY H H 2445 8.736 8.772 -0.036 1
1 209 . 6 1 1 A 22 22 GLY HA2 H 2445 3.412 3.989 -0.577 1
1 210 . 6 1 1 A 22 22 GLY HA3 H 2445 4.061 3.991 0.070 1
1 211 . 6 1 1 A 22 22 GLY C C 2445 172.973 173.502 -0.529 1
1 212 . 6 1 1 A 22 22 GLY CA C 2445 45.577 45.195 0.382 1
1 213 . 6 1 1 A 22 22 GLY N N 2445 107.888 113.975 -6.087 1
1 214 . 6 1 1 A 23 23 ASN H H 2446 7.877 7.817 0.060 1
1 215 . 6 1 1 A 23 23 ASN HA H 2446 5.253 5.121 0.132 1
1 220 . 6 1 1 A 23 23 ASN CA C 2446 49.740 49.770 -0.030 1
1 221 . 6 1 1 A 23 23 ASN CB C 2446 40.198 39.188 1.010 1
1 222 . 6 1 1 A 23 23 ASN N N 2446 120.684 119.603 1.081 1
1 224 . 6 1 1 A 24 24 PRO HA H 2447 4.525 4.563 -0.038 1
1 231 . 6 1 1 A 24 24 PRO CA C 2447 62.766 62.262 0.504 1
1 232 . 6 1 1 A 24 24 PRO CB C 2447 31.732 32.246 -0.514 1
1 235 . 6 1 1 A 25 25 ALA H H 2448 9.178 8.261 0.917 1
1 236 . 6 1 1 A 25 25 ALA HA H 2448 4.614 4.944 -0.330 1
1 240 . 6 1 1 A 25 25 ALA C C 2448 175.503 175.566 -0.063 1
1 241 . 6 1 1 A 25 25 ALA CA C 2448 50.526 50.005 0.521 1
1 242 . 6 1 1 A 25 25 ALA CB C 2448 20.458 22.248 -1.790 1
1 243 . 6 1 1 A 25 25 ALA N N 2448 132.079 123.234 8.845 1
1 244 . 6 1 1 A 26 26 GLU H H 2449 8.813 8.724 0.089 1
1 245 . 6 1 1 A 26 26 GLU HA H 2449 5.830 5.051 0.779 1
1 250 . 6 1 1 A 26 26 GLU C C 2449 176.272 174.560 1.712 1
1 251 . 6 1 1 A 26 26 GLU CA C 2449 54.376 55.478 -1.102 1
1 252 . 6 1 1 A 26 26 GLU CB C 2449 35.463 33.448 2.015 1
1 254 . 6 1 1 A 26 26 GLU N N 2449 120.079 121.352 -1.273 1
1 255 . 6 1 1 A 27 27 PHE H H 2450 8.782 8.619 0.163 1
1 256 . 6 1 1 A 27 27 PHE HA H 2450 5.021 5.129 -0.108 1
1 264 . 6 1 1 A 27 27 PHE C C 2450 171.205 172.045 -0.840 1
1 265 . 6 1 1 A 27 27 PHE CA C 2450 56.852 56.326 0.526 1
1 266 . 6 1 1 A 27 27 PHE CB C 2450 41.080 41.159 -0.079 1
1 270 . 6 1 1 A 27 27 PHE N N 2450 118.670 119.814 -1.144 1
1 271 . 6 1 1 A 28 28 VAL H H 2451 8.961 9.111 -0.150 1
1 272 . 6 1 1 A 28 28 VAL HA H 2451 4.761 4.654 0.107 1
1 280 . 6 1 1 A 28 28 VAL C C 2451 174.673 175.236 -0.563 1
1 281 . 6 1 1 A 28 28 VAL CA C 2451 60.619 60.966 -0.347 1
1 282 . 6 1 1 A 28 28 VAL CB C 2451 35.484 34.162 1.322 1
1 285 . 6 1 1 A 28 28 VAL N N 2451 121.552 120.456 1.096 1
1 286 . 6 1 1 A 29 29 VAL H H 2452 9.294 9.435 -0.141 1
1 287 . 6 1 1 A 29 29 VAL HA H 2452 4.363 4.478 -0.115 1
1 295 . 6 1 1 A 29 29 VAL C C 2452 174.218 175.280 -1.062 1
1 296 . 6 1 1 A 29 29 VAL CA C 2452 61.526 62.203 -0.677 1
1 297 . 6 1 1 A 29 29 VAL CB C 2452 32.666 31.604 1.062 1
1 300 . 6 1 1 A 29 29 VAL N N 2452 125.585 128.469 -2.884 1
1 301 . 6 1 1 A 30 30 ASN H H 2453 9.465 9.030 0.435 1
1 302 . 6 1 1 A 30 30 ASN HA H 2453 5.096 5.096 0.000 1
1 307 . 6 1 1 A 30 30 ASN C C 2453 176.216 176.118 0.098 1
1 308 . 6 1 1 A 30 30 ASN CA C 2453 52.011 52.958 -0.947 1
1 309 . 6 1 1 A 30 30 ASN CB C 2453 39.057 38.593 0.464 1
1 310 . 6 1 1 A 30 30 ASN N N 2453 127.724 127.008 0.716 1
1 312 . 6 1 1 A 31 31 THR H H 2454 8.915 8.140 0.775 1
1 313 . 6 1 1 A 31 31 THR HA H 2454 4.342 4.399 -0.057 1
1 318 . 6 1 1 A 31 31 THR C C 2454 176.816 176.357 0.459 1
1 319 . 6 1 1 A 31 31 THR CA C 2454 61.117 62.074 -0.957 1
1 320 . 6 1 1 A 31 31 THR CB C 2454 68.209 69.840 -1.631 1
1 322 . 6 1 1 A 31 31 THR N N 2454 117.783 116.935 0.848 1
1 323 . 6 1 1 A 32 32 SER H H 2455 8.454 7.518 0.936 1
1 324 . 6 1 1 A 32 32 SER HA H 2455 4.155 4.219 -0.064 1
1 327 . 6 1 1 A 32 32 SER C C 2455 175.458 175.775 -0.317 1
1 328 . 6 1 1 A 32 32 SER CA C 2455 62.148 62.357 -0.209 1
1 329 . 6 1 1 A 32 32 SER CB C 2455 63.476 63.009 0.467 1
1 330 . 6 1 1 A 32 32 SER N N 2455 121.781 118.852 2.929 1
1 331 . 6 1 1 A 33 33 ASN H H 2456 8.845 8.076 0.769 1
1 332 . 6 1 1 A 33 33 ASN HA H 2456 5.064 4.544 0.520 1
1 337 . 6 1 1 A 33 33 ASN C C 2456 174.674 176.196 -1.522 1
1 338 . 6 1 1 A 33 33 ASN CA C 2456 53.067 55.005 -1.938 1
1 339 . 6 1 1 A 33 33 ASN CB C 2456 39.632 38.860 0.772 1
1 340 . 6 1 1 A 33 33 ASN N N 2456 120.176 119.039 1.137 1
1 342 . 6 1 1 A 34 34 ALA H H 2457 7.714 7.810 -0.096 1
1 343 . 6 1 1 A 34 34 ALA HA H 2457 4.482 4.425 0.057 1
1 347 . 6 1 1 A 34 34 ALA C C 2457 177.582 177.672 -0.090 1
1 348 . 6 1 1 A 34 34 ALA CA C 2457 52.521 52.666 -0.145 1
1 349 . 6 1 1 A 34 34 ALA CB C 2457 22.252 20.682 1.570 1
1 350 . 6 1 1 A 34 34 ALA N N 2457 123.065 120.081 2.984 1
1 351 . 6 1 1 A 35 35 GLY H H 2458 8.195 7.433 0.762 1
1 352 . 6 1 1 A 35 35 GLY HA2 H 2458 4.246 4.169 0.077 1
1 353 . 6 1 1 A 35 35 GLY HA3 H 2458 3.902 4.192 -0.290 1
1 354 . 6 1 1 A 35 35 GLY C C 2458 173.360 173.100 0.260 1
1 355 . 6 1 1 A 35 35 GLY CA C 2458 44.486 44.612 -0.126 1
1 356 . 6 1 1 A 35 35 GLY N N 2458 108.472 104.137 4.335 1
1 357 . 6 1 1 A 36 36 ALA H H 2459 8.430 8.240 0.190 1
1 358 . 6 1 1 A 36 36 ALA HA H 2459 4.472 5.243 -0.771 1
1 362 . 6 1 1 A 36 36 ALA C C 2459 176.968 176.421 0.547 1
1 363 . 6 1 1 A 36 36 ALA CA C 2459 52.695 51.092 1.603 1
1 364 . 6 1 1 A 36 36 ALA CB C 2459 19.360 21.590 -2.230 1
1 365 . 6 1 1 A 36 36 ALA N N 2459 126.012 124.663 1.349 1
1 366 . 6 1 1 A 37 37 GLY H H 2460 7.781 8.637 -0.856 1
1 367 . 6 1 1 A 37 37 GLY HA2 H 2460 3.856 3.865 -0.009 1
1 368 . 6 1 1 A 37 37 GLY HA3 H 2460 3.164 4.120 -0.956 1
1 369 . 6 1 1 A 37 37 GLY C C 2460 170.730 171.557 -0.827 1
1 370 . 6 1 1 A 37 37 GLY CA C 2460 44.747 45.515 -0.768 1
1 371 . 6 1 1 A 37 37 GLY N N 2460 109.493 108.823 0.670 1
1 372 . 6 1 1 A 38 38 ALA H H 2461 8.055 7.999 0.056 1
1 373 . 6 1 1 A 38 38 ALA HA H 2461 4.389 4.616 -0.227 1
1 377 . 6 1 1 A 38 38 ALA C C 2461 176.609 176.712 -0.103 1
1 378 . 6 1 1 A 38 38 ALA CA C 2461 51.419 51.801 -0.382 1
1 379 . 6 1 1 A 38 38 ALA CB C 2461 19.665 19.395 0.270 1
1 380 . 6 1 1 A 38 38 ALA N N 2461 121.997 122.040 -0.043 1
1 381 . 6 1 1 A 39 39 LEU H H 2462 8.597 8.266 0.331 1
1 382 . 6 1 1 A 39 39 LEU HA H 2462 5.022 4.985 0.037 1
1 392 . 6 1 1 A 39 39 LEU C C 2462 175.883 175.546 0.337 1
1 393 . 6 1 1 A 39 39 LEU CA C 2462 53.907 53.672 0.235 1
1 394 . 6 1 1 A 39 39 LEU CB C 2462 44.576 44.357 0.219 1
1 398 . 6 1 1 A 39 39 LEU N N 2462 126.664 124.005 2.659 1
1 399 . 6 1 1 A 40 40 SER H H 2463 8.898 9.113 -0.215 1
1 400 . 6 1 1 A 40 40 SER HA H 2463 4.732 4.724 0.008 1
1 403 . 6 1 1 A 40 40 SER C C 2463 172.984 173.266 -0.282 1
1 404 . 6 1 1 A 40 40 SER CA C 2463 56.730 57.052 -0.322 1
1 405 . 6 1 1 A 40 40 SER CB C 2463 64.648 64.221 0.427 1
1 406 . 6 1 1 A 40 40 SER N N 2463 122.932 121.647 1.285 1
1 407 . 6 1 1 A 41 41 VAL H H 2464 8.538 7.380 1.158 1
1 408 . 6 1 1 A 41 41 VAL HA H 2464 5.131 4.111 1.020 1
1 416 . 6 1 1 A 41 41 VAL C C 2464 174.812 174.746 0.066 1
1 417 . 6 1 1 A 41 41 VAL CA C 2464 60.784 63.021 -2.237 1
1 418 . 6 1 1 A 41 41 VAL CB C 2464 34.262 32.315 1.947 1
1 420 . 6 1 1 A 41 41 VAL N N 2464 129.161 122.713 6.448 1
1 421 . 6 1 1 A 42 42 THR H H 2465 8.807 8.860 -0.053 1
1 422 . 6 1 1 A 42 42 THR HA H 2465 4.573 5.071 -0.498 1
1 427 . 6 1 1 A 42 42 THR CA C 2465 60.408 61.451 -1.043 1
1 428 . 6 1 1 A 42 42 THR CB C 2465 71.764 72.299 -0.535 1
1 430 . 6 1 1 A 42 42 THR N N 2465 120.898 124.434 -3.536 1
1 431 . 6 1 1 A 43 43 ILE H H 2466 8.648 8.827 -0.179 1
1 432 . 6 1 1 A 43 43 ILE HA H 2466 4.854 4.828 0.026 1
1 442 . 6 1 1 A 43 43 ILE C C 2466 174.073 174.216 -0.143 1
1 443 . 6 1 1 A 43 43 ILE CA C 2466 61.184 60.128 1.056 1
1 444 . 6 1 1 A 43 43 ILE CB C 2466 39.516 40.330 -0.814 1
1 448 . 6 1 1 A 43 43 ILE N N 2466 124.810 126.034 -1.224 1
1 449 . 6 1 1 A 44 44 ASP H H 2467 8.821 9.169 -0.348 1
1 450 . 6 1 1 A 44 44 ASP HA H 2467 5.217 5.515 -0.298 1
1 453 . 6 1 1 A 44 44 ASP C C 2467 175.002 175.123 -0.121 1
1 454 . 6 1 1 A 44 44 ASP CA C 2467 52.998 52.272 0.726 1
1 455 . 6 1 1 A 44 44 ASP CB C 2467 44.728 44.255 0.473 1
1 456 . 6 1 1 A 44 44 ASP N N 2467 129.093 128.700 0.393 1
1 457 . 6 1 1 A 45 45 GLY H H 2468 8.535 8.275 0.260 1
1 458 . 6 1 1 A 45 45 GLY HA2 H 2468 3.954 3.689 0.265 1
1 459 . 6 1 1 A 45 45 GLY HA3 H 2468 3.561 4.012 -0.451 1
1 460 . 6 1 1 A 45 45 GLY CA C 2468 45.659 44.862 0.797 1
1 461 . 6 1 1 A 45 45 GLY N N 2468 112.751 109.213 3.538 1
1 462 . 6 1 1 A 46 46 PRO HA H 2469 4.318 4.362 -0.044 1
1 469 . 6 1 1 A 46 46 PRO C C 2469 176.086 176.126 -0.040 1
1 470 . 6 1 1 A 46 46 PRO CA C 2469 64.198 63.838 0.360 1
1 471 . 6 1 1 A 46 46 PRO CB C 2469 32.348 31.883 0.465 1
1 474 . 6 1 1 A 47 47 SER H H 2470 7.106 7.565 -0.459 1
1 475 . 6 1 1 A 47 47 SER HA H 2470 4.632 4.805 -0.173 1
1 478 . 6 1 1 A 47 47 SER C C 2470 172.969 172.907 0.062 1
1 479 . 6 1 1 A 47 47 SER CA C 2470 57.106 57.228 -0.122 1
1 480 . 6 1 1 A 47 47 SER CB C 2470 66.262 67.075 -0.813 1
1 481 . 6 1 1 A 47 47 SER N N 2470 110.556 113.666 -3.110 1
1 482 . 6 1 1 A 48 48 LYS H H 2471 8.534 8.360 0.174 1
1 483 . 6 1 1 A 48 48 LYS HA H 2471 4.486 4.628 -0.142 1
1 492 . 6 1 1 A 48 48 LYS C C 2471 177.231 176.076 1.155 1
1 493 . 6 1 1 A 48 48 LYS CA C 2471 56.620 56.599 0.021 1
1 494 . 6 1 1 A 48 48 LYS CB C 2471 32.379 33.888 -1.509 1
1 498 . 6 1 1 A 48 48 LYS N N 2471 124.055 121.780 2.275 1
1 499 . 6 1 1 A 49 49 VAL H H 2472 8.497 8.694 -0.197 1
1 500 . 6 1 1 A 49 49 VAL HA H 2472 4.552 4.878 -0.326 1
1 508 . 6 1 1 A 49 49 VAL C C 2472 175.292 174.391 0.901 1
1 509 . 6 1 1 A 49 49 VAL CA C 2472 60.142 58.941 1.201 1
1 510 . 6 1 1 A 49 49 VAL CB C 2472 33.464 35.551 -2.087 1
1 513 . 6 1 1 A 49 49 VAL N N 2472 121.233 117.841 3.392 1
1 514 . 6 1 1 A 50 50 LYS H H 2473 8.190 8.444 -0.254 1
1 515 . 6 1 1 A 50 50 LYS HA H 2473 4.522 4.576 -0.054 1
1 518 . 6 1 1 A 50 50 LYS CA C 2473 55.952 55.725 0.227 1
1 519 . 6 1 1 A 50 50 LYS CB C 2473 32.896 31.972 0.924 1
1 520 . 6 1 1 A 50 50 LYS N N 2473 126.082 122.268 3.814 1
1 521 . 6 1 1 A 51 51 MET H H 2474 8.818 9.091 -0.273 1
1 522 . 6 1 1 A 51 51 MET HA H 2474 5.324 4.883 0.441 1
1 530 . 6 1 1 A 51 51 MET C C 2474 173.933 174.905 -0.972 1
1 531 . 6 1 1 A 51 51 MET CA C 2474 54.848 55.355 -0.507 1
1 532 . 6 1 1 A 51 51 MET CB C 2474 37.043 33.685 3.358 1
1 535 . 6 1 1 A 51 51 MET N N 2474 126.911 124.788 2.123 1
1 536 . 6 1 1 A 52 52 ASP H H 2475 9.095 8.999 0.096 1
1 537 . 6 1 1 A 52 52 ASP HA H 2475 4.947 5.073 -0.126 1
1 540 . 6 1 1 A 52 52 ASP C C 2475 173.923 174.832 -0.909 1
1 541 . 6 1 1 A 52 52 ASP CA C 2475 53.487 53.477 0.010 1
1 542 . 6 1 1 A 52 52 ASP CB C 2475 44.765 43.163 1.602 1
1 543 . 6 1 1 A 52 52 ASP N N 2475 125.526 125.129 0.397 1
1 544 . 6 1 1 A 53 53 CYS H H 2476 8.606 8.930 -0.324 1
1 545 . 6 1 1 A 53 53 CYS HA H 2476 5.145 5.452 -0.307 1
1 548 . 6 1 1 A 53 53 CYS C C 2476 173.330 173.421 -0.091 1
1 549 . 6 1 1 A 53 53 CYS CA C 2476 57.452 57.019 0.433 1
1 550 . 6 1 1 A 53 53 CYS CB C 2476 28.108 30.793 -2.685 1
1 551 . 6 1 1 A 53 53 CYS N N 2476 124.317 124.807 -0.490 1
1 552 . 6 1 1 A 54 54 GLN H H 2477 8.978 8.641 0.337 1
1 553 . 6 1 1 A 54 54 GLN HA H 2477 4.884 4.728 0.156 1
1 560 . 6 1 1 A 54 54 GLN C C 2477 174.854 173.923 0.931 1
1 561 . 6 1 1 A 54 54 GLN CA C 2477 53.891 55.208 -1.317 1
1 562 . 6 1 1 A 54 54 GLN CB C 2477 32.837 32.928 -0.091 1
1 564 . 6 1 1 A 54 54 GLN N N 2477 127.074 120.792 6.282 1
1 566 . 6 1 1 A 55 55 GLU H H 2478 9.065 8.610 0.455 1
1 567 . 6 1 1 A 55 55 GLU HA H 2478 4.280 4.557 -0.277 1
1 572 . 6 1 1 A 55 55 GLU C C 2478 175.383 175.641 -0.258 1
1 573 . 6 1 1 A 55 55 GLU CA C 2478 57.516 56.777 0.739 1
1 574 . 6 1 1 A 55 55 GLU CB C 2478 30.346 30.233 0.113 1
1 576 . 6 1 1 A 55 55 GLU N N 2478 125.186 125.625 -0.439 1
1 577 . 6 1 1 A 56 56 CYS H H 2479 8.407 8.230 0.177 1
1 578 . 6 1 1 A 56 56 CYS HA H 2479 5.056 4.925 0.131 1
1 581 . 6 1 1 A 56 56 CYS CA C 2479 55.858 56.629 -0.771 1
1 582 . 6 1 1 A 56 56 CYS CB C 2479 28.676 30.211 -1.535 1
1 583 . 6 1 1 A 56 56 CYS N N 2479 121.499 124.770 -3.271 1
1 584 . 6 1 1 A 57 57 PRO HA H 2480 4.159 4.309 -0.150 1
1 591 . 6 1 1 A 57 57 PRO C C 2480 177.964 177.984 -0.020 1
1 592 . 6 1 1 A 57 57 PRO CA C 2480 66.877 64.594 2.283 1
1 593 . 6 1 1 A 57 57 PRO CB C 2480 31.709 32.118 -0.409 1
1 596 . 6 1 1 A 58 58 GLU H H 2481 8.900 8.167 0.733 1
1 597 . 6 1 1 A 58 58 GLU HA H 2481 4.201 4.316 -0.115 1
1 602 . 6 1 1 A 58 58 GLU C C 2481 175.129 176.510 -1.381 1
1 603 . 6 1 1 A 58 58 GLU CA C 2481 57.883 57.310 0.573 1
1 604 . 6 1 1 A 58 58 GLU CB C 2481 29.991 30.323 -0.332 1
1 606 . 6 1 1 A 58 58 GLU N N 2481 115.316 117.862 -2.546 1
1 607 . 6 1 1 A 59 59 GLY H H 2482 7.527 7.028 0.499 1
1 608 . 6 1 1 A 59 59 GLY HA2 H 2482 4.935 3.932 1.003 1
1 609 . 6 1 1 A 59 59 GLY HA3 H 2482 3.381 4.054 -0.673 1
1 610 . 6 1 1 A 59 59 GLY CA C 2482 47.809 44.334 3.475 1
1 611 . 6 1 1 A 59 59 GLY N N 2482 110.079 107.241 2.838 1
1 612 . 6 1 1 A 60 60 TYR H H 2483 8.990 8.361 0.629 1
1 613 . 6 1 1 A 60 60 TYR HA H 2483 5.157 4.693 0.464 1
1 618 . 6 1 1 A 60 60 TYR C C 2483 175.096 175.180 -0.084 1
1 619 . 6 1 1 A 60 60 TYR CA C 2483 57.375 59.190 -1.815 1
1 620 . 6 1 1 A 60 60 TYR CB C 2483 43.153 38.645 4.508 1
1 622 . 6 1 1 A 60 60 TYR N N 2483 125.900 121.336 4.564 1
1 623 . 6 1 1 A 61 61 ARG H H 2484 9.557 9.063 0.494 1
1 624 . 6 1 1 A 61 61 ARG HA H 2484 4.858 4.866 -0.008 1
1 631 . 6 1 1 A 61 61 ARG CA C 2484 55.016 55.259 -0.243 1
1 632 . 6 1 1 A 61 61 ARG CB C 2484 32.128 31.731 0.397 1
1 635 . 6 1 1 A 61 61 ARG N N 2484 124.847 126.116 -1.269 1
1 636 . 6 1 1 A 62 62 VAL H H 2485 9.046 8.764 0.282 1
1 637 . 6 1 1 A 62 62 VAL HA H 2485 4.675 4.650 0.025 1
1 645 . 6 1 1 A 62 62 VAL C C 2485 173.837 174.397 -0.560 1
1 646 . 6 1 1 A 62 62 VAL CA C 2485 60.752 60.692 0.060 1
1 647 . 6 1 1 A 62 62 VAL CB C 2485 32.459 34.231 -1.772 1
1 650 . 6 1 1 A 62 62 VAL N N 2485 132.205 125.399 6.806 1
1 651 . 6 1 1 A 63 63 THR H H 2486 8.474 8.694 -0.220 1
1 652 . 6 1 1 A 63 63 THR HA H 2486 5.392 5.224 0.168 1
1 657 . 6 1 1 A 63 63 THR C C 2486 173.675 173.465 0.210 1
1 658 . 6 1 1 A 63 63 THR CA C 2486 60.008 61.629 -1.621 1
1 659 . 6 1 1 A 63 63 THR CB C 2486 71.035 70.847 0.188 1
1 661 . 6 1 1 A 63 63 THR N N 2486 121.216 122.879 -1.663 1
1 662 . 6 1 1 A 64 64 TYR H H 2487 9.409 9.029 0.380 1
1 663 . 6 1 1 A 64 64 TYR HA H 2487 5.617 5.484 0.133 1
1 670 . 6 1 1 A 64 64 TYR C C 2487 172.847 172.494 0.353 1
1 671 . 6 1 1 A 64 64 TYR CA C 2487 55.557 55.834 -0.277 1
1 672 . 6 1 1 A 64 64 TYR CB C 2487 41.968 41.620 0.348 1
1 675 . 6 1 1 A 64 64 TYR N N 2487 124.061 121.380 2.681 1
1 676 . 6 1 1 A 65 65 THR H H 2488 8.145 8.753 -0.608 1
1 677 . 6 1 1 A 65 65 THR HA H 2488 4.959 4.599 0.360 1
1 682 . 6 1 1 A 65 65 THR CA C 2488 58.532 58.998 -0.466 1
1 683 . 6 1 1 A 65 65 THR CB C 2488 70.141 69.972 0.169 1
1 685 . 6 1 1 A 65 65 THR N N 2488 117.924 117.044 0.880 1
1 686 . 6 1 1 A 66 66 PRO HA H 2489 4.602 4.798 -0.196 1
1 693 . 6 1 1 A 66 66 PRO C C 2489 176.647 176.514 0.133 1
1 694 . 6 1 1 A 66 66 PRO CA C 2489 61.442 62.229 -0.787 1
1 695 . 6 1 1 A 66 66 PRO CB C 2489 32.715 33.225 -0.510 1
1 698 . 6 1 1 A 67 67 MET H H 2490 8.832 8.438 0.394 1
1 699 . 6 1 1 A 67 67 MET HA H 2490 4.880 4.816 0.064 1
1 707 . 6 1 1 A 67 67 MET C C 2490 174.121 176.160 -2.039 1
1 708 . 6 1 1 A 67 67 MET CA C 2490 53.848 54.706 -0.858 1
1 709 . 6 1 1 A 67 67 MET CB C 2490 33.727 34.334 -0.607 1
1 712 . 6 1 1 A 67 67 MET N N 2490 119.212 117.337 1.875 1
1 713 . 6 1 1 A 68 68 ALA H H 2491 7.086 7.456 -0.370 1
1 714 . 6 1 1 A 68 68 ALA HA H 2491 4.851 4.839 0.012 1
1 718 . 6 1 1 A 68 68 ALA CA C 2491 49.222 49.813 -0.591 1
1 719 . 6 1 1 A 68 68 ALA CB C 2491 20.600 21.732 -1.132 1
1 720 . 6 1 1 A 68 68 ALA N N 2491 120.363 120.695 -0.332 1
1 721 . 6 1 1 A 69 69 PRO HA H 2492 4.263 4.554 -0.291 1
1 728 . 6 1 1 A 69 69 PRO C C 2492 174.370 176.284 -1.914 1
1 729 . 6 1 1 A 69 69 PRO CA C 2492 62.555 63.542 -0.987 1
1 730 . 6 1 1 A 69 69 PRO CB C 2492 32.752 32.851 -0.099 1
1 733 . 6 1 1 A 70 70 GLY H H 2493 8.858 8.182 0.676 1
1 734 . 6 1 1 A 70 70 GLY HA2 H 2493 4.544 4.080 0.464 1
1 735 . 6 1 1 A 70 70 GLY HA3 H 2493 3.849 4.120 -0.271 1
1 736 . 6 1 1 A 70 70 GLY C C 2493 172.182 173.346 -1.164 1
1 737 . 6 1 1 A 70 70 GLY CA C 2493 44.356 44.164 0.192 1
1 738 . 6 1 1 A 70 70 GLY N N 2493 106.539 109.205 -2.666 1
1 739 . 6 1 1 A 71 71 SER H H 2494 8.490 8.275 0.215 1
1 740 . 6 1 1 A 71 71 SER HA H 2494 5.280 5.065 0.215 1
1 743 . 6 1 1 A 71 71 SER C C 2494 173.512 173.014 0.498 1
1 744 . 6 1 1 A 71 71 SER CA C 2494 57.674 57.156 0.518 1
1 745 . 6 1 1 A 71 71 SER CB C 2494 63.799 64.319 -0.520 1
1 746 . 6 1 1 A 71 71 SER N N 2494 117.964 113.769 4.195 1
1 747 . 6 1 1 A 72 72 TYR H H 2495 9.320 9.354 -0.034 1
1 748 . 6 1 1 A 72 72 TYR HA H 2495 4.960 5.063 -0.103 1
1 755 . 6 1 1 A 72 72 TYR C C 2495 173.979 174.952 -0.973 1
1 756 . 6 1 1 A 72 72 TYR CA C 2495 56.384 57.542 -1.158 1
1 757 . 6 1 1 A 72 72 TYR CB C 2495 40.247 39.900 0.347 1
1 760 . 6 1 1 A 72 72 TYR N N 2495 126.442 125.878 0.564 1
1 761 . 6 1 1 A 73 73 LEU H H 2496 9.019 8.985 0.034 1
1 762 . 6 1 1 A 73 73 LEU HA H 2496 5.209 4.926 0.283 1
1 772 . 6 1 1 A 73 73 LEU C C 2496 177.015 174.802 2.213 1
1 773 . 6 1 1 A 73 73 LEU CA C 2496 53.393 54.160 -0.767 1
1 774 . 6 1 1 A 73 73 LEU CB C 2496 43.918 43.466 0.452 1
1 778 . 6 1 1 A 73 73 LEU N N 2496 125.439 126.221 -0.782 1
1 779 . 6 1 1 A 74 74 ILE H H 2497 9.921 9.486 0.435 1
1 780 . 6 1 1 A 74 74 ILE HA H 2497 5.128 4.586 0.542 1
1 790 . 6 1 1 A 74 74 ILE C C 2497 175.730 175.137 0.593 1
1 791 . 6 1 1 A 74 74 ILE CA C 2497 60.930 60.637 0.293 1
1 792 . 6 1 1 A 74 74 ILE CB C 2497 39.488 37.002 2.486 1
1 796 . 6 1 1 A 74 74 ILE N N 2497 132.185 129.362 2.823 1
1 797 . 6 1 1 A 75 75 SER H H 2498 9.284 9.039 0.245 1
1 798 . 6 1 1 A 75 75 SER HA H 2498 5.111 4.882 0.229 1
1 801 . 6 1 1 A 75 75 SER C C 2498 173.449 173.413 0.036 1
1 802 . 6 1 1 A 75 75 SER CA C 2498 58.260 58.240 0.020 1
1 803 . 6 1 1 A 75 75 SER CB C 2498 63.956 61.570 2.386 1
1 804 . 6 1 1 A 75 75 SER N N 2498 125.384 125.470 -0.086 1
1 805 . 6 1 1 A 76 76 ILE H H 2499 9.861 8.297 1.564 1
1 806 . 6 1 1 A 76 76 ILE HA H 2499 4.814 4.479 0.335 1
1 816 . 6 1 1 A 76 76 ILE CA C 2499 61.034 61.748 -0.714 1
1 817 . 6 1 1 A 76 76 ILE CB C 2499 40.387 37.467 2.920 1
1 821 . 6 1 1 A 76 76 ILE N N 2499 129.414 126.339 3.075 1
1 822 . 6 1 1 A 77 77 LYS H H 2500 8.827 8.747 0.080 1
1 823 . 6 1 1 A 77 77 LYS HA H 2500 5.254 5.316 -0.062 1
1 832 . 6 1 1 A 77 77 LYS C C 2500 175.245 175.040 0.205 1
1 833 . 6 1 1 A 77 77 LYS CA C 2500 54.388 54.255 0.133 1
1 834 . 6 1 1 A 77 77 LYS CB C 2500 36.127 35.755 0.372 1
1 838 . 6 1 1 A 77 77 LYS N N 2500 126.922 127.397 -0.475 1
1 839 . 6 1 1 A 78 78 TYR H H 2501 8.408 8.971 -0.563 1
1 840 . 6 1 1 A 78 78 TYR HA H 2501 5.479 5.032 0.447 1
1 847 . 6 1 1 A 78 78 TYR C C 2501 174.792 175.477 -0.685 1
1 848 . 6 1 1 A 78 78 TYR CA C 2501 56.837 57.522 -0.685 1
1 849 . 6 1 1 A 78 78 TYR CB C 2501 44.008 42.278 1.730 1
1 852 . 6 1 1 A 78 78 TYR N N 2501 122.282 124.293 -2.011 1
1 853 . 6 1 1 A 79 79 GLY H H 2502 8.196 8.557 -0.361 1
1 854 . 6 1 1 A 79 79 GLY HA2 H 2502 4.040 3.631 0.409 1
1 855 . 6 1 1 A 79 79 GLY HA3 H 2502 3.465 3.794 -0.329 1
1 856 . 6 1 1 A 79 79 GLY C C 2502 173.932 173.643 0.289 1
1 857 . 6 1 1 A 79 79 GLY CA C 2502 45.741 45.915 -0.174 1
1 858 . 6 1 1 A 79 79 GLY N N 2502 113.451 114.074 -0.623 1
1 859 . 6 1 1 A 80 80 GLY H H 2503 7.589 8.243 -0.654 1
1 860 . 6 1 1 A 80 80 GLY HA2 H 2503 4.490 4.045 0.445 1
1 861 . 6 1 1 A 80 80 GLY HA3 H 2503 3.555 4.131 -0.576 1
1 862 . 6 1 1 A 80 80 GLY CA C 2503 43.540 44.032 -0.492 1
1 863 . 6 1 1 A 80 80 GLY N N 2503 107.293 107.199 0.094 1
1 864 . 6 1 1 A 81 81 PRO HA H 2504 4.320 4.353 -0.033 1
1 871 . 6 1 1 A 81 81 PRO C C 2504 175.311 175.372 -0.061 1
1 872 . 6 1 1 A 81 81 PRO CA C 2504 62.722 63.522 -0.800 1
1 873 . 6 1 1 A 81 81 PRO CB C 2504 29.297 32.061 -2.764 1
1 876 . 6 1 1 A 82 82 TYR H H 2505 7.778 7.405 0.373 1
1 877 . 6 1 1 A 82 82 TYR HA H 2505 4.791 4.989 -0.198 1
1 884 . 6 1 1 A 82 82 TYR C C 2505 175.086 175.925 -0.839 1
1 885 . 6 1 1 A 82 82 TYR CA C 2505 56.111 56.641 -0.530 1
1 886 . 6 1 1 A 82 82 TYR CB C 2505 39.483 40.763 -1.280 1
1 889 . 6 1 1 A 82 82 TYR N N 2505 123.973 120.850 3.123 1
1 890 . 6 1 1 A 83 83 HIS H H 2506 8.625 9.012 -0.387 1
1 891 . 6 1 1 A 83 83 HIS HA H 2506 4.583 4.836 -0.253 1
1 896 . 6 1 1 A 83 83 HIS C C 2506 178.161 176.010 2.151 1
1 897 . 6 1 1 A 83 83 HIS CA C 2506 58.241 57.182 1.059 1
1 898 . 6 1 1 A 83 83 HIS CB C 2506 33.132 30.493 2.639 1
1 901 . 6 1 1 A 83 83 HIS N N 2506 124.092 121.283 2.809 1
1 902 . 6 1 1 A 84 84 ILE H H 2507 8.327 8.658 -0.331 1
1 903 . 6 1 1 A 84 84 ILE HA H 2507 4.553 4.324 0.229 1
1 913 . 6 1 1 A 84 84 ILE C C 2507 176.523 176.211 0.312 1
1 914 . 6 1 1 A 84 84 ILE CA C 2507 60.791 60.029 0.762 1
1 915 . 6 1 1 A 84 84 ILE CB C 2507 39.162 39.704 -0.542 1
1 919 . 6 1 1 A 84 84 ILE N N 2507 117.355 119.752 -2.397 1
1 920 . 6 1 1 A 85 85 GLY H H 2508 9.130 8.490 0.640 1
1 921 . 6 1 1 A 85 85 GLY HA2 H 2508 3.883 3.718 0.165 1
1 922 . 6 1 1 A 85 85 GLY HA3 H 2508 3.800 3.733 0.067 1
1 923 . 6 1 1 A 85 85 GLY C C 2508 174.438 175.403 -0.965 1
1 924 . 6 1 1 A 85 85 GLY CA C 2508 47.673 46.693 0.980 1
1 925 . 6 1 1 A 85 85 GLY N N 2508 111.346 109.635 1.711 1
1 926 . 6 1 1 A 86 86 GLY H H 2509 8.236 8.262 -0.026 1
1 927 . 6 1 1 A 86 86 GLY HA2 H 2509 3.893 3.914 -0.021 1
1 928 . 6 1 1 A 86 86 GLY HA3 H 2509 3.161 3.966 -0.805 1
1 929 . 6 1 1 A 86 86 GLY C C 2509 171.837 173.311 -1.474 1
1 930 . 6 1 1 A 86 86 GLY CA C 2509 44.844 45.322 -0.478 1
1 931 . 6 1 1 A 86 86 GLY N N 2509 115.594 117.538 -1.944 1
1 932 . 6 1 1 A 87 87 SER H H 2510 7.385 7.704 -0.319 1
1 933 . 6 1 1 A 87 87 SER HA H 2510 4.217 4.073 0.144 1
1 936 . 6 1 1 A 87 87 SER CA C 2510 54.783 56.926 -2.143 1
1 937 . 6 1 1 A 87 87 SER CB C 2510 62.683 63.514 -0.831 1
1 938 . 6 1 1 A 87 87 SER N N 2510 112.859 117.676 -4.817 1
1 939 . 6 1 1 A 88 88 PRO HA H 2511 5.532 4.705 0.827 1
1 946 . 6 1 1 A 88 88 PRO C C 2511 175.870 175.332 0.538 1
1 947 . 6 1 1 A 88 88 PRO CA C 2511 62.379 62.280 0.099 1
1 948 . 6 1 1 A 88 88 PRO CB C 2511 33.639 32.231 1.408 1
1 951 . 6 1 1 A 89 89 PHE H H 2512 9.359 8.585 0.774 1
1 952 . 6 1 1 A 89 89 PHE HA H 2512 4.467 4.772 -0.305 1
1 960 . 6 1 1 A 89 89 PHE C C 2512 175.152 175.969 -0.817 1
1 961 . 6 1 1 A 89 89 PHE CA C 2512 57.401 57.371 0.030 1
1 962 . 6 1 1 A 89 89 PHE CB C 2512 40.843 40.681 0.162 1
1 966 . 6 1 1 A 89 89 PHE N N 2512 124.789 120.108 4.681 1
1 967 . 6 1 1 A 90 90 LYS H H 2513 8.772 8.591 0.181 1
1 968 . 6 1 1 A 90 90 LYS HA H 2513 4.941 4.414 0.527 1
1 973 . 6 1 1 A 90 90 LYS C C 2513 174.183 175.943 -1.760 1
1 974 . 6 1 1 A 90 90 LYS CA C 2513 55.749 56.711 -0.962 1
1 975 . 6 1 1 A 90 90 LYS CB C 2513 32.817 32.027 0.790 1
1 978 . 6 1 1 A 90 90 LYS N N 2513 125.133 121.323 3.810 1
1 979 . 6 1 1 A 91 91 ALA H H 2514 9.158 7.698 1.460 1
1 980 . 6 1 1 A 91 91 ALA HA H 2514 4.510 4.185 0.325 1
1 984 . 6 1 1 A 91 91 ALA C C 2514 176.561 177.325 -0.764 1
1 985 . 6 1 1 A 91 91 ALA CA C 2514 50.528 52.957 -2.429 1
1 986 . 6 1 1 A 91 91 ALA CB C 2514 20.653 18.696 1.957 1
1 987 . 6 1 1 A 91 91 ALA N N 2514 131.989 122.614 9.375 1
1 988 . 6 1 1 A 92 92 LYS H H 2515 8.186 8.769 -0.583 1
1 989 . 6 1 1 A 92 92 LYS HA H 2515 4.926 4.829 0.097 1
1 998 . 6 1 1 A 92 92 LYS C C 2515 175.177 176.070 -0.893 1
1 999 . 6 1 1 A 92 92 LYS CA C 2515 55.725 55.909 -0.184 1
1 1000 . 6 1 1 A 92 92 LYS CB C 2515 33.765 32.772 0.993 1
1 1004 . 6 1 1 A 92 92 LYS N N 2515 124.887 123.942 0.945 1
1 1005 . 6 1 1 A 93 93 VAL H H 2516 9.362 9.204 0.158 1
1 1006 . 6 1 1 A 93 93 VAL HA H 2516 5.161 5.094 0.067 1
1 1014 . 6 1 1 A 93 93 VAL C C 2516 176.988 175.804 1.184 1
1 1015 . 6 1 1 A 93 93 VAL CA C 2516 60.523 60.588 -0.065 1
1 1016 . 6 1 1 A 93 93 VAL CB C 2516 33.291 33.773 -0.482 1
1 1019 . 6 1 1 A 93 93 VAL N N 2516 129.943 119.167 10.776 1
1 1020 . 6 1 1 A 94 94 THR H H 2517 8.614 8.643 -0.029 1
1 1021 . 6 1 1 A 94 94 THR HA H 2517 4.902 4.869 0.033 1
1 1026 . 6 1 1 A 94 94 THR C C 2517 172.759 173.517 -0.758 1
1 1027 . 6 1 1 A 94 94 THR CA C 2517 60.121 59.854 0.267 1
1 1028 . 6 1 1 A 94 94 THR CB C 2517 71.072 71.017 0.055 1
1 1030 . 6 1 1 A 94 94 THR N N 2517 122.032 113.792 8.240 1
1 1031 . 6 1 1 A 95 95 GLY H H 2518 8.280 8.439 -0.159 1
1 1032 . 6 1 1 A 95 95 GLY HA2 H 2518 3.852 4.127 -0.275 1
1 1033 . 6 1 1 A 95 95 GLY HA3 H 2518 4.846 4.132 0.714 1
1 1034 . 6 1 1 A 95 95 GLY CA C 2518 43.955 44.483 -0.528 1
1 1035 . 6 1 1 A 95 95 GLY N N 2518 107.949 108.620 -0.671 1
1 1036 . 6 1 1 A 96 96 PRO HA H 2519 4.449 4.643 -0.194 1
1 1043 . 6 1 1 A 96 96 PRO C C 2519 176.892 175.852 1.040 1
1 1044 . 6 1 1 A 96 96 PRO CA C 2519 62.062 62.746 -0.684 1
1 1045 . 6 1 1 A 96 96 PRO CB C 2519 32.286 32.396 -0.110 1
1 1048 . 6 1 1 A 97 97 ARG H H 2520 8.651 8.580 0.071 1
1 1049 . 6 1 1 A 97 97 ARG HA H 2520 4.348 4.618 -0.270 1
1 1056 . 6 1 1 A 97 97 ARG C C 2520 176.236 176.057 0.179 1
1 1057 . 6 1 1 A 97 97 ARG CA C 2520 57.587 55.847 1.740 1
1 1058 . 6 1 1 A 97 97 ARG CB C 2520 30.472 31.389 -0.917 1
1 1061 . 6 1 1 A 97 97 ARG N N 2520 120.781 121.904 -1.123 1
1 1062 . 6 1 1 A 98 98 LEU H H 2521 8.545 8.626 -0.081 1
1 1063 . 6 1 1 A 98 98 LEU HA H 2521 4.577 4.524 0.053 1
1 1073 . 6 1 1 A 98 98 LEU C C 2521 175.880 176.637 -0.757 1
1 1074 . 6 1 1 A 98 98 LEU CA C 2521 55.068 55.201 -0.133 1
1 1075 . 6 1 1 A 98 98 LEU CB C 2521 43.082 42.684 0.398 1
1 1079 . 6 1 1 A 98 98 LEU N N 2521 128.715 127.947 0.768 1
1 4 . 7 1 1 A 2 2 ALA HA H -2 4.374 4.019 0.355 1
1 8 . 7 1 1 A 2 2 ALA C C -2 177.865 179.104 -1.239 1
1 9 . 7 1 1 A 2 2 ALA CA C -2 52.670 54.501 -1.831 1
1 10 . 7 1 1 A 2 2 ALA CB C -2 19.508 18.414 1.094 1
1 32 . 7 1 1 A 5 5 ASP H H 2428 8.300 8.512 -0.212 1
1 33 . 7 1 1 A 5 5 ASP HA H 2428 5.082 5.289 -0.207 1
1 36 . 7 1 1 A 5 5 ASP CA C 2428 51.517 50.648 0.869 1
1 37 . 7 1 1 A 5 5 ASP CB C 2428 42.244 42.862 -0.618 1
1 38 . 7 1 1 A 5 5 ASP N N 2428 122.879 119.433 3.446 1
1 39 . 7 1 1 A 6 6 PRO HA H 2429 4.340 4.357 -0.017 1
1 46 . 7 1 1 A 6 6 PRO C C 2429 178.266 178.410 -0.144 1
1 47 . 7 1 1 A 6 6 PRO CA C 2429 64.494 64.934 -0.440 1
1 48 . 7 1 1 A 6 6 PRO CB C 2429 31.841 31.900 -0.059 1
1 51 . 7 1 1 A 7 7 GLY H H 2430 8.686 8.473 0.213 1
1 52 . 7 1 1 A 7 7 GLY HA2 H 2430 4.116 3.884 0.232 1
1 53 . 7 1 1 A 7 7 GLY HA3 H 2430 3.868 3.888 -0.020 1
1 54 . 7 1 1 A 7 7 GLY C C 2430 174.567 175.362 -0.795 1
1 55 . 7 1 1 A 7 7 GLY CA C 2430 46.038 46.507 -0.469 1
1 56 . 7 1 1 A 7 7 GLY N N 2430 107.655 106.162 1.493 1
1 57 . 7 1 1 A 8 8 LEU H H 2431 7.692 7.546 0.146 1
1 58 . 7 1 1 A 8 8 LEU HA H 2431 4.507 4.384 0.123 1
1 68 . 7 1 1 A 8 8 LEU C C 2431 176.876 177.360 -0.484 1
1 69 . 7 1 1 A 8 8 LEU CA C 2431 54.307 56.142 -1.835 1
1 70 . 7 1 1 A 8 8 LEU CB C 2431 42.879 42.801 0.078 1
1 74 . 7 1 1 A 8 8 LEU N N 2431 120.022 119.719 0.303 1
1 75 . 7 1 1 A 9 9 VAL H H 2432 7.378 7.548 -0.170 1
1 76 . 7 1 1 A 9 9 VAL HA H 2432 4.154 3.925 0.229 1
1 84 . 7 1 1 A 9 9 VAL C C 2432 174.703 175.347 -0.644 1
1 85 . 7 1 1 A 9 9 VAL CA C 2432 62.387 63.258 -0.871 1
1 86 . 7 1 1 A 9 9 VAL CB C 2432 32.519 31.414 1.105 1
1 89 . 7 1 1 A 9 9 VAL N N 2432 123.902 119.741 4.161 1
1 90 . 7 1 1 A 10 10 SER H H 2433 8.201 8.861 -0.660 1
1 91 . 7 1 1 A 10 10 SER HA H 2433 5.136 4.965 0.171 1
1 94 . 7 1 1 A 10 10 SER CA C 2433 56.554 55.537 1.017 1
1 95 . 7 1 1 A 10 10 SER CB C 2433 66.763 65.228 1.535 1
1 96 . 7 1 1 A 10 10 SER N N 2433 121.921 122.468 -0.547 1
1 97 . 7 1 1 A 11 11 ALA H H 2434 8.670 8.119 0.551 1
1 98 . 7 1 1 A 11 11 ALA HA H 2434 5.632 5.250 0.382 1
1 102 . 7 1 1 A 11 11 ALA C C 2434 175.459 174.479 0.980 1
1 103 . 7 1 1 A 11 11 ALA CA C 2434 50.575 50.935 -0.360 1
1 104 . 7 1 1 A 11 11 ALA CB C 2434 23.111 22.850 0.261 1
1 105 . 7 1 1 A 11 11 ALA N N 2434 124.828 123.595 1.233 1
1 106 . 7 1 1 A 12 12 TYR H H 2435 8.609 8.818 -0.209 1
1 107 . 7 1 1 A 12 12 TYR HA H 2435 4.879 5.095 -0.216 1
1 114 . 7 1 1 A 12 12 TYR C C 2435 173.645 174.632 -0.987 1
1 115 . 7 1 1 A 12 12 TYR CA C 2435 56.268 56.681 -0.413 1
1 116 . 7 1 1 A 12 12 TYR CB C 2435 39.522 42.298 -2.776 1
1 119 . 7 1 1 A 12 12 TYR N N 2435 118.305 119.641 -1.336 1
1 120 . 7 1 1 A 13 13 GLY H H 2436 8.655 8.466 0.189 1
1 121 . 7 1 1 A 13 13 GLY HA2 H 2436 4.943 4.290 0.653 1
1 122 . 7 1 1 A 13 13 GLY HA3 H 2436 4.028 4.357 -0.329 1
1 123 . 7 1 1 A 13 13 GLY C C 2436 175.334 174.899 0.435 1
1 124 . 7 1 1 A 13 13 GLY CA C 2436 44.389 44.417 -0.028 1
1 125 . 7 1 1 A 13 13 GLY N N 2436 110.710 110.381 0.329 1
1 126 . 7 1 1 A 14 14 ALA H H 2437 8.939 8.759 0.180 1
1 127 . 7 1 1 A 14 14 ALA HA H 2437 4.276 4.069 0.207 1
1 131 . 7 1 1 A 14 14 ALA C C 2437 180.524 179.214 1.310 1
1 132 . 7 1 1 A 14 14 ALA CA C 2437 55.551 55.079 0.472 1
1 133 . 7 1 1 A 14 14 ALA CB C 2437 18.411 18.456 -0.045 1
1 134 . 7 1 1 A 14 14 ALA N N 2437 126.973 123.767 3.206 1
1 135 . 7 1 1 A 15 15 GLY H H 2438 8.933 8.688 0.245 1
1 136 . 7 1 1 A 15 15 GLY HA2 H 2438 4.531 3.995 0.536 1
1 137 . 7 1 1 A 15 15 GLY HA3 H 2438 3.576 4.205 -0.629 1
1 138 . 7 1 1 A 15 15 GLY C C 2438 174.323 175.950 -1.627 1
1 139 . 7 1 1 A 15 15 GLY CA C 2438 46.855 47.008 -0.153 1
1 140 . 7 1 1 A 15 15 GLY N N 2438 104.803 105.776 -0.973 1
1 141 . 7 1 1 A 16 16 LEU H H 2439 7.529 7.445 0.084 1
1 142 . 7 1 1 A 16 16 LEU HA H 2439 3.768 3.753 0.015 1
1 152 . 7 1 1 A 16 16 LEU C C 2439 176.388 178.597 -2.209 1
1 153 . 7 1 1 A 16 16 LEU CA C 2439 56.137 57.272 -1.135 1
1 154 . 7 1 1 A 16 16 LEU CB C 2439 41.621 41.128 0.493 1
1 158 . 7 1 1 A 16 16 LEU N N 2439 119.633 122.718 -3.085 1
1 159 . 7 1 1 A 17 17 GLU H H 2440 7.505 7.883 -0.378 1
1 160 . 7 1 1 A 17 17 GLU HA H 2440 4.663 4.372 0.291 1
1 165 . 7 1 1 A 17 17 GLU C C 2440 178.126 177.326 0.800 1
1 166 . 7 1 1 A 17 17 GLU CA C 2440 56.447 56.534 -0.087 1
1 167 . 7 1 1 A 17 17 GLU CB C 2440 31.485 30.611 0.874 1
1 169 . 7 1 1 A 17 17 GLU N N 2440 114.368 115.909 -1.541 1
1 170 . 7 1 1 A 18 18 GLY H H 2441 7.921 7.319 0.602 1
1 171 . 7 1 1 A 18 18 GLY HA2 H 2441 4.889 4.117 0.772 1
1 172 . 7 1 1 A 18 18 GLY HA3 H 2441 3.707 4.132 -0.425 1
1 173 . 7 1 1 A 18 18 GLY C C 2441 170.965 172.544 -1.579 1
1 174 . 7 1 1 A 18 18 GLY CA C 2441 45.549 44.300 1.249 1
1 175 . 7 1 1 A 18 18 GLY N N 2441 109.165 107.245 1.920 1
1 176 . 7 1 1 A 19 19 GLY H H 2442 7.540 7.845 -0.305 1
1 177 . 7 1 1 A 19 19 GLY HA2 H 2442 4.086 4.220 -0.134 1
1 178 . 7 1 1 A 19 19 GLY HA3 H 2442 4.086 4.248 -0.162 1
1 179 . 7 1 1 A 19 19 GLY C C 2442 171.051 171.601 -0.550 1
1 180 . 7 1 1 A 19 19 GLY CA C 2442 44.937 45.866 -0.929 1
1 181 . 7 1 1 A 19 19 GLY N N 2442 105.460 108.325 -2.865 1
1 182 . 7 1 1 A 20 20 VAL H H 2443 8.899 8.296 0.603 1
1 183 . 7 1 1 A 20 20 VAL HA H 2443 5.062 4.380 0.682 1
1 191 . 7 1 1 A 20 20 VAL C C 2443 176.623 175.677 0.946 1
1 192 . 7 1 1 A 20 20 VAL CA C 2443 60.197 62.418 -2.221 1
1 193 . 7 1 1 A 20 20 VAL CB C 2443 35.107 31.989 3.118 1
1 196 . 7 1 1 A 20 20 VAL N N 2443 122.753 121.182 1.571 1
1 197 . 7 1 1 A 21 21 THR H H 2444 8.630 8.500 0.130 1
1 198 . 7 1 1 A 21 21 THR HA H 2444 3.773 4.219 -0.446 1
1 203 . 7 1 1 A 21 21 THR C C 2444 175.646 174.927 0.719 1
1 204 . 7 1 1 A 21 21 THR CA C 2444 62.732 63.339 -0.607 1
1 205 . 7 1 1 A 21 21 THR CB C 2444 68.925 68.431 0.494 1
1 207 . 7 1 1 A 21 21 THR N N 2444 118.179 119.774 -1.595 1
1 208 . 7 1 1 A 22 22 GLY H H 2445 8.736 8.973 -0.237 1
1 209 . 7 1 1 A 22 22 GLY HA2 H 2445 3.412 4.003 -0.591 1
1 210 . 7 1 1 A 22 22 GLY HA3 H 2445 4.061 4.007 0.054 1
1 211 . 7 1 1 A 22 22 GLY C C 2445 172.973 173.853 -0.880 1
1 212 . 7 1 1 A 22 22 GLY CA C 2445 45.577 45.174 0.403 1
1 213 . 7 1 1 A 22 22 GLY N N 2445 107.888 114.087 -6.199 1
1 214 . 7 1 1 A 23 23 ASN H H 2446 7.877 7.684 0.193 1
1 215 . 7 1 1 A 23 23 ASN HA H 2446 5.253 5.035 0.218 1
1 220 . 7 1 1 A 23 23 ASN CA C 2446 49.740 50.437 -0.697 1
1 221 . 7 1 1 A 23 23 ASN CB C 2446 40.198 39.143 1.055 1
1 222 . 7 1 1 A 23 23 ASN N N 2446 120.684 119.976 0.708 1
1 224 . 7 1 1 A 24 24 PRO HA H 2447 4.525 4.616 -0.091 1
1 231 . 7 1 1 A 24 24 PRO CA C 2447 62.766 62.417 0.349 1
1 232 . 7 1 1 A 24 24 PRO CB C 2447 31.732 32.605 -0.873 1
1 235 . 7 1 1 A 25 25 ALA H H 2448 9.178 8.287 0.891 1
1 236 . 7 1 1 A 25 25 ALA HA H 2448 4.614 4.950 -0.336 1
1 240 . 7 1 1 A 25 25 ALA C C 2448 175.503 175.614 -0.111 1
1 241 . 7 1 1 A 25 25 ALA CA C 2448 50.526 50.387 0.139 1
1 242 . 7 1 1 A 25 25 ALA CB C 2448 20.458 22.137 -1.679 1
1 243 . 7 1 1 A 25 25 ALA N N 2448 132.079 122.220 9.859 1
1 244 . 7 1 1 A 26 26 GLU H H 2449 8.813 9.038 -0.225 1
1 245 . 7 1 1 A 26 26 GLU HA H 2449 5.830 5.455 0.375 1
1 250 . 7 1 1 A 26 26 GLU C C 2449 176.272 174.863 1.409 1
1 251 . 7 1 1 A 26 26 GLU CA C 2449 54.376 54.945 -0.569 1
1 252 . 7 1 1 A 26 26 GLU CB C 2449 35.463 33.794 1.669 1
1 254 . 7 1 1 A 26 26 GLU N N 2449 120.079 117.797 2.282 1
1 255 . 7 1 1 A 27 27 PHE H H 2450 8.782 8.628 0.154 1
1 256 . 7 1 1 A 27 27 PHE HA H 2450 5.021 5.112 -0.091 1
1 264 . 7 1 1 A 27 27 PHE C C 2450 171.205 172.008 -0.803 1
1 265 . 7 1 1 A 27 27 PHE CA C 2450 56.852 56.290 0.562 1
1 266 . 7 1 1 A 27 27 PHE CB C 2450 41.080 40.955 0.125 1
1 270 . 7 1 1 A 27 27 PHE N N 2450 118.670 117.153 1.517 1
1 271 . 7 1 1 A 28 28 VAL H H 2451 8.961 9.096 -0.135 1
1 272 . 7 1 1 A 28 28 VAL HA H 2451 4.761 4.448 0.313 1
1 280 . 7 1 1 A 28 28 VAL C C 2451 174.673 175.679 -1.006 1
1 281 . 7 1 1 A 28 28 VAL CA C 2451 60.619 61.136 -0.517 1
1 282 . 7 1 1 A 28 28 VAL CB C 2451 35.484 34.118 1.366 1
1 285 . 7 1 1 A 28 28 VAL N N 2451 121.552 119.589 1.963 1
1 286 . 7 1 1 A 29 29 VAL H H 2452 9.294 8.892 0.402 1
1 287 . 7 1 1 A 29 29 VAL HA H 2452 4.363 4.255 0.108 1
1 295 . 7 1 1 A 29 29 VAL C C 2452 174.218 175.147 -0.929 1
1 296 . 7 1 1 A 29 29 VAL CA C 2452 61.526 62.973 -1.447 1
1 297 . 7 1 1 A 29 29 VAL CB C 2452 32.666 31.234 1.432 1
1 300 . 7 1 1 A 29 29 VAL N N 2452 125.585 128.326 -2.741 1
1 301 . 7 1 1 A 30 30 ASN H H 2453 9.465 8.863 0.602 1
1 302 . 7 1 1 A 30 30 ASN HA H 2453 5.096 5.070 0.026 1
1 307 . 7 1 1 A 30 30 ASN C C 2453 176.216 176.146 0.070 1
1 308 . 7 1 1 A 30 30 ASN CA C 2453 52.011 52.447 -0.436 1
1 309 . 7 1 1 A 30 30 ASN CB C 2453 39.057 38.587 0.470 1
1 310 . 7 1 1 A 30 30 ASN N N 2453 127.724 127.177 0.547 1
1 312 . 7 1 1 A 31 31 THR H H 2454 8.915 8.571 0.344 1
1 313 . 7 1 1 A 31 31 THR HA H 2454 4.342 4.368 -0.026 1
1 318 . 7 1 1 A 31 31 THR C C 2454 176.816 176.302 0.514 1
1 319 . 7 1 1 A 31 31 THR CA C 2454 61.117 62.657 -1.540 1
1 320 . 7 1 1 A 31 31 THR CB C 2454 68.209 69.516 -1.307 1
1 322 . 7 1 1 A 31 31 THR N N 2454 117.783 117.604 0.179 1
1 323 . 7 1 1 A 32 32 SER H H 2455 8.454 8.074 0.380 1
1 324 . 7 1 1 A 32 32 SER HA H 2455 4.155 4.140 0.015 1
1 327 . 7 1 1 A 32 32 SER C C 2455 175.458 176.760 -1.302 1
1 328 . 7 1 1 A 32 32 SER CA C 2455 62.148 61.079 1.069 1
1 329 . 7 1 1 A 32 32 SER CB C 2455 63.476 63.181 0.295 1
1 330 . 7 1 1 A 32 32 SER N N 2455 121.781 118.142 3.639 1
1 331 . 7 1 1 A 33 33 ASN H H 2456 8.845 8.302 0.543 1
1 332 . 7 1 1 A 33 33 ASN HA H 2456 5.064 4.589 0.475 1
1 337 . 7 1 1 A 33 33 ASN C C 2456 174.674 176.192 -1.518 1
1 338 . 7 1 1 A 33 33 ASN CA C 2456 53.067 55.199 -2.132 1
1 339 . 7 1 1 A 33 33 ASN CB C 2456 39.632 38.514 1.118 1
1 340 . 7 1 1 A 33 33 ASN N N 2456 120.176 118.627 1.549 1
1 342 . 7 1 1 A 34 34 ALA H H 2457 7.714 7.949 -0.235 1
1 343 . 7 1 1 A 34 34 ALA HA H 2457 4.482 4.488 -0.006 1
1 347 . 7 1 1 A 34 34 ALA C C 2457 177.582 178.048 -0.466 1
1 348 . 7 1 1 A 34 34 ALA CA C 2457 52.521 52.440 0.081 1
1 349 . 7 1 1 A 34 34 ALA CB C 2457 22.252 20.959 1.293 1
1 350 . 7 1 1 A 34 34 ALA N N 2457 123.065 120.172 2.893 1
1 351 . 7 1 1 A 35 35 GLY H H 2458 8.195 7.778 0.417 1
1 352 . 7 1 1 A 35 35 GLY HA2 H 2458 4.246 4.103 0.143 1
1 353 . 7 1 1 A 35 35 GLY HA3 H 2458 3.902 4.123 -0.221 1
1 354 . 7 1 1 A 35 35 GLY C C 2458 173.360 173.050 0.310 1
1 355 . 7 1 1 A 35 35 GLY CA C 2458 44.486 43.968 0.518 1
1 356 . 7 1 1 A 35 35 GLY N N 2458 108.472 104.412 4.060 1
1 357 . 7 1 1 A 36 36 ALA H H 2459 8.430 7.702 0.728 1
1 358 . 7 1 1 A 36 36 ALA HA H 2459 4.472 4.898 -0.426 1
1 362 . 7 1 1 A 36 36 ALA C C 2459 176.968 177.584 -0.616 1
1 363 . 7 1 1 A 36 36 ALA CA C 2459 52.695 51.131 1.564 1
1 364 . 7 1 1 A 36 36 ALA CB C 2459 19.360 20.419 -1.059 1
1 365 . 7 1 1 A 36 36 ALA N N 2459 126.012 124.122 1.890 1
1 366 . 7 1 1 A 37 37 GLY H H 2460 7.781 8.401 -0.620 1
1 367 . 7 1 1 A 37 37 GLY HA2 H 2460 3.856 3.993 -0.137 1
1 368 . 7 1 1 A 37 37 GLY HA3 H 2460 3.164 4.094 -0.930 1
1 369 . 7 1 1 A 37 37 GLY C C 2460 170.730 171.889 -1.159 1
1 370 . 7 1 1 A 37 37 GLY CA C 2460 44.747 45.468 -0.721 1
1 371 . 7 1 1 A 37 37 GLY N N 2460 109.493 106.746 2.747 1
1 372 . 7 1 1 A 38 38 ALA H H 2461 8.055 7.998 0.057 1
1 373 . 7 1 1 A 38 38 ALA HA H 2461 4.389 4.657 -0.268 1
1 377 . 7 1 1 A 38 38 ALA C C 2461 176.609 176.477 0.132 1
1 378 . 7 1 1 A 38 38 ALA CA C 2461 51.419 51.767 -0.348 1
1 379 . 7 1 1 A 38 38 ALA CB C 2461 19.665 19.548 0.117 1
1 380 . 7 1 1 A 38 38 ALA N N 2461 121.997 123.230 -1.233 1
1 381 . 7 1 1 A 39 39 LEU H H 2462 8.597 8.635 -0.038 1
1 382 . 7 1 1 A 39 39 LEU HA H 2462 5.022 5.206 -0.184 1
1 392 . 7 1 1 A 39 39 LEU C C 2462 175.883 175.140 0.743 1
1 393 . 7 1 1 A 39 39 LEU CA C 2462 53.907 53.224 0.683 1
1 394 . 7 1 1 A 39 39 LEU CB C 2462 44.576 45.006 -0.430 1
1 398 . 7 1 1 A 39 39 LEU N N 2462 126.664 124.670 1.994 1
1 399 . 7 1 1 A 40 40 SER H H 2463 8.898 9.327 -0.429 1
1 400 . 7 1 1 A 40 40 SER HA H 2463 4.732 4.733 -0.001 1
1 403 . 7 1 1 A 40 40 SER C C 2463 172.984 172.926 0.058 1
1 404 . 7 1 1 A 40 40 SER CA C 2463 56.730 56.932 -0.202 1
1 405 . 7 1 1 A 40 40 SER CB C 2463 64.648 64.150 0.498 1
1 406 . 7 1 1 A 40 40 SER N N 2463 122.932 122.226 0.706 1
1 407 . 7 1 1 A 41 41 VAL H H 2464 8.538 7.359 1.179 1
1 408 . 7 1 1 A 41 41 VAL HA H 2464 5.131 4.191 0.940 1
1 416 . 7 1 1 A 41 41 VAL C C 2464 174.812 175.320 -0.508 1
1 417 . 7 1 1 A 41 41 VAL CA C 2464 60.784 63.028 -2.244 1
1 418 . 7 1 1 A 41 41 VAL CB C 2464 34.262 31.993 2.269 1
1 420 . 7 1 1 A 41 41 VAL N N 2464 129.161 122.990 6.171 1
1 421 . 7 1 1 A 42 42 THR H H 2465 8.807 8.599 0.208 1
1 422 . 7 1 1 A 42 42 THR HA H 2465 4.573 4.807 -0.234 1
1 427 . 7 1 1 A 42 42 THR CA C 2465 60.408 60.511 -0.103 1
1 428 . 7 1 1 A 42 42 THR CB C 2465 71.764 70.084 1.680 1
1 430 . 7 1 1 A 42 42 THR N N 2465 120.898 121.408 -0.510 1
1 431 . 7 1 1 A 43 43 ILE H H 2466 8.648 8.465 0.183 1
1 432 . 7 1 1 A 43 43 ILE HA H 2466 4.854 4.937 -0.083 1
1 442 . 7 1 1 A 43 43 ILE C C 2466 174.073 173.917 0.156 1
1 443 . 7 1 1 A 43 43 ILE CA C 2466 61.184 60.145 1.039 1
1 444 . 7 1 1 A 43 43 ILE CB C 2466 39.516 41.609 -2.093 1
1 448 . 7 1 1 A 43 43 ILE N N 2466 124.810 122.944 1.866 1
1 449 . 7 1 1 A 44 44 ASP H H 2467 8.821 9.175 -0.354 1
1 450 . 7 1 1 A 44 44 ASP HA H 2467 5.217 5.661 -0.444 1
1 453 . 7 1 1 A 44 44 ASP C C 2467 175.002 175.223 -0.221 1
1 454 . 7 1 1 A 44 44 ASP CA C 2467 52.998 52.479 0.519 1
1 455 . 7 1 1 A 44 44 ASP CB C 2467 44.728 44.486 0.242 1
1 456 . 7 1 1 A 44 44 ASP N N 2467 129.093 127.925 1.168 1
1 457 . 7 1 1 A 45 45 GLY H H 2468 8.535 8.286 0.249 1
1 458 . 7 1 1 A 45 45 GLY HA2 H 2468 3.954 3.787 0.167 1
1 459 . 7 1 1 A 45 45 GLY HA3 H 2468 3.561 4.023 -0.462 1
1 460 . 7 1 1 A 45 45 GLY CA C 2468 45.659 45.084 0.575 1
1 461 . 7 1 1 A 45 45 GLY N N 2468 112.751 110.879 1.872 1
1 462 . 7 1 1 A 46 46 PRO HA H 2469 4.318 4.399 -0.081 1
1 469 . 7 1 1 A 46 46 PRO C C 2469 176.086 175.422 0.664 1
1 470 . 7 1 1 A 46 46 PRO CA C 2469 64.198 63.926 0.272 1
1 471 . 7 1 1 A 46 46 PRO CB C 2469 32.348 31.297 1.051 1
1 474 . 7 1 1 A 47 47 SER H H 2470 7.106 7.420 -0.314 1
1 475 . 7 1 1 A 47 47 SER HA H 2470 4.632 4.924 -0.292 1
1 478 . 7 1 1 A 47 47 SER C C 2470 172.969 172.759 0.210 1
1 479 . 7 1 1 A 47 47 SER CA C 2470 57.106 57.373 -0.267 1
1 480 . 7 1 1 A 47 47 SER CB C 2470 66.262 65.791 0.471 1
1 481 . 7 1 1 A 47 47 SER N N 2470 110.556 109.893 0.663 1
1 482 . 7 1 1 A 48 48 LYS H H 2471 8.534 8.335 0.199 1
1 483 . 7 1 1 A 48 48 LYS HA H 2471 4.486 4.489 -0.003 1
1 492 . 7 1 1 A 48 48 LYS C C 2471 177.231 176.365 0.866 1
1 493 . 7 1 1 A 48 48 LYS CA C 2471 56.620 55.669 0.951 1
1 494 . 7 1 1 A 48 48 LYS CB C 2471 32.379 31.158 1.221 1
1 498 . 7 1 1 A 48 48 LYS N N 2471 124.055 122.867 1.188 1
1 499 . 7 1 1 A 49 49 VAL H H 2472 8.497 8.270 0.227 1
1 500 . 7 1 1 A 49 49 VAL HA H 2472 4.552 4.053 0.499 1
1 508 . 7 1 1 A 49 49 VAL C C 2472 175.292 175.371 -0.079 1
1 509 . 7 1 1 A 49 49 VAL CA C 2472 60.142 62.491 -2.349 1
1 510 . 7 1 1 A 49 49 VAL CB C 2472 33.464 32.712 0.752 1
1 513 . 7 1 1 A 49 49 VAL N N 2472 121.233 122.847 -1.614 1
1 514 . 7 1 1 A 50 50 LYS H H 2473 8.190 8.688 -0.498 1
1 515 . 7 1 1 A 50 50 LYS HA H 2473 4.522 4.409 0.113 1
1 518 . 7 1 1 A 50 50 LYS CA C 2473 55.952 55.281 0.671 1
1 519 . 7 1 1 A 50 50 LYS CB C 2473 32.896 31.024 1.872 1
1 520 . 7 1 1 A 50 50 LYS N N 2473 126.082 126.008 0.074 1
1 521 . 7 1 1 A 51 51 MET H H 2474 8.818 8.804 0.014 1
1 522 . 7 1 1 A 51 51 MET HA H 2474 5.324 4.998 0.326 1
1 530 . 7 1 1 A 51 51 MET C C 2474 173.933 174.798 -0.865 1
1 531 . 7 1 1 A 51 51 MET CA C 2474 54.848 55.417 -0.569 1
1 532 . 7 1 1 A 51 51 MET CB C 2474 37.043 33.607 3.436 1
1 535 . 7 1 1 A 51 51 MET N N 2474 126.911 126.579 0.332 1
1 536 . 7 1 1 A 52 52 ASP H H 2475 9.095 9.320 -0.225 1
1 537 . 7 1 1 A 52 52 ASP HA H 2475 4.947 5.420 -0.473 1
1 540 . 7 1 1 A 52 52 ASP C C 2475 173.923 173.681 0.242 1
1 541 . 7 1 1 A 52 52 ASP CA C 2475 53.487 52.517 0.970 1
1 542 . 7 1 1 A 52 52 ASP CB C 2475 44.765 44.524 0.241 1
1 543 . 7 1 1 A 52 52 ASP N N 2475 125.526 126.513 -0.987 1
1 544 . 7 1 1 A 53 53 CYS H H 2476 8.606 9.037 -0.431 1
1 545 . 7 1 1 A 53 53 CYS HA H 2476 5.145 5.388 -0.243 1
1 548 . 7 1 1 A 53 53 CYS C C 2476 173.330 173.825 -0.495 1
1 549 . 7 1 1 A 53 53 CYS CA C 2476 57.452 57.219 0.233 1
1 550 . 7 1 1 A 53 53 CYS CB C 2476 28.108 30.765 -2.657 1
1 551 . 7 1 1 A 53 53 CYS N N 2476 124.317 126.368 -2.051 1
1 552 . 7 1 1 A 54 54 GLN H H 2477 8.978 9.098 -0.120 1
1 553 . 7 1 1 A 54 54 GLN HA H 2477 4.884 4.844 0.040 1
1 560 . 7 1 1 A 54 54 GLN C C 2477 174.854 174.039 0.815 1
1 561 . 7 1 1 A 54 54 GLN CA C 2477 53.891 54.589 -0.698 1
1 562 . 7 1 1 A 54 54 GLN CB C 2477 32.837 32.574 0.263 1
1 564 . 7 1 1 A 54 54 GLN N N 2477 127.074 125.821 1.253 1
1 566 . 7 1 1 A 55 55 GLU H H 2478 9.065 8.690 0.375 1
1 567 . 7 1 1 A 55 55 GLU HA H 2478 4.280 4.765 -0.485 1
1 572 . 7 1 1 A 55 55 GLU C C 2478 175.383 175.852 -0.469 1
1 573 . 7 1 1 A 55 55 GLU CA C 2478 57.516 56.158 1.358 1
1 574 . 7 1 1 A 55 55 GLU CB C 2478 30.346 30.744 -0.398 1
1 576 . 7 1 1 A 55 55 GLU N N 2478 125.186 122.382 2.804 1
1 577 . 7 1 1 A 56 56 CYS H H 2479 8.407 8.676 -0.269 1
1 578 . 7 1 1 A 56 56 CYS HA H 2479 5.056 4.725 0.331 1
1 581 . 7 1 1 A 56 56 CYS CA C 2479 55.858 56.980 -1.122 1
1 582 . 7 1 1 A 56 56 CYS CB C 2479 28.676 30.410 -1.734 1
1 583 . 7 1 1 A 56 56 CYS N N 2479 121.499 124.050 -2.551 1
1 584 . 7 1 1 A 57 57 PRO HA H 2480 4.159 4.279 -0.120 1
1 591 . 7 1 1 A 57 57 PRO C C 2480 177.964 177.728 0.236 1
1 592 . 7 1 1 A 57 57 PRO CA C 2480 66.877 64.825 2.052 1
1 593 . 7 1 1 A 57 57 PRO CB C 2480 31.709 31.821 -0.112 1
1 596 . 7 1 1 A 58 58 GLU H H 2481 8.900 8.244 0.656 1
1 597 . 7 1 1 A 58 58 GLU HA H 2481 4.201 4.373 -0.172 1
1 602 . 7 1 1 A 58 58 GLU C C 2481 175.129 176.587 -1.458 1
1 603 . 7 1 1 A 58 58 GLU CA C 2481 57.883 57.232 0.651 1
1 604 . 7 1 1 A 58 58 GLU CB C 2481 29.991 30.413 -0.422 1
1 606 . 7 1 1 A 58 58 GLU N N 2481 115.316 118.135 -2.819 1
1 607 . 7 1 1 A 59 59 GLY H H 2482 7.527 7.151 0.376 1
1 608 . 7 1 1 A 59 59 GLY HA2 H 2482 4.935 4.054 0.881 1
1 609 . 7 1 1 A 59 59 GLY HA3 H 2482 3.381 4.158 -0.777 1
1 610 . 7 1 1 A 59 59 GLY CA C 2482 47.809 44.461 3.348 1
1 611 . 7 1 1 A 59 59 GLY N N 2482 110.079 107.462 2.617 1
1 612 . 7 1 1 A 60 60 TYR H H 2483 8.990 8.339 0.651 1
1 613 . 7 1 1 A 60 60 TYR HA H 2483 5.157 4.849 0.308 1
1 618 . 7 1 1 A 60 60 TYR C C 2483 175.096 174.956 0.140 1
1 619 . 7 1 1 A 60 60 TYR CA C 2483 57.375 57.928 -0.553 1
1 620 . 7 1 1 A 60 60 TYR CB C 2483 43.153 38.916 4.237 1
1 622 . 7 1 1 A 60 60 TYR N N 2483 125.900 122.119 3.781 1
1 623 . 7 1 1 A 61 61 ARG H H 2484 9.557 8.708 0.849 1
1 624 . 7 1 1 A 61 61 ARG HA H 2484 4.858 4.436 0.422 1
1 631 . 7 1 1 A 61 61 ARG CA C 2484 55.016 56.549 -1.533 1
1 632 . 7 1 1 A 61 61 ARG CB C 2484 32.128 30.997 1.131 1
1 635 . 7 1 1 A 61 61 ARG N N 2484 124.847 125.965 -1.118 1
1 636 . 7 1 1 A 62 62 VAL H H 2485 9.046 8.907 0.139 1
1 637 . 7 1 1 A 62 62 VAL HA H 2485 4.675 4.894 -0.219 1
1 645 . 7 1 1 A 62 62 VAL C C 2485 173.837 174.630 -0.793 1
1 646 . 7 1 1 A 62 62 VAL CA C 2485 60.752 59.668 1.084 1
1 647 . 7 1 1 A 62 62 VAL CB C 2485 32.459 34.495 -2.036 1
1 650 . 7 1 1 A 62 62 VAL N N 2485 132.205 120.816 11.389 1
1 651 . 7 1 1 A 63 63 THR H H 2486 8.474 8.700 -0.226 1
1 652 . 7 1 1 A 63 63 THR HA H 2486 5.392 5.455 -0.063 1
1 657 . 7 1 1 A 63 63 THR C C 2486 173.675 173.574 0.101 1
1 658 . 7 1 1 A 63 63 THR CA C 2486 60.008 61.172 -1.164 1
1 659 . 7 1 1 A 63 63 THR CB C 2486 71.035 71.763 -0.728 1
1 661 . 7 1 1 A 63 63 THR N N 2486 121.216 118.904 2.312 1
1 662 . 7 1 1 A 64 64 TYR H H 2487 9.409 9.043 0.366 1
1 663 . 7 1 1 A 64 64 TYR HA H 2487 5.617 5.506 0.111 1
1 670 . 7 1 1 A 64 64 TYR C C 2487 172.847 172.428 0.419 1
1 671 . 7 1 1 A 64 64 TYR CA C 2487 55.557 55.933 -0.376 1
1 672 . 7 1 1 A 64 64 TYR CB C 2487 41.968 41.734 0.234 1
1 675 . 7 1 1 A 64 64 TYR N N 2487 124.061 122.287 1.774 1
1 676 . 7 1 1 A 65 65 THR H H 2488 8.145 8.777 -0.632 1
1 677 . 7 1 1 A 65 65 THR HA H 2488 4.959 4.635 0.324 1
1 682 . 7 1 1 A 65 65 THR CA C 2488 58.532 58.884 -0.352 1
1 683 . 7 1 1 A 65 65 THR CB C 2488 70.141 70.996 -0.855 1
1 685 . 7 1 1 A 65 65 THR N N 2488 117.924 115.852 2.072 1
1 686 . 7 1 1 A 66 66 PRO HA H 2489 4.602 4.803 -0.201 1
1 693 . 7 1 1 A 66 66 PRO C C 2489 176.647 176.967 -0.320 1
1 694 . 7 1 1 A 66 66 PRO CA C 2489 61.442 62.179 -0.737 1
1 695 . 7 1 1 A 66 66 PRO CB C 2489 32.715 32.171 0.544 1
1 698 . 7 1 1 A 67 67 MET H H 2490 8.832 8.024 0.808 1
1 699 . 7 1 1 A 67 67 MET HA H 2490 4.880 4.554 0.326 1
1 707 . 7 1 1 A 67 67 MET C C 2490 174.121 175.847 -1.726 1
1 708 . 7 1 1 A 67 67 MET CA C 2490 53.848 55.345 -1.497 1
1 709 . 7 1 1 A 67 67 MET CB C 2490 33.727 33.555 0.172 1
1 712 . 7 1 1 A 67 67 MET N N 2490 119.212 118.771 0.441 1
1 713 . 7 1 1 A 68 68 ALA H H 2491 7.086 7.592 -0.506 1
1 714 . 7 1 1 A 68 68 ALA HA H 2491 4.851 4.768 0.083 1
1 718 . 7 1 1 A 68 68 ALA CA C 2491 49.222 49.517 -0.295 1
1 719 . 7 1 1 A 68 68 ALA CB C 2491 20.600 21.183 -0.583 1
1 720 . 7 1 1 A 68 68 ALA N N 2491 120.363 122.132 -1.769 1
1 721 . 7 1 1 A 69 69 PRO HA H 2492 4.263 4.552 -0.289 1
1 728 . 7 1 1 A 69 69 PRO C C 2492 174.370 176.227 -1.857 1
1 729 . 7 1 1 A 69 69 PRO CA C 2492 62.555 63.547 -0.992 1
1 730 . 7 1 1 A 69 69 PRO CB C 2492 32.752 32.881 -0.129 1
1 733 . 7 1 1 A 70 70 GLY H H 2493 8.858 8.364 0.494 1
1 734 . 7 1 1 A 70 70 GLY HA2 H 2493 4.544 4.072 0.472 1
1 735 . 7 1 1 A 70 70 GLY HA3 H 2493 3.849 4.118 -0.269 1
1 736 . 7 1 1 A 70 70 GLY C C 2493 172.182 172.394 -0.212 1
1 737 . 7 1 1 A 70 70 GLY CA C 2493 44.356 44.398 -0.042 1
1 738 . 7 1 1 A 70 70 GLY N N 2493 106.539 109.633 -3.094 1
1 739 . 7 1 1 A 71 71 SER H H 2494 8.490 8.216 0.274 1
1 740 . 7 1 1 A 71 71 SER HA H 2494 5.280 5.458 -0.178 1
1 743 . 7 1 1 A 71 71 SER C C 2494 173.512 172.891 0.621 1
1 744 . 7 1 1 A 71 71 SER CA C 2494 57.674 57.794 -0.120 1
1 745 . 7 1 1 A 71 71 SER CB C 2494 63.799 65.973 -2.174 1
1 746 . 7 1 1 A 71 71 SER N N 2494 117.964 117.241 0.723 1
1 747 . 7 1 1 A 72 72 TYR H H 2495 9.320 9.567 -0.247 1
1 748 . 7 1 1 A 72 72 TYR HA H 2495 4.960 5.278 -0.318 1
1 755 . 7 1 1 A 72 72 TYR C C 2495 173.979 175.132 -1.153 1
1 756 . 7 1 1 A 72 72 TYR CA C 2495 56.384 56.652 -0.268 1
1 757 . 7 1 1 A 72 72 TYR CB C 2495 40.247 41.267 -1.020 1
1 760 . 7 1 1 A 72 72 TYR N N 2495 126.442 123.995 2.447 1
1 761 . 7 1 1 A 73 73 LEU H H 2496 9.019 9.035 -0.016 1
1 762 . 7 1 1 A 73 73 LEU HA H 2496 5.209 4.929 0.280 1
1 772 . 7 1 1 A 73 73 LEU C C 2496 177.015 175.880 1.135 1
1 773 . 7 1 1 A 73 73 LEU CA C 2496 53.393 53.931 -0.538 1
1 774 . 7 1 1 A 73 73 LEU CB C 2496 43.918 41.973 1.945 1
1 778 . 7 1 1 A 73 73 LEU N N 2496 125.439 124.888 0.551 1
1 779 . 7 1 1 A 74 74 ILE H H 2497 9.921 9.552 0.369 1
1 780 . 7 1 1 A 74 74 ILE HA H 2497 5.128 4.580 0.548 1
1 790 . 7 1 1 A 74 74 ILE C C 2497 175.730 175.016 0.714 1
1 791 . 7 1 1 A 74 74 ILE CA C 2497 60.930 60.471 0.459 1
1 792 . 7 1 1 A 74 74 ILE CB C 2497 39.488 37.954 1.534 1
1 796 . 7 1 1 A 74 74 ILE N N 2497 132.185 126.349 5.836 1
1 797 . 7 1 1 A 75 75 SER H H 2498 9.284 9.072 0.212 1
1 798 . 7 1 1 A 75 75 SER HA H 2498 5.111 5.104 0.007 1
1 801 . 7 1 1 A 75 75 SER C C 2498 173.449 173.435 0.014 1
1 802 . 7 1 1 A 75 75 SER CA C 2498 58.260 58.313 -0.053 1
1 803 . 7 1 1 A 75 75 SER CB C 2498 63.956 63.391 0.565 1
1 804 . 7 1 1 A 75 75 SER N N 2498 125.384 124.467 0.917 1
1 805 . 7 1 1 A 76 76 ILE H H 2499 9.861 9.451 0.410 1
1 806 . 7 1 1 A 76 76 ILE HA H 2499 4.814 4.689 0.125 1
1 816 . 7 1 1 A 76 76 ILE CA C 2499 61.034 60.855 0.179 1
1 817 . 7 1 1 A 76 76 ILE CB C 2499 40.387 37.573 2.814 1
1 821 . 7 1 1 A 76 76 ILE N N 2499 129.414 127.627 1.787 1
1 822 . 7 1 1 A 77 77 LYS H H 2500 8.827 9.031 -0.204 1
1 823 . 7 1 1 A 77 77 LYS HA H 2500 5.254 5.216 0.038 1
1 832 . 7 1 1 A 77 77 LYS C C 2500 175.245 175.598 -0.353 1
1 833 . 7 1 1 A 77 77 LYS CA C 2500 54.388 55.145 -0.757 1
1 834 . 7 1 1 A 77 77 LYS CB C 2500 36.127 35.069 1.058 1
1 838 . 7 1 1 A 77 77 LYS N N 2500 126.922 127.015 -0.093 1
1 839 . 7 1 1 A 78 78 TYR H H 2501 8.408 9.127 -0.719 1
1 840 . 7 1 1 A 78 78 TYR HA H 2501 5.479 5.023 0.456 1
1 847 . 7 1 1 A 78 78 TYR C C 2501 174.792 175.589 -0.797 1
1 848 . 7 1 1 A 78 78 TYR CA C 2501 56.837 57.218 -0.381 1
1 849 . 7 1 1 A 78 78 TYR CB C 2501 44.008 42.231 1.777 1
1 852 . 7 1 1 A 78 78 TYR N N 2501 122.282 124.304 -2.022 1
1 853 . 7 1 1 A 79 79 GLY H H 2502 8.196 8.404 -0.208 1
1 854 . 7 1 1 A 79 79 GLY HA2 H 2502 4.040 3.596 0.444 1
1 855 . 7 1 1 A 79 79 GLY HA3 H 2502 3.465 3.747 -0.282 1
1 856 . 7 1 1 A 79 79 GLY C C 2502 173.932 173.697 0.235 1
1 857 . 7 1 1 A 79 79 GLY CA C 2502 45.741 46.067 -0.326 1
1 858 . 7 1 1 A 79 79 GLY N N 2502 113.451 113.694 -0.243 1
1 859 . 7 1 1 A 80 80 GLY H H 2503 7.589 8.262 -0.673 1
1 860 . 7 1 1 A 80 80 GLY HA2 H 2503 4.490 4.004 0.486 1
1 861 . 7 1 1 A 80 80 GLY HA3 H 2503 3.555 4.089 -0.534 1
1 862 . 7 1 1 A 80 80 GLY CA C 2503 43.540 44.075 -0.535 1
1 863 . 7 1 1 A 80 80 GLY N N 2503 107.293 107.364 -0.071 1
1 864 . 7 1 1 A 81 81 PRO HA H 2504 4.320 4.344 -0.024 1
1 871 . 7 1 1 A 81 81 PRO C C 2504 175.311 175.373 -0.062 1
1 872 . 7 1 1 A 81 81 PRO CA C 2504 62.722 63.535 -0.813 1
1 873 . 7 1 1 A 81 81 PRO CB C 2504 29.297 32.057 -2.760 1
1 876 . 7 1 1 A 82 82 TYR H H 2505 7.778 7.436 0.342 1
1 877 . 7 1 1 A 82 82 TYR HA H 2505 4.791 4.915 -0.124 1
1 884 . 7 1 1 A 82 82 TYR C C 2505 175.086 175.884 -0.798 1
1 885 . 7 1 1 A 82 82 TYR CA C 2505 56.111 57.067 -0.956 1
1 886 . 7 1 1 A 82 82 TYR CB C 2505 39.483 40.329 -0.846 1
1 889 . 7 1 1 A 82 82 TYR N N 2505 123.973 121.084 2.889 1
1 890 . 7 1 1 A 83 83 HIS H H 2506 8.625 8.963 -0.338 1
1 891 . 7 1 1 A 83 83 HIS HA H 2506 4.583 4.966 -0.383 1
1 896 . 7 1 1 A 83 83 HIS C C 2506 178.161 175.702 2.459 1
1 897 . 7 1 1 A 83 83 HIS CA C 2506 58.241 57.301 0.940 1
1 898 . 7 1 1 A 83 83 HIS CB C 2506 33.132 30.695 2.437 1
1 901 . 7 1 1 A 83 83 HIS N N 2506 124.092 121.841 2.251 1
1 902 . 7 1 1 A 84 84 ILE H H 2507 8.327 8.604 -0.277 1
1 903 . 7 1 1 A 84 84 ILE HA H 2507 4.553 4.349 0.204 1
1 913 . 7 1 1 A 84 84 ILE C C 2507 176.523 176.526 -0.003 1
1 914 . 7 1 1 A 84 84 ILE CA C 2507 60.791 60.406 0.385 1
1 915 . 7 1 1 A 84 84 ILE CB C 2507 39.162 39.606 -0.444 1
1 919 . 7 1 1 A 84 84 ILE N N 2507 117.355 119.499 -2.144 1
1 920 . 7 1 1 A 85 85 GLY H H 2508 9.130 8.703 0.427 1
1 921 . 7 1 1 A 85 85 GLY HA2 H 2508 3.883 3.881 0.002 1
1 922 . 7 1 1 A 85 85 GLY HA3 H 2508 3.800 3.930 -0.130 1
1 923 . 7 1 1 A 85 85 GLY C C 2508 174.438 174.972 -0.534 1
1 924 . 7 1 1 A 85 85 GLY CA C 2508 47.673 47.227 0.446 1
1 925 . 7 1 1 A 85 85 GLY N N 2508 111.346 112.780 -1.434 1
1 926 . 7 1 1 A 86 86 GLY H H 2509 8.236 9.083 -0.847 1
1 927 . 7 1 1 A 86 86 GLY HA2 H 2509 3.893 3.589 0.304 1
1 928 . 7 1 1 A 86 86 GLY HA3 H 2509 3.161 3.731 -0.570 1
1 929 . 7 1 1 A 86 86 GLY C C 2509 171.837 173.262 -1.425 1
1 930 . 7 1 1 A 86 86 GLY CA C 2509 44.844 44.797 0.047 1
1 931 . 7 1 1 A 86 86 GLY N N 2509 115.594 115.825 -0.231 1
1 932 . 7 1 1 A 87 87 SER H H 2510 7.385 7.738 -0.353 1
1 933 . 7 1 1 A 87 87 SER HA H 2510 4.217 4.153 0.064 1
1 936 . 7 1 1 A 87 87 SER CA C 2510 54.783 55.511 -0.728 1
1 937 . 7 1 1 A 87 87 SER CB C 2510 62.683 63.775 -1.092 1
1 938 . 7 1 1 A 87 87 SER N N 2510 112.859 116.211 -3.352 1
1 939 . 7 1 1 A 88 88 PRO HA H 2511 5.532 4.769 0.763 1
1 946 . 7 1 1 A 88 88 PRO C C 2511 175.870 175.783 0.087 1
1 947 . 7 1 1 A 88 88 PRO CA C 2511 62.379 62.410 -0.031 1
1 948 . 7 1 1 A 88 88 PRO CB C 2511 33.639 32.493 1.146 1
1 951 . 7 1 1 A 89 89 PHE H H 2512 9.359 8.705 0.654 1
1 952 . 7 1 1 A 89 89 PHE HA H 2512 4.467 4.887 -0.420 1
1 960 . 7 1 1 A 89 89 PHE C C 2512 175.152 175.176 -0.024 1
1 961 . 7 1 1 A 89 89 PHE CA C 2512 57.401 57.465 -0.064 1
1 962 . 7 1 1 A 89 89 PHE CB C 2512 40.843 40.735 0.108 1
1 966 . 7 1 1 A 89 89 PHE N N 2512 124.789 120.469 4.320 1
1 967 . 7 1 1 A 90 90 LYS H H 2513 8.772 8.566 0.206 1
1 968 . 7 1 1 A 90 90 LYS HA H 2513 4.941 4.681 0.260 1
1 973 . 7 1 1 A 90 90 LYS C C 2513 174.183 175.852 -1.669 1
1 974 . 7 1 1 A 90 90 LYS CA C 2513 55.749 55.789 -0.040 1
1 975 . 7 1 1 A 90 90 LYS CB C 2513 32.817 32.486 0.331 1
1 978 . 7 1 1 A 90 90 LYS N N 2513 125.133 122.540 2.593 1
1 979 . 7 1 1 A 91 91 ALA H H 2514 9.158 9.131 0.027 1
1 980 . 7 1 1 A 91 91 ALA HA H 2514 4.510 4.955 -0.445 1
1 984 . 7 1 1 A 91 91 ALA C C 2514 176.561 176.900 -0.339 1
1 985 . 7 1 1 A 91 91 ALA CA C 2514 50.528 51.364 -0.836 1
1 986 . 7 1 1 A 91 91 ALA CB C 2514 20.653 20.308 0.345 1
1 987 . 7 1 1 A 91 91 ALA N N 2514 131.989 128.404 3.585 1
1 988 . 7 1 1 A 92 92 LYS H H 2515 8.186 8.855 -0.669 1
1 989 . 7 1 1 A 92 92 LYS HA H 2515 4.926 4.928 -0.002 1
1 998 . 7 1 1 A 92 92 LYS C C 2515 175.177 175.911 -0.734 1
1 999 . 7 1 1 A 92 92 LYS CA C 2515 55.725 55.597 0.128 1
1 1000 . 7 1 1 A 92 92 LYS CB C 2515 33.765 34.332 -0.567 1
1 1004 . 7 1 1 A 92 92 LYS N N 2515 124.887 123.595 1.292 1
1 1005 . 7 1 1 A 93 93 VAL H H 2516 9.362 9.137 0.225 1
1 1006 . 7 1 1 A 93 93 VAL HA H 2516 5.161 5.328 -0.167 1
1 1014 . 7 1 1 A 93 93 VAL C C 2516 176.988 175.335 1.653 1
1 1015 . 7 1 1 A 93 93 VAL CA C 2516 60.523 61.055 -0.532 1
1 1016 . 7 1 1 A 93 93 VAL CB C 2516 33.291 35.217 -1.926 1
1 1019 . 7 1 1 A 93 93 VAL N N 2516 129.943 123.391 6.552 1
1 1020 . 7 1 1 A 94 94 THR H H 2517 8.614 8.566 0.048 1
1 1021 . 7 1 1 A 94 94 THR HA H 2517 4.902 4.943 -0.041 1
1 1026 . 7 1 1 A 94 94 THR C C 2517 172.759 173.194 -0.435 1
1 1027 . 7 1 1 A 94 94 THR CA C 2517 60.121 59.753 0.368 1
1 1028 . 7 1 1 A 94 94 THR CB C 2517 71.072 71.432 -0.360 1
1 1030 . 7 1 1 A 94 94 THR N N 2517 122.032 116.943 5.089 1
1 1031 . 7 1 1 A 95 95 GLY H H 2518 8.280 8.446 -0.166 1
1 1032 . 7 1 1 A 95 95 GLY HA2 H 2518 3.852 4.138 -0.286 1
1 1033 . 7 1 1 A 95 95 GLY HA3 H 2518 4.846 4.141 0.705 1
1 1034 . 7 1 1 A 95 95 GLY CA C 2518 43.955 44.376 -0.421 1
1 1035 . 7 1 1 A 95 95 GLY N N 2518 107.949 107.304 0.645 1
1 1036 . 7 1 1 A 96 96 PRO HA H 2519 4.449 4.683 -0.234 1
1 1043 . 7 1 1 A 96 96 PRO C C 2519 176.892 177.202 -0.310 1
1 1044 . 7 1 1 A 96 96 PRO CA C 2519 62.062 62.674 -0.612 1
1 1045 . 7 1 1 A 96 96 PRO CB C 2519 32.286 32.682 -0.396 1
1 1048 . 7 1 1 A 97 97 ARG H H 2520 8.651 8.955 -0.304 1
1 1049 . 7 1 1 A 97 97 ARG HA H 2520 4.348 4.148 0.200 1
1 1056 . 7 1 1 A 97 97 ARG C C 2520 176.236 176.269 -0.033 1
1 1057 . 7 1 1 A 97 97 ARG CA C 2520 57.587 59.214 -1.627 1
1 1058 . 7 1 1 A 97 97 ARG CB C 2520 30.472 31.116 -0.644 1
1 1061 . 7 1 1 A 97 97 ARG N N 2520 120.781 123.549 -2.768 1
1 1062 . 7 1 1 A 98 98 LEU H H 2521 8.545 7.950 0.595 1
1 1063 . 7 1 1 A 98 98 LEU HA H 2521 4.577 3.982 0.595 1
1 1073 . 7 1 1 A 98 98 LEU C C 2521 175.880 176.375 -0.495 1
1 1074 . 7 1 1 A 98 98 LEU CA C 2521 55.068 57.599 -2.531 1
1 1075 . 7 1 1 A 98 98 LEU CB C 2521 43.082 39.913 3.169 1
1 1079 . 7 1 1 A 98 98 LEU N N 2521 128.715 119.498 9.217 1
1 4 . 8 1 1 A 2 2 ALA HA H -2 4.374 5.061 -0.687 1
1 8 . 8 1 1 A 2 2 ALA C C -2 177.865 176.169 1.696 1
1 9 . 8 1 1 A 2 2 ALA CA C -2 52.670 51.253 1.417 1
1 10 . 8 1 1 A 2 2 ALA CB C -2 19.508 23.281 -3.773 1
1 32 . 8 1 1 A 5 5 ASP H H 2428 8.300 8.280 0.020 1
1 33 . 8 1 1 A 5 5 ASP HA H 2428 5.082 5.313 -0.231 1
1 36 . 8 1 1 A 5 5 ASP CA C 2428 51.517 50.798 0.719 1
1 37 . 8 1 1 A 5 5 ASP CB C 2428 42.244 43.355 -1.111 1
1 38 . 8 1 1 A 5 5 ASP N N 2428 122.879 119.266 3.613 1
1 39 . 8 1 1 A 6 6 PRO HA H 2429 4.340 4.355 -0.015 1
1 46 . 8 1 1 A 6 6 PRO C C 2429 178.266 178.275 -0.009 1
1 47 . 8 1 1 A 6 6 PRO CA C 2429 64.494 64.840 -0.346 1
1 48 . 8 1 1 A 6 6 PRO CB C 2429 31.841 31.903 -0.062 1
1 51 . 8 1 1 A 7 7 GLY H H 2430 8.686 8.442 0.244 1
1 52 . 8 1 1 A 7 7 GLY HA2 H 2430 4.116 3.873 0.243 1
1 53 . 8 1 1 A 7 7 GLY HA3 H 2430 3.868 3.875 -0.007 1
1 54 . 8 1 1 A 7 7 GLY C C 2430 174.567 175.614 -1.047 1
1 55 . 8 1 1 A 7 7 GLY CA C 2430 46.038 46.535 -0.497 1
1 56 . 8 1 1 A 7 7 GLY N N 2430 107.655 106.272 1.383 1
1 57 . 8 1 1 A 8 8 LEU H H 2431 7.692 7.468 0.224 1
1 58 . 8 1 1 A 8 8 LEU HA H 2431 4.507 4.371 0.136 1
1 68 . 8 1 1 A 8 8 LEU C C 2431 176.876 177.687 -0.811 1
1 69 . 8 1 1 A 8 8 LEU CA C 2431 54.307 56.976 -2.669 1
1 70 . 8 1 1 A 8 8 LEU CB C 2431 42.879 42.691 0.188 1
1 74 . 8 1 1 A 8 8 LEU N N 2431 120.022 120.177 -0.155 1
1 75 . 8 1 1 A 9 9 VAL H H 2432 7.378 7.518 -0.140 1
1 76 . 8 1 1 A 9 9 VAL HA H 2432 4.154 3.895 0.259 1
1 84 . 8 1 1 A 9 9 VAL C C 2432 174.703 175.504 -0.801 1
1 85 . 8 1 1 A 9 9 VAL CA C 2432 62.387 63.261 -0.874 1
1 86 . 8 1 1 A 9 9 VAL CB C 2432 32.519 31.398 1.121 1
1 89 . 8 1 1 A 9 9 VAL N N 2432 123.902 119.541 4.361 1
1 90 . 8 1 1 A 10 10 SER H H 2433 8.201 8.721 -0.520 1
1 91 . 8 1 1 A 10 10 SER HA H 2433 5.136 4.924 0.212 1
1 94 . 8 1 1 A 10 10 SER CA C 2433 56.554 55.571 0.983 1
1 95 . 8 1 1 A 10 10 SER CB C 2433 66.763 65.149 1.614 1
1 96 . 8 1 1 A 10 10 SER N N 2433 121.921 122.080 -0.159 1
1 97 . 8 1 1 A 11 11 ALA H H 2434 8.670 8.163 0.507 1
1 98 . 8 1 1 A 11 11 ALA HA H 2434 5.632 5.232 0.400 1
1 102 . 8 1 1 A 11 11 ALA C C 2434 175.459 174.402 1.057 1
1 103 . 8 1 1 A 11 11 ALA CA C 2434 50.575 50.752 -0.177 1
1 104 . 8 1 1 A 11 11 ALA CB C 2434 23.111 23.170 -0.059 1
1 105 . 8 1 1 A 11 11 ALA N N 2434 124.828 123.511 1.317 1
1 106 . 8 1 1 A 12 12 TYR H H 2435 8.609 8.654 -0.045 1
1 107 . 8 1 1 A 12 12 TYR HA H 2435 4.879 5.076 -0.197 1
1 114 . 8 1 1 A 12 12 TYR C C 2435 173.645 174.609 -0.964 1
1 115 . 8 1 1 A 12 12 TYR CA C 2435 56.268 56.674 -0.406 1
1 116 . 8 1 1 A 12 12 TYR CB C 2435 39.522 42.277 -2.755 1
1 119 . 8 1 1 A 12 12 TYR N N 2435 118.305 119.372 -1.067 1
1 120 . 8 1 1 A 13 13 GLY H H 2436 8.655 8.483 0.172 1
1 121 . 8 1 1 A 13 13 GLY HA2 H 2436 4.943 4.289 0.654 1
1 122 . 8 1 1 A 13 13 GLY HA3 H 2436 4.028 4.340 -0.312 1
1 123 . 8 1 1 A 13 13 GLY C C 2436 175.334 174.911 0.423 1
1 124 . 8 1 1 A 13 13 GLY CA C 2436 44.389 44.412 -0.023 1
1 125 . 8 1 1 A 13 13 GLY N N 2436 110.710 110.355 0.355 1
1 126 . 8 1 1 A 14 14 ALA H H 2437 8.939 8.758 0.181 1
1 127 . 8 1 1 A 14 14 ALA HA H 2437 4.276 4.096 0.180 1
1 131 . 8 1 1 A 14 14 ALA C C 2437 180.524 179.245 1.279 1
1 132 . 8 1 1 A 14 14 ALA CA C 2437 55.551 55.079 0.472 1
1 133 . 8 1 1 A 14 14 ALA CB C 2437 18.411 18.378 0.033 1
1 134 . 8 1 1 A 14 14 ALA N N 2437 126.973 123.789 3.184 1
1 135 . 8 1 1 A 15 15 GLY H H 2438 8.933 8.743 0.190 1
1 136 . 8 1 1 A 15 15 GLY HA2 H 2438 4.531 3.974 0.557 1
1 137 . 8 1 1 A 15 15 GLY HA3 H 2438 3.576 4.224 -0.648 1
1 138 . 8 1 1 A 15 15 GLY C C 2438 174.323 175.736 -1.413 1
1 139 . 8 1 1 A 15 15 GLY CA C 2438 46.855 47.136 -0.281 1
1 140 . 8 1 1 A 15 15 GLY N N 2438 104.803 105.755 -0.952 1
1 141 . 8 1 1 A 16 16 LEU H H 2439 7.529 7.564 -0.035 1
1 142 . 8 1 1 A 16 16 LEU HA H 2439 3.768 3.862 -0.094 1
1 152 . 8 1 1 A 16 16 LEU C C 2439 176.388 178.408 -2.020 1
1 153 . 8 1 1 A 16 16 LEU CA C 2439 56.137 57.185 -1.048 1
1 154 . 8 1 1 A 16 16 LEU CB C 2439 41.621 41.235 0.386 1
1 158 . 8 1 1 A 16 16 LEU N N 2439 119.633 122.550 -2.917 1
1 159 . 8 1 1 A 17 17 GLU H H 2440 7.505 7.997 -0.492 1
1 160 . 8 1 1 A 17 17 GLU HA H 2440 4.663 4.425 0.238 1
1 165 . 8 1 1 A 17 17 GLU C C 2440 178.126 177.237 0.889 1
1 166 . 8 1 1 A 17 17 GLU CA C 2440 56.447 56.459 -0.012 1
1 167 . 8 1 1 A 17 17 GLU CB C 2440 31.485 30.814 0.671 1
1 169 . 8 1 1 A 17 17 GLU N N 2440 114.368 116.324 -1.956 1
1 170 . 8 1 1 A 18 18 GLY H H 2441 7.921 7.371 0.550 1
1 171 . 8 1 1 A 18 18 GLY HA2 H 2441 4.889 4.129 0.760 1
1 172 . 8 1 1 A 18 18 GLY HA3 H 2441 3.707 4.149 -0.442 1
1 173 . 8 1 1 A 18 18 GLY C C 2441 170.965 172.637 -1.672 1
1 174 . 8 1 1 A 18 18 GLY CA C 2441 45.549 44.337 1.212 1
1 175 . 8 1 1 A 18 18 GLY N N 2441 109.165 107.296 1.869 1
1 176 . 8 1 1 A 19 19 GLY H H 2442 7.540 7.764 -0.224 1
1 177 . 8 1 1 A 19 19 GLY HA2 H 2442 4.086 4.222 -0.136 1
1 178 . 8 1 1 A 19 19 GLY HA3 H 2442 4.086 4.247 -0.161 1
1 179 . 8 1 1 A 19 19 GLY C C 2442 171.051 171.801 -0.750 1
1 180 . 8 1 1 A 19 19 GLY CA C 2442 44.937 45.355 -0.418 1
1 181 . 8 1 1 A 19 19 GLY N N 2442 105.460 107.371 -1.911 1
1 182 . 8 1 1 A 20 20 VAL H H 2443 8.899 8.247 0.652 1
1 183 . 8 1 1 A 20 20 VAL HA H 2443 5.062 4.594 0.468 1
1 191 . 8 1 1 A 20 20 VAL C C 2443 176.623 175.777 0.846 1
1 192 . 8 1 1 A 20 20 VAL CA C 2443 60.197 62.320 -2.123 1
1 193 . 8 1 1 A 20 20 VAL CB C 2443 35.107 32.110 2.997 1
1 196 . 8 1 1 A 20 20 VAL N N 2443 122.753 121.611 1.142 1
1 197 . 8 1 1 A 21 21 THR H H 2444 8.630 8.523 0.107 1
1 198 . 8 1 1 A 21 21 THR HA H 2444 3.773 4.184 -0.411 1
1 203 . 8 1 1 A 21 21 THR C C 2444 175.646 174.849 0.797 1
1 204 . 8 1 1 A 21 21 THR CA C 2444 62.732 62.194 0.538 1
1 205 . 8 1 1 A 21 21 THR CB C 2444 68.925 69.262 -0.337 1
1 207 . 8 1 1 A 21 21 THR N N 2444 118.179 119.255 -1.076 1
1 208 . 8 1 1 A 22 22 GLY H H 2445 8.736 8.834 -0.098 1
1 209 . 8 1 1 A 22 22 GLY HA2 H 2445 3.412 3.922 -0.510 1
1 210 . 8 1 1 A 22 22 GLY HA3 H 2445 4.061 3.923 0.138 1
1 211 . 8 1 1 A 22 22 GLY C C 2445 172.973 173.461 -0.488 1
1 212 . 8 1 1 A 22 22 GLY CA C 2445 45.577 45.578 -0.001 1
1 213 . 8 1 1 A 22 22 GLY N N 2445 107.888 112.891 -5.003 1
1 214 . 8 1 1 A 23 23 ASN H H 2446 7.877 7.607 0.270 1
1 215 . 8 1 1 A 23 23 ASN HA H 2446 5.253 5.168 0.085 1
1 220 . 8 1 1 A 23 23 ASN CA C 2446 49.740 49.789 -0.049 1
1 221 . 8 1 1 A 23 23 ASN CB C 2446 40.198 39.465 0.733 1
1 222 . 8 1 1 A 23 23 ASN N N 2446 120.684 119.832 0.852 1
1 224 . 8 1 1 A 24 24 PRO HA H 2447 4.525 4.781 -0.256 1
1 231 . 8 1 1 A 24 24 PRO CA C 2447 62.766 62.291 0.475 1
1 232 . 8 1 1 A 24 24 PRO CB C 2447 31.732 32.428 -0.696 1
1 235 . 8 1 1 A 25 25 ALA H H 2448 9.178 8.130 1.048 1
1 236 . 8 1 1 A 25 25 ALA HA H 2448 4.614 4.859 -0.245 1
1 240 . 8 1 1 A 25 25 ALA C C 2448 175.503 175.786 -0.283 1
1 241 . 8 1 1 A 25 25 ALA CA C 2448 50.526 50.580 -0.054 1
1 242 . 8 1 1 A 25 25 ALA CB C 2448 20.458 22.133 -1.675 1
1 243 . 8 1 1 A 25 25 ALA N N 2448 132.079 122.638 9.441 1
1 244 . 8 1 1 A 26 26 GLU H H 2449 8.813 9.027 -0.214 1
1 245 . 8 1 1 A 26 26 GLU HA H 2449 5.830 5.370 0.460 1
1 250 . 8 1 1 A 26 26 GLU C C 2449 176.272 174.674 1.598 1
1 251 . 8 1 1 A 26 26 GLU CA C 2449 54.376 54.461 -0.085 1
1 252 . 8 1 1 A 26 26 GLU CB C 2449 35.463 34.042 1.421 1
1 254 . 8 1 1 A 26 26 GLU N N 2449 120.079 119.908 0.171 1
1 255 . 8 1 1 A 27 27 PHE H H 2450 8.782 8.971 -0.189 1
1 256 . 8 1 1 A 27 27 PHE HA H 2450 5.021 5.167 -0.146 1
1 264 . 8 1 1 A 27 27 PHE C C 2450 171.205 172.299 -1.094 1
1 265 . 8 1 1 A 27 27 PHE CA C 2450 56.852 56.291 0.561 1
1 266 . 8 1 1 A 27 27 PHE CB C 2450 41.080 41.052 0.028 1
1 270 . 8 1 1 A 27 27 PHE N N 2450 118.670 116.798 1.872 1
1 271 . 8 1 1 A 28 28 VAL H H 2451 8.961 9.059 -0.098 1
1 272 . 8 1 1 A 28 28 VAL HA H 2451 4.761 4.612 0.149 1
1 280 . 8 1 1 A 28 28 VAL C C 2451 174.673 175.535 -0.862 1
1 281 . 8 1 1 A 28 28 VAL CA C 2451 60.619 60.725 -0.106 1
1 282 . 8 1 1 A 28 28 VAL CB C 2451 35.484 34.544 0.940 1
1 285 . 8 1 1 A 28 28 VAL N N 2451 121.552 119.637 1.915 1
1 286 . 8 1 1 A 29 29 VAL H H 2452 9.294 9.066 0.228 1
1 287 . 8 1 1 A 29 29 VAL HA H 2452 4.363 4.279 0.084 1
1 295 . 8 1 1 A 29 29 VAL C C 2452 174.218 175.166 -0.948 1
1 296 . 8 1 1 A 29 29 VAL CA C 2452 61.526 62.748 -1.222 1
1 297 . 8 1 1 A 29 29 VAL CB C 2452 32.666 31.310 1.356 1
1 300 . 8 1 1 A 29 29 VAL N N 2452 125.585 128.160 -2.575 1
1 301 . 8 1 1 A 30 30 ASN H H 2453 9.465 8.915 0.550 1
1 302 . 8 1 1 A 30 30 ASN HA H 2453 5.096 5.117 -0.021 1
1 307 . 8 1 1 A 30 30 ASN C C 2453 176.216 176.206 0.010 1
1 308 . 8 1 1 A 30 30 ASN CA C 2453 52.011 52.456 -0.445 1
1 309 . 8 1 1 A 30 30 ASN CB C 2453 39.057 38.712 0.345 1
1 310 . 8 1 1 A 30 30 ASN N N 2453 127.724 127.186 0.538 1
1 312 . 8 1 1 A 31 31 THR H H 2454 8.915 8.582 0.333 1
1 313 . 8 1 1 A 31 31 THR HA H 2454 4.342 4.378 -0.036 1
1 318 . 8 1 1 A 31 31 THR C C 2454 176.816 176.445 0.371 1
1 319 . 8 1 1 A 31 31 THR CA C 2454 61.117 62.624 -1.507 1
1 320 . 8 1 1 A 31 31 THR CB C 2454 68.209 69.605 -1.396 1
1 322 . 8 1 1 A 31 31 THR N N 2454 117.783 117.066 0.717 1
1 323 . 8 1 1 A 32 32 SER H H 2455 8.454 7.975 0.479 1
1 324 . 8 1 1 A 32 32 SER HA H 2455 4.155 4.259 -0.104 1
1 327 . 8 1 1 A 32 32 SER C C 2455 175.458 176.166 -0.708 1
1 328 . 8 1 1 A 32 32 SER CA C 2455 62.148 62.345 -0.197 1
1 329 . 8 1 1 A 32 32 SER CB C 2455 63.476 63.029 0.447 1
1 330 . 8 1 1 A 32 32 SER N N 2455 121.781 119.112 2.669 1
1 331 . 8 1 1 A 33 33 ASN H H 2456 8.845 8.334 0.511 1
1 332 . 8 1 1 A 33 33 ASN HA H 2456 5.064 4.623 0.441 1
1 337 . 8 1 1 A 33 33 ASN C C 2456 174.674 176.237 -1.563 1
1 338 . 8 1 1 A 33 33 ASN CA C 2456 53.067 55.204 -2.137 1
1 339 . 8 1 1 A 33 33 ASN CB C 2456 39.632 38.748 0.884 1
1 340 . 8 1 1 A 33 33 ASN N N 2456 120.176 119.773 0.403 1
1 342 . 8 1 1 A 34 34 ALA H H 2457 7.714 7.998 -0.284 1
1 343 . 8 1 1 A 34 34 ALA HA H 2457 4.482 4.553 -0.071 1
1 347 . 8 1 1 A 34 34 ALA C C 2457 177.582 178.106 -0.524 1
1 348 . 8 1 1 A 34 34 ALA CA C 2457 52.521 52.514 0.007 1
1 349 . 8 1 1 A 34 34 ALA CB C 2457 22.252 21.169 1.083 1
1 350 . 8 1 1 A 34 34 ALA N N 2457 123.065 119.696 3.369 1
1 351 . 8 1 1 A 35 35 GLY H H 2458 8.195 8.056 0.139 1
1 352 . 8 1 1 A 35 35 GLY HA2 H 2458 4.246 4.127 0.119 1
1 353 . 8 1 1 A 35 35 GLY HA3 H 2458 3.902 4.141 -0.239 1
1 354 . 8 1 1 A 35 35 GLY C C 2458 173.360 173.580 -0.220 1
1 355 . 8 1 1 A 35 35 GLY CA C 2458 44.486 44.444 0.042 1
1 356 . 8 1 1 A 35 35 GLY N N 2458 108.472 104.756 3.716 1
1 357 . 8 1 1 A 36 36 ALA H H 2459 8.430 8.184 0.246 1
1 358 . 8 1 1 A 36 36 ALA HA H 2459 4.472 4.647 -0.175 1
1 362 . 8 1 1 A 36 36 ALA C C 2459 176.968 177.474 -0.506 1
1 363 . 8 1 1 A 36 36 ALA CA C 2459 52.695 52.653 0.042 1
1 364 . 8 1 1 A 36 36 ALA CB C 2459 19.360 19.366 -0.006 1
1 365 . 8 1 1 A 36 36 ALA N N 2459 126.012 124.886 1.126 1
1 366 . 8 1 1 A 37 37 GLY H H 2460 7.781 8.396 -0.615 1
1 367 . 8 1 1 A 37 37 GLY HA2 H 2460 3.856 3.966 -0.110 1
1 368 . 8 1 1 A 37 37 GLY HA3 H 2460 3.164 4.082 -0.918 1
1 369 . 8 1 1 A 37 37 GLY C C 2460 170.730 171.858 -1.128 1
1 370 . 8 1 1 A 37 37 GLY CA C 2460 44.747 45.625 -0.878 1
1 371 . 8 1 1 A 37 37 GLY N N 2460 109.493 108.073 1.420 1
1 372 . 8 1 1 A 38 38 ALA H H 2461 8.055 8.004 0.051 1
1 373 . 8 1 1 A 38 38 ALA HA H 2461 4.389 4.734 -0.345 1
1 377 . 8 1 1 A 38 38 ALA C C 2461 176.609 176.375 0.234 1
1 378 . 8 1 1 A 38 38 ALA CA C 2461 51.419 51.726 -0.307 1
1 379 . 8 1 1 A 38 38 ALA CB C 2461 19.665 19.564 0.101 1
1 380 . 8 1 1 A 38 38 ALA N N 2461 121.997 123.030 -1.033 1
1 381 . 8 1 1 A 39 39 LEU H H 2462 8.597 8.512 0.085 1
1 382 . 8 1 1 A 39 39 LEU HA H 2462 5.022 5.141 -0.119 1
1 392 . 8 1 1 A 39 39 LEU C C 2462 175.883 175.589 0.294 1
1 393 . 8 1 1 A 39 39 LEU CA C 2462 53.907 53.198 0.709 1
1 394 . 8 1 1 A 39 39 LEU CB C 2462 44.576 44.832 -0.256 1
1 398 . 8 1 1 A 39 39 LEU N N 2462 126.664 123.966 2.698 1
1 399 . 8 1 1 A 40 40 SER H H 2463 8.898 9.227 -0.329 1
1 400 . 8 1 1 A 40 40 SER HA H 2463 4.732 4.806 -0.074 1
1 403 . 8 1 1 A 40 40 SER C C 2463 172.984 173.529 -0.545 1
1 404 . 8 1 1 A 40 40 SER CA C 2463 56.730 57.250 -0.520 1
1 405 . 8 1 1 A 40 40 SER CB C 2463 64.648 64.245 0.403 1
1 406 . 8 1 1 A 40 40 SER N N 2463 122.932 122.548 0.384 1
1 407 . 8 1 1 A 41 41 VAL H H 2464 8.538 7.322 1.216 1
1 408 . 8 1 1 A 41 41 VAL HA H 2464 5.131 4.162 0.969 1
1 416 . 8 1 1 A 41 41 VAL C C 2464 174.812 174.680 0.132 1
1 417 . 8 1 1 A 41 41 VAL CA C 2464 60.784 62.859 -2.075 1
1 418 . 8 1 1 A 41 41 VAL CB C 2464 34.262 32.374 1.888 1
1 420 . 8 1 1 A 41 41 VAL N N 2464 129.161 122.480 6.681 1
1 421 . 8 1 1 A 42 42 THR H H 2465 8.807 8.682 0.125 1
1 422 . 8 1 1 A 42 42 THR HA H 2465 4.573 5.012 -0.439 1
1 427 . 8 1 1 A 42 42 THR CA C 2465 60.408 61.544 -1.136 1
1 428 . 8 1 1 A 42 42 THR CB C 2465 71.764 72.566 -0.802 1
1 430 . 8 1 1 A 42 42 THR N N 2465 120.898 124.245 -3.347 1
1 431 . 8 1 1 A 43 43 ILE H H 2466 8.648 9.098 -0.450 1
1 432 . 8 1 1 A 43 43 ILE HA H 2466 4.854 4.856 -0.002 1
1 442 . 8 1 1 A 43 43 ILE C C 2466 174.073 174.350 -0.277 1
1 443 . 8 1 1 A 43 43 ILE CA C 2466 61.184 60.031 1.153 1
1 444 . 8 1 1 A 43 43 ILE CB C 2466 39.516 38.842 0.674 1
1 448 . 8 1 1 A 43 43 ILE N N 2466 124.810 126.839 -2.029 1
1 449 . 8 1 1 A 44 44 ASP H H 2467 8.821 9.220 -0.399 1
1 450 . 8 1 1 A 44 44 ASP HA H 2467 5.217 5.566 -0.349 1
1 453 . 8 1 1 A 44 44 ASP C C 2467 175.002 175.096 -0.094 1
1 454 . 8 1 1 A 44 44 ASP CA C 2467 52.998 52.401 0.597 1
1 455 . 8 1 1 A 44 44 ASP CB C 2467 44.728 44.464 0.264 1
1 456 . 8 1 1 A 44 44 ASP N N 2467 129.093 128.609 0.484 1
1 457 . 8 1 1 A 45 45 GLY H H 2468 8.535 8.300 0.235 1
1 458 . 8 1 1 A 45 45 GLY HA2 H 2468 3.954 3.914 0.040 1
1 459 . 8 1 1 A 45 45 GLY HA3 H 2468 3.561 4.082 -0.521 1
1 460 . 8 1 1 A 45 45 GLY CA C 2468 45.659 44.899 0.760 1
1 461 . 8 1 1 A 45 45 GLY N N 2468 112.751 109.902 2.849 1
1 462 . 8 1 1 A 46 46 PRO HA H 2469 4.318 4.395 -0.077 1
1 469 . 8 1 1 A 46 46 PRO C C 2469 176.086 176.192 -0.106 1
1 470 . 8 1 1 A 46 46 PRO CA C 2469 64.198 63.890 0.308 1
1 471 . 8 1 1 A 46 46 PRO CB C 2469 32.348 31.868 0.480 1
1 474 . 8 1 1 A 47 47 SER H H 2470 7.106 7.701 -0.595 1
1 475 . 8 1 1 A 47 47 SER HA H 2470 4.632 4.907 -0.275 1
1 478 . 8 1 1 A 47 47 SER C C 2470 172.969 173.028 -0.059 1
1 479 . 8 1 1 A 47 47 SER CA C 2470 57.106 57.624 -0.518 1
1 480 . 8 1 1 A 47 47 SER CB C 2470 66.262 67.745 -1.483 1
1 481 . 8 1 1 A 47 47 SER N N 2470 110.556 114.196 -3.640 1
1 482 . 8 1 1 A 48 48 LYS H H 2471 8.534 8.287 0.247 1
1 483 . 8 1 1 A 48 48 LYS HA H 2471 4.486 4.537 -0.051 1
1 492 . 8 1 1 A 48 48 LYS C C 2471 177.231 176.591 0.640 1
1 493 . 8 1 1 A 48 48 LYS CA C 2471 56.620 56.092 0.528 1
1 494 . 8 1 1 A 48 48 LYS CB C 2471 32.379 32.499 -0.120 1
1 498 . 8 1 1 A 48 48 LYS N N 2471 124.055 123.529 0.526 1
1 499 . 8 1 1 A 49 49 VAL H H 2472 8.497 8.396 0.101 1
1 500 . 8 1 1 A 49 49 VAL HA H 2472 4.552 4.102 0.450 1
1 508 . 8 1 1 A 49 49 VAL C C 2472 175.292 175.497 -0.205 1
1 509 . 8 1 1 A 49 49 VAL CA C 2472 60.142 62.243 -2.101 1
1 510 . 8 1 1 A 49 49 VAL CB C 2472 33.464 32.801 0.663 1
1 513 . 8 1 1 A 49 49 VAL N N 2472 121.233 124.152 -2.919 1
1 514 . 8 1 1 A 50 50 LYS H H 2473 8.190 8.473 -0.283 1
1 515 . 8 1 1 A 50 50 LYS HA H 2473 4.522 4.539 -0.017 1
1 518 . 8 1 1 A 50 50 LYS CA C 2473 55.952 56.375 -0.423 1
1 519 . 8 1 1 A 50 50 LYS CB C 2473 32.896 32.912 -0.016 1
1 520 . 8 1 1 A 50 50 LYS N N 2473 126.082 125.389 0.693 1
1 521 . 8 1 1 A 51 51 MET H H 2474 8.818 9.013 -0.195 1
1 522 . 8 1 1 A 51 51 MET HA H 2474 5.324 5.276 0.048 1
1 530 . 8 1 1 A 51 51 MET C C 2474 173.933 174.162 -0.229 1
1 531 . 8 1 1 A 51 51 MET CA C 2474 54.848 53.989 0.859 1
1 532 . 8 1 1 A 51 51 MET CB C 2474 37.043 35.808 1.235 1
1 535 . 8 1 1 A 51 51 MET N N 2474 126.911 127.531 -0.620 1
1 536 . 8 1 1 A 52 52 ASP H H 2475 9.095 9.329 -0.234 1
1 537 . 8 1 1 A 52 52 ASP HA H 2475 4.947 5.599 -0.652 1
1 540 . 8 1 1 A 52 52 ASP C C 2475 173.923 174.228 -0.305 1
1 541 . 8 1 1 A 52 52 ASP CA C 2475 53.487 52.758 0.729 1
1 542 . 8 1 1 A 52 52 ASP CB C 2475 44.765 44.716 0.049 1
1 543 . 8 1 1 A 52 52 ASP N N 2475 125.526 124.727 0.799 1
1 544 . 8 1 1 A 53 53 CYS H H 2476 8.606 8.863 -0.257 1
1 545 . 8 1 1 A 53 53 CYS HA H 2476 5.145 5.338 -0.193 1
1 548 . 8 1 1 A 53 53 CYS C C 2476 173.330 172.747 0.583 1
1 549 . 8 1 1 A 53 53 CYS CA C 2476 57.452 57.867 -0.415 1
1 550 . 8 1 1 A 53 53 CYS CB C 2476 28.108 30.957 -2.849 1
1 551 . 8 1 1 A 53 53 CYS N N 2476 124.317 121.715 2.602 1
1 552 . 8 1 1 A 54 54 GLN H H 2477 8.978 8.968 0.010 1
1 553 . 8 1 1 A 54 54 GLN HA H 2477 4.884 5.082 -0.198 1
1 560 . 8 1 1 A 54 54 GLN C C 2477 174.854 173.365 1.489 1
1 561 . 8 1 1 A 54 54 GLN CA C 2477 53.891 54.422 -0.531 1
1 562 . 8 1 1 A 54 54 GLN CB C 2477 32.837 32.489 0.348 1
1 564 . 8 1 1 A 54 54 GLN N N 2477 127.074 121.815 5.259 1
1 566 . 8 1 1 A 55 55 GLU H H 2478 9.065 8.650 0.415 1
1 567 . 8 1 1 A 55 55 GLU HA H 2478 4.280 4.939 -0.659 1
1 572 . 8 1 1 A 55 55 GLU C C 2478 175.383 175.762 -0.379 1
1 573 . 8 1 1 A 55 55 GLU CA C 2478 57.516 55.977 1.539 1
1 574 . 8 1 1 A 55 55 GLU CB C 2478 30.346 31.245 -0.899 1
1 576 . 8 1 1 A 55 55 GLU N N 2478 125.186 122.253 2.933 1
1 577 . 8 1 1 A 56 56 CYS H H 2479 8.407 8.583 -0.176 1
1 578 . 8 1 1 A 56 56 CYS HA H 2479 5.056 4.802 0.254 1
1 581 . 8 1 1 A 56 56 CYS CA C 2479 55.858 56.765 -0.907 1
1 582 . 8 1 1 A 56 56 CYS CB C 2479 28.676 30.305 -1.629 1
1 583 . 8 1 1 A 56 56 CYS N N 2479 121.499 124.390 -2.891 1
1 584 . 8 1 1 A 57 57 PRO HA H 2480 4.159 4.270 -0.111 1
1 591 . 8 1 1 A 57 57 PRO C C 2480 177.964 177.716 0.248 1
1 592 . 8 1 1 A 57 57 PRO CA C 2480 66.877 64.701 2.176 1
1 593 . 8 1 1 A 57 57 PRO CB C 2480 31.709 31.917 -0.208 1
1 596 . 8 1 1 A 58 58 GLU H H 2481 8.900 8.172 0.728 1
1 597 . 8 1 1 A 58 58 GLU HA H 2481 4.201 4.366 -0.165 1
1 602 . 8 1 1 A 58 58 GLU C C 2481 175.129 176.581 -1.452 1
1 603 . 8 1 1 A 58 58 GLU CA C 2481 57.883 57.197 0.686 1
1 604 . 8 1 1 A 58 58 GLU CB C 2481 29.991 30.131 -0.140 1
1 606 . 8 1 1 A 58 58 GLU N N 2481 115.316 117.873 -2.557 1
1 607 . 8 1 1 A 59 59 GLY H H 2482 7.527 7.281 0.246 1
1 608 . 8 1 1 A 59 59 GLY HA2 H 2482 4.935 3.988 0.947 1
1 609 . 8 1 1 A 59 59 GLY HA3 H 2482 3.381 4.097 -0.716 1
1 610 . 8 1 1 A 59 59 GLY CA C 2482 47.809 44.231 3.578 1
1 611 . 8 1 1 A 59 59 GLY N N 2482 110.079 107.874 2.205 1
1 612 . 8 1 1 A 60 60 TYR H H 2483 8.990 8.078 0.912 1
1 613 . 8 1 1 A 60 60 TYR HA H 2483 5.157 4.654 0.503 1
1 618 . 8 1 1 A 60 60 TYR C C 2483 175.096 174.916 0.180 1
1 619 . 8 1 1 A 60 60 TYR CA C 2483 57.375 58.818 -1.443 1
1 620 . 8 1 1 A 60 60 TYR CB C 2483 43.153 38.429 4.724 1
1 622 . 8 1 1 A 60 60 TYR N N 2483 125.900 121.421 4.479 1
1 623 . 8 1 1 A 61 61 ARG H H 2484 9.557 8.892 0.665 1
1 624 . 8 1 1 A 61 61 ARG HA H 2484 4.858 4.534 0.324 1
1 631 . 8 1 1 A 61 61 ARG CA C 2484 55.016 55.711 -0.695 1
1 632 . 8 1 1 A 61 61 ARG CB C 2484 32.128 31.160 0.968 1
1 635 . 8 1 1 A 61 61 ARG N N 2484 124.847 126.441 -1.594 1
1 636 . 8 1 1 A 62 62 VAL H H 2485 9.046 8.963 0.083 1
1 637 . 8 1 1 A 62 62 VAL HA H 2485 4.675 4.856 -0.181 1
1 645 . 8 1 1 A 62 62 VAL C C 2485 173.837 174.877 -1.040 1
1 646 . 8 1 1 A 62 62 VAL CA C 2485 60.752 60.975 -0.223 1
1 647 . 8 1 1 A 62 62 VAL CB C 2485 32.459 33.782 -1.323 1
1 650 . 8 1 1 A 62 62 VAL N N 2485 132.205 126.049 6.156 1
1 651 . 8 1 1 A 63 63 THR H H 2486 8.474 8.738 -0.264 1
1 652 . 8 1 1 A 63 63 THR HA H 2486 5.392 5.312 0.080 1
1 657 . 8 1 1 A 63 63 THR C C 2486 173.675 173.548 0.127 1
1 658 . 8 1 1 A 63 63 THR CA C 2486 60.008 61.188 -1.180 1
1 659 . 8 1 1 A 63 63 THR CB C 2486 71.035 71.866 -0.831 1
1 661 . 8 1 1 A 63 63 THR N N 2486 121.216 122.780 -1.564 1
1 662 . 8 1 1 A 64 64 TYR H H 2487 9.409 9.007 0.402 1
1 663 . 8 1 1 A 64 64 TYR HA H 2487 5.617 5.592 0.025 1
1 670 . 8 1 1 A 64 64 TYR C C 2487 172.847 172.712 0.135 1
1 671 . 8 1 1 A 64 64 TYR CA C 2487 55.557 55.861 -0.304 1
1 672 . 8 1 1 A 64 64 TYR CB C 2487 41.968 41.889 0.079 1
1 675 . 8 1 1 A 64 64 TYR N N 2487 124.061 122.136 1.925 1
1 676 . 8 1 1 A 65 65 THR H H 2488 8.145 8.979 -0.834 1
1 677 . 8 1 1 A 65 65 THR HA H 2488 4.959 4.624 0.335 1
1 682 . 8 1 1 A 65 65 THR CA C 2488 58.532 58.980 -0.448 1
1 683 . 8 1 1 A 65 65 THR CB C 2488 70.141 70.305 -0.164 1
1 685 . 8 1 1 A 65 65 THR N N 2488 117.924 116.869 1.055 1
1 686 . 8 1 1 A 66 66 PRO HA H 2489 4.602 4.768 -0.166 1
1 693 . 8 1 1 A 66 66 PRO C C 2489 176.647 177.125 -0.478 1
1 694 . 8 1 1 A 66 66 PRO CA C 2489 61.442 62.298 -0.856 1
1 695 . 8 1 1 A 66 66 PRO CB C 2489 32.715 32.298 0.417 1
1 698 . 8 1 1 A 67 67 MET H H 2490 8.832 8.512 0.320 1
1 699 . 8 1 1 A 67 67 MET HA H 2490 4.880 4.478 0.402 1
1 707 . 8 1 1 A 67 67 MET C C 2490 174.121 175.669 -1.548 1
1 708 . 8 1 1 A 67 67 MET CA C 2490 53.848 55.401 -1.553 1
1 709 . 8 1 1 A 67 67 MET CB C 2490 33.727 32.956 0.771 1
1 712 . 8 1 1 A 67 67 MET N N 2490 119.212 118.724 0.488 1
1 713 . 8 1 1 A 68 68 ALA H H 2491 7.086 7.789 -0.703 1
1 714 . 8 1 1 A 68 68 ALA HA H 2491 4.851 4.873 -0.022 1
1 718 . 8 1 1 A 68 68 ALA CA C 2491 49.222 50.039 -0.817 1
1 719 . 8 1 1 A 68 68 ALA CB C 2491 20.600 22.278 -1.678 1
1 720 . 8 1 1 A 68 68 ALA N N 2491 120.363 120.304 0.059 1
1 721 . 8 1 1 A 69 69 PRO HA H 2492 4.263 4.704 -0.441 1
1 728 . 8 1 1 A 69 69 PRO C C 2492 174.370 176.245 -1.875 1
1 729 . 8 1 1 A 69 69 PRO CA C 2492 62.555 62.929 -0.374 1
1 730 . 8 1 1 A 69 69 PRO CB C 2492 32.752 33.456 -0.704 1
1 733 . 8 1 1 A 70 70 GLY H H 2493 8.858 8.376 0.482 1
1 734 . 8 1 1 A 70 70 GLY HA2 H 2493 4.544 4.051 0.493 1
1 735 . 8 1 1 A 70 70 GLY HA3 H 2493 3.849 4.115 -0.266 1
1 736 . 8 1 1 A 70 70 GLY C C 2493 172.182 172.358 -0.176 1
1 737 . 8 1 1 A 70 70 GLY CA C 2493 44.356 44.132 0.224 1
1 738 . 8 1 1 A 70 70 GLY N N 2493 106.539 107.821 -1.282 1
1 739 . 8 1 1 A 71 71 SER H H 2494 8.490 8.136 0.354 1
1 740 . 8 1 1 A 71 71 SER HA H 2494 5.280 5.359 -0.079 1
1 743 . 8 1 1 A 71 71 SER C C 2494 173.512 173.008 0.504 1
1 744 . 8 1 1 A 71 71 SER CA C 2494 57.674 57.801 -0.127 1
1 745 . 8 1 1 A 71 71 SER CB C 2494 63.799 64.652 -0.853 1
1 746 . 8 1 1 A 71 71 SER N N 2494 117.964 116.873 1.091 1
1 747 . 8 1 1 A 72 72 TYR H H 2495 9.320 9.657 -0.337 1
1 748 . 8 1 1 A 72 72 TYR HA H 2495 4.960 5.234 -0.274 1
1 755 . 8 1 1 A 72 72 TYR C C 2495 173.979 174.952 -0.973 1
1 756 . 8 1 1 A 72 72 TYR CA C 2495 56.384 56.373 0.011 1
1 757 . 8 1 1 A 72 72 TYR CB C 2495 40.247 41.026 -0.779 1
1 760 . 8 1 1 A 72 72 TYR N N 2495 126.442 125.088 1.354 1
1 761 . 8 1 1 A 73 73 LEU H H 2496 9.019 8.999 0.020 1
1 762 . 8 1 1 A 73 73 LEU HA H 2496 5.209 4.884 0.325 1
1 772 . 8 1 1 A 73 73 LEU C C 2496 177.015 175.628 1.387 1
1 773 . 8 1 1 A 73 73 LEU CA C 2496 53.393 53.606 -0.213 1
1 774 . 8 1 1 A 73 73 LEU CB C 2496 43.918 42.411 1.507 1
1 778 . 8 1 1 A 73 73 LEU N N 2496 125.439 124.310 1.129 1
1 779 . 8 1 1 A 74 74 ILE H H 2497 9.921 9.432 0.489 1
1 780 . 8 1 1 A 74 74 ILE HA H 2497 5.128 4.592 0.536 1
1 790 . 8 1 1 A 74 74 ILE C C 2497 175.730 175.189 0.541 1
1 791 . 8 1 1 A 74 74 ILE CA C 2497 60.930 60.677 0.253 1
1 792 . 8 1 1 A 74 74 ILE CB C 2497 39.488 36.709 2.779 1
1 796 . 8 1 1 A 74 74 ILE N N 2497 132.185 126.499 5.686 1
1 797 . 8 1 1 A 75 75 SER H H 2498 9.284 9.090 0.194 1
1 798 . 8 1 1 A 75 75 SER HA H 2498 5.111 4.841 0.270 1
1 801 . 8 1 1 A 75 75 SER C C 2498 173.449 173.386 0.063 1
1 802 . 8 1 1 A 75 75 SER CA C 2498 58.260 58.234 0.026 1
1 803 . 8 1 1 A 75 75 SER CB C 2498 63.956 61.466 2.490 1
1 804 . 8 1 1 A 75 75 SER N N 2498 125.384 125.524 -0.140 1
1 805 . 8 1 1 A 76 76 ILE H H 2499 9.861 8.362 1.499 1
1 806 . 8 1 1 A 76 76 ILE HA H 2499 4.814 4.485 0.329 1
1 816 . 8 1 1 A 76 76 ILE CA C 2499 61.034 61.369 -0.335 1
1 817 . 8 1 1 A 76 76 ILE CB C 2499 40.387 37.164 3.223 1
1 821 . 8 1 1 A 76 76 ILE N N 2499 129.414 126.294 3.120 1
1 822 . 8 1 1 A 77 77 LYS H H 2500 8.827 8.902 -0.075 1
1 823 . 8 1 1 A 77 77 LYS HA H 2500 5.254 5.281 -0.027 1
1 832 . 8 1 1 A 77 77 LYS C C 2500 175.245 175.419 -0.174 1
1 833 . 8 1 1 A 77 77 LYS CA C 2500 54.388 54.388 0.000 1
1 834 . 8 1 1 A 77 77 LYS CB C 2500 36.127 35.403 0.724 1
1 838 . 8 1 1 A 77 77 LYS N N 2500 126.922 127.410 -0.488 1
1 839 . 8 1 1 A 78 78 TYR H H 2501 8.408 9.005 -0.597 1
1 840 . 8 1 1 A 78 78 TYR HA H 2501 5.479 4.999 0.480 1
1 847 . 8 1 1 A 78 78 TYR C C 2501 174.792 175.549 -0.757 1
1 848 . 8 1 1 A 78 78 TYR CA C 2501 56.837 57.342 -0.505 1
1 849 . 8 1 1 A 78 78 TYR CB C 2501 44.008 42.254 1.754 1
1 852 . 8 1 1 A 78 78 TYR N N 2501 122.282 123.938 -1.656 1
1 853 . 8 1 1 A 79 79 GLY H H 2502 8.196 8.519 -0.323 1
1 854 . 8 1 1 A 79 79 GLY HA2 H 2502 4.040 3.571 0.469 1
1 855 . 8 1 1 A 79 79 GLY HA3 H 2502 3.465 3.718 -0.253 1
1 856 . 8 1 1 A 79 79 GLY C C 2502 173.932 173.543 0.389 1
1 857 . 8 1 1 A 79 79 GLY CA C 2502 45.741 45.783 -0.042 1
1 858 . 8 1 1 A 79 79 GLY N N 2502 113.451 114.050 -0.599 1
1 859 . 8 1 1 A 80 80 GLY H H 2503 7.589 8.143 -0.554 1
1 860 . 8 1 1 A 80 80 GLY HA2 H 2503 4.490 4.057 0.433 1
1 861 . 8 1 1 A 80 80 GLY HA3 H 2503 3.555 4.142 -0.587 1
1 862 . 8 1 1 A 80 80 GLY CA C 2503 43.540 44.198 -0.658 1
1 863 . 8 1 1 A 80 80 GLY N N 2503 107.293 107.515 -0.222 1
1 864 . 8 1 1 A 81 81 PRO HA H 2504 4.320 4.394 -0.074 1
1 871 . 8 1 1 A 81 81 PRO C C 2504 175.311 175.177 0.134 1
1 872 . 8 1 1 A 81 81 PRO CA C 2504 62.722 63.360 -0.638 1
1 873 . 8 1 1 A 81 81 PRO CB C 2504 29.297 31.206 -1.909 1
1 876 . 8 1 1 A 82 82 TYR H H 2505 7.778 7.354 0.424 1
1 877 . 8 1 1 A 82 82 TYR HA H 2505 4.791 5.032 -0.241 1
1 884 . 8 1 1 A 82 82 TYR C C 2505 175.086 175.773 -0.687 1
1 885 . 8 1 1 A 82 82 TYR CA C 2505 56.111 56.565 -0.454 1
1 886 . 8 1 1 A 82 82 TYR CB C 2505 39.483 41.669 -2.186 1
1 889 . 8 1 1 A 82 82 TYR N N 2505 123.973 120.807 3.166 1
1 890 . 8 1 1 A 83 83 HIS H H 2506 8.625 9.050 -0.425 1
1 891 . 8 1 1 A 83 83 HIS HA H 2506 4.583 4.967 -0.384 1
1 896 . 8 1 1 A 83 83 HIS C C 2506 178.161 176.022 2.139 1
1 897 . 8 1 1 A 83 83 HIS CA C 2506 58.241 56.846 1.395 1
1 898 . 8 1 1 A 83 83 HIS CB C 2506 33.132 30.432 2.700 1
1 901 . 8 1 1 A 83 83 HIS N N 2506 124.092 121.407 2.685 1
1 902 . 8 1 1 A 84 84 ILE H H 2507 8.327 8.687 -0.360 1
1 903 . 8 1 1 A 84 84 ILE HA H 2507 4.553 4.299 0.254 1
1 913 . 8 1 1 A 84 84 ILE C C 2507 176.523 176.223 0.300 1
1 914 . 8 1 1 A 84 84 ILE CA C 2507 60.791 60.105 0.686 1
1 915 . 8 1 1 A 84 84 ILE CB C 2507 39.162 39.720 -0.558 1
1 919 . 8 1 1 A 84 84 ILE N N 2507 117.355 119.707 -2.352 1
1 920 . 8 1 1 A 85 85 GLY H H 2508 9.130 8.593 0.537 1
1 921 . 8 1 1 A 85 85 GLY HA2 H 2508 3.883 3.752 0.131 1
1 922 . 8 1 1 A 85 85 GLY HA3 H 2508 3.800 3.772 0.028 1
1 923 . 8 1 1 A 85 85 GLY C C 2508 174.438 175.449 -1.011 1
1 924 . 8 1 1 A 85 85 GLY CA C 2508 47.673 46.705 0.968 1
1 925 . 8 1 1 A 85 85 GLY N N 2508 111.346 109.649 1.697 1
1 926 . 8 1 1 A 86 86 GLY H H 2509 8.236 8.151 0.085 1
1 927 . 8 1 1 A 86 86 GLY HA2 H 2509 3.893 3.803 0.090 1
1 928 . 8 1 1 A 86 86 GLY HA3 H 2509 3.161 3.848 -0.687 1
1 929 . 8 1 1 A 86 86 GLY C C 2509 171.837 172.990 -1.153 1
1 930 . 8 1 1 A 86 86 GLY CA C 2509 44.844 45.287 -0.443 1
1 931 . 8 1 1 A 86 86 GLY N N 2509 115.594 117.916 -2.322 1
1 932 . 8 1 1 A 87 87 SER H H 2510 7.385 7.770 -0.385 1
1 933 . 8 1 1 A 87 87 SER HA H 2510 4.217 4.306 -0.089 1
1 936 . 8 1 1 A 87 87 SER CA C 2510 54.783 55.248 -0.465 1
1 937 . 8 1 1 A 87 87 SER CB C 2510 62.683 63.996 -1.313 1
1 938 . 8 1 1 A 87 87 SER N N 2510 112.859 116.440 -3.581 1
1 939 . 8 1 1 A 88 88 PRO HA H 2511 5.532 4.786 0.746 1
1 946 . 8 1 1 A 88 88 PRO C C 2511 175.870 175.706 0.164 1
1 947 . 8 1 1 A 88 88 PRO CA C 2511 62.379 62.351 0.028 1
1 948 . 8 1 1 A 88 88 PRO CB C 2511 33.639 32.804 0.835 1
1 951 . 8 1 1 A 89 89 PHE H H 2512 9.359 8.666 0.693 1
1 952 . 8 1 1 A 89 89 PHE HA H 2512 4.467 4.892 -0.425 1
1 960 . 8 1 1 A 89 89 PHE C C 2512 175.152 175.305 -0.153 1
1 961 . 8 1 1 A 89 89 PHE CA C 2512 57.401 57.412 -0.011 1
1 962 . 8 1 1 A 89 89 PHE CB C 2512 40.843 40.642 0.201 1
1 966 . 8 1 1 A 89 89 PHE N N 2512 124.789 121.306 3.483 1
1 967 . 8 1 1 A 90 90 LYS H H 2513 8.772 8.505 0.267 1
1 968 . 8 1 1 A 90 90 LYS HA H 2513 4.941 4.624 0.317 1
1 973 . 8 1 1 A 90 90 LYS C C 2513 174.183 175.797 -1.614 1
1 974 . 8 1 1 A 90 90 LYS CA C 2513 55.749 55.898 -0.149 1
1 975 . 8 1 1 A 90 90 LYS CB C 2513 32.817 32.382 0.435 1
1 978 . 8 1 1 A 90 90 LYS N N 2513 125.133 122.702 2.431 1
1 979 . 8 1 1 A 91 91 ALA H H 2514 9.158 9.141 0.017 1
1 980 . 8 1 1 A 91 91 ALA HA H 2514 4.510 5.149 -0.639 1
1 984 . 8 1 1 A 91 91 ALA C C 2514 176.561 176.421 0.140 1
1 985 . 8 1 1 A 91 91 ALA CA C 2514 50.528 50.879 -0.351 1
1 986 . 8 1 1 A 91 91 ALA CB C 2514 20.653 20.497 0.156 1
1 987 . 8 1 1 A 91 91 ALA N N 2514 131.989 128.570 3.419 1
1 988 . 8 1 1 A 92 92 LYS H H 2515 8.186 9.025 -0.839 1
1 989 . 8 1 1 A 92 92 LYS HA H 2515 4.926 4.965 -0.039 1
1 998 . 8 1 1 A 92 92 LYS C C 2515 175.177 175.698 -0.521 1
1 999 . 8 1 1 A 92 92 LYS CA C 2515 55.725 55.434 0.291 1
1 1000 . 8 1 1 A 92 92 LYS CB C 2515 33.765 34.062 -0.297 1
1 1004 . 8 1 1 A 92 92 LYS N N 2515 124.887 123.317 1.570 1
1 1005 . 8 1 1 A 93 93 VAL H H 2516 9.362 9.273 0.089 1
1 1006 . 8 1 1 A 93 93 VAL HA H 2516 5.161 5.242 -0.081 1
1 1014 . 8 1 1 A 93 93 VAL C C 2516 176.988 175.583 1.405 1
1 1015 . 8 1 1 A 93 93 VAL CA C 2516 60.523 61.294 -0.771 1
1 1016 . 8 1 1 A 93 93 VAL CB C 2516 33.291 34.931 -1.640 1
1 1019 . 8 1 1 A 93 93 VAL N N 2516 129.943 124.433 5.510 1
1 1020 . 8 1 1 A 94 94 THR H H 2517 8.614 8.854 -0.240 1
1 1021 . 8 1 1 A 94 94 THR HA H 2517 4.902 4.936 -0.034 1
1 1026 . 8 1 1 A 94 94 THR C C 2517 172.759 173.247 -0.488 1
1 1027 . 8 1 1 A 94 94 THR CA C 2517 60.121 59.681 0.440 1
1 1028 . 8 1 1 A 94 94 THR CB C 2517 71.072 71.326 -0.254 1
1 1030 . 8 1 1 A 94 94 THR N N 2517 122.032 116.445 5.587 1
1 1031 . 8 1 1 A 95 95 GLY H H 2518 8.280 8.485 -0.205 1
1 1032 . 8 1 1 A 95 95 GLY HA2 H 2518 3.852 4.144 -0.292 1
1 1033 . 8 1 1 A 95 95 GLY HA3 H 2518 4.846 4.148 0.698 1
1 1034 . 8 1 1 A 95 95 GLY CA C 2518 43.955 44.370 -0.415 1
1 1035 . 8 1 1 A 95 95 GLY N N 2518 107.949 107.299 0.650 1
1 1036 . 8 1 1 A 96 96 PRO HA H 2519 4.449 4.680 -0.231 1
1 1043 . 8 1 1 A 96 96 PRO C C 2519 176.892 176.214 0.678 1
1 1044 . 8 1 1 A 96 96 PRO CA C 2519 62.062 62.648 -0.586 1
1 1045 . 8 1 1 A 96 96 PRO CB C 2519 32.286 32.785 -0.499 1
1 1048 . 8 1 1 A 97 97 ARG H H 2520 8.651 8.552 0.099 1
1 1049 . 8 1 1 A 97 97 ARG HA H 2520 4.348 4.507 -0.159 1
1 1056 . 8 1 1 A 97 97 ARG C C 2520 176.236 176.334 -0.098 1
1 1057 . 8 1 1 A 97 97 ARG CA C 2520 57.587 56.383 1.204 1
1 1058 . 8 1 1 A 97 97 ARG CB C 2520 30.472 30.984 -0.512 1
1 1061 . 8 1 1 A 97 97 ARG N N 2520 120.781 121.506 -0.725 1
1 1062 . 8 1 1 A 98 98 LEU H H 2521 8.545 8.951 -0.406 1
1 1063 . 8 1 1 A 98 98 LEU HA H 2521 4.577 4.152 0.425 1
1 1073 . 8 1 1 A 98 98 LEU C C 2521 175.880 178.056 -2.176 1
1 1074 . 8 1 1 A 98 98 LEU CA C 2521 55.068 57.321 -2.253 1
1 1075 . 8 1 1 A 98 98 LEU CB C 2521 43.082 42.187 0.895 1
1 1079 . 8 1 1 A 98 98 LEU N N 2521 128.715 127.494 1.221 1
1 4 . 9 1 1 A 2 2 ALA HA H -2 4.374 4.964 -0.590 1
1 8 . 9 1 1 A 2 2 ALA C C -2 177.865 176.052 1.813 1
1 9 . 9 1 1 A 2 2 ALA CA C -2 52.670 51.351 1.319 1
1 10 . 9 1 1 A 2 2 ALA CB C -2 19.508 23.125 -3.617 1
1 32 . 9 1 1 A 5 5 ASP H H 2428 8.300 8.912 -0.612 1
1 33 . 9 1 1 A 5 5 ASP HA H 2428 5.082 5.382 -0.300 1
1 36 . 9 1 1 A 5 5 ASP CA C 2428 51.517 50.884 0.633 1
1 37 . 9 1 1 A 5 5 ASP CB C 2428 42.244 43.916 -1.672 1
1 38 . 9 1 1 A 5 5 ASP N N 2428 122.879 120.284 2.595 1
1 39 . 9 1 1 A 6 6 PRO HA H 2429 4.340 4.398 -0.058 1
1 46 . 9 1 1 A 6 6 PRO C C 2429 178.266 177.718 0.548 1
1 47 . 9 1 1 A 6 6 PRO CA C 2429 64.494 64.307 0.187 1
1 48 . 9 1 1 A 6 6 PRO CB C 2429 31.841 31.946 -0.105 1
1 51 . 9 1 1 A 7 7 GLY H H 2430 8.686 8.560 0.126 1
1 52 . 9 1 1 A 7 7 GLY HA2 H 2430 4.116 3.839 0.277 1
1 53 . 9 1 1 A 7 7 GLY HA3 H 2430 3.868 3.839 0.029 1
1 54 . 9 1 1 A 7 7 GLY C C 2430 174.567 175.718 -1.151 1
1 55 . 9 1 1 A 7 7 GLY CA C 2430 46.038 46.573 -0.535 1
1 56 . 9 1 1 A 7 7 GLY N N 2430 107.655 107.044 0.611 1
1 57 . 9 1 1 A 8 8 LEU H H 2431 7.692 7.351 0.341 1
1 58 . 9 1 1 A 8 8 LEU HA H 2431 4.507 4.368 0.139 1
1 68 . 9 1 1 A 8 8 LEU C C 2431 176.876 177.555 -0.679 1
1 69 . 9 1 1 A 8 8 LEU CA C 2431 54.307 56.847 -2.540 1
1 70 . 9 1 1 A 8 8 LEU CB C 2431 42.879 42.868 0.011 1
1 74 . 9 1 1 A 8 8 LEU N N 2431 120.022 120.405 -0.383 1
1 75 . 9 1 1 A 9 9 VAL H H 2432 7.378 7.577 -0.199 1
1 76 . 9 1 1 A 9 9 VAL HA H 2432 4.154 3.891 0.263 1
1 84 . 9 1 1 A 9 9 VAL C C 2432 174.703 175.538 -0.835 1
1 85 . 9 1 1 A 9 9 VAL CA C 2432 62.387 63.256 -0.869 1
1 86 . 9 1 1 A 9 9 VAL CB C 2432 32.519 31.467 1.052 1
1 89 . 9 1 1 A 9 9 VAL N N 2432 123.902 119.336 4.566 1
1 90 . 9 1 1 A 10 10 SER H H 2433 8.201 8.560 -0.359 1
1 91 . 9 1 1 A 10 10 SER HA H 2433 5.136 4.876 0.260 1
1 94 . 9 1 1 A 10 10 SER CA C 2433 56.554 55.516 1.038 1
1 95 . 9 1 1 A 10 10 SER CB C 2433 66.763 65.156 1.607 1
1 96 . 9 1 1 A 10 10 SER N N 2433 121.921 122.052 -0.131 1
1 97 . 9 1 1 A 11 11 ALA H H 2434 8.670 8.240 0.430 1
1 98 . 9 1 1 A 11 11 ALA HA H 2434 5.632 5.214 0.418 1
1 102 . 9 1 1 A 11 11 ALA C C 2434 175.459 174.420 1.039 1
1 103 . 9 1 1 A 11 11 ALA CA C 2434 50.575 50.799 -0.224 1
1 104 . 9 1 1 A 11 11 ALA CB C 2434 23.111 23.253 -0.142 1
1 105 . 9 1 1 A 11 11 ALA N N 2434 124.828 123.572 1.256 1
1 106 . 9 1 1 A 12 12 TYR H H 2435 8.609 8.751 -0.142 1
1 107 . 9 1 1 A 12 12 TYR HA H 2435 4.879 5.123 -0.244 1
1 114 . 9 1 1 A 12 12 TYR C C 2435 173.645 174.671 -1.026 1
1 115 . 9 1 1 A 12 12 TYR CA C 2435 56.268 56.836 -0.568 1
1 116 . 9 1 1 A 12 12 TYR CB C 2435 39.522 42.383 -2.861 1
1 119 . 9 1 1 A 12 12 TYR N N 2435 118.305 119.268 -0.963 1
1 120 . 9 1 1 A 13 13 GLY H H 2436 8.655 8.537 0.118 1
1 121 . 9 1 1 A 13 13 GLY HA2 H 2436 4.943 4.298 0.645 1
1 122 . 9 1 1 A 13 13 GLY HA3 H 2436 4.028 4.342 -0.314 1
1 123 . 9 1 1 A 13 13 GLY C C 2436 175.334 174.996 0.338 1
1 124 . 9 1 1 A 13 13 GLY CA C 2436 44.389 44.369 0.020 1
1 125 . 9 1 1 A 13 13 GLY N N 2436 110.710 110.486 0.224 1
1 126 . 9 1 1 A 14 14 ALA H H 2437 8.939 8.728 0.211 1
1 127 . 9 1 1 A 14 14 ALA HA H 2437 4.276 4.074 0.202 1
1 131 . 9 1 1 A 14 14 ALA C C 2437 180.524 179.100 1.424 1
1 132 . 9 1 1 A 14 14 ALA CA C 2437 55.551 55.095 0.456 1
1 133 . 9 1 1 A 14 14 ALA CB C 2437 18.411 18.519 -0.108 1
1 134 . 9 1 1 A 14 14 ALA N N 2437 126.973 123.873 3.100 1
1 135 . 9 1 1 A 15 15 GLY H H 2438 8.933 8.703 0.230 1
1 136 . 9 1 1 A 15 15 GLY HA2 H 2438 4.531 4.040 0.491 1
1 137 . 9 1 1 A 15 15 GLY HA3 H 2438 3.576 4.254 -0.678 1
1 138 . 9 1 1 A 15 15 GLY C C 2438 174.323 175.476 -1.153 1
1 139 . 9 1 1 A 15 15 GLY CA C 2438 46.855 46.634 0.221 1
1 140 . 9 1 1 A 15 15 GLY N N 2438 104.803 105.430 -0.627 1
1 141 . 9 1 1 A 16 16 LEU H H 2439 7.529 7.533 -0.004 1
1 142 . 9 1 1 A 16 16 LEU HA H 2439 3.768 3.742 0.026 1
1 152 . 9 1 1 A 16 16 LEU C C 2439 176.388 178.595 -2.207 1
1 153 . 9 1 1 A 16 16 LEU CA C 2439 56.137 57.210 -1.073 1
1 154 . 9 1 1 A 16 16 LEU CB C 2439 41.621 41.056 0.565 1
1 158 . 9 1 1 A 16 16 LEU N N 2439 119.633 121.787 -2.154 1
1 159 . 9 1 1 A 17 17 GLU H H 2440 7.505 7.874 -0.369 1
1 160 . 9 1 1 A 17 17 GLU HA H 2440 4.663 4.331 0.332 1
1 165 . 9 1 1 A 17 17 GLU C C 2440 178.126 176.636 1.490 1
1 166 . 9 1 1 A 17 17 GLU CA C 2440 56.447 56.600 -0.153 1
1 167 . 9 1 1 A 17 17 GLU CB C 2440 31.485 30.934 0.551 1
1 169 . 9 1 1 A 17 17 GLU N N 2440 114.368 116.157 -1.789 1
1 170 . 9 1 1 A 18 18 GLY H H 2441 7.921 7.690 0.231 1
1 171 . 9 1 1 A 18 18 GLY HA2 H 2441 4.889 4.215 0.674 1
1 172 . 9 1 1 A 18 18 GLY HA3 H 2441 3.707 4.263 -0.556 1
1 173 . 9 1 1 A 18 18 GLY C C 2441 170.965 171.808 -0.843 1
1 174 . 9 1 1 A 18 18 GLY CA C 2441 45.549 44.862 0.687 1
1 175 . 9 1 1 A 18 18 GLY N N 2441 109.165 106.070 3.095 1
1 176 . 9 1 1 A 19 19 GLY H H 2442 7.540 8.177 -0.637 1
1 177 . 9 1 1 A 19 19 GLY HA2 H 2442 4.086 4.185 -0.099 1
1 178 . 9 1 1 A 19 19 GLY HA3 H 2442 4.086 4.221 -0.135 1
1 179 . 9 1 1 A 19 19 GLY C C 2442 171.051 171.219 -0.168 1
1 180 . 9 1 1 A 19 19 GLY CA C 2442 44.937 45.786 -0.849 1
1 181 . 9 1 1 A 19 19 GLY N N 2442 105.460 108.523 -3.063 1
1 182 . 9 1 1 A 20 20 VAL H H 2443 8.899 8.522 0.377 1
1 183 . 9 1 1 A 20 20 VAL HA H 2443 5.062 4.908 0.154 1
1 191 . 9 1 1 A 20 20 VAL C C 2443 176.623 174.612 2.011 1
1 192 . 9 1 1 A 20 20 VAL CA C 2443 60.197 59.466 0.731 1
1 193 . 9 1 1 A 20 20 VAL CB C 2443 35.107 35.950 -0.843 1
1 196 . 9 1 1 A 20 20 VAL N N 2443 122.753 120.388 2.365 1
1 197 . 9 1 1 A 21 21 THR H H 2444 8.630 8.481 0.149 1
1 198 . 9 1 1 A 21 21 THR HA H 2444 3.773 4.149 -0.376 1
1 203 . 9 1 1 A 21 21 THR C C 2444 175.646 174.949 0.697 1
1 204 . 9 1 1 A 21 21 THR CA C 2444 62.732 63.321 -0.589 1
1 205 . 9 1 1 A 21 21 THR CB C 2444 68.925 68.427 0.498 1
1 207 . 9 1 1 A 21 21 THR N N 2444 118.179 118.350 -0.171 1
1 208 . 9 1 1 A 22 22 GLY H H 2445 8.736 8.956 -0.220 1
1 209 . 9 1 1 A 22 22 GLY HA2 H 2445 3.412 4.014 -0.602 1
1 210 . 9 1 1 A 22 22 GLY HA3 H 2445 4.061 4.017 0.044 1
1 211 . 9 1 1 A 22 22 GLY C C 2445 172.973 173.837 -0.864 1
1 212 . 9 1 1 A 22 22 GLY CA C 2445 45.577 45.204 0.373 1
1 213 . 9 1 1 A 22 22 GLY N N 2445 107.888 114.094 -6.206 1
1 214 . 9 1 1 A 23 23 ASN H H 2446 7.877 7.679 0.198 1
1 215 . 9 1 1 A 23 23 ASN HA H 2446 5.253 4.969 0.284 1
1 220 . 9 1 1 A 23 23 ASN CA C 2446 49.740 50.764 -1.024 1
1 221 . 9 1 1 A 23 23 ASN CB C 2446 40.198 39.582 0.616 1
1 222 . 9 1 1 A 23 23 ASN N N 2446 120.684 118.866 1.818 1
1 224 . 9 1 1 A 24 24 PRO HA H 2447 4.525 4.699 -0.174 1
1 231 . 9 1 1 A 24 24 PRO CA C 2447 62.766 62.451 0.315 1
1 232 . 9 1 1 A 24 24 PRO CB C 2447 31.732 31.751 -0.019 1
1 235 . 9 1 1 A 25 25 ALA H H 2448 9.178 8.239 0.939 1
1 236 . 9 1 1 A 25 25 ALA HA H 2448 4.614 4.985 -0.371 1
1 240 . 9 1 1 A 25 25 ALA C C 2448 175.503 176.268 -0.765 1
1 241 . 9 1 1 A 25 25 ALA CA C 2448 50.526 50.241 0.285 1
1 242 . 9 1 1 A 25 25 ALA CB C 2448 20.458 22.085 -1.627 1
1 243 . 9 1 1 A 25 25 ALA N N 2448 132.079 125.194 6.885 1
1 244 . 9 1 1 A 26 26 GLU H H 2449 8.813 9.051 -0.238 1
1 245 . 9 1 1 A 26 26 GLU HA H 2449 5.830 5.368 0.462 1
1 250 . 9 1 1 A 26 26 GLU C C 2449 176.272 174.632 1.640 1
1 251 . 9 1 1 A 26 26 GLU CA C 2449 54.376 54.921 -0.545 1
1 252 . 9 1 1 A 26 26 GLU CB C 2449 35.463 33.903 1.560 1
1 254 . 9 1 1 A 26 26 GLU N N 2449 120.079 117.087 2.992 1
1 255 . 9 1 1 A 27 27 PHE H H 2450 8.782 8.730 0.052 1
1 256 . 9 1 1 A 27 27 PHE HA H 2450 5.021 5.097 -0.076 1
1 264 . 9 1 1 A 27 27 PHE C C 2450 171.205 172.099 -0.894 1
1 265 . 9 1 1 A 27 27 PHE CA C 2450 56.852 56.398 0.454 1
1 266 . 9 1 1 A 27 27 PHE CB C 2450 41.080 40.890 0.190 1
1 270 . 9 1 1 A 27 27 PHE N N 2450 118.670 117.161 1.509 1
1 271 . 9 1 1 A 28 28 VAL H H 2451 8.961 9.112 -0.151 1
1 272 . 9 1 1 A 28 28 VAL HA H 2451 4.761 4.661 0.100 1
1 280 . 9 1 1 A 28 28 VAL C C 2451 174.673 175.625 -0.952 1
1 281 . 9 1 1 A 28 28 VAL CA C 2451 60.619 61.148 -0.529 1
1 282 . 9 1 1 A 28 28 VAL CB C 2451 35.484 34.077 1.407 1
1 285 . 9 1 1 A 28 28 VAL N N 2451 121.552 120.121 1.431 1
1 286 . 9 1 1 A 29 29 VAL H H 2452 9.294 9.196 0.098 1
1 287 . 9 1 1 A 29 29 VAL HA H 2452 4.363 4.303 0.060 1
1 295 . 9 1 1 A 29 29 VAL C C 2452 174.218 175.030 -0.812 1
1 296 . 9 1 1 A 29 29 VAL CA C 2452 61.526 62.752 -1.226 1
1 297 . 9 1 1 A 29 29 VAL CB C 2452 32.666 31.271 1.395 1
1 300 . 9 1 1 A 29 29 VAL N N 2452 125.585 128.436 -2.851 1
1 301 . 9 1 1 A 30 30 ASN H H 2453 9.465 9.044 0.421 1
1 302 . 9 1 1 A 30 30 ASN HA H 2453 5.096 5.128 -0.032 1
1 307 . 9 1 1 A 30 30 ASN C C 2453 176.216 176.247 -0.031 1
1 308 . 9 1 1 A 30 30 ASN CA C 2453 52.011 52.539 -0.528 1
1 309 . 9 1 1 A 30 30 ASN CB C 2453 39.057 38.960 0.097 1
1 310 . 9 1 1 A 30 30 ASN N N 2453 127.724 127.061 0.663 1
1 312 . 9 1 1 A 31 31 THR H H 2454 8.915 8.114 0.801 1
1 313 . 9 1 1 A 31 31 THR HA H 2454 4.342 4.469 -0.127 1
1 318 . 9 1 1 A 31 31 THR C C 2454 176.816 176.140 0.676 1
1 319 . 9 1 1 A 31 31 THR CA C 2454 61.117 61.918 -0.801 1
1 320 . 9 1 1 A 31 31 THR CB C 2454 68.209 69.606 -1.397 1
1 322 . 9 1 1 A 31 31 THR N N 2454 117.783 117.036 0.747 1
1 323 . 9 1 1 A 32 32 SER H H 2455 8.454 8.092 0.362 1
1 324 . 9 1 1 A 32 32 SER HA H 2455 4.155 4.162 -0.007 1
1 327 . 9 1 1 A 32 32 SER C C 2455 175.458 176.227 -0.769 1
1 328 . 9 1 1 A 32 32 SER CA C 2455 62.148 61.203 0.945 1
1 329 . 9 1 1 A 32 32 SER CB C 2455 63.476 63.168 0.308 1
1 330 . 9 1 1 A 32 32 SER N N 2455 121.781 118.565 3.216 1
1 331 . 9 1 1 A 33 33 ASN H H 2456 8.845 8.209 0.636 1
1 332 . 9 1 1 A 33 33 ASN HA H 2456 5.064 4.587 0.477 1
1 337 . 9 1 1 A 33 33 ASN C C 2456 174.674 176.111 -1.437 1
1 338 . 9 1 1 A 33 33 ASN CA C 2456 53.067 55.053 -1.986 1
1 339 . 9 1 1 A 33 33 ASN CB C 2456 39.632 38.747 0.885 1
1 340 . 9 1 1 A 33 33 ASN N N 2456 120.176 118.135 2.041 1
1 342 . 9 1 1 A 34 34 ALA H H 2457 7.714 7.760 -0.046 1
1 343 . 9 1 1 A 34 34 ALA HA H 2457 4.482 4.426 0.056 1
1 347 . 9 1 1 A 34 34 ALA C C 2457 177.582 177.630 -0.048 1
1 348 . 9 1 1 A 34 34 ALA CA C 2457 52.521 52.664 -0.143 1
1 349 . 9 1 1 A 34 34 ALA CB C 2457 22.252 20.607 1.645 1
1 350 . 9 1 1 A 34 34 ALA N N 2457 123.065 120.087 2.978 1
1 351 . 9 1 1 A 35 35 GLY H H 2458 8.195 7.865 0.330 1
1 352 . 9 1 1 A 35 35 GLY HA2 H 2458 4.246 4.119 0.127 1
1 353 . 9 1 1 A 35 35 GLY HA3 H 2458 3.902 4.139 -0.237 1
1 354 . 9 1 1 A 35 35 GLY C C 2458 173.360 172.744 0.616 1
1 355 . 9 1 1 A 35 35 GLY CA C 2458 44.486 45.069 -0.583 1
1 356 . 9 1 1 A 35 35 GLY N N 2458 108.472 104.448 4.024 1
1 357 . 9 1 1 A 36 36 ALA H H 2459 8.430 8.290 0.140 1
1 358 . 9 1 1 A 36 36 ALA HA H 2459 4.472 5.316 -0.844 1
1 362 . 9 1 1 A 36 36 ALA C C 2459 176.968 176.046 0.922 1
1 363 . 9 1 1 A 36 36 ALA CA C 2459 52.695 51.529 1.166 1
1 364 . 9 1 1 A 36 36 ALA CB C 2459 19.360 23.303 -3.943 1
1 365 . 9 1 1 A 36 36 ALA N N 2459 126.012 124.925 1.087 1
1 366 . 9 1 1 A 37 37 GLY H H 2460 7.781 8.528 -0.747 1
1 367 . 9 1 1 A 37 37 GLY HA2 H 2460 3.856 3.884 -0.028 1
1 368 . 9 1 1 A 37 37 GLY HA3 H 2460 3.164 4.086 -0.922 1
1 369 . 9 1 1 A 37 37 GLY C C 2460 170.730 172.019 -1.289 1
1 370 . 9 1 1 A 37 37 GLY CA C 2460 44.747 45.199 -0.452 1
1 371 . 9 1 1 A 37 37 GLY N N 2460 109.493 105.940 3.553 1
1 372 . 9 1 1 A 38 38 ALA H H 2461 8.055 8.059 -0.004 1
1 373 . 9 1 1 A 38 38 ALA HA H 2461 4.389 4.643 -0.254 1
1 377 . 9 1 1 A 38 38 ALA C C 2461 176.609 176.580 0.029 1
1 378 . 9 1 1 A 38 38 ALA CA C 2461 51.419 51.893 -0.474 1
1 379 . 9 1 1 A 38 38 ALA CB C 2461 19.665 19.510 0.155 1
1 380 . 9 1 1 A 38 38 ALA N N 2461 121.997 122.534 -0.537 1
1 381 . 9 1 1 A 39 39 LEU H H 2462 8.597 8.554 0.043 1
1 382 . 9 1 1 A 39 39 LEU HA H 2462 5.022 5.148 -0.126 1
1 392 . 9 1 1 A 39 39 LEU C C 2462 175.883 174.029 1.854 1
1 393 . 9 1 1 A 39 39 LEU CA C 2462 53.907 53.624 0.283 1
1 394 . 9 1 1 A 39 39 LEU CB C 2462 44.576 46.515 -1.939 1
1 398 . 9 1 1 A 39 39 LEU N N 2462 126.664 122.614 4.050 1
1 399 . 9 1 1 A 40 40 SER H H 2463 8.898 9.149 -0.251 1
1 400 . 9 1 1 A 40 40 SER HA H 2463 4.732 5.398 -0.666 1
1 403 . 9 1 1 A 40 40 SER C C 2463 172.984 172.153 0.831 1
1 404 . 9 1 1 A 40 40 SER CA C 2463 56.730 56.477 0.253 1
1 405 . 9 1 1 A 40 40 SER CB C 2463 64.648 66.767 -2.119 1
1 406 . 9 1 1 A 40 40 SER N N 2463 122.932 120.039 2.893 1
1 407 . 9 1 1 A 41 41 VAL H H 2464 8.538 8.530 0.008 1
1 408 . 9 1 1 A 41 41 VAL HA H 2464 5.131 4.859 0.272 1
1 416 . 9 1 1 A 41 41 VAL C C 2464 174.812 173.310 1.502 1
1 417 . 9 1 1 A 41 41 VAL CA C 2464 60.784 60.603 0.181 1
1 418 . 9 1 1 A 41 41 VAL CB C 2464 34.262 34.883 -0.621 1
1 420 . 9 1 1 A 41 41 VAL N N 2464 129.161 122.600 6.561 1
1 421 . 9 1 1 A 42 42 THR H H 2465 8.807 8.928 -0.121 1
1 422 . 9 1 1 A 42 42 THR HA H 2465 4.573 4.999 -0.426 1
1 427 . 9 1 1 A 42 42 THR CA C 2465 60.408 61.507 -1.099 1
1 428 . 9 1 1 A 42 42 THR CB C 2465 71.764 72.824 -1.060 1
1 430 . 9 1 1 A 42 42 THR N N 2465 120.898 122.186 -1.288 1
1 431 . 9 1 1 A 43 43 ILE H H 2466 8.648 8.929 -0.281 1
1 432 . 9 1 1 A 43 43 ILE HA H 2466 4.854 4.851 0.003 1
1 442 . 9 1 1 A 43 43 ILE C C 2466 174.073 174.175 -0.102 1
1 443 . 9 1 1 A 43 43 ILE CA C 2466 61.184 60.346 0.838 1
1 444 . 9 1 1 A 43 43 ILE CB C 2466 39.516 39.945 -0.429 1
1 448 . 9 1 1 A 43 43 ILE N N 2466 124.810 126.607 -1.797 1
1 449 . 9 1 1 A 44 44 ASP H H 2467 8.821 9.171 -0.350 1
1 450 . 9 1 1 A 44 44 ASP HA H 2467 5.217 5.526 -0.309 1
1 453 . 9 1 1 A 44 44 ASP C C 2467 175.002 175.327 -0.325 1
1 454 . 9 1 1 A 44 44 ASP CA C 2467 52.998 52.235 0.763 1
1 455 . 9 1 1 A 44 44 ASP CB C 2467 44.728 44.223 0.505 1
1 456 . 9 1 1 A 44 44 ASP N N 2467 129.093 128.710 0.383 1
1 457 . 9 1 1 A 45 45 GLY H H 2468 8.535 8.225 0.310 1
1 458 . 9 1 1 A 45 45 GLY HA2 H 2468 3.954 3.651 0.303 1
1 459 . 9 1 1 A 45 45 GLY HA3 H 2468 3.561 3.966 -0.405 1
1 460 . 9 1 1 A 45 45 GLY CA C 2468 45.659 44.986 0.673 1
1 461 . 9 1 1 A 45 45 GLY N N 2468 112.751 109.444 3.307 1
1 462 . 9 1 1 A 46 46 PRO HA H 2469 4.318 4.368 -0.050 1
1 469 . 9 1 1 A 46 46 PRO C C 2469 176.086 176.136 -0.050 1
1 470 . 9 1 1 A 46 46 PRO CA C 2469 64.198 63.855 0.343 1
1 471 . 9 1 1 A 46 46 PRO CB C 2469 32.348 31.869 0.479 1
1 474 . 9 1 1 A 47 47 SER H H 2470 7.106 7.555 -0.449 1
1 475 . 9 1 1 A 47 47 SER HA H 2470 4.632 4.778 -0.146 1
1 478 . 9 1 1 A 47 47 SER C C 2470 172.969 173.828 -0.859 1
1 479 . 9 1 1 A 47 47 SER CA C 2470 57.106 57.332 -0.226 1
1 480 . 9 1 1 A 47 47 SER CB C 2470 66.262 67.302 -1.040 1
1 481 . 9 1 1 A 47 47 SER N N 2470 110.556 114.201 -3.645 1
1 482 . 9 1 1 A 48 48 LYS H H 2471 8.534 8.293 0.241 1
1 483 . 9 1 1 A 48 48 LYS HA H 2471 4.486 4.294 0.192 1
1 492 . 9 1 1 A 48 48 LYS C C 2471 177.231 176.189 1.042 1
1 493 . 9 1 1 A 48 48 LYS CA C 2471 56.620 56.060 0.560 1
1 494 . 9 1 1 A 48 48 LYS CB C 2471 32.379 33.102 -0.723 1
1 498 . 9 1 1 A 48 48 LYS N N 2471 124.055 122.656 1.399 1
1 499 . 9 1 1 A 49 49 VAL H H 2472 8.497 8.658 -0.161 1
1 500 . 9 1 1 A 49 49 VAL HA H 2472 4.552 4.898 -0.346 1
1 508 . 9 1 1 A 49 49 VAL C C 2472 175.292 174.257 1.035 1
1 509 . 9 1 1 A 49 49 VAL CA C 2472 60.142 58.950 1.192 1
1 510 . 9 1 1 A 49 49 VAL CB C 2472 33.464 35.524 -2.060 1
1 513 . 9 1 1 A 49 49 VAL N N 2472 121.233 112.997 8.236 1
1 514 . 9 1 1 A 50 50 LYS H H 2473 8.190 8.210 -0.020 1
1 515 . 9 1 1 A 50 50 LYS HA H 2473 4.522 4.583 -0.061 1
1 518 . 9 1 1 A 50 50 LYS CA C 2473 55.952 56.436 -0.484 1
1 519 . 9 1 1 A 50 50 LYS CB C 2473 32.896 33.041 -0.145 1
1 520 . 9 1 1 A 50 50 LYS N N 2473 126.082 124.582 1.500 1
1 521 . 9 1 1 A 51 51 MET H H 2474 8.818 8.829 -0.011 1
1 522 . 9 1 1 A 51 51 MET HA H 2474 5.324 5.275 0.049 1
1 530 . 9 1 1 A 51 51 MET C C 2474 173.933 173.378 0.555 1
1 531 . 9 1 1 A 51 51 MET CA C 2474 54.848 54.304 0.544 1
1 532 . 9 1 1 A 51 51 MET CB C 2474 37.043 35.753 1.290 1
1 535 . 9 1 1 A 51 51 MET N N 2474 126.911 125.557 1.354 1
1 536 . 9 1 1 A 52 52 ASP H H 2475 9.095 9.049 0.046 1
1 537 . 9 1 1 A 52 52 ASP HA H 2475 4.947 5.517 -0.570 1
1 540 . 9 1 1 A 52 52 ASP C C 2475 173.923 174.312 -0.389 1
1 541 . 9 1 1 A 52 52 ASP CA C 2475 53.487 52.775 0.712 1
1 542 . 9 1 1 A 52 52 ASP CB C 2475 44.765 45.675 -0.910 1
1 543 . 9 1 1 A 52 52 ASP N N 2475 125.526 124.759 0.767 1
1 544 . 9 1 1 A 53 53 CYS H H 2476 8.606 8.708 -0.102 1
1 545 . 9 1 1 A 53 53 CYS HA H 2476 5.145 5.276 -0.131 1
1 548 . 9 1 1 A 53 53 CYS C C 2476 173.330 172.869 0.461 1
1 549 . 9 1 1 A 53 53 CYS CA C 2476 57.452 58.025 -0.573 1
1 550 . 9 1 1 A 53 53 CYS CB C 2476 28.108 31.797 -3.689 1
1 551 . 9 1 1 A 53 53 CYS N N 2476 124.317 119.096 5.221 1
1 552 . 9 1 1 A 54 54 GLN H H 2477 8.978 8.872 0.106 1
1 553 . 9 1 1 A 54 54 GLN HA H 2477 4.884 4.705 0.179 1
1 560 . 9 1 1 A 54 54 GLN C C 2477 174.854 174.490 0.364 1
1 561 . 9 1 1 A 54 54 GLN CA C 2477 53.891 55.064 -1.173 1
1 562 . 9 1 1 A 54 54 GLN CB C 2477 32.837 32.942 -0.105 1
1 564 . 9 1 1 A 54 54 GLN N N 2477 127.074 124.482 2.592 1
1 566 . 9 1 1 A 55 55 GLU H H 2478 9.065 8.739 0.326 1
1 567 . 9 1 1 A 55 55 GLU HA H 2478 4.280 4.493 -0.213 1
1 572 . 9 1 1 A 55 55 GLU C C 2478 175.383 175.905 -0.522 1
1 573 . 9 1 1 A 55 55 GLU CA C 2478 57.516 55.980 1.536 1
1 574 . 9 1 1 A 55 55 GLU CB C 2478 30.346 30.229 0.117 1
1 576 . 9 1 1 A 55 55 GLU N N 2478 125.186 124.177 1.009 1
1 577 . 9 1 1 A 56 56 CYS H H 2479 8.407 8.527 -0.120 1
1 578 . 9 1 1 A 56 56 CYS HA H 2479 5.056 4.653 0.403 1
1 581 . 9 1 1 A 56 56 CYS CA C 2479 55.858 56.964 -1.106 1
1 582 . 9 1 1 A 56 56 CYS CB C 2479 28.676 30.401 -1.725 1
1 583 . 9 1 1 A 56 56 CYS N N 2479 121.499 118.300 3.199 1
1 584 . 9 1 1 A 57 57 PRO HA H 2480 4.159 4.261 -0.102 1
1 591 . 9 1 1 A 57 57 PRO C C 2480 177.964 177.759 0.205 1
1 592 . 9 1 1 A 57 57 PRO CA C 2480 66.877 64.774 2.103 1
1 593 . 9 1 1 A 57 57 PRO CB C 2480 31.709 31.886 -0.177 1
1 596 . 9 1 1 A 58 58 GLU H H 2481 8.900 8.228 0.672 1
1 597 . 9 1 1 A 58 58 GLU HA H 2481 4.201 4.332 -0.131 1
1 602 . 9 1 1 A 58 58 GLU C C 2481 175.129 176.538 -1.409 1
1 603 . 9 1 1 A 58 58 GLU CA C 2481 57.883 57.349 0.534 1
1 604 . 9 1 1 A 58 58 GLU CB C 2481 29.991 30.306 -0.315 1
1 606 . 9 1 1 A 58 58 GLU N N 2481 115.316 118.072 -2.756 1
1 607 . 9 1 1 A 59 59 GLY H H 2482 7.527 7.198 0.329 1
1 608 . 9 1 1 A 59 59 GLY HA2 H 2482 4.935 4.101 0.834 1
1 609 . 9 1 1 A 59 59 GLY HA3 H 2482 3.381 4.190 -0.809 1
1 610 . 9 1 1 A 59 59 GLY CA C 2482 47.809 44.346 3.463 1
1 611 . 9 1 1 A 59 59 GLY N N 2482 110.079 107.173 2.906 1
1 612 . 9 1 1 A 60 60 TYR H H 2483 8.990 8.419 0.571 1
1 613 . 9 1 1 A 60 60 TYR HA H 2483 5.157 4.765 0.392 1
1 618 . 9 1 1 A 60 60 TYR C C 2483 175.096 174.951 0.145 1
1 619 . 9 1 1 A 60 60 TYR CA C 2483 57.375 57.947 -0.572 1
1 620 . 9 1 1 A 60 60 TYR CB C 2483 43.153 39.088 4.065 1
1 622 . 9 1 1 A 60 60 TYR N N 2483 125.900 121.833 4.067 1
1 623 . 9 1 1 A 61 61 ARG H H 2484 9.557 8.909 0.648 1
1 624 . 9 1 1 A 61 61 ARG HA H 2484 4.858 4.603 0.255 1
1 631 . 9 1 1 A 61 61 ARG CA C 2484 55.016 56.308 -1.292 1
1 632 . 9 1 1 A 61 61 ARG CB C 2484 32.128 30.972 1.156 1
1 635 . 9 1 1 A 61 61 ARG N N 2484 124.847 126.004 -1.157 1
1 636 . 9 1 1 A 62 62 VAL H H 2485 9.046 8.890 0.156 1
1 637 . 9 1 1 A 62 62 VAL HA H 2485 4.675 4.727 -0.052 1
1 645 . 9 1 1 A 62 62 VAL C C 2485 173.837 174.693 -0.856 1
1 646 . 9 1 1 A 62 62 VAL CA C 2485 60.752 60.797 -0.045 1
1 647 . 9 1 1 A 62 62 VAL CB C 2485 32.459 34.231 -1.772 1
1 650 . 9 1 1 A 62 62 VAL N N 2485 132.205 126.367 5.838 1
1 651 . 9 1 1 A 63 63 THR H H 2486 8.474 8.910 -0.436 1
1 652 . 9 1 1 A 63 63 THR HA H 2486 5.392 5.416 -0.024 1
1 657 . 9 1 1 A 63 63 THR C C 2486 173.675 173.457 0.218 1
1 658 . 9 1 1 A 63 63 THR CA C 2486 60.008 61.208 -1.200 1
1 659 . 9 1 1 A 63 63 THR CB C 2486 71.035 71.798 -0.763 1
1 661 . 9 1 1 A 63 63 THR N N 2486 121.216 123.050 -1.834 1
1 662 . 9 1 1 A 64 64 TYR H H 2487 9.409 9.091 0.318 1
1 663 . 9 1 1 A 64 64 TYR HA H 2487 5.617 5.581 0.036 1
1 670 . 9 1 1 A 64 64 TYR C C 2487 172.847 172.472 0.375 1
1 671 . 9 1 1 A 64 64 TYR CA C 2487 55.557 55.867 -0.310 1
1 672 . 9 1 1 A 64 64 TYR CB C 2487 41.968 41.497 0.471 1
1 675 . 9 1 1 A 64 64 TYR N N 2487 124.061 121.994 2.067 1
1 676 . 9 1 1 A 65 65 THR H H 2488 8.145 8.872 -0.727 1
1 677 . 9 1 1 A 65 65 THR HA H 2488 4.959 4.588 0.371 1
1 682 . 9 1 1 A 65 65 THR CA C 2488 58.532 58.929 -0.397 1
1 683 . 9 1 1 A 65 65 THR CB C 2488 70.141 70.653 -0.512 1
1 685 . 9 1 1 A 65 65 THR N N 2488 117.924 116.809 1.115 1
1 686 . 9 1 1 A 66 66 PRO HA H 2489 4.602 4.766 -0.164 1
1 693 . 9 1 1 A 66 66 PRO C C 2489 176.647 176.623 0.024 1
1 694 . 9 1 1 A 66 66 PRO CA C 2489 61.442 62.216 -0.774 1
1 695 . 9 1 1 A 66 66 PRO CB C 2489 32.715 33.205 -0.490 1
1 698 . 9 1 1 A 67 67 MET H H 2490 8.832 8.486 0.346 1
1 699 . 9 1 1 A 67 67 MET HA H 2490 4.880 4.872 0.008 1
1 707 . 9 1 1 A 67 67 MET C C 2490 174.121 175.980 -1.859 1
1 708 . 9 1 1 A 67 67 MET CA C 2490 53.848 54.820 -0.972 1
1 709 . 9 1 1 A 67 67 MET CB C 2490 33.727 34.274 -0.547 1
1 712 . 9 1 1 A 67 67 MET N N 2490 119.212 116.941 2.271 1
1 713 . 9 1 1 A 68 68 ALA H H 2491 7.086 7.621 -0.535 1
1 714 . 9 1 1 A 68 68 ALA HA H 2491 4.851 4.836 0.015 1
1 718 . 9 1 1 A 68 68 ALA CA C 2491 49.222 49.775 -0.553 1
1 719 . 9 1 1 A 68 68 ALA CB C 2491 20.600 22.037 -1.437 1
1 720 . 9 1 1 A 68 68 ALA N N 2491 120.363 121.277 -0.914 1
1 721 . 9 1 1 A 69 69 PRO HA H 2492 4.263 4.567 -0.304 1
1 728 . 9 1 1 A 69 69 PRO C C 2492 174.370 176.242 -1.872 1
1 729 . 9 1 1 A 69 69 PRO CA C 2492 62.555 63.496 -0.941 1
1 730 . 9 1 1 A 69 69 PRO CB C 2492 32.752 32.522 0.230 1
1 733 . 9 1 1 A 70 70 GLY H H 2493 8.858 8.361 0.497 1
1 734 . 9 1 1 A 70 70 GLY HA2 H 2493 4.544 4.036 0.508 1
1 735 . 9 1 1 A 70 70 GLY HA3 H 2493 3.849 4.078 -0.229 1
1 736 . 9 1 1 A 70 70 GLY C C 2493 172.182 172.276 -0.094 1
1 737 . 9 1 1 A 70 70 GLY CA C 2493 44.356 44.167 0.189 1
1 738 . 9 1 1 A 70 70 GLY N N 2493 106.539 109.473 -2.934 1
1 739 . 9 1 1 A 71 71 SER H H 2494 8.490 8.312 0.178 1
1 740 . 9 1 1 A 71 71 SER HA H 2494 5.280 5.132 0.148 1
1 743 . 9 1 1 A 71 71 SER C C 2494 173.512 173.567 -0.055 1
1 744 . 9 1 1 A 71 71 SER CA C 2494 57.674 58.445 -0.771 1
1 745 . 9 1 1 A 71 71 SER CB C 2494 63.799 64.101 -0.302 1
1 746 . 9 1 1 A 71 71 SER N N 2494 117.964 117.454 0.510 1
1 747 . 9 1 1 A 72 72 TYR H H 2495 9.320 9.491 -0.171 1
1 748 . 9 1 1 A 72 72 TYR HA H 2495 4.960 5.275 -0.315 1
1 755 . 9 1 1 A 72 72 TYR C C 2495 173.979 174.830 -0.851 1
1 756 . 9 1 1 A 72 72 TYR CA C 2495 56.384 57.443 -1.059 1
1 757 . 9 1 1 A 72 72 TYR CB C 2495 40.247 40.208 0.039 1
1 760 . 9 1 1 A 72 72 TYR N N 2495 126.442 126.802 -0.360 1
1 761 . 9 1 1 A 73 73 LEU H H 2496 9.019 8.940 0.079 1
1 762 . 9 1 1 A 73 73 LEU HA H 2496 5.209 4.973 0.236 1
1 772 . 9 1 1 A 73 73 LEU C C 2496 177.015 174.685 2.330 1
1 773 . 9 1 1 A 73 73 LEU CA C 2496 53.393 54.185 -0.792 1
1 774 . 9 1 1 A 73 73 LEU CB C 2496 43.918 43.136 0.782 1
1 778 . 9 1 1 A 73 73 LEU N N 2496 125.439 126.401 -0.962 1
1 779 . 9 1 1 A 74 74 ILE H H 2497 9.921 9.667 0.254 1
1 780 . 9 1 1 A 74 74 ILE HA H 2497 5.128 4.778 0.350 1
1 790 . 9 1 1 A 74 74 ILE C C 2497 175.730 174.834 0.896 1
1 791 . 9 1 1 A 74 74 ILE CA C 2497 60.930 60.269 0.661 1
1 792 . 9 1 1 A 74 74 ILE CB C 2497 39.488 37.924 1.564 1
1 796 . 9 1 1 A 74 74 ILE N N 2497 132.185 130.646 1.539 1
1 797 . 9 1 1 A 75 75 SER H H 2498 9.284 9.010 0.274 1
1 798 . 9 1 1 A 75 75 SER HA H 2498 5.111 5.171 -0.060 1
1 801 . 9 1 1 A 75 75 SER C C 2498 173.449 174.052 -0.603 1
1 802 . 9 1 1 A 75 75 SER CA C 2498 58.260 58.062 0.198 1
1 803 . 9 1 1 A 75 75 SER CB C 2498 63.956 64.361 -0.405 1
1 804 . 9 1 1 A 75 75 SER N N 2498 125.384 124.422 0.962 1
1 805 . 9 1 1 A 76 76 ILE H H 2499 9.861 9.178 0.683 1
1 806 . 9 1 1 A 76 76 ILE HA H 2499 4.814 5.014 -0.200 1
1 816 . 9 1 1 A 76 76 ILE CA C 2499 61.034 60.470 0.564 1
1 817 . 9 1 1 A 76 76 ILE CB C 2499 40.387 40.726 -0.339 1
1 821 . 9 1 1 A 76 76 ILE N N 2499 129.414 126.798 2.616 1
1 822 . 9 1 1 A 77 77 LYS H H 2500 8.827 9.143 -0.316 1
1 823 . 9 1 1 A 77 77 LYS HA H 2500 5.254 5.435 -0.181 1
1 832 . 9 1 1 A 77 77 LYS C C 2500 175.245 174.888 0.357 1
1 833 . 9 1 1 A 77 77 LYS CA C 2500 54.388 54.559 -0.171 1
1 834 . 9 1 1 A 77 77 LYS CB C 2500 36.127 36.215 -0.088 1
1 838 . 9 1 1 A 77 77 LYS N N 2500 126.922 125.999 0.923 1
1 839 . 9 1 1 A 78 78 TYR H H 2501 8.408 8.746 -0.338 1
1 840 . 9 1 1 A 78 78 TYR HA H 2501 5.479 5.023 0.456 1
1 847 . 9 1 1 A 78 78 TYR C C 2501 174.792 175.480 -0.688 1
1 848 . 9 1 1 A 78 78 TYR CA C 2501 56.837 57.476 -0.639 1
1 849 . 9 1 1 A 78 78 TYR CB C 2501 44.008 42.055 1.953 1
1 852 . 9 1 1 A 78 78 TYR N N 2501 122.282 124.288 -2.006 1
1 853 . 9 1 1 A 79 79 GLY H H 2502 8.196 8.559 -0.363 1
1 854 . 9 1 1 A 79 79 GLY HA2 H 2502 4.040 3.678 0.362 1
1 855 . 9 1 1 A 79 79 GLY HA3 H 2502 3.465 3.835 -0.370 1
1 856 . 9 1 1 A 79 79 GLY C C 2502 173.932 173.516 0.416 1
1 857 . 9 1 1 A 79 79 GLY CA C 2502 45.741 45.805 -0.064 1
1 858 . 9 1 1 A 79 79 GLY N N 2502 113.451 114.176 -0.725 1
1 859 . 9 1 1 A 80 80 GLY H H 2503 7.589 7.959 -0.370 1
1 860 . 9 1 1 A 80 80 GLY HA2 H 2503 4.490 4.064 0.426 1
1 861 . 9 1 1 A 80 80 GLY HA3 H 2503 3.555 4.161 -0.606 1
1 862 . 9 1 1 A 80 80 GLY CA C 2503 43.540 44.447 -0.907 1
1 863 . 9 1 1 A 80 80 GLY N N 2503 107.293 107.736 -0.443 1
1 864 . 9 1 1 A 81 81 PRO HA H 2504 4.320 4.328 -0.008 1
1 871 . 9 1 1 A 81 81 PRO C C 2504 175.311 175.316 -0.005 1
1 872 . 9 1 1 A 81 81 PRO CA C 2504 62.722 63.536 -0.814 1
1 873 . 9 1 1 A 81 81 PRO CB C 2504 29.297 32.010 -2.713 1
1 876 . 9 1 1 A 82 82 TYR H H 2505 7.778 7.382 0.396 1
1 877 . 9 1 1 A 82 82 TYR HA H 2505 4.791 4.991 -0.200 1
1 884 . 9 1 1 A 82 82 TYR C C 2505 175.086 175.843 -0.757 1
1 885 . 9 1 1 A 82 82 TYR CA C 2505 56.111 56.599 -0.488 1
1 886 . 9 1 1 A 82 82 TYR CB C 2505 39.483 40.804 -1.321 1
1 889 . 9 1 1 A 82 82 TYR N N 2505 123.973 120.874 3.099 1
1 890 . 9 1 1 A 83 83 HIS H H 2506 8.625 8.954 -0.329 1
1 891 . 9 1 1 A 83 83 HIS HA H 2506 4.583 4.915 -0.332 1
1 896 . 9 1 1 A 83 83 HIS C C 2506 178.161 176.017 2.144 1
1 897 . 9 1 1 A 83 83 HIS CA C 2506 58.241 57.173 1.068 1
1 898 . 9 1 1 A 83 83 HIS CB C 2506 33.132 30.461 2.671 1
1 901 . 9 1 1 A 83 83 HIS N N 2506 124.092 121.273 2.819 1
1 902 . 9 1 1 A 84 84 ILE H H 2507 8.327 8.625 -0.298 1
1 903 . 9 1 1 A 84 84 ILE HA H 2507 4.553 4.412 0.141 1
1 913 . 9 1 1 A 84 84 ILE C C 2507 176.523 176.223 0.300 1
1 914 . 9 1 1 A 84 84 ILE CA C 2507 60.791 60.232 0.559 1
1 915 . 9 1 1 A 84 84 ILE CB C 2507 39.162 39.377 -0.215 1
1 919 . 9 1 1 A 84 84 ILE N N 2507 117.355 119.674 -2.319 1
1 920 . 9 1 1 A 85 85 GLY H H 2508 9.130 8.484 0.646 1
1 921 . 9 1 1 A 85 85 GLY HA2 H 2508 3.883 3.713 0.170 1
1 922 . 9 1 1 A 85 85 GLY HA3 H 2508 3.800 3.730 0.070 1
1 923 . 9 1 1 A 85 85 GLY C C 2508 174.438 175.475 -1.037 1
1 924 . 9 1 1 A 85 85 GLY CA C 2508 47.673 46.698 0.975 1
1 925 . 9 1 1 A 85 85 GLY N N 2508 111.346 109.855 1.491 1
1 926 . 9 1 1 A 86 86 GLY H H 2509 8.236 8.152 0.084 1
1 927 . 9 1 1 A 86 86 GLY HA2 H 2509 3.893 3.905 -0.012 1
1 928 . 9 1 1 A 86 86 GLY HA3 H 2509 3.161 3.931 -0.770 1
1 929 . 9 1 1 A 86 86 GLY C C 2509 171.837 173.049 -1.212 1
1 930 . 9 1 1 A 86 86 GLY CA C 2509 44.844 45.370 -0.526 1
1 931 . 9 1 1 A 86 86 GLY N N 2509 115.594 118.000 -2.406 1
1 932 . 9 1 1 A 87 87 SER H H 2510 7.385 7.750 -0.365 1
1 933 . 9 1 1 A 87 87 SER HA H 2510 4.217 4.042 0.175 1
1 936 . 9 1 1 A 87 87 SER CA C 2510 54.783 55.122 -0.339 1
1 937 . 9 1 1 A 87 87 SER CB C 2510 62.683 64.087 -1.404 1
1 938 . 9 1 1 A 87 87 SER N N 2510 112.859 116.669 -3.810 1
1 939 . 9 1 1 A 88 88 PRO HA H 2511 5.532 4.759 0.773 1
1 946 . 9 1 1 A 88 88 PRO C C 2511 175.870 175.312 0.558 1
1 947 . 9 1 1 A 88 88 PRO CA C 2511 62.379 62.278 0.101 1
1 948 . 9 1 1 A 88 88 PRO CB C 2511 33.639 32.150 1.489 1
1 951 . 9 1 1 A 89 89 PHE H H 2512 9.359 8.575 0.784 1
1 952 . 9 1 1 A 89 89 PHE HA H 2512 4.467 4.798 -0.331 1
1 960 . 9 1 1 A 89 89 PHE C C 2512 175.152 176.162 -1.010 1
1 961 . 9 1 1 A 89 89 PHE CA C 2512 57.401 57.304 0.097 1
1 962 . 9 1 1 A 89 89 PHE CB C 2512 40.843 40.783 0.060 1
1 966 . 9 1 1 A 89 89 PHE N N 2512 124.789 120.055 4.734 1
1 967 . 9 1 1 A 90 90 LYS H H 2513 8.772 8.603 0.169 1
1 968 . 9 1 1 A 90 90 LYS HA H 2513 4.941 4.402 0.539 1
1 973 . 9 1 1 A 90 90 LYS C C 2513 174.183 176.013 -1.830 1
1 974 . 9 1 1 A 90 90 LYS CA C 2513 55.749 56.713 -0.964 1
1 975 . 9 1 1 A 90 90 LYS CB C 2513 32.817 32.052 0.765 1
1 978 . 9 1 1 A 90 90 LYS N N 2513 125.133 120.942 4.191 1
1 979 . 9 1 1 A 91 91 ALA H H 2514 9.158 7.561 1.597 1
1 980 . 9 1 1 A 91 91 ALA HA H 2514 4.510 4.176 0.334 1
1 984 . 9 1 1 A 91 91 ALA C C 2514 176.561 177.550 -0.989 1
1 985 . 9 1 1 A 91 91 ALA CA C 2514 50.528 52.978 -2.450 1
1 986 . 9 1 1 A 91 91 ALA CB C 2514 20.653 18.896 1.757 1
1 987 . 9 1 1 A 91 91 ALA N N 2514 131.989 122.944 9.045 1
1 988 . 9 1 1 A 92 92 LYS H H 2515 8.186 8.707 -0.521 1
1 989 . 9 1 1 A 92 92 LYS HA H 2515 4.926 4.993 -0.067 1
1 998 . 9 1 1 A 92 92 LYS C C 2515 175.177 176.226 -1.049 1
1 999 . 9 1 1 A 92 92 LYS CA C 2515 55.725 55.836 -0.111 1
1 1000 . 9 1 1 A 92 92 LYS CB C 2515 33.765 34.414 -0.649 1
1 1004 . 9 1 1 A 92 92 LYS N N 2515 124.887 124.047 0.840 1
1 1005 . 9 1 1 A 93 93 VAL H H 2516 9.362 9.337 0.025 1
1 1006 . 9 1 1 A 93 93 VAL HA H 2516 5.161 5.065 0.096 1
1 1014 . 9 1 1 A 93 93 VAL C C 2516 176.988 174.688 2.300 1
1 1015 . 9 1 1 A 93 93 VAL CA C 2516 60.523 59.764 0.759 1
1 1016 . 9 1 1 A 93 93 VAL CB C 2516 33.291 35.832 -2.541 1
1 1019 . 9 1 1 A 93 93 VAL N N 2516 129.943 118.059 11.884 1
1 1020 . 9 1 1 A 94 94 THR H H 2517 8.614 8.717 -0.103 1
1 1021 . 9 1 1 A 94 94 THR HA H 2517 4.902 4.859 0.043 1
1 1026 . 9 1 1 A 94 94 THR C C 2517 172.759 173.456 -0.697 1
1 1027 . 9 1 1 A 94 94 THR CA C 2517 60.121 59.793 0.328 1
1 1028 . 9 1 1 A 94 94 THR CB C 2517 71.072 71.109 -0.037 1
1 1030 . 9 1 1 A 94 94 THR N N 2517 122.032 113.375 8.657 1
1 1031 . 9 1 1 A 95 95 GLY H H 2518 8.280 8.455 -0.175 1
1 1032 . 9 1 1 A 95 95 GLY HA2 H 2518 3.852 4.139 -0.287 1
1 1033 . 9 1 1 A 95 95 GLY HA3 H 2518 4.846 4.144 0.702 1
1 1034 . 9 1 1 A 95 95 GLY CA C 2518 43.955 44.577 -0.622 1
1 1035 . 9 1 1 A 95 95 GLY N N 2518 107.949 108.347 -0.398 1
1 1036 . 9 1 1 A 96 96 PRO HA H 2519 4.449 4.636 -0.187 1
1 1043 . 9 1 1 A 96 96 PRO C C 2519 176.892 176.521 0.371 1
1 1044 . 9 1 1 A 96 96 PRO CA C 2519 62.062 62.788 -0.726 1
1 1045 . 9 1 1 A 96 96 PRO CB C 2519 32.286 31.977 0.309 1
1 1048 . 9 1 1 A 97 97 ARG H H 2520 8.651 8.569 0.082 1
1 1049 . 9 1 1 A 97 97 ARG HA H 2520 4.348 4.439 -0.091 1
1 1056 . 9 1 1 A 97 97 ARG C C 2520 176.236 175.840 0.396 1
1 1057 . 9 1 1 A 97 97 ARG CA C 2520 57.587 56.446 1.141 1
1 1058 . 9 1 1 A 97 97 ARG CB C 2520 30.472 30.794 -0.322 1
1 1061 . 9 1 1 A 97 97 ARG N N 2520 120.781 122.166 -1.385 1
1 1062 . 9 1 1 A 98 98 LEU H H 2521 8.545 8.797 -0.252 1
1 1063 . 9 1 1 A 98 98 LEU HA H 2521 4.577 4.262 0.315 1
1 1073 . 9 1 1 A 98 98 LEU C C 2521 175.880 178.999 -3.119 1
1 1074 . 9 1 1 A 98 98 LEU CA C 2521 55.068 57.062 -1.994 1
1 1075 . 9 1 1 A 98 98 LEU CB C 2521 43.082 42.090 0.992 1
1 1079 . 9 1 1 A 98 98 LEU N N 2521 128.715 127.638 1.077 1
1 4 . 10 1 1 A 2 2 ALA HA H -2 4.374 4.369 0.005 1
1 8 . 10 1 1 A 2 2 ALA C C -2 177.865 178.059 -0.194 1
1 9 . 10 1 1 A 2 2 ALA CA C -2 52.670 52.214 0.456 1
1 10 . 10 1 1 A 2 2 ALA CB C -2 19.508 19.034 0.474 1
1 32 . 10 1 1 A 5 5 ASP H H 2428 8.300 8.629 -0.329 1
1 33 . 10 1 1 A 5 5 ASP HA H 2428 5.082 5.229 -0.147 1
1 36 . 10 1 1 A 5 5 ASP CA C 2428 51.517 50.910 0.607 1
1 37 . 10 1 1 A 5 5 ASP CB C 2428 42.244 42.176 0.068 1
1 38 . 10 1 1 A 5 5 ASP N N 2428 122.879 120.113 2.766 1
1 39 . 10 1 1 A 6 6 PRO HA H 2429 4.340 4.423 -0.083 1
1 46 . 10 1 1 A 6 6 PRO C C 2429 178.266 178.743 -0.477 1
1 47 . 10 1 1 A 6 6 PRO CA C 2429 64.494 64.986 -0.492 1
1 48 . 10 1 1 A 6 6 PRO CB C 2429 31.841 31.910 -0.069 1
1 51 . 10 1 1 A 7 7 GLY H H 2430 8.686 8.452 0.234 1
1 52 . 10 1 1 A 7 7 GLY HA2 H 2430 4.116 3.898 0.218 1
1 53 . 10 1 1 A 7 7 GLY HA3 H 2430 3.868 3.899 -0.031 1
1 54 . 10 1 1 A 7 7 GLY C C 2430 174.567 175.557 -0.990 1
1 55 . 10 1 1 A 7 7 GLY CA C 2430 46.038 46.583 -0.545 1
1 56 . 10 1 1 A 7 7 GLY N N 2430 107.655 105.814 1.841 1
1 57 . 10 1 1 A 8 8 LEU H H 2431 7.692 7.469 0.223 1
1 58 . 10 1 1 A 8 8 LEU HA H 2431 4.507 4.400 0.107 1
1 68 . 10 1 1 A 8 8 LEU C C 2431 176.876 177.471 -0.595 1
1 69 . 10 1 1 A 8 8 LEU CA C 2431 54.307 56.569 -2.262 1
1 70 . 10 1 1 A 8 8 LEU CB C 2431 42.879 42.710 0.169 1
1 74 . 10 1 1 A 8 8 LEU N N 2431 120.022 119.992 0.030 1
1 75 . 10 1 1 A 9 9 VAL H H 2432 7.378 7.440 -0.062 1
1 76 . 10 1 1 A 9 9 VAL HA H 2432 4.154 3.930 0.224 1
1 84 . 10 1 1 A 9 9 VAL C C 2432 174.703 175.534 -0.831 1
1 85 . 10 1 1 A 9 9 VAL CA C 2432 62.387 63.235 -0.848 1
1 86 . 10 1 1 A 9 9 VAL CB C 2432 32.519 31.485 1.034 1
1 89 . 10 1 1 A 9 9 VAL N N 2432 123.902 119.752 4.150 1
1 90 . 10 1 1 A 10 10 SER H H 2433 8.201 8.627 -0.426 1
1 91 . 10 1 1 A 10 10 SER HA H 2433 5.136 4.920 0.216 1
1 94 . 10 1 1 A 10 10 SER CA C 2433 56.554 55.519 1.035 1
1 95 . 10 1 1 A 10 10 SER CB C 2433 66.763 65.133 1.630 1
1 96 . 10 1 1 A 10 10 SER N N 2433 121.921 121.982 -0.061 1
1 97 . 10 1 1 A 11 11 ALA H H 2434 8.670 8.193 0.477 1
1 98 . 10 1 1 A 11 11 ALA HA H 2434 5.632 5.217 0.415 1
1 102 . 10 1 1 A 11 11 ALA C C 2434 175.459 174.689 0.770 1
1 103 . 10 1 1 A 11 11 ALA CA C 2434 50.575 50.777 -0.202 1
1 104 . 10 1 1 A 11 11 ALA CB C 2434 23.111 23.097 0.014 1
1 105 . 10 1 1 A 11 11 ALA N N 2434 124.828 123.692 1.136 1
1 106 . 10 1 1 A 12 12 TYR H H 2435 8.609 8.790 -0.181 1
1 107 . 10 1 1 A 12 12 TYR HA H 2435 4.879 5.097 -0.218 1
1 114 . 10 1 1 A 12 12 TYR C C 2435 173.645 174.699 -1.054 1
1 115 . 10 1 1 A 12 12 TYR CA C 2435 56.268 56.776 -0.508 1
1 116 . 10 1 1 A 12 12 TYR CB C 2435 39.522 42.456 -2.934 1
1 119 . 10 1 1 A 12 12 TYR N N 2435 118.305 119.617 -1.312 1
1 120 . 10 1 1 A 13 13 GLY H H 2436 8.655 8.581 0.074 1
1 121 . 10 1 1 A 13 13 GLY HA2 H 2436 4.943 4.285 0.658 1
1 122 . 10 1 1 A 13 13 GLY HA3 H 2436 4.028 4.335 -0.307 1
1 123 . 10 1 1 A 13 13 GLY C C 2436 175.334 175.003 0.331 1
1 124 . 10 1 1 A 13 13 GLY CA C 2436 44.389 44.288 0.101 1
1 125 . 10 1 1 A 13 13 GLY N N 2436 110.710 110.523 0.187 1
1 126 . 10 1 1 A 14 14 ALA H H 2437 8.939 8.717 0.222 1
1 127 . 10 1 1 A 14 14 ALA HA H 2437 4.276 4.087 0.189 1
1 131 . 10 1 1 A 14 14 ALA C C 2437 180.524 179.153 1.371 1
1 132 . 10 1 1 A 14 14 ALA CA C 2437 55.551 55.074 0.477 1
1 133 . 10 1 1 A 14 14 ALA CB C 2437 18.411 18.406 0.005 1
1 134 . 10 1 1 A 14 14 ALA N N 2437 126.973 123.811 3.162 1
1 135 . 10 1 1 A 15 15 GLY H H 2438 8.933 8.724 0.209 1
1 136 . 10 1 1 A 15 15 GLY HA2 H 2438 4.531 3.953 0.578 1
1 137 . 10 1 1 A 15 15 GLY HA3 H 2438 3.576 4.148 -0.572 1
1 138 . 10 1 1 A 15 15 GLY C C 2438 174.323 175.531 -1.208 1
1 139 . 10 1 1 A 15 15 GLY CA C 2438 46.855 46.821 0.034 1
1 140 . 10 1 1 A 15 15 GLY N N 2438 104.803 105.549 -0.746 1
1 141 . 10 1 1 A 16 16 LEU H H 2439 7.529 7.565 -0.036 1
1 142 . 10 1 1 A 16 16 LEU HA H 2439 3.768 3.800 -0.032 1
1 152 . 10 1 1 A 16 16 LEU C C 2439 176.388 178.845 -2.457 1
1 153 . 10 1 1 A 16 16 LEU CA C 2439 56.137 57.334 -1.197 1
1 154 . 10 1 1 A 16 16 LEU CB C 2439 41.621 41.175 0.446 1
1 158 . 10 1 1 A 16 16 LEU N N 2439 119.633 122.029 -2.396 1
1 159 . 10 1 1 A 17 17 GLU H H 2440 7.505 7.807 -0.302 1
1 160 . 10 1 1 A 17 17 GLU HA H 2440 4.663 4.309 0.354 1
1 165 . 10 1 1 A 17 17 GLU C C 2440 178.126 177.319 0.807 1
1 166 . 10 1 1 A 17 17 GLU CA C 2440 56.447 56.696 -0.249 1
1 167 . 10 1 1 A 17 17 GLU CB C 2440 31.485 30.524 0.961 1
1 169 . 10 1 1 A 17 17 GLU N N 2440 114.368 115.855 -1.487 1
1 170 . 10 1 1 A 18 18 GLY H H 2441 7.921 7.524 0.397 1
1 171 . 10 1 1 A 18 18 GLY HA2 H 2441 4.889 4.093 0.796 1
1 172 . 10 1 1 A 18 18 GLY HA3 H 2441 3.707 4.094 -0.387 1
1 173 . 10 1 1 A 18 18 GLY C C 2441 170.965 172.234 -1.269 1
1 174 . 10 1 1 A 18 18 GLY CA C 2441 45.549 43.928 1.621 1
1 175 . 10 1 1 A 18 18 GLY N N 2441 109.165 106.716 2.449 1
1 176 . 10 1 1 A 19 19 GLY H H 2442 7.540 7.775 -0.235 1
1 177 . 10 1 1 A 19 19 GLY HA2 H 2442 4.086 4.180 -0.094 1
1 178 . 10 1 1 A 19 19 GLY HA3 H 2442 4.086 4.219 -0.133 1
1 179 . 10 1 1 A 19 19 GLY C C 2442 171.051 171.570 -0.519 1
1 180 . 10 1 1 A 19 19 GLY CA C 2442 44.937 46.146 -1.209 1
1 181 . 10 1 1 A 19 19 GLY N N 2442 105.460 108.094 -2.634 1
1 182 . 10 1 1 A 20 20 VAL H H 2443 8.899 8.310 0.589 1
1 183 . 10 1 1 A 20 20 VAL HA H 2443 5.062 4.562 0.500 1
1 191 . 10 1 1 A 20 20 VAL C C 2443 176.623 175.650 0.973 1
1 192 . 10 1 1 A 20 20 VAL CA C 2443 60.197 61.910 -1.713 1
1 193 . 10 1 1 A 20 20 VAL CB C 2443 35.107 32.780 2.327 1
1 196 . 10 1 1 A 20 20 VAL N N 2443 122.753 121.113 1.640 1
1 197 . 10 1 1 A 21 21 THR H H 2444 8.630 8.573 0.057 1
1 198 . 10 1 1 A 21 21 THR HA H 2444 3.773 4.189 -0.416 1
1 203 . 10 1 1 A 21 21 THR C C 2444 175.646 174.822 0.824 1
1 204 . 10 1 1 A 21 21 THR CA C 2444 62.732 62.625 0.107 1
1 205 . 10 1 1 A 21 21 THR CB C 2444 68.925 68.647 0.278 1
1 207 . 10 1 1 A 21 21 THR N N 2444 118.179 118.968 -0.789 1
1 208 . 10 1 1 A 22 22 GLY H H 2445 8.736 8.939 -0.203 1
1 209 . 10 1 1 A 22 22 GLY HA2 H 2445 3.412 3.914 -0.502 1
1 210 . 10 1 1 A 22 22 GLY HA3 H 2445 4.061 3.916 0.145 1
1 211 . 10 1 1 A 22 22 GLY C C 2445 172.973 173.441 -0.468 1
1 212 . 10 1 1 A 22 22 GLY CA C 2445 45.577 45.548 0.029 1
1 213 . 10 1 1 A 22 22 GLY N N 2445 107.888 113.260 -5.372 1
1 214 . 10 1 1 A 23 23 ASN H H 2446 7.877 7.679 0.198 1
1 215 . 10 1 1 A 23 23 ASN HA H 2446 5.253 5.187 0.066 1
1 220 . 10 1 1 A 23 23 ASN CA C 2446 49.740 49.734 0.006 1
1 221 . 10 1 1 A 23 23 ASN CB C 2446 40.198 39.525 0.673 1
1 222 . 10 1 1 A 23 23 ASN N N 2446 120.684 119.632 1.052 1
1 224 . 10 1 1 A 24 24 PRO HA H 2447 4.525 4.607 -0.082 1
1 231 . 10 1 1 A 24 24 PRO CA C 2447 62.766 62.219 0.547 1
1 232 . 10 1 1 A 24 24 PRO CB C 2447 31.732 32.185 -0.453 1
1 235 . 10 1 1 A 25 25 ALA H H 2448 9.178 8.259 0.919 1
1 236 . 10 1 1 A 25 25 ALA HA H 2448 4.614 4.733 -0.119 1
1 240 . 10 1 1 A 25 25 ALA C C 2448 175.503 175.671 -0.168 1
1 241 . 10 1 1 A 25 25 ALA CA C 2448 50.526 50.580 -0.054 1
1 242 . 10 1 1 A 25 25 ALA CB C 2448 20.458 20.303 0.155 1
1 243 . 10 1 1 A 25 25 ALA N N 2448 132.079 125.287 6.792 1
1 244 . 10 1 1 A 26 26 GLU H H 2449 8.813 9.059 -0.246 1
1 245 . 10 1 1 A 26 26 GLU HA H 2449 5.830 5.389 0.441 1
1 250 . 10 1 1 A 26 26 GLU C C 2449 176.272 175.086 1.186 1
1 251 . 10 1 1 A 26 26 GLU CA C 2449 54.376 55.038 -0.662 1
1 252 . 10 1 1 A 26 26 GLU CB C 2449 35.463 33.486 1.977 1
1 254 . 10 1 1 A 26 26 GLU N N 2449 120.079 123.482 -3.403 1
1 255 . 10 1 1 A 27 27 PHE H H 2450 8.782 8.943 -0.161 1
1 256 . 10 1 1 A 27 27 PHE HA H 2450 5.021 5.207 -0.186 1
1 264 . 10 1 1 A 27 27 PHE C C 2450 171.205 172.351 -1.146 1
1 265 . 10 1 1 A 27 27 PHE CA C 2450 56.852 56.241 0.611 1
1 266 . 10 1 1 A 27 27 PHE CB C 2450 41.080 41.082 -0.002 1
1 270 . 10 1 1 A 27 27 PHE N N 2450 118.670 121.107 -2.437 1
1 271 . 10 1 1 A 28 28 VAL H H 2451 8.961 9.041 -0.080 1
1 272 . 10 1 1 A 28 28 VAL HA H 2451 4.761 4.616 0.145 1
1 280 . 10 1 1 A 28 28 VAL C C 2451 174.673 175.150 -0.477 1
1 281 . 10 1 1 A 28 28 VAL CA C 2451 60.619 60.695 -0.076 1
1 282 . 10 1 1 A 28 28 VAL CB C 2451 35.484 34.902 0.582 1
1 285 . 10 1 1 A 28 28 VAL N N 2451 121.552 119.309 2.243 1
1 286 . 10 1 1 A 29 29 VAL H H 2452 9.294 9.154 0.140 1
1 287 . 10 1 1 A 29 29 VAL HA H 2452 4.363 4.350 0.013 1
1 295 . 10 1 1 A 29 29 VAL C C 2452 174.218 175.120 -0.902 1
1 296 . 10 1 1 A 29 29 VAL CA C 2452 61.526 62.549 -1.023 1
1 297 . 10 1 1 A 29 29 VAL CB C 2452 32.666 31.683 0.983 1
1 300 . 10 1 1 A 29 29 VAL N N 2452 125.585 128.161 -2.576 1
1 301 . 10 1 1 A 30 30 ASN H H 2453 9.465 8.924 0.541 1
1 302 . 10 1 1 A 30 30 ASN HA H 2453 5.096 5.103 -0.007 1
1 307 . 10 1 1 A 30 30 ASN C C 2453 176.216 176.199 0.017 1
1 308 . 10 1 1 A 30 30 ASN CA C 2453 52.011 52.693 -0.682 1
1 309 . 10 1 1 A 30 30 ASN CB C 2453 39.057 38.526 0.531 1
1 310 . 10 1 1 A 30 30 ASN N N 2453 127.724 127.035 0.689 1
1 312 . 10 1 1 A 31 31 THR H H 2454 8.915 8.557 0.358 1
1 313 . 10 1 1 A 31 31 THR HA H 2454 4.342 4.428 -0.086 1
1 318 . 10 1 1 A 31 31 THR C C 2454 176.816 176.403 0.413 1
1 319 . 10 1 1 A 31 31 THR CA C 2454 61.117 62.429 -1.312 1
1 320 . 10 1 1 A 31 31 THR CB C 2454 68.209 69.552 -1.343 1
1 322 . 10 1 1 A 31 31 THR N N 2454 117.783 116.843 0.940 1
1 323 . 10 1 1 A 32 32 SER H H 2455 8.454 7.947 0.507 1
1 324 . 10 1 1 A 32 32 SER HA H 2455 4.155 4.154 0.001 1
1 327 . 10 1 1 A 32 32 SER C C 2455 175.458 175.768 -0.310 1
1 328 . 10 1 1 A 32 32 SER CA C 2455 62.148 62.383 -0.235 1
1 329 . 10 1 1 A 32 32 SER CB C 2455 63.476 62.947 0.529 1
1 330 . 10 1 1 A 32 32 SER N N 2455 121.781 118.996 2.785 1
1 331 . 10 1 1 A 33 33 ASN H H 2456 8.845 8.088 0.757 1
1 332 . 10 1 1 A 33 33 ASN HA H 2456 5.064 4.544 0.520 1
1 337 . 10 1 1 A 33 33 ASN C C 2456 174.674 176.222 -1.548 1
1 338 . 10 1 1 A 33 33 ASN CA C 2456 53.067 55.089 -2.022 1
1 339 . 10 1 1 A 33 33 ASN CB C 2456 39.632 38.868 0.764 1
1 340 . 10 1 1 A 33 33 ASN N N 2456 120.176 118.501 1.675 1
1 342 . 10 1 1 A 34 34 ALA H H 2457 7.714 7.865 -0.151 1
1 343 . 10 1 1 A 34 34 ALA HA H 2457 4.482 4.523 -0.041 1
1 347 . 10 1 1 A 34 34 ALA C C 2457 177.582 178.085 -0.503 1
1 348 . 10 1 1 A 34 34 ALA CA C 2457 52.521 52.144 0.377 1
1 349 . 10 1 1 A 34 34 ALA CB C 2457 22.252 20.895 1.357 1
1 350 . 10 1 1 A 34 34 ALA N N 2457 123.065 119.162 3.903 1
1 351 . 10 1 1 A 35 35 GLY H H 2458 8.195 8.413 -0.218 1
1 352 . 10 1 1 A 35 35 GLY HA2 H 2458 4.246 4.064 0.182 1
1 353 . 10 1 1 A 35 35 GLY HA3 H 2458 3.902 4.086 -0.184 1
1 354 . 10 1 1 A 35 35 GLY C C 2458 173.360 173.282 0.078 1
1 355 . 10 1 1 A 35 35 GLY CA C 2458 44.486 46.167 -1.681 1
1 356 . 10 1 1 A 35 35 GLY N N 2458 108.472 105.600 2.872 1
1 357 . 10 1 1 A 36 36 ALA H H 2459 8.430 8.227 0.203 1
1 358 . 10 1 1 A 36 36 ALA HA H 2459 4.472 5.265 -0.793 1
1 362 . 10 1 1 A 36 36 ALA C C 2459 176.968 176.049 0.919 1
1 363 . 10 1 1 A 36 36 ALA CA C 2459 52.695 51.502 1.193 1
1 364 . 10 1 1 A 36 36 ALA CB C 2459 19.360 22.745 -3.385 1
1 365 . 10 1 1 A 36 36 ALA N N 2459 126.012 125.151 0.861 1
1 366 . 10 1 1 A 37 37 GLY H H 2460 7.781 8.548 -0.767 1
1 367 . 10 1 1 A 37 37 GLY HA2 H 2460 3.856 3.889 -0.033 1
1 368 . 10 1 1 A 37 37 GLY HA3 H 2460 3.164 4.100 -0.936 1
1 369 . 10 1 1 A 37 37 GLY C C 2460 170.730 172.128 -1.398 1
1 370 . 10 1 1 A 37 37 GLY CA C 2460 44.747 45.234 -0.487 1
1 371 . 10 1 1 A 37 37 GLY N N 2460 109.493 105.123 4.370 1
1 372 . 10 1 1 A 38 38 ALA H H 2461 8.055 8.066 -0.011 1
1 373 . 10 1 1 A 38 38 ALA HA H 2461 4.389 4.628 -0.239 1
1 377 . 10 1 1 A 38 38 ALA C C 2461 176.609 176.737 -0.128 1
1 378 . 10 1 1 A 38 38 ALA CA C 2461 51.419 51.928 -0.509 1
1 379 . 10 1 1 A 38 38 ALA CB C 2461 19.665 19.468 0.197 1
1 380 . 10 1 1 A 38 38 ALA N N 2461 121.997 122.552 -0.555 1
1 381 . 10 1 1 A 39 39 LEU H H 2462 8.597 8.614 -0.017 1
1 382 . 10 1 1 A 39 39 LEU HA H 2462 5.022 5.175 -0.153 1
1 392 . 10 1 1 A 39 39 LEU C C 2462 175.883 175.280 0.603 1
1 393 . 10 1 1 A 39 39 LEU CA C 2462 53.907 53.740 0.167 1
1 394 . 10 1 1 A 39 39 LEU CB C 2462 44.576 46.441 -1.865 1
1 398 . 10 1 1 A 39 39 LEU N N 2462 126.664 123.148 3.516 1
1 399 . 10 1 1 A 40 40 SER H H 2463 8.898 9.277 -0.379 1
1 400 . 10 1 1 A 40 40 SER HA H 2463 4.732 4.855 -0.123 1
1 403 . 10 1 1 A 40 40 SER C C 2463 172.984 173.488 -0.504 1
1 404 . 10 1 1 A 40 40 SER CA C 2463 56.730 56.861 -0.131 1
1 405 . 10 1 1 A 40 40 SER CB C 2463 64.648 64.193 0.455 1
1 406 . 10 1 1 A 40 40 SER N N 2463 122.932 122.874 0.058 1
1 407 . 10 1 1 A 41 41 VAL H H 2464 8.538 7.542 0.996 1
1 408 . 10 1 1 A 41 41 VAL HA H 2464 5.131 4.168 0.963 1
1 416 . 10 1 1 A 41 41 VAL C C 2464 174.812 175.475 -0.663 1
1 417 . 10 1 1 A 41 41 VAL CA C 2464 60.784 62.987 -2.203 1
1 418 . 10 1 1 A 41 41 VAL CB C 2464 34.262 32.052 2.210 1
1 420 . 10 1 1 A 41 41 VAL N N 2464 129.161 121.921 7.240 1
1 421 . 10 1 1 A 42 42 THR H H 2465 8.807 8.754 0.053 1
1 422 . 10 1 1 A 42 42 THR HA H 2465 4.573 5.172 -0.599 1
1 427 . 10 1 1 A 42 42 THR CA C 2465 60.408 61.442 -1.034 1
1 428 . 10 1 1 A 42 42 THR CB C 2465 71.764 71.196 0.568 1
1 430 . 10 1 1 A 42 42 THR N N 2465 120.898 122.803 -1.905 1
1 431 . 10 1 1 A 43 43 ILE H H 2466 8.648 9.006 -0.358 1
1 432 . 10 1 1 A 43 43 ILE HA H 2466 4.854 4.704 0.150 1
1 442 . 10 1 1 A 43 43 ILE C C 2466 174.073 174.053 0.020 1
1 443 . 10 1 1 A 43 43 ILE CA C 2466 61.184 60.548 0.636 1
1 444 . 10 1 1 A 43 43 ILE CB C 2466 39.516 39.740 -0.224 1
1 448 . 10 1 1 A 43 43 ILE N N 2466 124.810 126.024 -1.214 1
1 449 . 10 1 1 A 44 44 ASP H H 2467 8.821 9.131 -0.310 1
1 450 . 10 1 1 A 44 44 ASP HA H 2467 5.217 5.343 -0.126 1
1 453 . 10 1 1 A 44 44 ASP C C 2467 175.002 175.238 -0.236 1
1 454 . 10 1 1 A 44 44 ASP CA C 2467 52.998 52.821 0.177 1
1 455 . 10 1 1 A 44 44 ASP CB C 2467 44.728 42.747 1.981 1
1 456 . 10 1 1 A 44 44 ASP N N 2467 129.093 129.030 0.063 1
1 457 . 10 1 1 A 45 45 GLY H H 2468 8.535 8.194 0.341 1
1 458 . 10 1 1 A 45 45 GLY HA2 H 2468 3.954 3.684 0.270 1
1 459 . 10 1 1 A 45 45 GLY HA3 H 2468 3.561 3.922 -0.361 1
1 460 . 10 1 1 A 45 45 GLY CA C 2468 45.659 45.022 0.637 1
1 461 . 10 1 1 A 45 45 GLY N N 2468 112.751 109.450 3.301 1
1 462 . 10 1 1 A 46 46 PRO HA H 2469 4.318 4.319 -0.001 1
1 469 . 10 1 1 A 46 46 PRO C C 2469 176.086 176.236 -0.150 1
1 470 . 10 1 1 A 46 46 PRO CA C 2469 64.198 64.034 0.164 1
1 471 . 10 1 1 A 46 46 PRO CB C 2469 32.348 32.078 0.270 1
1 474 . 10 1 1 A 47 47 SER H H 2470 7.106 7.591 -0.485 1
1 475 . 10 1 1 A 47 47 SER HA H 2470 4.632 4.922 -0.290 1
1 478 . 10 1 1 A 47 47 SER C C 2470 172.969 173.375 -0.406 1
1 479 . 10 1 1 A 47 47 SER CA C 2470 57.106 57.467 -0.361 1
1 480 . 10 1 1 A 47 47 SER CB C 2470 66.262 67.184 -0.922 1
1 481 . 10 1 1 A 47 47 SER N N 2470 110.556 114.050 -3.494 1
1 482 . 10 1 1 A 48 48 LYS H H 2471 8.534 8.324 0.210 1
1 483 . 10 1 1 A 48 48 LYS HA H 2471 4.486 4.565 -0.079 1
1 492 . 10 1 1 A 48 48 LYS C C 2471 177.231 176.321 0.910 1
1 493 . 10 1 1 A 48 48 LYS CA C 2471 56.620 56.893 -0.273 1
1 494 . 10 1 1 A 48 48 LYS CB C 2471 32.379 33.658 -1.279 1
1 498 . 10 1 1 A 48 48 LYS N N 2471 124.055 121.884 2.171 1
1 499 . 10 1 1 A 49 49 VAL H H 2472 8.497 8.771 -0.274 1
1 500 . 10 1 1 A 49 49 VAL HA H 2472 4.552 4.923 -0.371 1
1 508 . 10 1 1 A 49 49 VAL C C 2472 175.292 174.114 1.178 1
1 509 . 10 1 1 A 49 49 VAL CA C 2472 60.142 59.125 1.017 1
1 510 . 10 1 1 A 49 49 VAL CB C 2472 33.464 35.537 -2.073 1
1 513 . 10 1 1 A 49 49 VAL N N 2472 121.233 118.087 3.146 1
1 514 . 10 1 1 A 50 50 LYS H H 2473 8.190 8.283 -0.093 1
1 515 . 10 1 1 A 50 50 LYS HA H 2473 4.522 4.412 0.110 1
1 518 . 10 1 1 A 50 50 LYS CA C 2473 55.952 55.283 0.669 1
1 519 . 10 1 1 A 50 50 LYS CB C 2473 32.896 31.071 1.825 1
1 520 . 10 1 1 A 50 50 LYS N N 2473 126.082 124.304 1.778 1
1 521 . 10 1 1 A 51 51 MET H H 2474 8.818 8.678 0.140 1
1 522 . 10 1 1 A 51 51 MET HA H 2474 5.324 4.771 0.553 1
1 530 . 10 1 1 A 51 51 MET C C 2474 173.933 174.811 -0.878 1
1 531 . 10 1 1 A 51 51 MET CA C 2474 54.848 55.862 -1.014 1
1 532 . 10 1 1 A 51 51 MET CB C 2474 37.043 33.409 3.634 1
1 535 . 10 1 1 A 51 51 MET N N 2474 126.911 126.371 0.540 1
1 536 . 10 1 1 A 52 52 ASP H H 2475 9.095 8.912 0.183 1
1 537 . 10 1 1 A 52 52 ASP HA H 2475 4.947 5.209 -0.262 1
1 540 . 10 1 1 A 52 52 ASP C C 2475 173.923 174.299 -0.376 1
1 541 . 10 1 1 A 52 52 ASP CA C 2475 53.487 53.194 0.293 1
1 542 . 10 1 1 A 52 52 ASP CB C 2475 44.765 44.449 0.316 1
1 543 . 10 1 1 A 52 52 ASP N N 2475 125.526 125.584 -0.058 1
1 544 . 10 1 1 A 53 53 CYS H H 2476 8.606 9.020 -0.414 1
1 545 . 10 1 1 A 53 53 CYS HA H 2476 5.145 5.583 -0.438 1
1 548 . 10 1 1 A 53 53 CYS C C 2476 173.330 173.895 -0.565 1
1 549 . 10 1 1 A 53 53 CYS CA C 2476 57.452 57.287 0.165 1
1 550 . 10 1 1 A 53 53 CYS CB C 2476 28.108 31.065 -2.957 1
1 551 . 10 1 1 A 53 53 CYS N N 2476 124.317 123.786 0.531 1
1 552 . 10 1 1 A 54 54 GLN H H 2477 8.978 8.642 0.336 1
1 553 . 10 1 1 A 54 54 GLN HA H 2477 4.884 4.723 0.161 1
1 560 . 10 1 1 A 54 54 GLN C C 2477 174.854 173.641 1.213 1
1 561 . 10 1 1 A 54 54 GLN CA C 2477 53.891 54.872 -0.981 1
1 562 . 10 1 1 A 54 54 GLN CB C 2477 32.837 33.066 -0.229 1
1 564 . 10 1 1 A 54 54 GLN N N 2477 127.074 123.740 3.334 1
1 566 . 10 1 1 A 55 55 GLU H H 2478 9.065 8.584 0.481 1
1 567 . 10 1 1 A 55 55 GLU HA H 2478 4.280 4.710 -0.430 1
1 572 . 10 1 1 A 55 55 GLU C C 2478 175.383 175.519 -0.136 1
1 573 . 10 1 1 A 55 55 GLU CA C 2478 57.516 56.110 1.406 1
1 574 . 10 1 1 A 55 55 GLU CB C 2478 30.346 30.835 -0.489 1
1 576 . 10 1 1 A 55 55 GLU N N 2478 125.186 125.362 -0.176 1
1 577 . 10 1 1 A 56 56 CYS H H 2479 8.407 8.285 0.122 1
1 578 . 10 1 1 A 56 56 CYS HA H 2479 5.056 4.884 0.172 1
1 581 . 10 1 1 A 56 56 CYS CA C 2479 55.858 56.481 -0.623 1
1 582 . 10 1 1 A 56 56 CYS CB C 2479 28.676 30.160 -1.484 1
1 583 . 10 1 1 A 56 56 CYS N N 2479 121.499 124.736 -3.237 1
1 584 . 10 1 1 A 57 57 PRO HA H 2480 4.159 4.257 -0.098 1
1 591 . 10 1 1 A 57 57 PRO C C 2480 177.964 177.774 0.190 1
1 592 . 10 1 1 A 57 57 PRO CA C 2480 66.877 64.944 1.933 1
1 593 . 10 1 1 A 57 57 PRO CB C 2480 31.709 31.822 -0.113 1
1 596 . 10 1 1 A 58 58 GLU H H 2481 8.900 8.076 0.824 1
1 597 . 10 1 1 A 58 58 GLU HA H 2481 4.201 4.321 -0.120 1
1 602 . 10 1 1 A 58 58 GLU C C 2481 175.129 176.500 -1.371 1
1 603 . 10 1 1 A 58 58 GLU CA C 2481 57.883 57.086 0.797 1
1 604 . 10 1 1 A 58 58 GLU CB C 2481 29.991 30.093 -0.102 1
1 606 . 10 1 1 A 58 58 GLU N N 2481 115.316 117.616 -2.300 1
1 607 . 10 1 1 A 59 59 GLY H H 2482 7.527 7.409 0.118 1
1 608 . 10 1 1 A 59 59 GLY HA2 H 2482 4.935 3.930 1.005 1
1 609 . 10 1 1 A 59 59 GLY HA3 H 2482 3.381 4.033 -0.652 1
1 610 . 10 1 1 A 59 59 GLY CA C 2482 47.809 43.885 3.924 1
1 611 . 10 1 1 A 59 59 GLY N N 2482 110.079 107.861 2.218 1
1 612 . 10 1 1 A 60 60 TYR H H 2483 8.990 8.064 0.926 1
1 613 . 10 1 1 A 60 60 TYR HA H 2483 5.157 4.661 0.496 1
1 618 . 10 1 1 A 60 60 TYR C C 2483 175.096 175.074 0.022 1
1 619 . 10 1 1 A 60 60 TYR CA C 2483 57.375 58.854 -1.479 1
1 620 . 10 1 1 A 60 60 TYR CB C 2483 43.153 38.054 5.099 1
1 622 . 10 1 1 A 60 60 TYR N N 2483 125.900 121.530 4.370 1
1 623 . 10 1 1 A 61 61 ARG H H 2484 9.557 8.805 0.752 1
1 624 . 10 1 1 A 61 61 ARG HA H 2484 4.858 4.469 0.389 1
1 631 . 10 1 1 A 61 61 ARG CA C 2484 55.016 56.366 -1.350 1
1 632 . 10 1 1 A 61 61 ARG CB C 2484 32.128 31.014 1.114 1
1 635 . 10 1 1 A 61 61 ARG N N 2484 124.847 126.146 -1.299 1
1 636 . 10 1 1 A 62 62 VAL H H 2485 9.046 8.879 0.167 1
1 637 . 10 1 1 A 62 62 VAL HA H 2485 4.675 4.791 -0.116 1
1 645 . 10 1 1 A 62 62 VAL C C 2485 173.837 174.674 -0.837 1
1 646 . 10 1 1 A 62 62 VAL CA C 2485 60.752 60.847 -0.095 1
1 647 . 10 1 1 A 62 62 VAL CB C 2485 32.459 34.131 -1.672 1
1 650 . 10 1 1 A 62 62 VAL N N 2485 132.205 126.025 6.180 1
1 651 . 10 1 1 A 63 63 THR H H 2486 8.474 8.901 -0.427 1
1 652 . 10 1 1 A 63 63 THR HA H 2486 5.392 5.500 -0.108 1
1 657 . 10 1 1 A 63 63 THR C C 2486 173.675 173.741 -0.066 1
1 658 . 10 1 1 A 63 63 THR CA C 2486 60.008 61.250 -1.242 1
1 659 . 10 1 1 A 63 63 THR CB C 2486 71.035 71.248 -0.213 1
1 661 . 10 1 1 A 63 63 THR N N 2486 121.216 122.748 -1.532 1
1 662 . 10 1 1 A 64 64 TYR H H 2487 9.409 9.013 0.396 1
1 663 . 10 1 1 A 64 64 TYR HA H 2487 5.617 5.484 0.133 1
1 670 . 10 1 1 A 64 64 TYR C C 2487 172.847 172.526 0.321 1
1 671 . 10 1 1 A 64 64 TYR CA C 2487 55.557 55.808 -0.251 1
1 672 . 10 1 1 A 64 64 TYR CB C 2487 41.968 41.812 0.156 1
1 675 . 10 1 1 A 64 64 TYR N N 2487 124.061 122.065 1.996 1
1 676 . 10 1 1 A 65 65 THR H H 2488 8.145 8.858 -0.713 1
1 677 . 10 1 1 A 65 65 THR HA H 2488 4.959 4.612 0.347 1
1 682 . 10 1 1 A 65 65 THR CA C 2488 58.532 58.968 -0.436 1
1 683 . 10 1 1 A 65 65 THR CB C 2488 70.141 70.119 0.022 1
1 685 . 10 1 1 A 65 65 THR N N 2488 117.924 116.877 1.047 1
1 686 . 10 1 1 A 66 66 PRO HA H 2489 4.602 4.782 -0.180 1
1 693 . 10 1 1 A 66 66 PRO C C 2489 176.647 176.685 -0.038 1
1 694 . 10 1 1 A 66 66 PRO CA C 2489 61.442 62.159 -0.717 1
1 695 . 10 1 1 A 66 66 PRO CB C 2489 32.715 32.491 0.224 1
1 698 . 10 1 1 A 67 67 MET H H 2490 8.832 8.487 0.345 1
1 699 . 10 1 1 A 67 67 MET HA H 2490 4.880 4.693 0.187 1
1 707 . 10 1 1 A 67 67 MET C C 2490 174.121 175.544 -1.423 1
1 708 . 10 1 1 A 67 67 MET CA C 2490 53.848 54.874 -1.026 1
1 709 . 10 1 1 A 67 67 MET CB C 2490 33.727 33.598 0.129 1
1 712 . 10 1 1 A 67 67 MET N N 2490 119.212 117.780 1.432 1
1 713 . 10 1 1 A 68 68 ALA H H 2491 7.086 7.344 -0.258 1
1 714 . 10 1 1 A 68 68 ALA HA H 2491 4.851 4.855 -0.004 1
1 718 . 10 1 1 A 68 68 ALA CA C 2491 49.222 50.002 -0.780 1
1 719 . 10 1 1 A 68 68 ALA CB C 2491 20.600 22.474 -1.874 1
1 720 . 10 1 1 A 68 68 ALA N N 2491 120.363 120.698 -0.335 1
1 721 . 10 1 1 A 69 69 PRO HA H 2492 4.263 4.750 -0.487 1
1 728 . 10 1 1 A 69 69 PRO C C 2492 174.370 176.327 -1.957 1
1 729 . 10 1 1 A 69 69 PRO CA C 2492 62.555 62.929 -0.374 1
1 730 . 10 1 1 A 69 69 PRO CB C 2492 32.752 33.201 -0.449 1
1 733 . 10 1 1 A 70 70 GLY H H 2493 8.858 8.375 0.483 1
1 734 . 10 1 1 A 70 70 GLY HA2 H 2493 4.544 4.098 0.446 1
1 735 . 10 1 1 A 70 70 GLY HA3 H 2493 3.849 4.138 -0.289 1
1 736 . 10 1 1 A 70 70 GLY C C 2493 172.182 172.299 -0.117 1
1 737 . 10 1 1 A 70 70 GLY CA C 2493 44.356 44.509 -0.153 1
1 738 . 10 1 1 A 70 70 GLY N N 2493 106.539 108.043 -1.504 1
1 739 . 10 1 1 A 71 71 SER H H 2494 8.490 8.248 0.242 1
1 740 . 10 1 1 A 71 71 SER HA H 2494 5.280 5.403 -0.123 1
1 743 . 10 1 1 A 71 71 SER C C 2494 173.512 173.112 0.400 1
1 744 . 10 1 1 A 71 71 SER CA C 2494 57.674 57.813 -0.139 1
1 745 . 10 1 1 A 71 71 SER CB C 2494 63.799 65.550 -1.751 1
1 746 . 10 1 1 A 71 71 SER N N 2494 117.964 117.217 0.747 1
1 747 . 10 1 1 A 72 72 TYR H H 2495 9.320 9.682 -0.362 1
1 748 . 10 1 1 A 72 72 TYR HA H 2495 4.960 5.401 -0.441 1
1 755 . 10 1 1 A 72 72 TYR C C 2495 173.979 174.681 -0.702 1
1 756 . 10 1 1 A 72 72 TYR CA C 2495 56.384 56.730 -0.346 1
1 757 . 10 1 1 A 72 72 TYR CB C 2495 40.247 40.359 -0.112 1
1 760 . 10 1 1 A 72 72 TYR N N 2495 126.442 124.913 1.529 1
1 761 . 10 1 1 A 73 73 LEU H H 2496 9.019 9.027 -0.008 1
1 762 . 10 1 1 A 73 73 LEU HA H 2496 5.209 4.926 0.283 1
1 772 . 10 1 1 A 73 73 LEU C C 2496 177.015 174.771 2.244 1
1 773 . 10 1 1 A 73 73 LEU CA C 2496 53.393 54.121 -0.728 1
1 774 . 10 1 1 A 73 73 LEU CB C 2496 43.918 43.857 0.061 1
1 778 . 10 1 1 A 73 73 LEU N N 2496 125.439 125.826 -0.387 1
1 779 . 10 1 1 A 74 74 ILE H H 2497 9.921 9.699 0.222 1
1 780 . 10 1 1 A 74 74 ILE HA H 2497 5.128 4.704 0.424 1
1 790 . 10 1 1 A 74 74 ILE C C 2497 175.730 174.974 0.756 1
1 791 . 10 1 1 A 74 74 ILE CA C 2497 60.930 60.573 0.357 1
1 792 . 10 1 1 A 74 74 ILE CB C 2497 39.488 37.846 1.642 1
1 796 . 10 1 1 A 74 74 ILE N N 2497 132.185 130.183 2.002 1
1 797 . 10 1 1 A 75 75 SER H H 2498 9.284 9.277 0.007 1
1 798 . 10 1 1 A 75 75 SER HA H 2498 5.111 5.122 -0.011 1
1 801 . 10 1 1 A 75 75 SER C C 2498 173.449 173.137 0.312 1
1 802 . 10 1 1 A 75 75 SER CA C 2498 58.260 58.063 0.197 1
1 803 . 10 1 1 A 75 75 SER CB C 2498 63.956 62.717 1.239 1
1 804 . 10 1 1 A 75 75 SER N N 2498 125.384 124.876 0.508 1
1 805 . 10 1 1 A 76 76 ILE H H 2499 9.861 9.012 0.849 1
1 806 . 10 1 1 A 76 76 ILE HA H 2499 4.814 4.580 0.234 1
1 816 . 10 1 1 A 76 76 ILE CA C 2499 61.034 60.799 0.235 1
1 817 . 10 1 1 A 76 76 ILE CB C 2499 40.387 37.313 3.074 1
1 821 . 10 1 1 A 76 76 ILE N N 2499 129.414 127.238 2.176 1
1 822 . 10 1 1 A 77 77 LYS H H 2500 8.827 9.050 -0.223 1
1 823 . 10 1 1 A 77 77 LYS HA H 2500 5.254 5.127 0.127 1
1 832 . 10 1 1 A 77 77 LYS C C 2500 175.245 175.282 -0.037 1
1 833 . 10 1 1 A 77 77 LYS CA C 2500 54.388 54.783 -0.395 1
1 834 . 10 1 1 A 77 77 LYS CB C 2500 36.127 35.240 0.887 1
1 838 . 10 1 1 A 77 77 LYS N N 2500 126.922 127.338 -0.416 1
1 839 . 10 1 1 A 78 78 TYR H H 2501 8.408 9.117 -0.709 1
1 840 . 10 1 1 A 78 78 TYR HA H 2501 5.479 5.119 0.360 1
1 847 . 10 1 1 A 78 78 TYR C C 2501 174.792 175.593 -0.801 1
1 848 . 10 1 1 A 78 78 TYR CA C 2501 56.837 56.990 -0.153 1
1 849 . 10 1 1 A 78 78 TYR CB C 2501 44.008 42.060 1.948 1
1 852 . 10 1 1 A 78 78 TYR N N 2501 122.282 124.313 -2.031 1
1 853 . 10 1 1 A 79 79 GLY H H 2502 8.196 8.496 -0.300 1
1 854 . 10 1 1 A 79 79 GLY HA2 H 2502 4.040 3.614 0.426 1
1 855 . 10 1 1 A 79 79 GLY HA3 H 2502 3.465 3.740 -0.275 1
1 856 . 10 1 1 A 79 79 GLY C C 2502 173.932 173.694 0.238 1
1 857 . 10 1 1 A 79 79 GLY CA C 2502 45.741 46.067 -0.326 1
1 858 . 10 1 1 A 79 79 GLY N N 2502 113.451 113.787 -0.336 1
1 859 . 10 1 1 A 80 80 GLY H H 2503 7.589 8.256 -0.667 1
1 860 . 10 1 1 A 80 80 GLY HA2 H 2503 4.490 4.017 0.473 1
1 861 . 10 1 1 A 80 80 GLY HA3 H 2503 3.555 4.115 -0.560 1
1 862 . 10 1 1 A 80 80 GLY CA C 2503 43.540 44.103 -0.563 1
1 863 . 10 1 1 A 80 80 GLY N N 2503 107.293 107.383 -0.090 1
1 864 . 10 1 1 A 81 81 PRO HA H 2504 4.320 4.399 -0.079 1
1 871 . 10 1 1 A 81 81 PRO C C 2504 175.311 175.050 0.261 1
1 872 . 10 1 1 A 81 81 PRO CA C 2504 62.722 62.900 -0.178 1
1 873 . 10 1 1 A 81 81 PRO CB C 2504 29.297 29.972 -0.675 1
1 876 . 10 1 1 A 82 82 TYR H H 2505 7.778 7.349 0.429 1
1 877 . 10 1 1 A 82 82 TYR HA H 2505 4.791 4.976 -0.185 1
1 884 . 10 1 1 A 82 82 TYR C C 2505 175.086 175.797 -0.711 1
1 885 . 10 1 1 A 82 82 TYR CA C 2505 56.111 56.733 -0.622 1
1 886 . 10 1 1 A 82 82 TYR CB C 2505 39.483 41.733 -2.250 1
1 889 . 10 1 1 A 82 82 TYR N N 2505 123.973 121.375 2.598 1
1 890 . 10 1 1 A 83 83 HIS H H 2506 8.625 9.134 -0.509 1
1 891 . 10 1 1 A 83 83 HIS HA H 2506 4.583 4.951 -0.368 1
1 896 . 10 1 1 A 83 83 HIS C C 2506 178.161 175.953 2.208 1
1 897 . 10 1 1 A 83 83 HIS CA C 2506 58.241 57.581 0.660 1
1 898 . 10 1 1 A 83 83 HIS CB C 2506 33.132 30.630 2.502 1
1 901 . 10 1 1 A 83 83 HIS N N 2506 124.092 121.530 2.562 1
1 902 . 10 1 1 A 84 84 ILE H H 2507 8.327 8.541 -0.214 1
1 903 . 10 1 1 A 84 84 ILE HA H 2507 4.553 4.351 0.202 1
1 913 . 10 1 1 A 84 84 ILE C C 2507 176.523 176.250 0.273 1
1 914 . 10 1 1 A 84 84 ILE CA C 2507 60.791 59.897 0.894 1
1 915 . 10 1 1 A 84 84 ILE CB C 2507 39.162 39.608 -0.446 1
1 919 . 10 1 1 A 84 84 ILE N N 2507 117.355 118.889 -1.534 1
1 920 . 10 1 1 A 85 85 GLY H H 2508 9.130 8.475 0.655 1
1 921 . 10 1 1 A 85 85 GLY HA2 H 2508 3.883 3.782 0.101 1
1 922 . 10 1 1 A 85 85 GLY HA3 H 2508 3.800 3.793 0.007 1
1 923 . 10 1 1 A 85 85 GLY C C 2508 174.438 175.471 -1.033 1
1 924 . 10 1 1 A 85 85 GLY CA C 2508 47.673 46.803 0.870 1
1 925 . 10 1 1 A 85 85 GLY N N 2508 111.346 109.675 1.671 1
1 926 . 10 1 1 A 86 86 GLY H H 2509 8.236 8.449 -0.213 1
1 927 . 10 1 1 A 86 86 GLY HA2 H 2509 3.893 3.908 -0.015 1
1 928 . 10 1 1 A 86 86 GLY HA3 H 2509 3.161 3.969 -0.808 1
1 929 . 10 1 1 A 86 86 GLY C C 2509 171.837 173.765 -1.928 1
1 930 . 10 1 1 A 86 86 GLY CA C 2509 44.844 45.266 -0.422 1
1 931 . 10 1 1 A 86 86 GLY N N 2509 115.594 116.885 -1.291 1
1 932 . 10 1 1 A 87 87 SER H H 2510 7.385 7.993 -0.608 1
1 933 . 10 1 1 A 87 87 SER HA H 2510 4.217 4.252 -0.035 1
1 936 . 10 1 1 A 87 87 SER CA C 2510 54.783 55.506 -0.723 1
1 937 . 10 1 1 A 87 87 SER CB C 2510 62.683 64.169 -1.486 1
1 938 . 10 1 1 A 87 87 SER N N 2510 112.859 116.678 -3.819 1
1 939 . 10 1 1 A 88 88 PRO HA H 2511 5.532 4.877 0.655 1
1 946 . 10 1 1 A 88 88 PRO C C 2511 175.870 175.212 0.658 1
1 947 . 10 1 1 A 88 88 PRO CA C 2511 62.379 62.362 0.017 1
1 948 . 10 1 1 A 88 88 PRO CB C 2511 33.639 32.259 1.380 1
1 951 . 10 1 1 A 89 89 PHE H H 2512 9.359 8.784 0.575 1
1 952 . 10 1 1 A 89 89 PHE HA H 2512 4.467 4.871 -0.404 1
1 960 . 10 1 1 A 89 89 PHE C C 2512 175.152 174.876 0.276 1
1 961 . 10 1 1 A 89 89 PHE CA C 2512 57.401 56.819 0.582 1
1 962 . 10 1 1 A 89 89 PHE CB C 2512 40.843 41.209 -0.366 1
1 966 . 10 1 1 A 89 89 PHE N N 2512 124.789 118.966 5.823 1
1 967 . 10 1 1 A 90 90 LYS H H 2513 8.772 8.699 0.073 1
1 968 . 10 1 1 A 90 90 LYS HA H 2513 4.941 4.630 0.311 1
1 973 . 10 1 1 A 90 90 LYS C C 2513 174.183 175.662 -1.479 1
1 974 . 10 1 1 A 90 90 LYS CA C 2513 55.749 55.674 0.075 1
1 975 . 10 1 1 A 90 90 LYS CB C 2513 32.817 32.556 0.261 1
1 978 . 10 1 1 A 90 90 LYS N N 2513 125.133 122.701 2.432 1
1 979 . 10 1 1 A 91 91 ALA H H 2514 9.158 9.010 0.148 1
1 980 . 10 1 1 A 91 91 ALA HA H 2514 4.510 4.959 -0.449 1
1 984 . 10 1 1 A 91 91 ALA C C 2514 176.561 176.846 -0.285 1
1 985 . 10 1 1 A 91 91 ALA CA C 2514 50.528 51.268 -0.740 1
1 986 . 10 1 1 A 91 91 ALA CB C 2514 20.653 20.294 0.359 1
1 987 . 10 1 1 A 91 91 ALA N N 2514 131.989 128.166 3.823 1
1 988 . 10 1 1 A 92 92 LYS H H 2515 8.186 8.891 -0.705 1
1 989 . 10 1 1 A 92 92 LYS HA H 2515 4.926 4.987 -0.061 1
1 998 . 10 1 1 A 92 92 LYS C C 2515 175.177 175.952 -0.775 1
1 999 . 10 1 1 A 92 92 LYS CA C 2515 55.725 55.548 0.177 1
1 1000 . 10 1 1 A 92 92 LYS CB C 2515 33.765 34.409 -0.644 1
1 1004 . 10 1 1 A 92 92 LYS N N 2515 124.887 123.478 1.409 1
1 1005 . 10 1 1 A 93 93 VAL H H 2516 9.362 9.172 0.190 1
1 1006 . 10 1 1 A 93 93 VAL HA H 2516 5.161 5.315 -0.154 1
1 1014 . 10 1 1 A 93 93 VAL C C 2516 176.988 175.338 1.650 1
1 1015 . 10 1 1 A 93 93 VAL CA C 2516 60.523 61.167 -0.644 1
1 1016 . 10 1 1 A 93 93 VAL CB C 2516 33.291 35.398 -2.107 1
1 1019 . 10 1 1 A 93 93 VAL N N 2516 129.943 123.210 6.733 1
1 1020 . 10 1 1 A 94 94 THR H H 2517 8.614 8.524 0.090 1
1 1021 . 10 1 1 A 94 94 THR HA H 2517 4.902 4.900 0.002 1
1 1026 . 10 1 1 A 94 94 THR C C 2517 172.759 173.226 -0.467 1
1 1027 . 10 1 1 A 94 94 THR CA C 2517 60.121 59.823 0.298 1
1 1028 . 10 1 1 A 94 94 THR CB C 2517 71.072 71.675 -0.603 1
1 1030 . 10 1 1 A 94 94 THR N N 2517 122.032 116.681 5.351 1
1 1031 . 10 1 1 A 95 95 GLY H H 2518 8.280 8.449 -0.169 1
1 1032 . 10 1 1 A 95 95 GLY HA2 H 2518 3.852 4.140 -0.288 1
1 1033 . 10 1 1 A 95 95 GLY HA3 H 2518 4.846 4.141 0.705 1
1 1034 . 10 1 1 A 95 95 GLY CA C 2518 43.955 44.471 -0.516 1
1 1035 . 10 1 1 A 95 95 GLY N N 2518 107.949 107.825 0.124 1
1 1036 . 10 1 1 A 96 96 PRO HA H 2519 4.449 4.630 -0.181 1
1 1043 . 10 1 1 A 96 96 PRO C C 2519 176.892 176.592 0.300 1
1 1044 . 10 1 1 A 96 96 PRO CA C 2519 62.062 62.786 -0.724 1
1 1045 . 10 1 1 A 96 96 PRO CB C 2519 32.286 32.073 0.213 1
1 1048 . 10 1 1 A 97 97 ARG H H 2520 8.651 8.547 0.104 1
1 1049 . 10 1 1 A 97 97 ARG HA H 2520 4.348 4.356 -0.008 1
1 1056 . 10 1 1 A 97 97 ARG C C 2520 176.236 177.089 -0.853 1
1 1057 . 10 1 1 A 97 97 ARG CA C 2520 57.587 56.461 1.126 1
1 1058 . 10 1 1 A 97 97 ARG CB C 2520 30.472 31.157 -0.685 1
1 1061 . 10 1 1 A 97 97 ARG N N 2520 120.781 122.139 -1.358 1
1 1062 . 10 1 1 A 98 98 LEU H H 2521 8.545 8.749 -0.204 1
1 1063 . 10 1 1 A 98 98 LEU HA H 2521 4.577 4.117 0.460 1
1 1073 . 10 1 1 A 98 98 LEU C C 2521 175.880 178.652 -2.772 1
1 1074 . 10 1 1 A 98 98 LEU CA C 2521 55.068 57.088 -2.020 1
1 1075 . 10 1 1 A 98 98 LEU CB C 2521 43.082 41.665 1.417 1
1 1079 . 10 1 1 A 98 98 LEU N N 2521 128.715 127.134 1.581 1
1 4 . 11 1 1 A 2 2 ALA HA H -2 4.374 4.427 -0.053 1
1 8 . 11 1 1 A 2 2 ALA C C -2 177.865 177.140 0.725 1
1 9 . 11 1 1 A 2 2 ALA CA C -2 52.670 52.087 0.583 1
1 10 . 11 1 1 A 2 2 ALA CB C -2 19.508 19.212 0.296 1
1 32 . 11 1 1 A 5 5 ASP H H 2428 8.300 8.567 -0.267 1
1 33 . 11 1 1 A 5 5 ASP HA H 2428 5.082 5.266 -0.184 1
1 36 . 11 1 1 A 5 5 ASP CA C 2428 51.517 50.584 0.933 1
1 37 . 11 1 1 A 5 5 ASP CB C 2428 42.244 43.914 -1.670 1
1 38 . 11 1 1 A 5 5 ASP N N 2428 122.879 121.309 1.570 1
1 39 . 11 1 1 A 6 6 PRO HA H 2429 4.340 4.390 -0.050 1
1 46 . 11 1 1 A 6 6 PRO C C 2429 178.266 179.000 -0.734 1
1 47 . 11 1 1 A 6 6 PRO CA C 2429 64.494 65.193 -0.699 1
1 48 . 11 1 1 A 6 6 PRO CB C 2429 31.841 31.995 -0.154 1
1 51 . 11 1 1 A 7 7 GLY H H 2430 8.686 8.285 0.401 1
1 52 . 11 1 1 A 7 7 GLY HA2 H 2430 4.116 3.831 0.285 1
1 53 . 11 1 1 A 7 7 GLY HA3 H 2430 3.868 3.839 0.029 1
1 54 . 11 1 1 A 7 7 GLY C C 2430 174.567 175.336 -0.769 1
1 55 . 11 1 1 A 7 7 GLY CA C 2430 46.038 46.516 -0.478 1
1 56 . 11 1 1 A 7 7 GLY N N 2430 107.655 104.556 3.099 1
1 57 . 11 1 1 A 8 8 LEU H H 2431 7.692 7.537 0.155 1
1 58 . 11 1 1 A 8 8 LEU HA H 2431 4.507 4.387 0.120 1
1 68 . 11 1 1 A 8 8 LEU C C 2431 176.876 177.281 -0.405 1
1 69 . 11 1 1 A 8 8 LEU CA C 2431 54.307 55.547 -1.240 1
1 70 . 11 1 1 A 8 8 LEU CB C 2431 42.879 42.782 0.097 1
1 74 . 11 1 1 A 8 8 LEU N N 2431 120.022 119.658 0.364 1
1 75 . 11 1 1 A 9 9 VAL H H 2432 7.378 7.188 0.190 1
1 76 . 11 1 1 A 9 9 VAL HA H 2432 4.154 3.930 0.224 1
1 84 . 11 1 1 A 9 9 VAL C C 2432 174.703 175.201 -0.498 1
1 85 . 11 1 1 A 9 9 VAL CA C 2432 62.387 62.589 -0.202 1
1 86 . 11 1 1 A 9 9 VAL CB C 2432 32.519 32.148 0.371 1
1 89 . 11 1 1 A 9 9 VAL N N 2432 123.902 119.698 4.204 1
1 90 . 11 1 1 A 10 10 SER H H 2433 8.201 9.024 -0.823 1
1 91 . 11 1 1 A 10 10 SER HA H 2433 5.136 5.019 0.117 1
1 94 . 11 1 1 A 10 10 SER CA C 2433 56.554 55.571 0.983 1
1 95 . 11 1 1 A 10 10 SER CB C 2433 66.763 65.352 1.411 1
1 96 . 11 1 1 A 10 10 SER N N 2433 121.921 122.283 -0.362 1
1 97 . 11 1 1 A 11 11 ALA H H 2434 8.670 8.243 0.427 1
1 98 . 11 1 1 A 11 11 ALA HA H 2434 5.632 5.166 0.466 1
1 102 . 11 1 1 A 11 11 ALA C C 2434 175.459 174.496 0.963 1
1 103 . 11 1 1 A 11 11 ALA CA C 2434 50.575 50.994 -0.419 1
1 104 . 11 1 1 A 11 11 ALA CB C 2434 23.111 23.068 0.043 1
1 105 . 11 1 1 A 11 11 ALA N N 2434 124.828 123.628 1.200 1
1 106 . 11 1 1 A 12 12 TYR H H 2435 8.609 8.759 -0.150 1
1 107 . 11 1 1 A 12 12 TYR HA H 2435 4.879 5.105 -0.226 1
1 114 . 11 1 1 A 12 12 TYR C C 2435 173.645 174.542 -0.897 1
1 115 . 11 1 1 A 12 12 TYR CA C 2435 56.268 56.806 -0.538 1
1 116 . 11 1 1 A 12 12 TYR CB C 2435 39.522 42.389 -2.867 1
1 119 . 11 1 1 A 12 12 TYR N N 2435 118.305 118.954 -0.649 1
1 120 . 11 1 1 A 13 13 GLY H H 2436 8.655 8.584 0.071 1
1 121 . 11 1 1 A 13 13 GLY HA2 H 2436 4.943 4.311 0.632 1
1 122 . 11 1 1 A 13 13 GLY HA3 H 2436 4.028 4.354 -0.326 1
1 123 . 11 1 1 A 13 13 GLY C C 2436 175.334 174.904 0.430 1
1 124 . 11 1 1 A 13 13 GLY CA C 2436 44.389 44.557 -0.168 1
1 125 . 11 1 1 A 13 13 GLY N N 2436 110.710 110.367 0.343 1
1 126 . 11 1 1 A 14 14 ALA H H 2437 8.939 8.809 0.130 1
1 127 . 11 1 1 A 14 14 ALA HA H 2437 4.276 4.099 0.177 1
1 131 . 11 1 1 A 14 14 ALA C C 2437 180.524 179.225 1.299 1
1 132 . 11 1 1 A 14 14 ALA CA C 2437 55.551 55.089 0.462 1
1 133 . 11 1 1 A 14 14 ALA CB C 2437 18.411 18.389 0.022 1
1 134 . 11 1 1 A 14 14 ALA N N 2437 126.973 123.952 3.021 1
1 135 . 11 1 1 A 15 15 GLY H H 2438 8.933 8.703 0.230 1
1 136 . 11 1 1 A 15 15 GLY HA2 H 2438 4.531 4.031 0.500 1
1 137 . 11 1 1 A 15 15 GLY HA3 H 2438 3.576 4.240 -0.664 1
1 138 . 11 1 1 A 15 15 GLY C C 2438 174.323 175.860 -1.537 1
1 139 . 11 1 1 A 15 15 GLY CA C 2438 46.855 47.004 -0.149 1
1 140 . 11 1 1 A 15 15 GLY N N 2438 104.803 105.649 -0.846 1
1 141 . 11 1 1 A 16 16 LEU H H 2439 7.529 7.631 -0.102 1
1 142 . 11 1 1 A 16 16 LEU HA H 2439 3.768 3.849 -0.081 1
1 152 . 11 1 1 A 16 16 LEU C C 2439 176.388 178.686 -2.298 1
1 153 . 11 1 1 A 16 16 LEU CA C 2439 56.137 57.373 -1.236 1
1 154 . 11 1 1 A 16 16 LEU CB C 2439 41.621 41.128 0.493 1
1 158 . 11 1 1 A 16 16 LEU N N 2439 119.633 122.442 -2.809 1
1 159 . 11 1 1 A 17 17 GLU H H 2440 7.505 7.974 -0.469 1
1 160 . 11 1 1 A 17 17 GLU HA H 2440 4.663 4.348 0.315 1
1 165 . 11 1 1 A 17 17 GLU C C 2440 178.126 176.649 1.477 1
1 166 . 11 1 1 A 17 17 GLU CA C 2440 56.447 56.857 -0.410 1
1 167 . 11 1 1 A 17 17 GLU CB C 2440 31.485 30.818 0.667 1
1 169 . 11 1 1 A 17 17 GLU N N 2440 114.368 116.204 -1.836 1
1 170 . 11 1 1 A 18 18 GLY H H 2441 7.921 7.345 0.576 1
1 171 . 11 1 1 A 18 18 GLY HA2 H 2441 4.889 4.198 0.691 1
1 172 . 11 1 1 A 18 18 GLY HA3 H 2441 3.707 4.244 -0.537 1
1 173 . 11 1 1 A 18 18 GLY C C 2441 170.965 171.529 -0.564 1
1 174 . 11 1 1 A 18 18 GLY CA C 2441 45.549 45.386 0.163 1
1 175 . 11 1 1 A 18 18 GLY N N 2441 109.165 105.244 3.921 1
1 176 . 11 1 1 A 19 19 GLY H H 2442 7.540 7.932 -0.392 1
1 177 . 11 1 1 A 19 19 GLY HA2 H 2442 4.086 4.204 -0.118 1
1 178 . 11 1 1 A 19 19 GLY HA3 H 2442 4.086 4.232 -0.146 1
1 179 . 11 1 1 A 19 19 GLY C C 2442 171.051 171.502 -0.451 1
1 180 . 11 1 1 A 19 19 GLY CA C 2442 44.937 46.287 -1.350 1
1 181 . 11 1 1 A 19 19 GLY N N 2442 105.460 108.725 -3.265 1
1 182 . 11 1 1 A 20 20 VAL H H 2443 8.899 8.423 0.476 1
1 183 . 11 1 1 A 20 20 VAL HA H 2443 5.062 5.064 -0.002 1
1 191 . 11 1 1 A 20 20 VAL C C 2443 176.623 175.281 1.342 1
1 192 . 11 1 1 A 20 20 VAL CA C 2443 60.197 60.109 0.088 1
1 193 . 11 1 1 A 20 20 VAL CB C 2443 35.107 35.407 -0.300 1
1 196 . 11 1 1 A 20 20 VAL N N 2443 122.753 119.507 3.246 1
1 197 . 11 1 1 A 21 21 THR H H 2444 8.630 8.530 0.100 1
1 198 . 11 1 1 A 21 21 THR HA H 2444 3.773 4.165 -0.392 1
1 203 . 11 1 1 A 21 21 THR C C 2444 175.646 174.962 0.684 1
1 204 . 11 1 1 A 21 21 THR CA C 2444 62.732 63.416 -0.684 1
1 205 . 11 1 1 A 21 21 THR CB C 2444 68.925 68.420 0.505 1
1 207 . 11 1 1 A 21 21 THR N N 2444 118.179 119.465 -1.286 1
1 208 . 11 1 1 A 22 22 GLY H H 2445 8.736 8.845 -0.109 1
1 209 . 11 1 1 A 22 22 GLY HA2 H 2445 3.412 3.988 -0.576 1
1 210 . 11 1 1 A 22 22 GLY HA3 H 2445 4.061 3.990 0.071 1
1 211 . 11 1 1 A 22 22 GLY C C 2445 172.973 173.379 -0.406 1
1 212 . 11 1 1 A 22 22 GLY CA C 2445 45.577 45.305 0.272 1
1 213 . 11 1 1 A 22 22 GLY N N 2445 107.888 114.067 -6.179 1
1 214 . 11 1 1 A 23 23 ASN H H 2446 7.877 7.800 0.077 1
1 215 . 11 1 1 A 23 23 ASN HA H 2446 5.253 5.025 0.228 1
1 220 . 11 1 1 A 23 23 ASN CA C 2446 49.740 50.364 -0.624 1
1 221 . 11 1 1 A 23 23 ASN CB C 2446 40.198 39.872 0.326 1
1 222 . 11 1 1 A 23 23 ASN N N 2446 120.684 120.184 0.500 1
1 224 . 11 1 1 A 24 24 PRO HA H 2447 4.525 4.710 -0.185 1
1 231 . 11 1 1 A 24 24 PRO CA C 2447 62.766 62.447 0.319 1
1 232 . 11 1 1 A 24 24 PRO CB C 2447 31.732 31.784 -0.052 1
1 235 . 11 1 1 A 25 25 ALA H H 2448 9.178 8.228 0.950 1
1 236 . 11 1 1 A 25 25 ALA HA H 2448 4.614 4.863 -0.249 1
1 240 . 11 1 1 A 25 25 ALA C C 2448 175.503 176.368 -0.865 1
1 241 . 11 1 1 A 25 25 ALA CA C 2448 50.526 50.489 0.037 1
1 242 . 11 1 1 A 25 25 ALA CB C 2448 20.458 21.899 -1.441 1
1 243 . 11 1 1 A 25 25 ALA N N 2448 132.079 124.927 7.152 1
1 244 . 11 1 1 A 26 26 GLU H H 2449 8.813 8.974 -0.161 1
1 245 . 11 1 1 A 26 26 GLU HA H 2449 5.830 5.339 0.491 1
1 250 . 11 1 1 A 26 26 GLU C C 2449 176.272 174.735 1.537 1
1 251 . 11 1 1 A 26 26 GLU CA C 2449 54.376 55.042 -0.666 1
1 252 . 11 1 1 A 26 26 GLU CB C 2449 35.463 33.790 1.673 1
1 254 . 11 1 1 A 26 26 GLU N N 2449 120.079 116.335 3.744 1
1 255 . 11 1 1 A 27 27 PHE H H 2450 8.782 8.593 0.189 1
1 256 . 11 1 1 A 27 27 PHE HA H 2450 5.021 5.051 -0.030 1
1 264 . 11 1 1 A 27 27 PHE C C 2450 171.205 172.023 -0.818 1
1 265 . 11 1 1 A 27 27 PHE CA C 2450 56.852 56.547 0.305 1
1 266 . 11 1 1 A 27 27 PHE CB C 2450 41.080 41.682 -0.602 1
1 270 . 11 1 1 A 27 27 PHE N N 2450 118.670 117.233 1.437 1
1 271 . 11 1 1 A 28 28 VAL H H 2451 8.961 9.251 -0.290 1
1 272 . 11 1 1 A 28 28 VAL HA H 2451 4.761 4.590 0.171 1
1 280 . 11 1 1 A 28 28 VAL C C 2451 174.673 175.772 -1.099 1
1 281 . 11 1 1 A 28 28 VAL CA C 2451 60.619 61.474 -0.855 1
1 282 . 11 1 1 A 28 28 VAL CB C 2451 35.484 33.041 2.443 1
1 285 . 11 1 1 A 28 28 VAL N N 2451 121.552 121.013 0.539 1
1 286 . 11 1 1 A 29 29 VAL H H 2452 9.294 9.147 0.147 1
1 287 . 11 1 1 A 29 29 VAL HA H 2452 4.363 4.185 0.178 1
1 295 . 11 1 1 A 29 29 VAL C C 2452 174.218 175.039 -0.821 1
1 296 . 11 1 1 A 29 29 VAL CA C 2452 61.526 63.022 -1.496 1
1 297 . 11 1 1 A 29 29 VAL CB C 2452 32.666 31.561 1.105 1
1 300 . 11 1 1 A 29 29 VAL N N 2452 125.585 128.195 -2.610 1
1 301 . 11 1 1 A 30 30 ASN H H 2453 9.465 8.937 0.528 1
1 302 . 11 1 1 A 30 30 ASN HA H 2453 5.096 5.150 -0.054 1
1 307 . 11 1 1 A 30 30 ASN C C 2453 176.216 176.067 0.149 1
1 308 . 11 1 1 A 30 30 ASN CA C 2453 52.011 52.638 -0.627 1
1 309 . 11 1 1 A 30 30 ASN CB C 2453 39.057 38.612 0.445 1
1 310 . 11 1 1 A 30 30 ASN N N 2453 127.724 127.051 0.673 1
1 312 . 11 1 1 A 31 31 THR H H 2454 8.915 8.562 0.353 1
1 313 . 11 1 1 A 31 31 THR HA H 2454 4.342 4.501 -0.159 1
1 318 . 11 1 1 A 31 31 THR C C 2454 176.816 175.981 0.835 1
1 319 . 11 1 1 A 31 31 THR CA C 2454 61.117 61.492 -0.375 1
1 320 . 11 1 1 A 31 31 THR CB C 2454 68.209 69.435 -1.226 1
1 322 . 11 1 1 A 31 31 THR N N 2454 117.783 116.639 1.144 1
1 323 . 11 1 1 A 32 32 SER H H 2455 8.454 7.854 0.600 1
1 324 . 11 1 1 A 32 32 SER HA H 2455 4.155 4.207 -0.052 1
1 327 . 11 1 1 A 32 32 SER C C 2455 175.458 175.152 0.306 1
1 328 . 11 1 1 A 32 32 SER CA C 2455 62.148 62.311 -0.163 1
1 329 . 11 1 1 A 32 32 SER CB C 2455 63.476 63.070 0.406 1
1 330 . 11 1 1 A 32 32 SER N N 2455 121.781 119.024 2.757 1
1 331 . 11 1 1 A 33 33 ASN H H 2456 8.845 7.936 0.909 1
1 332 . 11 1 1 A 33 33 ASN HA H 2456 5.064 4.612 0.452 1
1 337 . 11 1 1 A 33 33 ASN C C 2456 174.674 176.173 -1.499 1
1 338 . 11 1 1 A 33 33 ASN CA C 2456 53.067 54.341 -1.274 1
1 339 . 11 1 1 A 33 33 ASN CB C 2456 39.632 38.951 0.681 1
1 340 . 11 1 1 A 33 33 ASN N N 2456 120.176 117.801 2.375 1
1 342 . 11 1 1 A 34 34 ALA H H 2457 7.714 7.785 -0.071 1
1 343 . 11 1 1 A 34 34 ALA HA H 2457 4.482 4.428 0.054 1
1 347 . 11 1 1 A 34 34 ALA C C 2457 177.582 178.445 -0.863 1
1 348 . 11 1 1 A 34 34 ALA CA C 2457 52.521 52.542 -0.021 1
1 349 . 11 1 1 A 34 34 ALA CB C 2457 22.252 20.583 1.669 1
1 350 . 11 1 1 A 34 34 ALA N N 2457 123.065 120.479 2.586 1
1 351 . 11 1 1 A 35 35 GLY H H 2458 8.195 8.063 0.132 1
1 352 . 11 1 1 A 35 35 GLY HA2 H 2458 4.246 4.152 0.094 1
1 353 . 11 1 1 A 35 35 GLY HA3 H 2458 3.902 4.165 -0.263 1
1 354 . 11 1 1 A 35 35 GLY C C 2458 173.360 174.069 -0.709 1
1 355 . 11 1 1 A 35 35 GLY CA C 2458 44.486 44.578 -0.092 1
1 356 . 11 1 1 A 35 35 GLY N N 2458 108.472 105.149 3.323 1
1 357 . 11 1 1 A 36 36 ALA H H 2459 8.430 8.141 0.289 1
1 358 . 11 1 1 A 36 36 ALA HA H 2459 4.472 4.511 -0.039 1
1 362 . 11 1 1 A 36 36 ALA C C 2459 176.968 177.503 -0.535 1
1 363 . 11 1 1 A 36 36 ALA CA C 2459 52.695 52.825 -0.130 1
1 364 . 11 1 1 A 36 36 ALA CB C 2459 19.360 19.685 -0.325 1
1 365 . 11 1 1 A 36 36 ALA N N 2459 126.012 123.515 2.497 1
1 366 . 11 1 1 A 37 37 GLY H H 2460 7.781 8.553 -0.772 1
1 367 . 11 1 1 A 37 37 GLY HA2 H 2460 3.856 4.044 -0.188 1
1 368 . 11 1 1 A 37 37 GLY HA3 H 2460 3.164 4.113 -0.949 1
1 369 . 11 1 1 A 37 37 GLY C C 2460 170.730 171.349 -0.619 1
1 370 . 11 1 1 A 37 37 GLY CA C 2460 44.747 45.425 -0.678 1
1 371 . 11 1 1 A 37 37 GLY N N 2460 109.493 107.314 2.179 1
1 372 . 11 1 1 A 38 38 ALA H H 2461 8.055 7.884 0.171 1
1 373 . 11 1 1 A 38 38 ALA HA H 2461 4.389 5.078 -0.689 1
1 377 . 11 1 1 A 38 38 ALA C C 2461 176.609 174.397 2.212 1
1 378 . 11 1 1 A 38 38 ALA CA C 2461 51.419 50.063 1.356 1
1 379 . 11 1 1 A 38 38 ALA CB C 2461 19.665 22.408 -2.743 1
1 380 . 11 1 1 A 38 38 ALA N N 2461 121.997 121.479 0.518 1
1 381 . 11 1 1 A 39 39 LEU H H 2462 8.597 8.373 0.224 1
1 382 . 11 1 1 A 39 39 LEU HA H 2462 5.022 4.876 0.146 1
1 392 . 11 1 1 A 39 39 LEU C C 2462 175.883 175.427 0.456 1
1 393 . 11 1 1 A 39 39 LEU CA C 2462 53.907 53.844 0.063 1
1 394 . 11 1 1 A 39 39 LEU CB C 2462 44.576 44.212 0.364 1
1 398 . 11 1 1 A 39 39 LEU N N 2462 126.664 124.425 2.239 1
1 399 . 11 1 1 A 40 40 SER H H 2463 8.898 9.223 -0.325 1
1 400 . 11 1 1 A 40 40 SER HA H 2463 4.732 4.732 0.000 1
1 403 . 11 1 1 A 40 40 SER C C 2463 172.984 172.840 0.144 1
1 404 . 11 1 1 A 40 40 SER CA C 2463 56.730 57.014 -0.284 1
1 405 . 11 1 1 A 40 40 SER CB C 2463 64.648 64.339 0.309 1
1 406 . 11 1 1 A 40 40 SER N N 2463 122.932 121.696 1.236 1
1 407 . 11 1 1 A 41 41 VAL H H 2464 8.538 7.357 1.181 1
1 408 . 11 1 1 A 41 41 VAL HA H 2464 5.131 4.178 0.953 1
1 416 . 11 1 1 A 41 41 VAL C C 2464 174.812 175.386 -0.574 1
1 417 . 11 1 1 A 41 41 VAL CA C 2464 60.784 62.873 -2.089 1
1 418 . 11 1 1 A 41 41 VAL CB C 2464 34.262 32.251 2.011 1
1 420 . 11 1 1 A 41 41 VAL N N 2464 129.161 123.089 6.072 1
1 421 . 11 1 1 A 42 42 THR H H 2465 8.807 8.629 0.178 1
1 422 . 11 1 1 A 42 42 THR HA H 2465 4.573 4.839 -0.266 1
1 427 . 11 1 1 A 42 42 THR CA C 2465 60.408 60.387 0.021 1
1 428 . 11 1 1 A 42 42 THR CB C 2465 71.764 70.548 1.216 1
1 430 . 11 1 1 A 42 42 THR N N 2465 120.898 121.114 -0.216 1
1 431 . 11 1 1 A 43 43 ILE H H 2466 8.648 8.630 0.018 1
1 432 . 11 1 1 A 43 43 ILE HA H 2466 4.854 4.923 -0.069 1
1 442 . 11 1 1 A 43 43 ILE C C 2466 174.073 174.505 -0.432 1
1 443 . 11 1 1 A 43 43 ILE CA C 2466 61.184 60.443 0.741 1
1 444 . 11 1 1 A 43 43 ILE CB C 2466 39.516 41.279 -1.763 1
1 448 . 11 1 1 A 43 43 ILE N N 2466 124.810 123.963 0.847 1
1 449 . 11 1 1 A 44 44 ASP H H 2467 8.821 8.905 -0.084 1
1 450 . 11 1 1 A 44 44 ASP HA H 2467 5.217 5.371 -0.154 1
1 453 . 11 1 1 A 44 44 ASP C C 2467 175.002 175.586 -0.584 1
1 454 . 11 1 1 A 44 44 ASP CA C 2467 52.998 52.735 0.263 1
1 455 . 11 1 1 A 44 44 ASP CB C 2467 44.728 43.690 1.038 1
1 456 . 11 1 1 A 44 44 ASP N N 2467 129.093 126.325 2.768 1
1 457 . 11 1 1 A 45 45 GLY H H 2468 8.535 8.292 0.243 1
1 458 . 11 1 1 A 45 45 GLY HA2 H 2468 3.954 3.960 -0.006 1
1 459 . 11 1 1 A 45 45 GLY HA3 H 2468 3.561 4.100 -0.539 1
1 460 . 11 1 1 A 45 45 GLY CA C 2468 45.659 44.564 1.095 1
1 461 . 11 1 1 A 45 45 GLY N N 2468 112.751 108.262 4.489 1
1 462 . 11 1 1 A 46 46 PRO HA H 2469 4.318 4.386 -0.068 1
1 469 . 11 1 1 A 46 46 PRO C C 2469 176.086 175.790 0.296 1
1 470 . 11 1 1 A 46 46 PRO CA C 2469 64.198 63.902 0.296 1
1 471 . 11 1 1 A 46 46 PRO CB C 2469 32.348 31.795 0.553 1
1 474 . 11 1 1 A 47 47 SER H H 2470 7.106 7.322 -0.216 1
1 475 . 11 1 1 A 47 47 SER HA H 2470 4.632 4.681 -0.049 1
1 478 . 11 1 1 A 47 47 SER C C 2470 172.969 172.511 0.458 1
1 479 . 11 1 1 A 47 47 SER CA C 2470 57.106 57.580 -0.474 1
1 480 . 11 1 1 A 47 47 SER CB C 2470 66.262 65.361 0.901 1
1 481 . 11 1 1 A 47 47 SER N N 2470 110.556 108.600 1.956 1
1 482 . 11 1 1 A 48 48 LYS H H 2471 8.534 8.519 0.015 1
1 483 . 11 1 1 A 48 48 LYS HA H 2471 4.486 4.654 -0.168 1
1 492 . 11 1 1 A 48 48 LYS C C 2471 177.231 176.777 0.454 1
1 493 . 11 1 1 A 48 48 LYS CA C 2471 56.620 56.185 0.435 1
1 494 . 11 1 1 A 48 48 LYS CB C 2471 32.379 32.936 -0.557 1
1 498 . 11 1 1 A 48 48 LYS N N 2471 124.055 121.315 2.740 1
1 499 . 11 1 1 A 49 49 VAL H H 2472 8.497 8.447 0.050 1
1 500 . 11 1 1 A 49 49 VAL HA H 2472 4.552 4.110 0.442 1
1 508 . 11 1 1 A 49 49 VAL C C 2472 175.292 175.566 -0.274 1
1 509 . 11 1 1 A 49 49 VAL CA C 2472 60.142 62.219 -2.077 1
1 510 . 11 1 1 A 49 49 VAL CB C 2472 33.464 32.674 0.790 1
1 513 . 11 1 1 A 49 49 VAL N N 2472 121.233 124.399 -3.166 1
1 514 . 11 1 1 A 50 50 LYS H H 2473 8.190 8.372 -0.182 1
1 515 . 11 1 1 A 50 50 LYS HA H 2473 4.522 4.566 -0.044 1
1 518 . 11 1 1 A 50 50 LYS CA C 2473 55.952 56.306 -0.354 1
1 519 . 11 1 1 A 50 50 LYS CB C 2473 32.896 33.001 -0.105 1
1 520 . 11 1 1 A 50 50 LYS N N 2473 126.082 123.994 2.088 1
1 521 . 11 1 1 A 51 51 MET H H 2474 8.818 8.674 0.144 1
1 522 . 11 1 1 A 51 51 MET HA H 2474 5.324 5.136 0.188 1
1 530 . 11 1 1 A 51 51 MET C C 2474 173.933 173.947 -0.014 1
1 531 . 11 1 1 A 51 51 MET CA C 2474 54.848 54.492 0.356 1
1 532 . 11 1 1 A 51 51 MET CB C 2474 37.043 35.975 1.068 1
1 535 . 11 1 1 A 51 51 MET N N 2474 126.911 122.029 4.882 1
1 536 . 11 1 1 A 52 52 ASP H H 2475 9.095 9.074 0.021 1
1 537 . 11 1 1 A 52 52 ASP HA H 2475 4.947 5.347 -0.400 1
1 540 . 11 1 1 A 52 52 ASP C C 2475 173.923 173.989 -0.066 1
1 541 . 11 1 1 A 52 52 ASP CA C 2475 53.487 53.033 0.454 1
1 542 . 11 1 1 A 52 52 ASP CB C 2475 44.765 44.845 -0.080 1
1 543 . 11 1 1 A 52 52 ASP N N 2475 125.526 123.219 2.307 1
1 544 . 11 1 1 A 53 53 CYS H H 2476 8.606 8.865 -0.259 1
1 545 . 11 1 1 A 53 53 CYS HA H 2476 5.145 5.491 -0.346 1
1 548 . 11 1 1 A 53 53 CYS C C 2476 173.330 173.305 0.025 1
1 549 . 11 1 1 A 53 53 CYS CA C 2476 57.452 57.517 -0.065 1
1 550 . 11 1 1 A 53 53 CYS CB C 2476 28.108 30.724 -2.616 1
1 551 . 11 1 1 A 53 53 CYS N N 2476 124.317 122.271 2.046 1
1 552 . 11 1 1 A 54 54 GLN H H 2477 8.978 9.152 -0.174 1
1 553 . 11 1 1 A 54 54 GLN HA H 2477 4.884 5.099 -0.215 1
1 560 . 11 1 1 A 54 54 GLN C C 2477 174.854 174.111 0.743 1
1 561 . 11 1 1 A 54 54 GLN CA C 2477 53.891 53.713 0.178 1
1 562 . 11 1 1 A 54 54 GLN CB C 2477 32.837 32.428 0.409 1
1 564 . 11 1 1 A 54 54 GLN N N 2477 127.074 121.635 5.439 1
1 566 . 11 1 1 A 55 55 GLU H H 2478 9.065 8.685 0.380 1
1 567 . 11 1 1 A 55 55 GLU HA H 2478 4.280 4.513 -0.233 1
1 572 . 11 1 1 A 55 55 GLU C C 2478 175.383 175.840 -0.457 1
1 573 . 11 1 1 A 55 55 GLU CA C 2478 57.516 56.583 0.933 1
1 574 . 11 1 1 A 55 55 GLU CB C 2478 30.346 30.609 -0.263 1
1 576 . 11 1 1 A 55 55 GLU N N 2478 125.186 121.895 3.291 1
1 577 . 11 1 1 A 56 56 CYS H H 2479 8.407 8.485 -0.078 1
1 578 . 11 1 1 A 56 56 CYS HA H 2479 5.056 4.823 0.233 1
1 581 . 11 1 1 A 56 56 CYS CA C 2479 55.858 57.146 -1.288 1
1 582 . 11 1 1 A 56 56 CYS CB C 2479 28.676 31.014 -2.338 1
1 583 . 11 1 1 A 56 56 CYS N N 2479 121.499 124.836 -3.337 1
1 584 . 11 1 1 A 57 57 PRO HA H 2480 4.159 4.329 -0.170 1
1 591 . 11 1 1 A 57 57 PRO C C 2480 177.964 177.629 0.335 1
1 592 . 11 1 1 A 57 57 PRO CA C 2480 66.877 64.752 2.125 1
1 593 . 11 1 1 A 57 57 PRO CB C 2480 31.709 32.121 -0.412 1
1 596 . 11 1 1 A 58 58 GLU H H 2481 8.900 8.718 0.182 1
1 597 . 11 1 1 A 58 58 GLU HA H 2481 4.201 4.323 -0.122 1
1 602 . 11 1 1 A 58 58 GLU C C 2481 175.129 176.546 -1.417 1
1 603 . 11 1 1 A 58 58 GLU CA C 2481 57.883 56.581 1.302 1
1 604 . 11 1 1 A 58 58 GLU CB C 2481 29.991 30.293 -0.302 1
1 606 . 11 1 1 A 58 58 GLU N N 2481 115.316 115.565 -0.249 1
1 607 . 11 1 1 A 59 59 GLY H H 2482 7.527 7.380 0.147 1
1 608 . 11 1 1 A 59 59 GLY HA2 H 2482 4.935 3.994 0.941 1
1 609 . 11 1 1 A 59 59 GLY HA3 H 2482 3.381 4.113 -0.732 1
1 610 . 11 1 1 A 59 59 GLY CA C 2482 47.809 45.647 2.162 1
1 611 . 11 1 1 A 59 59 GLY N N 2482 110.079 106.931 3.148 1
1 612 . 11 1 1 A 60 60 TYR H H 2483 8.990 8.379 0.611 1
1 613 . 11 1 1 A 60 60 TYR HA H 2483 5.157 5.351 -0.194 1
1 618 . 11 1 1 A 60 60 TYR C C 2483 175.096 174.341 0.755 1
1 619 . 11 1 1 A 60 60 TYR CA C 2483 57.375 56.844 0.531 1
1 620 . 11 1 1 A 60 60 TYR CB C 2483 43.153 41.403 1.750 1
1 622 . 11 1 1 A 60 60 TYR N N 2483 125.900 121.962 3.938 1
1 623 . 11 1 1 A 61 61 ARG H H 2484 9.557 8.849 0.708 1
1 624 . 11 1 1 A 61 61 ARG HA H 2484 4.858 4.742 0.116 1
1 631 . 11 1 1 A 61 61 ARG CA C 2484 55.016 55.480 -0.464 1
1 632 . 11 1 1 A 61 61 ARG CB C 2484 32.128 31.572 0.556 1
1 635 . 11 1 1 A 61 61 ARG N N 2484 124.847 125.288 -0.441 1
1 636 . 11 1 1 A 62 62 VAL H H 2485 9.046 8.546 0.500 1
1 637 . 11 1 1 A 62 62 VAL HA H 2485 4.675 4.561 0.114 1
1 645 . 11 1 1 A 62 62 VAL C C 2485 173.837 174.941 -1.104 1
1 646 . 11 1 1 A 62 62 VAL CA C 2485 60.752 61.057 -0.305 1
1 647 . 11 1 1 A 62 62 VAL CB C 2485 32.459 32.471 -0.012 1
1 650 . 11 1 1 A 62 62 VAL N N 2485 132.205 126.557 5.648 1
1 651 . 11 1 1 A 63 63 THR H H 2486 8.474 8.980 -0.506 1
1 652 . 11 1 1 A 63 63 THR HA H 2486 5.392 5.308 0.084 1
1 657 . 11 1 1 A 63 63 THR C C 2486 173.675 173.600 0.075 1
1 658 . 11 1 1 A 63 63 THR CA C 2486 60.008 60.996 -0.988 1
1 659 . 11 1 1 A 63 63 THR CB C 2486 71.035 70.742 0.293 1
1 661 . 11 1 1 A 63 63 THR N N 2486 121.216 123.492 -2.276 1
1 662 . 11 1 1 A 64 64 TYR H H 2487 9.409 9.048 0.361 1
1 663 . 11 1 1 A 64 64 TYR HA H 2487 5.617 5.623 -0.006 1
1 670 . 11 1 1 A 64 64 TYR C C 2487 172.847 172.897 -0.050 1
1 671 . 11 1 1 A 64 64 TYR CA C 2487 55.557 55.733 -0.176 1
1 672 . 11 1 1 A 64 64 TYR CB C 2487 41.968 42.193 -0.225 1
1 675 . 11 1 1 A 64 64 TYR N N 2487 124.061 122.834 1.227 1
1 676 . 11 1 1 A 65 65 THR H H 2488 8.145 9.139 -0.994 1
1 677 . 11 1 1 A 65 65 THR HA H 2488 4.959 4.651 0.308 1
1 682 . 11 1 1 A 65 65 THR CA C 2488 58.532 58.963 -0.431 1
1 683 . 11 1 1 A 65 65 THR CB C 2488 70.141 70.700 -0.559 1
1 685 . 11 1 1 A 65 65 THR N N 2488 117.924 116.668 1.256 1
1 686 . 11 1 1 A 66 66 PRO HA H 2489 4.602 4.780 -0.178 1
1 693 . 11 1 1 A 66 66 PRO C C 2489 176.647 176.485 0.162 1
1 694 . 11 1 1 A 66 66 PRO CA C 2489 61.442 62.376 -0.934 1
1 695 . 11 1 1 A 66 66 PRO CB C 2489 32.715 32.976 -0.261 1
1 698 . 11 1 1 A 67 67 MET H H 2490 8.832 8.159 0.673 1
1 699 . 11 1 1 A 67 67 MET HA H 2490 4.880 4.692 0.188 1
1 707 . 11 1 1 A 67 67 MET C C 2490 174.121 175.979 -1.858 1
1 708 . 11 1 1 A 67 67 MET CA C 2490 53.848 55.048 -1.200 1
1 709 . 11 1 1 A 67 67 MET CB C 2490 33.727 33.911 -0.184 1
1 712 . 11 1 1 A 67 67 MET N N 2490 119.212 117.736 1.476 1
1 713 . 11 1 1 A 68 68 ALA H H 2491 7.086 7.549 -0.463 1
1 714 . 11 1 1 A 68 68 ALA HA H 2491 4.851 4.844 0.007 1
1 718 . 11 1 1 A 68 68 ALA CA C 2491 49.222 49.926 -0.704 1
1 719 . 11 1 1 A 68 68 ALA CB C 2491 20.600 21.971 -1.371 1
1 720 . 11 1 1 A 68 68 ALA N N 2491 120.363 120.488 -0.125 1
1 721 . 11 1 1 A 69 69 PRO HA H 2492 4.263 4.725 -0.462 1
1 728 . 11 1 1 A 69 69 PRO C C 2492 174.370 176.293 -1.923 1
1 729 . 11 1 1 A 69 69 PRO CA C 2492 62.555 63.060 -0.505 1
1 730 . 11 1 1 A 69 69 PRO CB C 2492 32.752 32.980 -0.228 1
1 733 . 11 1 1 A 70 70 GLY H H 2493 8.858 8.256 0.602 1
1 734 . 11 1 1 A 70 70 GLY HA2 H 2493 4.544 4.032 0.512 1
1 735 . 11 1 1 A 70 70 GLY HA3 H 2493 3.849 4.094 -0.245 1
1 736 . 11 1 1 A 70 70 GLY C C 2493 172.182 172.306 -0.124 1
1 737 . 11 1 1 A 70 70 GLY CA C 2493 44.356 44.192 0.164 1
1 738 . 11 1 1 A 70 70 GLY N N 2493 106.539 107.747 -1.208 1
1 739 . 11 1 1 A 71 71 SER H H 2494 8.490 8.290 0.200 1
1 740 . 11 1 1 A 71 71 SER HA H 2494 5.280 5.192 0.088 1
1 743 . 11 1 1 A 71 71 SER C C 2494 173.512 173.496 0.016 1
1 744 . 11 1 1 A 71 71 SER CA C 2494 57.674 58.428 -0.754 1
1 745 . 11 1 1 A 71 71 SER CB C 2494 63.799 64.004 -0.205 1
1 746 . 11 1 1 A 71 71 SER N N 2494 117.964 117.512 0.452 1
1 747 . 11 1 1 A 72 72 TYR H H 2495 9.320 9.246 0.074 1
1 748 . 11 1 1 A 72 72 TYR HA H 2495 4.960 4.890 0.070 1
1 755 . 11 1 1 A 72 72 TYR C C 2495 173.979 174.982 -1.003 1
1 756 . 11 1 1 A 72 72 TYR CA C 2495 56.384 57.604 -1.220 1
1 757 . 11 1 1 A 72 72 TYR CB C 2495 40.247 40.364 -0.117 1
1 760 . 11 1 1 A 72 72 TYR N N 2495 126.442 127.416 -0.974 1
1 761 . 11 1 1 A 73 73 LEU H H 2496 9.019 8.979 0.040 1
1 762 . 11 1 1 A 73 73 LEU HA H 2496 5.209 5.103 0.106 1
1 772 . 11 1 1 A 73 73 LEU C C 2496 177.015 174.483 2.532 1
1 773 . 11 1 1 A 73 73 LEU CA C 2496 53.393 53.700 -0.307 1
1 774 . 11 1 1 A 73 73 LEU CB C 2496 43.918 45.349 -1.431 1
1 778 . 11 1 1 A 73 73 LEU N N 2496 125.439 123.438 2.001 1
1 779 . 11 1 1 A 74 74 ILE H H 2497 9.921 9.548 0.373 1
1 780 . 11 1 1 A 74 74 ILE HA H 2497 5.128 4.791 0.337 1
1 790 . 11 1 1 A 74 74 ILE C C 2497 175.730 174.797 0.933 1
1 791 . 11 1 1 A 74 74 ILE CA C 2497 60.930 60.077 0.853 1
1 792 . 11 1 1 A 74 74 ILE CB C 2497 39.488 38.114 1.374 1
1 796 . 11 1 1 A 74 74 ILE N N 2497 132.185 129.405 2.780 1
1 797 . 11 1 1 A 75 75 SER H H 2498 9.284 9.175 0.109 1
1 798 . 11 1 1 A 75 75 SER HA H 2498 5.111 5.183 -0.072 1
1 801 . 11 1 1 A 75 75 SER C C 2498 173.449 173.546 -0.097 1
1 802 . 11 1 1 A 75 75 SER CA C 2498 58.260 58.142 0.118 1
1 803 . 11 1 1 A 75 75 SER CB C 2498 63.956 63.421 0.535 1
1 804 . 11 1 1 A 75 75 SER N N 2498 125.384 124.865 0.519 1
1 805 . 11 1 1 A 76 76 ILE H H 2499 9.861 9.228 0.633 1
1 806 . 11 1 1 A 76 76 ILE HA H 2499 4.814 4.698 0.116 1
1 816 . 11 1 1 A 76 76 ILE CA C 2499 61.034 60.691 0.343 1
1 817 . 11 1 1 A 76 76 ILE CB C 2499 40.387 38.022 2.365 1
1 821 . 11 1 1 A 76 76 ILE N N 2499 129.414 127.379 2.035 1
1 822 . 11 1 1 A 77 77 LYS H H 2500 8.827 9.005 -0.178 1
1 823 . 11 1 1 A 77 77 LYS HA H 2500 5.254 5.191 0.063 1
1 832 . 11 1 1 A 77 77 LYS C C 2500 175.245 175.375 -0.130 1
1 833 . 11 1 1 A 77 77 LYS CA C 2500 54.388 54.581 -0.193 1
1 834 . 11 1 1 A 77 77 LYS CB C 2500 36.127 35.419 0.708 1
1 838 . 11 1 1 A 77 77 LYS N N 2500 126.922 127.237 -0.315 1
1 839 . 11 1 1 A 78 78 TYR H H 2501 8.408 8.710 -0.302 1
1 840 . 11 1 1 A 78 78 TYR HA H 2501 5.479 5.032 0.447 1
1 847 . 11 1 1 A 78 78 TYR C C 2501 174.792 175.481 -0.689 1
1 848 . 11 1 1 A 78 78 TYR CA C 2501 56.837 57.498 -0.661 1
1 849 . 11 1 1 A 78 78 TYR CB C 2501 44.008 42.095 1.913 1
1 852 . 11 1 1 A 78 78 TYR N N 2501 122.282 124.317 -2.035 1
1 853 . 11 1 1 A 79 79 GLY H H 2502 8.196 8.646 -0.450 1
1 854 . 11 1 1 A 79 79 GLY HA2 H 2502 4.040 3.747 0.293 1
1 855 . 11 1 1 A 79 79 GLY HA3 H 2502 3.465 3.931 -0.466 1
1 856 . 11 1 1 A 79 79 GLY C C 2502 173.932 173.488 0.444 1
1 857 . 11 1 1 A 79 79 GLY CA C 2502 45.741 45.868 -0.127 1
1 858 . 11 1 1 A 79 79 GLY N N 2502 113.451 114.258 -0.807 1
1 859 . 11 1 1 A 80 80 GLY H H 2503 7.589 7.850 -0.261 1
1 860 . 11 1 1 A 80 80 GLY HA2 H 2503 4.490 4.067 0.423 1
1 861 . 11 1 1 A 80 80 GLY HA3 H 2503 3.555 4.151 -0.596 1
1 862 . 11 1 1 A 80 80 GLY CA C 2503 43.540 44.589 -1.049 1
1 863 . 11 1 1 A 80 80 GLY N N 2503 107.293 107.398 -0.105 1
1 864 . 11 1 1 A 81 81 PRO HA H 2504 4.320 4.358 -0.038 1
1 871 . 11 1 1 A 81 81 PRO C C 2504 175.311 175.415 -0.104 1
1 872 . 11 1 1 A 81 81 PRO CA C 2504 62.722 63.490 -0.768 1
1 873 . 11 1 1 A 81 81 PRO CB C 2504 29.297 31.932 -2.635 1
1 876 . 11 1 1 A 82 82 TYR H H 2505 7.778 7.356 0.422 1
1 877 . 11 1 1 A 82 82 TYR HA H 2505 4.791 5.004 -0.213 1
1 884 . 11 1 1 A 82 82 TYR C C 2505 175.086 175.891 -0.805 1
1 885 . 11 1 1 A 82 82 TYR CA C 2505 56.111 56.818 -0.707 1
1 886 . 11 1 1 A 82 82 TYR CB C 2505 39.483 40.567 -1.084 1
1 889 . 11 1 1 A 82 82 TYR N N 2505 123.973 120.728 3.245 1
1 890 . 11 1 1 A 83 83 HIS H H 2506 8.625 9.109 -0.484 1
1 891 . 11 1 1 A 83 83 HIS HA H 2506 4.583 4.905 -0.322 1
1 896 . 11 1 1 A 83 83 HIS C C 2506 178.161 175.998 2.163 1
1 897 . 11 1 1 A 83 83 HIS CA C 2506 58.241 57.173 1.068 1
1 898 . 11 1 1 A 83 83 HIS CB C 2506 33.132 30.501 2.631 1
1 901 . 11 1 1 A 83 83 HIS N N 2506 124.092 121.242 2.850 1
1 902 . 11 1 1 A 84 84 ILE H H 2507 8.327 8.612 -0.285 1
1 903 . 11 1 1 A 84 84 ILE HA H 2507 4.553 4.307 0.246 1
1 913 . 11 1 1 A 84 84 ILE C C 2507 176.523 176.232 0.291 1
1 914 . 11 1 1 A 84 84 ILE CA C 2507 60.791 59.890 0.901 1
1 915 . 11 1 1 A 84 84 ILE CB C 2507 39.162 39.680 -0.518 1
1 919 . 11 1 1 A 84 84 ILE N N 2507 117.355 119.813 -2.458 1
1 920 . 11 1 1 A 85 85 GLY H H 2508 9.130 8.377 0.753 1
1 921 . 11 1 1 A 85 85 GLY HA2 H 2508 3.883 3.768 0.115 1
1 922 . 11 1 1 A 85 85 GLY HA3 H 2508 3.800 3.784 0.016 1
1 923 . 11 1 1 A 85 85 GLY C C 2508 174.438 175.457 -1.019 1
1 924 . 11 1 1 A 85 85 GLY CA C 2508 47.673 46.811 0.862 1
1 925 . 11 1 1 A 85 85 GLY N N 2508 111.346 109.674 1.672 1
1 926 . 11 1 1 A 86 86 GLY H H 2509 8.236 8.457 -0.221 1
1 927 . 11 1 1 A 86 86 GLY HA2 H 2509 3.893 3.860 0.033 1
1 928 . 11 1 1 A 86 86 GLY HA3 H 2509 3.161 3.898 -0.737 1
1 929 . 11 1 1 A 86 86 GLY C C 2509 171.837 173.631 -1.794 1
1 930 . 11 1 1 A 86 86 GLY CA C 2509 44.844 45.191 -0.347 1
1 931 . 11 1 1 A 86 86 GLY N N 2509 115.594 116.736 -1.142 1
1 932 . 11 1 1 A 87 87 SER H H 2510 7.385 7.975 -0.590 1
1 933 . 11 1 1 A 87 87 SER HA H 2510 4.217 4.180 0.037 1
1 936 . 11 1 1 A 87 87 SER CA C 2510 54.783 55.401 -0.618 1
1 937 . 11 1 1 A 87 87 SER CB C 2510 62.683 63.949 -1.266 1
1 938 . 11 1 1 A 87 87 SER N N 2510 112.859 116.627 -3.768 1
1 939 . 11 1 1 A 88 88 PRO HA H 2511 5.532 4.834 0.698 1
1 946 . 11 1 1 A 88 88 PRO C C 2511 175.870 175.192 0.678 1
1 947 . 11 1 1 A 88 88 PRO CA C 2511 62.379 62.226 0.153 1
1 948 . 11 1 1 A 88 88 PRO CB C 2511 33.639 32.244 1.395 1
1 951 . 11 1 1 A 89 89 PHE H H 2512 9.359 8.769 0.590 1
1 952 . 11 1 1 A 89 89 PHE HA H 2512 4.467 4.835 -0.368 1
1 960 . 11 1 1 A 89 89 PHE C C 2512 175.152 175.300 -0.148 1
1 961 . 11 1 1 A 89 89 PHE CA C 2512 57.401 56.857 0.544 1
1 962 . 11 1 1 A 89 89 PHE CB C 2512 40.843 40.966 -0.123 1
1 966 . 11 1 1 A 89 89 PHE N N 2512 124.789 118.880 5.909 1
1 967 . 11 1 1 A 90 90 LYS H H 2513 8.772 8.669 0.103 1
1 968 . 11 1 1 A 90 90 LYS HA H 2513 4.941 4.729 0.212 1
1 973 . 11 1 1 A 90 90 LYS C C 2513 174.183 175.545 -1.362 1
1 974 . 11 1 1 A 90 90 LYS CA C 2513 55.749 55.988 -0.239 1
1 975 . 11 1 1 A 90 90 LYS CB C 2513 32.817 32.651 0.166 1
1 978 . 11 1 1 A 90 90 LYS N N 2513 125.133 122.600 2.533 1
1 979 . 11 1 1 A 91 91 ALA H H 2514 9.158 9.246 -0.088 1
1 980 . 11 1 1 A 91 91 ALA HA H 2514 4.510 5.163 -0.653 1
1 984 . 11 1 1 A 91 91 ALA C C 2514 176.561 175.765 0.796 1
1 985 . 11 1 1 A 91 91 ALA CA C 2514 50.528 50.549 -0.021 1
1 986 . 11 1 1 A 91 91 ALA CB C 2514 20.653 20.688 -0.035 1
1 987 . 11 1 1 A 91 91 ALA N N 2514 131.989 127.339 4.650 1
1 988 . 11 1 1 A 92 92 LYS H H 2515 8.186 9.198 -1.012 1
1 989 . 11 1 1 A 92 92 LYS HA H 2515 4.926 4.827 0.099 1
1 998 . 11 1 1 A 92 92 LYS C C 2515 175.177 175.281 -0.104 1
1 999 . 11 1 1 A 92 92 LYS CA C 2515 55.725 55.751 -0.026 1
1 1000 . 11 1 1 A 92 92 LYS CB C 2515 33.765 33.323 0.442 1
1 1004 . 11 1 1 A 92 92 LYS N N 2515 124.887 123.462 1.425 1
1 1005 . 11 1 1 A 93 93 VAL H H 2516 9.362 9.385 -0.023 1
1 1006 . 11 1 1 A 93 93 VAL HA H 2516 5.161 5.164 -0.003 1
1 1014 . 11 1 1 A 93 93 VAL C C 2516 176.988 175.008 1.980 1
1 1015 . 11 1 1 A 93 93 VAL CA C 2516 60.523 61.168 -0.645 1
1 1016 . 11 1 1 A 93 93 VAL CB C 2516 33.291 34.330 -1.039 1
1 1019 . 11 1 1 A 93 93 VAL N N 2516 129.943 125.704 4.239 1
1 1020 . 11 1 1 A 94 94 THR H H 2517 8.614 8.473 0.141 1
1 1021 . 11 1 1 A 94 94 THR HA H 2517 4.902 4.917 -0.015 1
1 1026 . 11 1 1 A 94 94 THR C C 2517 172.759 173.198 -0.439 1
1 1027 . 11 1 1 A 94 94 THR CA C 2517 60.121 59.846 0.275 1
1 1028 . 11 1 1 A 94 94 THR CB C 2517 71.072 71.732 -0.660 1
1 1030 . 11 1 1 A 94 94 THR N N 2517 122.032 115.936 6.096 1
1 1031 . 11 1 1 A 95 95 GLY H H 2518 8.280 8.453 -0.173 1
1 1032 . 11 1 1 A 95 95 GLY HA2 H 2518 3.852 4.143 -0.291 1
1 1033 . 11 1 1 A 95 95 GLY HA3 H 2518 4.846 4.147 0.699 1
1 1034 . 11 1 1 A 95 95 GLY CA C 2518 43.955 44.485 -0.530 1
1 1035 . 11 1 1 A 95 95 GLY N N 2518 107.949 107.877 0.072 1
1 1036 . 11 1 1 A 96 96 PRO HA H 2519 4.449 4.637 -0.188 1
1 1043 . 11 1 1 A 96 96 PRO C C 2519 176.892 176.715 0.177 1
1 1044 . 11 1 1 A 96 96 PRO CA C 2519 62.062 62.785 -0.723 1
1 1045 . 11 1 1 A 96 96 PRO CB C 2519 32.286 32.116 0.170 1
1 1048 . 11 1 1 A 97 97 ARG H H 2520 8.651 8.421 0.230 1
1 1049 . 11 1 1 A 97 97 ARG HA H 2520 4.348 4.280 0.068 1
1 1056 . 11 1 1 A 97 97 ARG C C 2520 176.236 177.220 -0.984 1
1 1057 . 11 1 1 A 97 97 ARG CA C 2520 57.587 56.589 0.998 1
1 1058 . 11 1 1 A 97 97 ARG CB C 2520 30.472 30.964 -0.492 1
1 1061 . 11 1 1 A 97 97 ARG N N 2520 120.781 122.371 -1.590 1
1 1062 . 11 1 1 A 98 98 LEU H H 2521 8.545 8.919 -0.374 1
1 1063 . 11 1 1 A 98 98 LEU HA H 2521 4.577 4.133 0.444 1
1 1073 . 11 1 1 A 98 98 LEU C C 2521 175.880 177.831 -1.951 1
1 1074 . 11 1 1 A 98 98 LEU CA C 2521 55.068 57.068 -2.000 1
1 1075 . 11 1 1 A 98 98 LEU CB C 2521 43.082 42.163 0.919 1
1 1079 . 11 1 1 A 98 98 LEU N N 2521 128.715 127.161 1.554 1
1 4 . 12 1 1 A 2 2 ALA HA H -2 4.374 4.128 0.246 1
1 8 . 12 1 1 A 2 2 ALA C C -2 177.865 178.768 -0.903 1
1 9 . 12 1 1 A 2 2 ALA CA C -2 52.670 53.529 -0.859 1
1 10 . 12 1 1 A 2 2 ALA CB C -2 19.508 18.942 0.566 1
1 32 . 12 1 1 A 5 5 ASP H H 2428 8.300 8.518 -0.218 1
1 33 . 12 1 1 A 5 5 ASP HA H 2428 5.082 5.159 -0.077 1
1 36 . 12 1 1 A 5 5 ASP CA C 2428 51.517 50.817 0.700 1
1 37 . 12 1 1 A 5 5 ASP CB C 2428 42.244 42.806 -0.562 1
1 38 . 12 1 1 A 5 5 ASP N N 2428 122.879 123.641 -0.762 1
1 39 . 12 1 1 A 6 6 PRO HA H 2429 4.340 4.456 -0.116 1
1 46 . 12 1 1 A 6 6 PRO C C 2429 178.266 178.325 -0.059 1
1 47 . 12 1 1 A 6 6 PRO CA C 2429 64.494 64.844 -0.350 1
1 48 . 12 1 1 A 6 6 PRO CB C 2429 31.841 31.952 -0.111 1
1 51 . 12 1 1 A 7 7 GLY H H 2430 8.686 8.550 0.136 1
1 52 . 12 1 1 A 7 7 GLY HA2 H 2430 4.116 3.882 0.234 1
1 53 . 12 1 1 A 7 7 GLY HA3 H 2430 3.868 3.884 -0.016 1
1 54 . 12 1 1 A 7 7 GLY C C 2430 174.567 175.626 -1.059 1
1 55 . 12 1 1 A 7 7 GLY CA C 2430 46.038 46.531 -0.493 1
1 56 . 12 1 1 A 7 7 GLY N N 2430 107.655 106.212 1.443 1
1 57 . 12 1 1 A 8 8 LEU H H 2431 7.692 7.447 0.245 1
1 58 . 12 1 1 A 8 8 LEU HA H 2431 4.507 4.391 0.116 1
1 68 . 12 1 1 A 8 8 LEU C C 2431 176.876 177.483 -0.607 1
1 69 . 12 1 1 A 8 8 LEU CA C 2431 54.307 56.702 -2.395 1
1 70 . 12 1 1 A 8 8 LEU CB C 2431 42.879 42.936 -0.057 1
1 74 . 12 1 1 A 8 8 LEU N N 2431 120.022 120.147 -0.125 1
1 75 . 12 1 1 A 9 9 VAL H H 2432 7.378 7.448 -0.070 1
1 76 . 12 1 1 A 9 9 VAL HA H 2432 4.154 3.916 0.238 1
1 84 . 12 1 1 A 9 9 VAL C C 2432 174.703 175.675 -0.972 1
1 85 . 12 1 1 A 9 9 VAL CA C 2432 62.387 63.102 -0.715 1
1 86 . 12 1 1 A 9 9 VAL CB C 2432 32.519 31.515 1.004 1
1 89 . 12 1 1 A 9 9 VAL N N 2432 123.902 119.682 4.220 1
1 90 . 12 1 1 A 10 10 SER H H 2433 8.201 8.382 -0.181 1
1 91 . 12 1 1 A 10 10 SER HA H 2433 5.136 5.083 0.053 1
1 94 . 12 1 1 A 10 10 SER CA C 2433 56.554 57.351 -0.797 1
1 95 . 12 1 1 A 10 10 SER CB C 2433 66.763 66.182 0.581 1
1 96 . 12 1 1 A 10 10 SER N N 2433 121.921 123.432 -1.511 1
1 97 . 12 1 1 A 11 11 ALA H H 2434 8.670 8.539 0.131 1
1 98 . 12 1 1 A 11 11 ALA HA H 2434 5.632 5.195 0.437 1
1 102 . 12 1 1 A 11 11 ALA C C 2434 175.459 176.179 -0.720 1
1 103 . 12 1 1 A 11 11 ALA CA C 2434 50.575 50.995 -0.420 1
1 104 . 12 1 1 A 11 11 ALA CB C 2434 23.111 20.939 2.172 1
1 105 . 12 1 1 A 11 11 ALA N N 2434 124.828 126.294 -1.466 1
1 106 . 12 1 1 A 12 12 TYR H H 2435 8.609 9.011 -0.402 1
1 107 . 12 1 1 A 12 12 TYR HA H 2435 4.879 5.060 -0.181 1
1 114 . 12 1 1 A 12 12 TYR C C 2435 173.645 174.659 -1.014 1
1 115 . 12 1 1 A 12 12 TYR CA C 2435 56.268 56.894 -0.626 1
1 116 . 12 1 1 A 12 12 TYR CB C 2435 39.522 42.239 -2.717 1
1 119 . 12 1 1 A 12 12 TYR N N 2435 118.305 119.760 -1.455 1
1 120 . 12 1 1 A 13 13 GLY H H 2436 8.655 8.541 0.114 1
1 121 . 12 1 1 A 13 13 GLY HA2 H 2436 4.943 4.292 0.651 1
1 122 . 12 1 1 A 13 13 GLY HA3 H 2436 4.028 4.337 -0.309 1
1 123 . 12 1 1 A 13 13 GLY C C 2436 175.334 174.898 0.436 1
1 124 . 12 1 1 A 13 13 GLY CA C 2436 44.389 44.353 0.036 1
1 125 . 12 1 1 A 13 13 GLY N N 2436 110.710 110.489 0.221 1
1 126 . 12 1 1 A 14 14 ALA H H 2437 8.939 8.719 0.220 1
1 127 . 12 1 1 A 14 14 ALA HA H 2437 4.276 4.087 0.189 1
1 131 . 12 1 1 A 14 14 ALA C C 2437 180.524 179.162 1.362 1
1 132 . 12 1 1 A 14 14 ALA CA C 2437 55.551 55.076 0.475 1
1 133 . 12 1 1 A 14 14 ALA CB C 2437 18.411 18.404 0.007 1
1 134 . 12 1 1 A 14 14 ALA N N 2437 126.973 123.856 3.117 1
1 135 . 12 1 1 A 15 15 GLY H H 2438 8.933 8.611 0.322 1
1 136 . 12 1 1 A 15 15 GLY HA2 H 2438 4.531 4.012 0.519 1
1 137 . 12 1 1 A 15 15 GLY HA3 H 2438 3.576 4.237 -0.661 1
1 138 . 12 1 1 A 15 15 GLY C C 2438 174.323 175.618 -1.295 1
1 139 . 12 1 1 A 15 15 GLY CA C 2438 46.855 46.755 0.100 1
1 140 . 12 1 1 A 15 15 GLY N N 2438 104.803 105.568 -0.765 1
1 141 . 12 1 1 A 16 16 LEU H H 2439 7.529 7.515 0.014 1
1 142 . 12 1 1 A 16 16 LEU HA H 2439 3.768 3.800 -0.032 1
1 152 . 12 1 1 A 16 16 LEU C C 2439 176.388 178.783 -2.395 1
1 153 . 12 1 1 A 16 16 LEU CA C 2439 56.137 57.329 -1.192 1
1 154 . 12 1 1 A 16 16 LEU CB C 2439 41.621 41.035 0.586 1
1 158 . 12 1 1 A 16 16 LEU N N 2439 119.633 122.048 -2.415 1
1 159 . 12 1 1 A 17 17 GLU H H 2440 7.505 7.782 -0.277 1
1 160 . 12 1 1 A 17 17 GLU HA H 2440 4.663 4.335 0.328 1
1 165 . 12 1 1 A 17 17 GLU C C 2440 178.126 177.255 0.871 1
1 166 . 12 1 1 A 17 17 GLU CA C 2440 56.447 56.657 -0.210 1
1 167 . 12 1 1 A 17 17 GLU CB C 2440 31.485 30.511 0.974 1
1 169 . 12 1 1 A 17 17 GLU N N 2440 114.368 116.326 -1.958 1
1 170 . 12 1 1 A 18 18 GLY H H 2441 7.921 7.516 0.405 1
1 171 . 12 1 1 A 18 18 GLY HA2 H 2441 4.889 4.118 0.771 1
1 172 . 12 1 1 A 18 18 GLY HA3 H 2441 3.707 4.135 -0.428 1
1 173 . 12 1 1 A 18 18 GLY C C 2441 170.965 172.608 -1.643 1
1 174 . 12 1 1 A 18 18 GLY CA C 2441 45.549 44.377 1.172 1
1 175 . 12 1 1 A 18 18 GLY N N 2441 109.165 106.732 2.433 1
1 176 . 12 1 1 A 19 19 GLY H H 2442 7.540 7.935 -0.395 1
1 177 . 12 1 1 A 19 19 GLY HA2 H 2442 4.086 4.185 -0.099 1
1 178 . 12 1 1 A 19 19 GLY HA3 H 2442 4.086 4.208 -0.122 1
1 179 . 12 1 1 A 19 19 GLY C C 2442 171.051 172.277 -1.226 1
1 180 . 12 1 1 A 19 19 GLY CA C 2442 44.937 44.525 0.412 1
1 181 . 12 1 1 A 19 19 GLY N N 2442 105.460 107.932 -2.472 1
1 182 . 12 1 1 A 20 20 VAL H H 2443 8.899 8.149 0.750 1
1 183 . 12 1 1 A 20 20 VAL HA H 2443 5.062 4.608 0.454 1
1 191 . 12 1 1 A 20 20 VAL C C 2443 176.623 175.761 0.862 1
1 192 . 12 1 1 A 20 20 VAL CA C 2443 60.197 62.488 -2.291 1
1 193 . 12 1 1 A 20 20 VAL CB C 2443 35.107 32.165 2.942 1
1 196 . 12 1 1 A 20 20 VAL N N 2443 122.753 121.661 1.092 1
1 197 . 12 1 1 A 21 21 THR H H 2444 8.630 8.644 -0.014 1
1 198 . 12 1 1 A 21 21 THR HA H 2444 3.773 4.323 -0.550 1
1 203 . 12 1 1 A 21 21 THR C C 2444 175.646 174.981 0.665 1
1 204 . 12 1 1 A 21 21 THR CA C 2444 62.732 62.056 0.676 1
1 205 . 12 1 1 A 21 21 THR CB C 2444 68.925 69.218 -0.293 1
1 207 . 12 1 1 A 21 21 THR N N 2444 118.179 119.327 -1.148 1
1 208 . 12 1 1 A 22 22 GLY H H 2445 8.736 8.859 -0.123 1
1 209 . 12 1 1 A 22 22 GLY HA2 H 2445 3.412 3.977 -0.565 1
1 210 . 12 1 1 A 22 22 GLY HA3 H 2445 4.061 3.980 0.081 1
1 211 . 12 1 1 A 22 22 GLY C C 2445 172.973 173.504 -0.531 1
1 212 . 12 1 1 A 22 22 GLY CA C 2445 45.577 45.268 0.309 1
1 213 . 12 1 1 A 22 22 GLY N N 2445 107.888 113.517 -5.629 1
1 214 . 12 1 1 A 23 23 ASN H H 2446 7.877 7.594 0.283 1
1 215 . 12 1 1 A 23 23 ASN HA H 2446 5.253 5.093 0.160 1
1 220 . 12 1 1 A 23 23 ASN CA C 2446 49.740 49.843 -0.103 1
1 221 . 12 1 1 A 23 23 ASN CB C 2446 40.198 39.188 1.010 1
1 222 . 12 1 1 A 23 23 ASN N N 2446 120.684 119.749 0.935 1
1 224 . 12 1 1 A 24 24 PRO HA H 2447 4.525 4.620 -0.095 1
1 231 . 12 1 1 A 24 24 PRO CA C 2447 62.766 62.378 0.388 1
1 232 . 12 1 1 A 24 24 PRO CB C 2447 31.732 32.650 -0.918 1
1 235 . 12 1 1 A 25 25 ALA H H 2448 9.178 8.323 0.855 1
1 236 . 12 1 1 A 25 25 ALA HA H 2448 4.614 4.885 -0.271 1
1 240 . 12 1 1 A 25 25 ALA C C 2448 175.503 175.279 0.224 1
1 241 . 12 1 1 A 25 25 ALA CA C 2448 50.526 50.226 0.300 1
1 242 . 12 1 1 A 25 25 ALA CB C 2448 20.458 21.505 -1.047 1
1 243 . 12 1 1 A 25 25 ALA N N 2448 132.079 122.972 9.107 1
1 244 . 12 1 1 A 26 26 GLU H H 2449 8.813 8.992 -0.179 1
1 245 . 12 1 1 A 26 26 GLU HA H 2449 5.830 5.398 0.432 1
1 250 . 12 1 1 A 26 26 GLU C C 2449 176.272 174.865 1.407 1
1 251 . 12 1 1 A 26 26 GLU CA C 2449 54.376 54.910 -0.534 1
1 252 . 12 1 1 A 26 26 GLU CB C 2449 35.463 33.733 1.730 1
1 254 . 12 1 1 A 26 26 GLU N N 2449 120.079 122.594 -2.515 1
1 255 . 12 1 1 A 27 27 PHE H H 2450 8.782 8.780 0.002 1
1 256 . 12 1 1 A 27 27 PHE HA H 2450 5.021 5.168 -0.147 1
1 264 . 12 1 1 A 27 27 PHE C C 2450 171.205 171.971 -0.766 1
1 265 . 12 1 1 A 27 27 PHE CA C 2450 56.852 56.336 0.516 1
1 266 . 12 1 1 A 27 27 PHE CB C 2450 41.080 41.164 -0.084 1
1 270 . 12 1 1 A 27 27 PHE N N 2450 118.670 120.653 -1.983 1
1 271 . 12 1 1 A 28 28 VAL H H 2451 8.961 9.294 -0.333 1
1 272 . 12 1 1 A 28 28 VAL HA H 2451 4.761 5.065 -0.304 1
1 280 . 12 1 1 A 28 28 VAL C C 2451 174.673 173.780 0.893 1
1 281 . 12 1 1 A 28 28 VAL CA C 2451 60.619 59.486 1.133 1
1 282 . 12 1 1 A 28 28 VAL CB C 2451 35.484 34.786 0.698 1
1 285 . 12 1 1 A 28 28 VAL N N 2451 121.552 120.096 1.456 1
1 286 . 12 1 1 A 29 29 VAL H H 2452 9.294 9.357 -0.063 1
1 287 . 12 1 1 A 29 29 VAL HA H 2452 4.363 4.625 -0.262 1
1 295 . 12 1 1 A 29 29 VAL C C 2452 174.218 174.789 -0.571 1
1 296 . 12 1 1 A 29 29 VAL CA C 2452 61.526 61.633 -0.107 1
1 297 . 12 1 1 A 29 29 VAL CB C 2452 32.666 31.679 0.987 1
1 300 . 12 1 1 A 29 29 VAL N N 2452 125.585 128.578 -2.993 1
1 301 . 12 1 1 A 30 30 ASN H H 2453 9.465 9.064 0.401 1
1 302 . 12 1 1 A 30 30 ASN HA H 2453 5.096 5.141 -0.045 1
1 307 . 12 1 1 A 30 30 ASN C C 2453 176.216 176.492 -0.276 1
1 308 . 12 1 1 A 30 30 ASN CA C 2453 52.011 52.759 -0.748 1
1 309 . 12 1 1 A 30 30 ASN CB C 2453 39.057 38.576 0.481 1
1 310 . 12 1 1 A 30 30 ASN N N 2453 127.724 126.908 0.816 1
1 312 . 12 1 1 A 31 31 THR H H 2454 8.915 8.559 0.356 1
1 313 . 12 1 1 A 31 31 THR HA H 2454 4.342 4.449 -0.107 1
1 318 . 12 1 1 A 31 31 THR C C 2454 176.816 176.443 0.373 1
1 319 . 12 1 1 A 31 31 THR CA C 2454 61.117 62.442 -1.325 1
1 320 . 12 1 1 A 31 31 THR CB C 2454 68.209 69.530 -1.321 1
1 322 . 12 1 1 A 31 31 THR N N 2454 117.783 117.100 0.683 1
1 323 . 12 1 1 A 32 32 SER H H 2455 8.454 7.927 0.527 1
1 324 . 12 1 1 A 32 32 SER HA H 2455 4.155 4.121 0.034 1
1 327 . 12 1 1 A 32 32 SER C C 2455 175.458 175.987 -0.529 1
1 328 . 12 1 1 A 32 32 SER CA C 2455 62.148 62.434 -0.286 1
1 329 . 12 1 1 A 32 32 SER CB C 2455 63.476 62.958 0.518 1
1 330 . 12 1 1 A 32 32 SER N N 2455 121.781 119.089 2.692 1
1 331 . 12 1 1 A 33 33 ASN H H 2456 8.845 8.102 0.743 1
1 332 . 12 1 1 A 33 33 ASN HA H 2456 5.064 4.595 0.469 1
1 337 . 12 1 1 A 33 33 ASN C C 2456 174.674 176.205 -1.531 1
1 338 . 12 1 1 A 33 33 ASN CA C 2456 53.067 54.935 -1.868 1
1 339 . 12 1 1 A 33 33 ASN CB C 2456 39.632 38.890 0.742 1
1 340 . 12 1 1 A 33 33 ASN N N 2456 120.176 118.512 1.664 1
1 342 . 12 1 1 A 34 34 ALA H H 2457 7.714 7.823 -0.109 1
1 343 . 12 1 1 A 34 34 ALA HA H 2457 4.482 4.428 0.054 1
1 347 . 12 1 1 A 34 34 ALA C C 2457 177.582 177.619 -0.037 1
1 348 . 12 1 1 A 34 34 ALA CA C 2457 52.521 52.652 -0.131 1
1 349 . 12 1 1 A 34 34 ALA CB C 2457 22.252 20.653 1.599 1
1 350 . 12 1 1 A 34 34 ALA N N 2457 123.065 119.987 3.078 1
1 351 . 12 1 1 A 35 35 GLY H H 2458 8.195 7.885 0.310 1
1 352 . 12 1 1 A 35 35 GLY HA2 H 2458 4.246 4.134 0.112 1
1 353 . 12 1 1 A 35 35 GLY HA3 H 2458 3.902 4.153 -0.251 1
1 354 . 12 1 1 A 35 35 GLY C C 2458 173.360 172.733 0.627 1
1 355 . 12 1 1 A 35 35 GLY CA C 2458 44.486 45.081 -0.595 1
1 356 . 12 1 1 A 35 35 GLY N N 2458 108.472 104.743 3.729 1
1 357 . 12 1 1 A 36 36 ALA H H 2459 8.430 8.431 -0.001 1
1 358 . 12 1 1 A 36 36 ALA HA H 2459 4.472 5.273 -0.801 1
1 362 . 12 1 1 A 36 36 ALA C C 2459 176.968 176.146 0.822 1
1 363 . 12 1 1 A 36 36 ALA CA C 2459 52.695 51.510 1.185 1
1 364 . 12 1 1 A 36 36 ALA CB C 2459 19.360 23.300 -3.940 1
1 365 . 12 1 1 A 36 36 ALA N N 2459 126.012 124.957 1.055 1
1 366 . 12 1 1 A 37 37 GLY H H 2460 7.781 8.603 -0.822 1
1 367 . 12 1 1 A 37 37 GLY HA2 H 2460 3.856 3.908 -0.052 1
1 368 . 12 1 1 A 37 37 GLY HA3 H 2460 3.164 4.082 -0.918 1
1 369 . 12 1 1 A 37 37 GLY C C 2460 170.730 171.692 -0.962 1
1 370 . 12 1 1 A 37 37 GLY CA C 2460 44.747 45.581 -0.834 1
1 371 . 12 1 1 A 37 37 GLY N N 2460 109.493 106.337 3.156 1
1 372 . 12 1 1 A 38 38 ALA H H 2461 8.055 8.039 0.016 1
1 373 . 12 1 1 A 38 38 ALA HA H 2461 4.389 4.704 -0.315 1
1 377 . 12 1 1 A 38 38 ALA C C 2461 176.609 176.404 0.205 1
1 378 . 12 1 1 A 38 38 ALA CA C 2461 51.419 51.590 -0.171 1
1 379 . 12 1 1 A 38 38 ALA CB C 2461 19.665 19.711 -0.046 1
1 380 . 12 1 1 A 38 38 ALA N N 2461 121.997 122.936 -0.939 1
1 381 . 12 1 1 A 39 39 LEU H H 2462 8.597 8.464 0.133 1
1 382 . 12 1 1 A 39 39 LEU HA H 2462 5.022 5.053 -0.031 1
1 392 . 12 1 1 A 39 39 LEU C C 2462 175.883 175.382 0.501 1
1 393 . 12 1 1 A 39 39 LEU CA C 2462 53.907 53.390 0.517 1
1 394 . 12 1 1 A 39 39 LEU CB C 2462 44.576 44.604 -0.028 1
1 398 . 12 1 1 A 39 39 LEU N N 2462 126.664 124.311 2.353 1
1 399 . 12 1 1 A 40 40 SER H H 2463 8.898 9.068 -0.170 1
1 400 . 12 1 1 A 40 40 SER HA H 2463 4.732 4.718 0.014 1
1 403 . 12 1 1 A 40 40 SER C C 2463 172.984 172.726 0.258 1
1 404 . 12 1 1 A 40 40 SER CA C 2463 56.730 56.988 -0.258 1
1 405 . 12 1 1 A 40 40 SER CB C 2463 64.648 64.151 0.497 1
1 406 . 12 1 1 A 40 40 SER N N 2463 122.932 121.819 1.113 1
1 407 . 12 1 1 A 41 41 VAL H H 2464 8.538 7.548 0.990 1
1 408 . 12 1 1 A 41 41 VAL HA H 2464 5.131 4.131 1.000 1
1 416 . 12 1 1 A 41 41 VAL C C 2464 174.812 174.589 0.223 1
1 417 . 12 1 1 A 41 41 VAL CA C 2464 60.784 62.830 -2.046 1
1 418 . 12 1 1 A 41 41 VAL CB C 2464 34.262 32.285 1.977 1
1 420 . 12 1 1 A 41 41 VAL N N 2464 129.161 123.877 5.284 1
1 421 . 12 1 1 A 42 42 THR H H 2465 8.807 8.939 -0.132 1
1 422 . 12 1 1 A 42 42 THR HA H 2465 4.573 5.128 -0.555 1
1 427 . 12 1 1 A 42 42 THR CA C 2465 60.408 61.408 -1.000 1
1 428 . 12 1 1 A 42 42 THR CB C 2465 71.764 72.216 -0.452 1
1 430 . 12 1 1 A 42 42 THR N N 2465 120.898 123.792 -2.894 1
1 431 . 12 1 1 A 43 43 ILE H H 2466 8.648 8.837 -0.189 1
1 432 . 12 1 1 A 43 43 ILE HA H 2466 4.854 4.871 -0.017 1
1 442 . 12 1 1 A 43 43 ILE C C 2466 174.073 174.770 -0.697 1
1 443 . 12 1 1 A 43 43 ILE CA C 2466 61.184 60.252 0.932 1
1 444 . 12 1 1 A 43 43 ILE CB C 2466 39.516 40.540 -1.024 1
1 448 . 12 1 1 A 43 43 ILE N N 2466 124.810 125.666 -0.856 1
1 449 . 12 1 1 A 44 44 ASP H H 2467 8.821 8.857 -0.036 1
1 450 . 12 1 1 A 44 44 ASP HA H 2467 5.217 5.361 -0.144 1
1 453 . 12 1 1 A 44 44 ASP C C 2467 175.002 175.809 -0.807 1
1 454 . 12 1 1 A 44 44 ASP CA C 2467 52.998 52.750 0.248 1
1 455 . 12 1 1 A 44 44 ASP CB C 2467 44.728 43.477 1.251 1
1 456 . 12 1 1 A 44 44 ASP N N 2467 129.093 127.020 2.073 1
1 457 . 12 1 1 A 45 45 GLY H H 2468 8.535 8.241 0.294 1
1 458 . 12 1 1 A 45 45 GLY HA2 H 2468 3.954 3.558 0.396 1
1 459 . 12 1 1 A 45 45 GLY HA3 H 2468 3.561 3.949 -0.388 1
1 460 . 12 1 1 A 45 45 GLY CA C 2468 45.659 44.758 0.901 1
1 461 . 12 1 1 A 45 45 GLY N N 2468 112.751 108.138 4.613 1
1 462 . 12 1 1 A 46 46 PRO HA H 2469 4.318 4.375 -0.057 1
1 469 . 12 1 1 A 46 46 PRO C C 2469 176.086 176.144 -0.058 1
1 470 . 12 1 1 A 46 46 PRO CA C 2469 64.198 63.820 0.378 1
1 471 . 12 1 1 A 46 46 PRO CB C 2469 32.348 31.906 0.442 1
1 474 . 12 1 1 A 47 47 SER H H 2470 7.106 7.570 -0.464 1
1 475 . 12 1 1 A 47 47 SER HA H 2470 4.632 4.881 -0.249 1
1 478 . 12 1 1 A 47 47 SER C C 2470 172.969 173.768 -0.799 1
1 479 . 12 1 1 A 47 47 SER CA C 2470 57.106 57.351 -0.245 1
1 480 . 12 1 1 A 47 47 SER CB C 2470 66.262 67.376 -1.114 1
1 481 . 12 1 1 A 47 47 SER N N 2470 110.556 114.405 -3.849 1
1 482 . 12 1 1 A 48 48 LYS H H 2471 8.534 8.285 0.249 1
1 483 . 12 1 1 A 48 48 LYS HA H 2471 4.486 4.312 0.174 1
1 492 . 12 1 1 A 48 48 LYS C C 2471 177.231 176.467 0.764 1
1 493 . 12 1 1 A 48 48 LYS CA C 2471 56.620 56.053 0.567 1
1 494 . 12 1 1 A 48 48 LYS CB C 2471 32.379 33.151 -0.772 1
1 498 . 12 1 1 A 48 48 LYS N N 2471 124.055 122.645 1.410 1
1 499 . 12 1 1 A 49 49 VAL H H 2472 8.497 8.678 -0.181 1
1 500 . 12 1 1 A 49 49 VAL HA H 2472 4.552 4.882 -0.330 1
1 508 . 12 1 1 A 49 49 VAL C C 2472 175.292 174.673 0.619 1
1 509 . 12 1 1 A 49 49 VAL CA C 2472 60.142 59.053 1.089 1
1 510 . 12 1 1 A 49 49 VAL CB C 2472 33.464 35.599 -2.135 1
1 513 . 12 1 1 A 49 49 VAL N N 2472 121.233 112.950 8.283 1
1 514 . 12 1 1 A 50 50 LYS H H 2473 8.190 8.574 -0.384 1
1 515 . 12 1 1 A 50 50 LYS HA H 2473 4.522 4.443 0.079 1
1 518 . 12 1 1 A 50 50 LYS CA C 2473 55.952 55.981 -0.029 1
1 519 . 12 1 1 A 50 50 LYS CB C 2473 32.896 31.211 1.685 1
1 520 . 12 1 1 A 50 50 LYS N N 2473 126.082 122.327 3.755 1
1 521 . 12 1 1 A 51 51 MET H H 2474 8.818 8.083 0.735 1
1 522 . 12 1 1 A 51 51 MET HA H 2474 5.324 4.905 0.419 1
1 530 . 12 1 1 A 51 51 MET C C 2474 173.933 174.776 -0.843 1
1 531 . 12 1 1 A 51 51 MET CA C 2474 54.848 55.787 -0.939 1
1 532 . 12 1 1 A 51 51 MET CB C 2474 37.043 33.395 3.648 1
1 535 . 12 1 1 A 51 51 MET N N 2474 126.911 121.739 5.172 1
1 536 . 12 1 1 A 52 52 ASP H H 2475 9.095 9.024 0.071 1
1 537 . 12 1 1 A 52 52 ASP HA H 2475 4.947 5.492 -0.545 1
1 540 . 12 1 1 A 52 52 ASP C C 2475 173.923 174.049 -0.126 1
1 541 . 12 1 1 A 52 52 ASP CA C 2475 53.487 52.693 0.794 1
1 542 . 12 1 1 A 52 52 ASP CB C 2475 44.765 44.591 0.174 1
1 543 . 12 1 1 A 52 52 ASP N N 2475 125.526 125.886 -0.360 1
1 544 . 12 1 1 A 53 53 CYS H H 2476 8.606 9.013 -0.407 1
1 545 . 12 1 1 A 53 53 CYS HA H 2476 5.145 5.487 -0.342 1
1 548 . 12 1 1 A 53 53 CYS C C 2476 173.330 172.884 0.446 1
1 549 . 12 1 1 A 53 53 CYS CA C 2476 57.452 57.628 -0.176 1
1 550 . 12 1 1 A 53 53 CYS CB C 2476 28.108 30.914 -2.806 1
1 551 . 12 1 1 A 53 53 CYS N N 2476 124.317 122.653 1.664 1
1 552 . 12 1 1 A 54 54 GLN H H 2477 8.978 8.724 0.254 1
1 553 . 12 1 1 A 54 54 GLN HA H 2477 4.884 4.714 0.170 1
1 560 . 12 1 1 A 54 54 GLN C C 2477 174.854 174.531 0.323 1
1 561 . 12 1 1 A 54 54 GLN CA C 2477 53.891 55.014 -1.123 1
1 562 . 12 1 1 A 54 54 GLN CB C 2477 32.837 32.826 0.011 1
1 564 . 12 1 1 A 54 54 GLN N N 2477 127.074 124.730 2.344 1
1 566 . 12 1 1 A 55 55 GLU H H 2478 9.065 8.587 0.478 1
1 567 . 12 1 1 A 55 55 GLU HA H 2478 4.280 4.309 -0.029 1
1 572 . 12 1 1 A 55 55 GLU C C 2478 175.383 176.209 -0.826 1
1 573 . 12 1 1 A 55 55 GLU CA C 2478 57.516 56.562 0.954 1
1 574 . 12 1 1 A 55 55 GLU CB C 2478 30.346 29.742 0.604 1
1 576 . 12 1 1 A 55 55 GLU N N 2478 125.186 123.519 1.667 1
1 577 . 12 1 1 A 56 56 CYS H H 2479 8.407 8.276 0.131 1
1 578 . 12 1 1 A 56 56 CYS HA H 2479 5.056 4.885 0.171 1
1 581 . 12 1 1 A 56 56 CYS CA C 2479 55.858 56.753 -0.895 1
1 582 . 12 1 1 A 56 56 CYS CB C 2479 28.676 30.664 -1.988 1
1 583 . 12 1 1 A 56 56 CYS N N 2479 121.499 120.630 0.869 1
1 584 . 12 1 1 A 57 57 PRO HA H 2480 4.159 4.254 -0.095 1
1 591 . 12 1 1 A 57 57 PRO C C 2480 177.964 177.721 0.243 1
1 592 . 12 1 1 A 57 57 PRO CA C 2480 66.877 64.861 2.016 1
1 593 . 12 1 1 A 57 57 PRO CB C 2480 31.709 31.867 -0.158 1
1 596 . 12 1 1 A 58 58 GLU H H 2481 8.900 8.053 0.847 1
1 597 . 12 1 1 A 58 58 GLU HA H 2481 4.201 4.333 -0.132 1
1 602 . 12 1 1 A 58 58 GLU C C 2481 175.129 176.515 -1.386 1
1 603 . 12 1 1 A 58 58 GLU CA C 2481 57.883 56.605 1.278 1
1 604 . 12 1 1 A 58 58 GLU CB C 2481 29.991 30.236 -0.245 1
1 606 . 12 1 1 A 58 58 GLU N N 2481 115.316 117.821 -2.505 1
1 607 . 12 1 1 A 59 59 GLY H H 2482 7.527 7.738 -0.211 1
1 608 . 12 1 1 A 59 59 GLY HA2 H 2482 4.935 3.924 1.011 1
1 609 . 12 1 1 A 59 59 GLY HA3 H 2482 3.381 4.033 -0.652 1
1 610 . 12 1 1 A 59 59 GLY CA C 2482 47.809 43.859 3.950 1
1 611 . 12 1 1 A 59 59 GLY N N 2482 110.079 107.700 2.379 1
1 612 . 12 1 1 A 60 60 TYR H H 2483 8.990 7.997 0.993 1
1 613 . 12 1 1 A 60 60 TYR HA H 2483 5.157 4.687 0.470 1
1 618 . 12 1 1 A 60 60 TYR C C 2483 175.096 175.074 0.022 1
1 619 . 12 1 1 A 60 60 TYR CA C 2483 57.375 59.089 -1.714 1
1 620 . 12 1 1 A 60 60 TYR CB C 2483 43.153 38.505 4.648 1
1 622 . 12 1 1 A 60 60 TYR N N 2483 125.900 121.424 4.476 1
1 623 . 12 1 1 A 61 61 ARG H H 2484 9.557 8.881 0.676 1
1 624 . 12 1 1 A 61 61 ARG HA H 2484 4.858 4.914 -0.056 1
1 631 . 12 1 1 A 61 61 ARG CA C 2484 55.016 55.076 -0.060 1
1 632 . 12 1 1 A 61 61 ARG CB C 2484 32.128 31.953 0.175 1
1 635 . 12 1 1 A 61 61 ARG N N 2484 124.847 126.326 -1.479 1
1 636 . 12 1 1 A 62 62 VAL H H 2485 9.046 8.923 0.123 1
1 637 . 12 1 1 A 62 62 VAL HA H 2485 4.675 5.069 -0.394 1
1 645 . 12 1 1 A 62 62 VAL C C 2485 173.837 174.645 -0.808 1
1 646 . 12 1 1 A 62 62 VAL CA C 2485 60.752 59.277 1.475 1
1 647 . 12 1 1 A 62 62 VAL CB C 2485 32.459 35.565 -3.106 1
1 650 . 12 1 1 A 62 62 VAL N N 2485 132.205 119.609 12.596 1
1 651 . 12 1 1 A 63 63 THR H H 2486 8.474 8.350 0.124 1
1 652 . 12 1 1 A 63 63 THR HA H 2486 5.392 5.454 -0.062 1
1 657 . 12 1 1 A 63 63 THR C C 2486 173.675 173.442 0.233 1
1 658 . 12 1 1 A 63 63 THR CA C 2486 60.008 61.202 -1.194 1
1 659 . 12 1 1 A 63 63 THR CB C 2486 71.035 71.765 -0.730 1
1 661 . 12 1 1 A 63 63 THR N N 2486 121.216 117.027 4.189 1
1 662 . 12 1 1 A 64 64 TYR H H 2487 9.409 9.004 0.405 1
1 663 . 12 1 1 A 64 64 TYR HA H 2487 5.617 5.572 0.045 1
1 670 . 12 1 1 A 64 64 TYR C C 2487 172.847 172.927 -0.080 1
1 671 . 12 1 1 A 64 64 TYR CA C 2487 55.557 55.726 -0.169 1
1 672 . 12 1 1 A 64 64 TYR CB C 2487 41.968 42.270 -0.302 1
1 675 . 12 1 1 A 64 64 TYR N N 2487 124.061 122.166 1.895 1
1 676 . 12 1 1 A 65 65 THR H H 2488 8.145 8.936 -0.791 1
1 677 . 12 1 1 A 65 65 THR HA H 2488 4.959 4.591 0.368 1
1 682 . 12 1 1 A 65 65 THR CA C 2488 58.532 58.963 -0.431 1
1 683 . 12 1 1 A 65 65 THR CB C 2488 70.141 70.496 -0.355 1
1 685 . 12 1 1 A 65 65 THR N N 2488 117.924 116.964 0.960 1
1 686 . 12 1 1 A 66 66 PRO HA H 2489 4.602 4.726 -0.124 1
1 693 . 12 1 1 A 66 66 PRO C C 2489 176.647 176.528 0.119 1
1 694 . 12 1 1 A 66 66 PRO CA C 2489 61.442 62.198 -0.756 1
1 695 . 12 1 1 A 66 66 PRO CB C 2489 32.715 32.077 0.638 1
1 698 . 12 1 1 A 67 67 MET H H 2490 8.832 8.508 0.324 1
1 699 . 12 1 1 A 67 67 MET HA H 2490 4.880 4.553 0.327 1
1 707 . 12 1 1 A 67 67 MET C C 2490 174.121 175.440 -1.319 1
1 708 . 12 1 1 A 67 67 MET CA C 2490 53.848 55.227 -1.379 1
1 709 . 12 1 1 A 67 67 MET CB C 2490 33.727 32.926 0.801 1
1 712 . 12 1 1 A 67 67 MET N N 2490 119.212 117.231 1.981 1
1 713 . 12 1 1 A 68 68 ALA H H 2491 7.086 7.271 -0.185 1
1 714 . 12 1 1 A 68 68 ALA HA H 2491 4.851 4.854 -0.003 1
1 718 . 12 1 1 A 68 68 ALA CA C 2491 49.222 50.048 -0.826 1
1 719 . 12 1 1 A 68 68 ALA CB C 2491 20.600 22.497 -1.897 1
1 720 . 12 1 1 A 68 68 ALA N N 2491 120.363 120.211 0.152 1
1 721 . 12 1 1 A 69 69 PRO HA H 2492 4.263 4.796 -0.533 1
1 728 . 12 1 1 A 69 69 PRO C C 2492 174.370 176.482 -2.112 1
1 729 . 12 1 1 A 69 69 PRO CA C 2492 62.555 62.914 -0.359 1
1 730 . 12 1 1 A 69 69 PRO CB C 2492 32.752 32.971 -0.219 1
1 733 . 12 1 1 A 70 70 GLY H H 2493 8.858 8.350 0.508 1
1 734 . 12 1 1 A 70 70 GLY HA2 H 2493 4.544 4.134 0.410 1
1 735 . 12 1 1 A 70 70 GLY HA3 H 2493 3.849 4.161 -0.312 1
1 736 . 12 1 1 A 70 70 GLY C C 2493 172.182 172.361 -0.179 1
1 737 . 12 1 1 A 70 70 GLY CA C 2493 44.356 44.517 -0.161 1
1 738 . 12 1 1 A 70 70 GLY N N 2493 106.539 108.046 -1.507 1
1 739 . 12 1 1 A 71 71 SER H H 2494 8.490 8.252 0.238 1
1 740 . 12 1 1 A 71 71 SER HA H 2494 5.280 5.312 -0.032 1
1 743 . 12 1 1 A 71 71 SER C C 2494 173.512 173.347 0.165 1
1 744 . 12 1 1 A 71 71 SER CA C 2494 57.674 57.946 -0.272 1
1 745 . 12 1 1 A 71 71 SER CB C 2494 63.799 64.837 -1.038 1
1 746 . 12 1 1 A 71 71 SER N N 2494 117.964 117.405 0.559 1
1 747 . 12 1 1 A 72 72 TYR H H 2495 9.320 9.675 -0.355 1
1 748 . 12 1 1 A 72 72 TYR HA H 2495 4.960 5.407 -0.447 1
1 755 . 12 1 1 A 72 72 TYR C C 2495 173.979 174.855 -0.876 1
1 756 . 12 1 1 A 72 72 TYR CA C 2495 56.384 56.754 -0.370 1
1 757 . 12 1 1 A 72 72 TYR CB C 2495 40.247 40.271 -0.024 1
1 760 . 12 1 1 A 72 72 TYR N N 2495 126.442 125.728 0.714 1
1 761 . 12 1 1 A 73 73 LEU H H 2496 9.019 8.886 0.133 1
1 762 . 12 1 1 A 73 73 LEU HA H 2496 5.209 4.929 0.280 1
1 772 . 12 1 1 A 73 73 LEU C C 2496 177.015 174.783 2.232 1
1 773 . 12 1 1 A 73 73 LEU CA C 2496 53.393 54.123 -0.730 1
1 774 . 12 1 1 A 73 73 LEU CB C 2496 43.918 43.500 0.418 1
1 778 . 12 1 1 A 73 73 LEU N N 2496 125.439 126.083 -0.644 1
1 779 . 12 1 1 A 74 74 ILE H H 2497 9.921 9.624 0.297 1
1 780 . 12 1 1 A 74 74 ILE HA H 2497 5.128 4.628 0.500 1
1 790 . 12 1 1 A 74 74 ILE C C 2497 175.730 174.343 1.387 1
1 791 . 12 1 1 A 74 74 ILE CA C 2497 60.930 60.701 0.229 1
1 792 . 12 1 1 A 74 74 ILE CB C 2497 39.488 37.637 1.851 1
1 796 . 12 1 1 A 74 74 ILE N N 2497 132.185 129.758 2.427 1
1 797 . 12 1 1 A 75 75 SER H H 2498 9.284 9.275 0.009 1
1 798 . 12 1 1 A 75 75 SER HA H 2498 5.111 4.896 0.215 1
1 801 . 12 1 1 A 75 75 SER C C 2498 173.449 172.764 0.685 1
1 802 . 12 1 1 A 75 75 SER CA C 2498 58.260 56.961 1.299 1
1 803 . 12 1 1 A 75 75 SER CB C 2498 63.956 63.417 0.539 1
1 804 . 12 1 1 A 75 75 SER N N 2498 125.384 123.134 2.250 1
1 805 . 12 1 1 A 76 76 ILE H H 2499 9.861 9.005 0.856 1
1 806 . 12 1 1 A 76 76 ILE HA H 2499 4.814 4.642 0.172 1
1 816 . 12 1 1 A 76 76 ILE CA C 2499 61.034 60.940 0.094 1
1 817 . 12 1 1 A 76 76 ILE CB C 2499 40.387 37.007 3.380 1
1 821 . 12 1 1 A 76 76 ILE N N 2499 129.414 128.052 1.362 1
1 822 . 12 1 1 A 77 77 LYS H H 2500 8.827 8.417 0.410 1
1 823 . 12 1 1 A 77 77 LYS HA H 2500 5.254 5.001 0.253 1
1 832 . 12 1 1 A 77 77 LYS C C 2500 175.245 175.457 -0.212 1
1 833 . 12 1 1 A 77 77 LYS CA C 2500 54.388 55.685 -1.297 1
1 834 . 12 1 1 A 77 77 LYS CB C 2500 36.127 33.981 2.146 1
1 838 . 12 1 1 A 77 77 LYS N N 2500 126.922 127.302 -0.380 1
1 839 . 12 1 1 A 78 78 TYR H H 2501 8.408 9.108 -0.700 1
1 840 . 12 1 1 A 78 78 TYR HA H 2501 5.479 5.011 0.468 1
1 847 . 12 1 1 A 78 78 TYR C C 2501 174.792 175.566 -0.774 1
1 848 . 12 1 1 A 78 78 TYR CA C 2501 56.837 57.280 -0.443 1
1 849 . 12 1 1 A 78 78 TYR CB C 2501 44.008 42.280 1.728 1
1 852 . 12 1 1 A 78 78 TYR N N 2501 122.282 123.877 -1.595 1
1 853 . 12 1 1 A 79 79 GLY H H 2502 8.196 8.373 -0.177 1
1 854 . 12 1 1 A 79 79 GLY HA2 H 2502 4.040 3.548 0.492 1
1 855 . 12 1 1 A 79 79 GLY HA3 H 2502 3.465 3.681 -0.216 1
1 856 . 12 1 1 A 79 79 GLY C C 2502 173.932 173.605 0.327 1
1 857 . 12 1 1 A 79 79 GLY CA C 2502 45.741 45.833 -0.092 1
1 858 . 12 1 1 A 79 79 GLY N N 2502 113.451 113.639 -0.188 1
1 859 . 12 1 1 A 80 80 GLY H H 2503 7.589 8.212 -0.623 1
1 860 . 12 1 1 A 80 80 GLY HA2 H 2503 4.490 4.039 0.451 1
1 861 . 12 1 1 A 80 80 GLY HA3 H 2503 3.555 4.129 -0.574 1
1 862 . 12 1 1 A 80 80 GLY CA C 2503 43.540 44.051 -0.511 1
1 863 . 12 1 1 A 80 80 GLY N N 2503 107.293 107.519 -0.226 1
1 864 . 12 1 1 A 81 81 PRO HA H 2504 4.320 4.402 -0.082 1
1 871 . 12 1 1 A 81 81 PRO C C 2504 175.311 175.278 0.033 1
1 872 . 12 1 1 A 81 81 PRO CA C 2504 62.722 63.361 -0.639 1
1 873 . 12 1 1 A 81 81 PRO CB C 2504 29.297 31.244 -1.947 1
1 876 . 12 1 1 A 82 82 TYR H H 2505 7.778 7.354 0.424 1
1 877 . 12 1 1 A 82 82 TYR HA H 2505 4.791 5.086 -0.295 1
1 884 . 12 1 1 A 82 82 TYR C C 2505 175.086 175.681 -0.595 1
1 885 . 12 1 1 A 82 82 TYR CA C 2505 56.111 56.605 -0.494 1
1 886 . 12 1 1 A 82 82 TYR CB C 2505 39.483 41.626 -2.143 1
1 889 . 12 1 1 A 82 82 TYR N N 2505 123.973 120.830 3.143 1
1 890 . 12 1 1 A 83 83 HIS H H 2506 8.625 9.025 -0.400 1
1 891 . 12 1 1 A 83 83 HIS HA H 2506 4.583 4.918 -0.335 1
1 896 . 12 1 1 A 83 83 HIS C C 2506 178.161 176.021 2.140 1
1 897 . 12 1 1 A 83 83 HIS CA C 2506 58.241 57.355 0.886 1
1 898 . 12 1 1 A 83 83 HIS CB C 2506 33.132 30.506 2.626 1
1 901 . 12 1 1 A 83 83 HIS N N 2506 124.092 121.531 2.561 1
1 902 . 12 1 1 A 84 84 ILE H H 2507 8.327 8.523 -0.196 1
1 903 . 12 1 1 A 84 84 ILE HA H 2507 4.553 4.300 0.253 1
1 913 . 12 1 1 A 84 84 ILE C C 2507 176.523 176.227 0.296 1
1 914 . 12 1 1 A 84 84 ILE CA C 2507 60.791 60.108 0.683 1
1 915 . 12 1 1 A 84 84 ILE CB C 2507 39.162 39.612 -0.450 1
1 919 . 12 1 1 A 84 84 ILE N N 2507 117.355 119.820 -2.465 1
1 920 . 12 1 1 A 85 85 GLY H H 2508 9.130 8.590 0.540 1
1 921 . 12 1 1 A 85 85 GLY HA2 H 2508 3.883 3.755 0.128 1
1 922 . 12 1 1 A 85 85 GLY HA3 H 2508 3.800 3.767 0.033 1
1 923 . 12 1 1 A 85 85 GLY C C 2508 174.438 175.437 -0.999 1
1 924 . 12 1 1 A 85 85 GLY CA C 2508 47.673 46.713 0.960 1
1 925 . 12 1 1 A 85 85 GLY N N 2508 111.346 109.882 1.464 1
1 926 . 12 1 1 A 86 86 GLY H H 2509 8.236 8.120 0.116 1
1 927 . 12 1 1 A 86 86 GLY HA2 H 2509 3.893 3.921 -0.028 1
1 928 . 12 1 1 A 86 86 GLY HA3 H 2509 3.161 3.971 -0.810 1
1 929 . 12 1 1 A 86 86 GLY C C 2509 171.837 173.372 -1.535 1
1 930 . 12 1 1 A 86 86 GLY CA C 2509 44.844 45.445 -0.601 1
1 931 . 12 1 1 A 86 86 GLY N N 2509 115.594 118.375 -2.781 1
1 932 . 12 1 1 A 87 87 SER H H 2510 7.385 7.781 -0.396 1
1 933 . 12 1 1 A 87 87 SER HA H 2510 4.217 4.239 -0.022 1
1 936 . 12 1 1 A 87 87 SER CA C 2510 54.783 55.411 -0.628 1
1 937 . 12 1 1 A 87 87 SER CB C 2510 62.683 64.268 -1.585 1
1 938 . 12 1 1 A 87 87 SER N N 2510 112.859 116.869 -4.010 1
1 939 . 12 1 1 A 88 88 PRO HA H 2511 5.532 4.880 0.652 1
1 946 . 12 1 1 A 88 88 PRO C C 2511 175.870 175.205 0.665 1
1 947 . 12 1 1 A 88 88 PRO CA C 2511 62.379 62.256 0.123 1
1 948 . 12 1 1 A 88 88 PRO CB C 2511 33.639 32.277 1.362 1
1 951 . 12 1 1 A 89 89 PHE H H 2512 9.359 8.516 0.843 1
1 952 . 12 1 1 A 89 89 PHE HA H 2512 4.467 4.807 -0.340 1
1 960 . 12 1 1 A 89 89 PHE C C 2512 175.152 175.948 -0.796 1
1 961 . 12 1 1 A 89 89 PHE CA C 2512 57.401 57.226 0.175 1
1 962 . 12 1 1 A 89 89 PHE CB C 2512 40.843 41.137 -0.294 1
1 966 . 12 1 1 A 89 89 PHE N N 2512 124.789 119.782 5.007 1
1 967 . 12 1 1 A 90 90 LYS H H 2513 8.772 8.579 0.193 1
1 968 . 12 1 1 A 90 90 LYS HA H 2513 4.941 4.536 0.405 1
1 973 . 12 1 1 A 90 90 LYS C C 2513 174.183 176.385 -2.202 1
1 974 . 12 1 1 A 90 90 LYS CA C 2513 55.749 56.017 -0.268 1
1 975 . 12 1 1 A 90 90 LYS CB C 2513 32.817 31.859 0.958 1
1 978 . 12 1 1 A 90 90 LYS N N 2513 125.133 120.251 4.882 1
1 979 . 12 1 1 A 91 91 ALA H H 2514 9.158 7.563 1.595 1
1 980 . 12 1 1 A 91 91 ALA HA H 2514 4.510 4.237 0.273 1
1 984 . 12 1 1 A 91 91 ALA C C 2514 176.561 177.632 -1.071 1
1 985 . 12 1 1 A 91 91 ALA CA C 2514 50.528 52.958 -2.430 1
1 986 . 12 1 1 A 91 91 ALA CB C 2514 20.653 19.182 1.471 1
1 987 . 12 1 1 A 91 91 ALA N N 2514 131.989 123.053 8.936 1
1 988 . 12 1 1 A 92 92 LYS H H 2515 8.186 8.745 -0.559 1
1 989 . 12 1 1 A 92 92 LYS HA H 2515 4.926 4.947 -0.021 1
1 998 . 12 1 1 A 92 92 LYS C C 2515 175.177 176.103 -0.926 1
1 999 . 12 1 1 A 92 92 LYS CA C 2515 55.725 55.728 -0.003 1
1 1000 . 12 1 1 A 92 92 LYS CB C 2515 33.765 34.008 -0.243 1
1 1004 . 12 1 1 A 92 92 LYS N N 2515 124.887 124.872 0.015 1
1 1005 . 12 1 1 A 93 93 VAL H H 2516 9.362 9.385 -0.023 1
1 1006 . 12 1 1 A 93 93 VAL HA H 2516 5.161 5.184 -0.023 1
1 1014 . 12 1 1 A 93 93 VAL C C 2516 176.988 174.450 2.538 1
1 1015 . 12 1 1 A 93 93 VAL CA C 2516 60.523 59.733 0.790 1
1 1016 . 12 1 1 A 93 93 VAL CB C 2516 33.291 35.999 -2.708 1
1 1019 . 12 1 1 A 93 93 VAL N N 2516 129.943 117.873 12.070 1
1 1020 . 12 1 1 A 94 94 THR H H 2517 8.614 8.610 0.004 1
1 1021 . 12 1 1 A 94 94 THR HA H 2517 4.902 4.928 -0.026 1
1 1026 . 12 1 1 A 94 94 THR C C 2517 172.759 173.200 -0.441 1
1 1027 . 12 1 1 A 94 94 THR CA C 2517 60.121 59.897 0.224 1
1 1028 . 12 1 1 A 94 94 THR CB C 2517 71.072 71.548 -0.476 1
1 1030 . 12 1 1 A 94 94 THR N N 2517 122.032 113.054 8.978 1
1 1031 . 12 1 1 A 95 95 GLY H H 2518 8.280 8.519 -0.239 1
1 1032 . 12 1 1 A 95 95 GLY HA2 H 2518 3.852 4.128 -0.276 1
1 1033 . 12 1 1 A 95 95 GLY HA3 H 2518 4.846 4.129 0.717 1
1 1034 . 12 1 1 A 95 95 GLY CA C 2518 43.955 43.709 0.246 1
1 1035 . 12 1 1 A 95 95 GLY N N 2518 107.949 106.579 1.370 1
1 1036 . 12 1 1 A 96 96 PRO HA H 2519 4.449 4.675 -0.226 1
1 1043 . 12 1 1 A 96 96 PRO C C 2519 176.892 175.525 1.367 1
1 1044 . 12 1 1 A 96 96 PRO CA C 2519 62.062 62.777 -0.715 1
1 1045 . 12 1 1 A 96 96 PRO CB C 2519 32.286 33.220 -0.934 1
1 1048 . 12 1 1 A 97 97 ARG H H 2520 8.651 8.599 0.052 1
1 1049 . 12 1 1 A 97 97 ARG HA H 2520 4.348 4.586 -0.238 1
1 1056 . 12 1 1 A 97 97 ARG C C 2520 176.236 176.156 0.080 1
1 1057 . 12 1 1 A 97 97 ARG CA C 2520 57.587 55.594 1.993 1
1 1058 . 12 1 1 A 97 97 ARG CB C 2520 30.472 31.322 -0.850 1
1 1061 . 12 1 1 A 97 97 ARG N N 2520 120.781 121.757 -0.976 1
1 1062 . 12 1 1 A 98 98 LEU H H 2521 8.545 8.847 -0.302 1
1 1063 . 12 1 1 A 98 98 LEU HA H 2521 4.577 4.432 0.145 1
1 1073 . 12 1 1 A 98 98 LEU C C 2521 175.880 177.647 -1.767 1
1 1074 . 12 1 1 A 98 98 LEU CA C 2521 55.068 54.830 0.238 1
1 1075 . 12 1 1 A 98 98 LEU CB C 2521 43.082 42.014 1.068 1
1 1079 . 12 1 1 A 98 98 LEU N N 2521 128.715 127.741 0.974 1
1 4 . 13 1 1 A 2 2 ALA HA H -2 4.374 4.464 -0.090 1
1 8 . 13 1 1 A 2 2 ALA C C -2 177.865 176.617 1.248 1
1 9 . 13 1 1 A 2 2 ALA CA C -2 52.670 51.649 1.021 1
1 10 . 13 1 1 A 2 2 ALA CB C -2 19.508 20.015 -0.507 1
1 32 . 13 1 1 A 5 5 ASP H H 2428 8.300 8.642 -0.342 1
1 33 . 13 1 1 A 5 5 ASP HA H 2428 5.082 5.105 -0.023 1
1 36 . 13 1 1 A 5 5 ASP CA C 2428 51.517 51.215 0.302 1
1 37 . 13 1 1 A 5 5 ASP CB C 2428 42.244 42.845 -0.601 1
1 38 . 13 1 1 A 5 5 ASP N N 2428 122.879 121.305 1.574 1
1 39 . 13 1 1 A 6 6 PRO HA H 2429 4.340 4.414 -0.074 1
1 46 . 13 1 1 A 6 6 PRO C C 2429 178.266 177.665 0.601 1
1 47 . 13 1 1 A 6 6 PRO CA C 2429 64.494 63.900 0.594 1
1 48 . 13 1 1 A 6 6 PRO CB C 2429 31.841 31.931 -0.090 1
1 51 . 13 1 1 A 7 7 GLY H H 2430 8.686 8.542 0.144 1
1 52 . 13 1 1 A 7 7 GLY HA2 H 2430 4.116 3.879 0.237 1
1 53 . 13 1 1 A 7 7 GLY HA3 H 2430 3.868 3.880 -0.012 1
1 54 . 13 1 1 A 7 7 GLY C C 2430 174.567 175.803 -1.236 1
1 55 . 13 1 1 A 7 7 GLY CA C 2430 46.038 46.385 -0.347 1
1 56 . 13 1 1 A 7 7 GLY N N 2430 107.655 107.035 0.620 1
1 57 . 13 1 1 A 8 8 LEU H H 2431 7.692 7.726 -0.034 1
1 58 . 13 1 1 A 8 8 LEU HA H 2431 4.507 4.299 0.208 1
1 68 . 13 1 1 A 8 8 LEU C C 2431 176.876 177.564 -0.688 1
1 69 . 13 1 1 A 8 8 LEU CA C 2431 54.307 57.494 -3.187 1
1 70 . 13 1 1 A 8 8 LEU CB C 2431 42.879 42.614 0.265 1
1 74 . 13 1 1 A 8 8 LEU N N 2431 120.022 120.856 -0.834 1
1 75 . 13 1 1 A 9 9 VAL H H 2432 7.378 7.650 -0.272 1
1 76 . 13 1 1 A 9 9 VAL HA H 2432 4.154 3.913 0.241 1
1 84 . 13 1 1 A 9 9 VAL C C 2432 174.703 175.546 -0.843 1
1 85 . 13 1 1 A 9 9 VAL CA C 2432 62.387 63.353 -0.966 1
1 86 . 13 1 1 A 9 9 VAL CB C 2432 32.519 31.455 1.064 1
1 89 . 13 1 1 A 9 9 VAL N N 2432 123.902 119.257 4.645 1
1 90 . 13 1 1 A 10 10 SER H H 2433 8.201 8.619 -0.418 1
1 91 . 13 1 1 A 10 10 SER HA H 2433 5.136 4.876 0.260 1
1 94 . 13 1 1 A 10 10 SER CA C 2433 56.554 55.558 0.996 1
1 95 . 13 1 1 A 10 10 SER CB C 2433 66.763 65.156 1.607 1
1 96 . 13 1 1 A 10 10 SER N N 2433 121.921 121.771 0.150 1
1 97 . 13 1 1 A 11 11 ALA H H 2434 8.670 8.217 0.453 1
1 98 . 13 1 1 A 11 11 ALA HA H 2434 5.632 5.201 0.431 1
1 102 . 13 1 1 A 11 11 ALA C C 2434 175.459 174.624 0.835 1
1 103 . 13 1 1 A 11 11 ALA CA C 2434 50.575 50.783 -0.208 1
1 104 . 13 1 1 A 11 11 ALA CB C 2434 23.111 22.942 0.169 1
1 105 . 13 1 1 A 11 11 ALA N N 2434 124.828 123.555 1.273 1
1 106 . 13 1 1 A 12 12 TYR H H 2435 8.609 8.695 -0.086 1
1 107 . 13 1 1 A 12 12 TYR HA H 2435 4.879 5.076 -0.197 1
1 114 . 13 1 1 A 12 12 TYR C C 2435 173.645 174.681 -1.036 1
1 115 . 13 1 1 A 12 12 TYR CA C 2435 56.268 56.589 -0.321 1
1 116 . 13 1 1 A 12 12 TYR CB C 2435 39.522 42.340 -2.818 1
1 119 . 13 1 1 A 12 12 TYR N N 2435 118.305 119.305 -1.000 1
1 120 . 13 1 1 A 13 13 GLY H H 2436 8.655 8.598 0.057 1
1 121 . 13 1 1 A 13 13 GLY HA2 H 2436 4.943 4.285 0.658 1
1 122 . 13 1 1 A 13 13 GLY HA3 H 2436 4.028 4.324 -0.296 1
1 123 . 13 1 1 A 13 13 GLY C C 2436 175.334 175.003 0.331 1
1 124 . 13 1 1 A 13 13 GLY CA C 2436 44.389 44.400 -0.011 1
1 125 . 13 1 1 A 13 13 GLY N N 2436 110.710 110.334 0.376 1
1 126 . 13 1 1 A 14 14 ALA H H 2437 8.939 8.725 0.214 1
1 127 . 13 1 1 A 14 14 ALA HA H 2437 4.276 4.092 0.184 1
1 131 . 13 1 1 A 14 14 ALA C C 2437 180.524 179.015 1.509 1
1 132 . 13 1 1 A 14 14 ALA CA C 2437 55.551 55.078 0.473 1
1 133 . 13 1 1 A 14 14 ALA CB C 2437 18.411 18.412 -0.001 1
1 134 . 13 1 1 A 14 14 ALA N N 2437 126.973 123.945 3.028 1
1 135 . 13 1 1 A 15 15 GLY H H 2438 8.933 8.687 0.246 1
1 136 . 13 1 1 A 15 15 GLY HA2 H 2438 4.531 3.984 0.547 1
1 137 . 13 1 1 A 15 15 GLY HA3 H 2438 3.576 4.166 -0.590 1
1 138 . 13 1 1 A 15 15 GLY C C 2438 174.323 175.308 -0.985 1
1 139 . 13 1 1 A 15 15 GLY CA C 2438 46.855 46.605 0.250 1
1 140 . 13 1 1 A 15 15 GLY N N 2438 104.803 105.549 -0.746 1
1 141 . 13 1 1 A 16 16 LEU H H 2439 7.529 7.617 -0.088 1
1 142 . 13 1 1 A 16 16 LEU HA H 2439 3.768 3.897 -0.129 1
1 152 . 13 1 1 A 16 16 LEU C C 2439 176.388 178.720 -2.332 1
1 153 . 13 1 1 A 16 16 LEU CA C 2439 56.137 57.038 -0.901 1
1 154 . 13 1 1 A 16 16 LEU CB C 2439 41.621 41.404 0.217 1
1 158 . 13 1 1 A 16 16 LEU N N 2439 119.633 121.565 -1.932 1
1 159 . 13 1 1 A 17 17 GLU H H 2440 7.505 7.934 -0.429 1
1 160 . 13 1 1 A 17 17 GLU HA H 2440 4.663 4.324 0.339 1
1 165 . 13 1 1 A 17 17 GLU C C 2440 178.126 176.635 1.491 1
1 166 . 13 1 1 A 17 17 GLU CA C 2440 56.447 57.061 -0.614 1
1 167 . 13 1 1 A 17 17 GLU CB C 2440 31.485 30.842 0.643 1
1 169 . 13 1 1 A 17 17 GLU N N 2440 114.368 116.393 -2.025 1
1 170 . 13 1 1 A 18 18 GLY H H 2441 7.921 7.397 0.524 1
1 171 . 13 1 1 A 18 18 GLY HA2 H 2441 4.889 4.178 0.711 1
1 172 . 13 1 1 A 18 18 GLY HA3 H 2441 3.707 4.212 -0.505 1
1 173 . 13 1 1 A 18 18 GLY C C 2441 170.965 171.477 -0.512 1
1 174 . 13 1 1 A 18 18 GLY CA C 2441 45.549 45.431 0.118 1
1 175 . 13 1 1 A 18 18 GLY N N 2441 109.165 104.795 4.370 1
1 176 . 13 1 1 A 19 19 GLY H H 2442 7.540 7.970 -0.430 1
1 177 . 13 1 1 A 19 19 GLY HA2 H 2442 4.086 4.236 -0.150 1
1 178 . 13 1 1 A 19 19 GLY HA3 H 2442 4.086 4.269 -0.183 1
1 179 . 13 1 1 A 19 19 GLY C C 2442 171.051 171.473 -0.422 1
1 180 . 13 1 1 A 19 19 GLY CA C 2442 44.937 46.232 -1.295 1
1 181 . 13 1 1 A 19 19 GLY N N 2442 105.460 108.768 -3.308 1
1 182 . 13 1 1 A 20 20 VAL H H 2443 8.899 8.497 0.402 1
1 183 . 13 1 1 A 20 20 VAL HA H 2443 5.062 5.008 0.054 1
1 191 . 13 1 1 A 20 20 VAL C C 2443 176.623 174.978 1.645 1
1 192 . 13 1 1 A 20 20 VAL CA C 2443 60.197 60.222 -0.025 1
1 193 . 13 1 1 A 20 20 VAL CB C 2443 35.107 35.508 -0.401 1
1 196 . 13 1 1 A 20 20 VAL N N 2443 122.753 119.566 3.187 1
1 197 . 13 1 1 A 21 21 THR H H 2444 8.630 8.585 0.045 1
1 198 . 13 1 1 A 21 21 THR HA H 2444 3.773 4.159 -0.386 1
1 203 . 13 1 1 A 21 21 THR C C 2444 175.646 174.957 0.689 1
1 204 . 13 1 1 A 21 21 THR CA C 2444 62.732 63.300 -0.568 1
1 205 . 13 1 1 A 21 21 THR CB C 2444 68.925 68.463 0.462 1
1 207 . 13 1 1 A 21 21 THR N N 2444 118.179 118.801 -0.622 1
1 208 . 13 1 1 A 22 22 GLY H H 2445 8.736 8.800 -0.064 1
1 209 . 13 1 1 A 22 22 GLY HA2 H 2445 3.412 3.983 -0.571 1
1 210 . 13 1 1 A 22 22 GLY HA3 H 2445 4.061 3.985 0.076 1
1 211 . 13 1 1 A 22 22 GLY C C 2445 172.973 173.267 -0.294 1
1 212 . 13 1 1 A 22 22 GLY CA C 2445 45.577 45.259 0.318 1
1 213 . 13 1 1 A 22 22 GLY N N 2445 107.888 114.007 -6.119 1
1 214 . 13 1 1 A 23 23 ASN H H 2446 7.877 7.784 0.093 1
1 215 . 13 1 1 A 23 23 ASN HA H 2446 5.253 5.063 0.190 1
1 220 . 13 1 1 A 23 23 ASN CA C 2446 49.740 50.203 -0.463 1
1 221 . 13 1 1 A 23 23 ASN CB C 2446 40.198 40.215 -0.017 1
1 222 . 13 1 1 A 23 23 ASN N N 2446 120.684 120.710 -0.026 1
1 224 . 13 1 1 A 24 24 PRO HA H 2447 4.525 4.606 -0.081 1
1 231 . 13 1 1 A 24 24 PRO CA C 2447 62.766 62.285 0.481 1
1 232 . 13 1 1 A 24 24 PRO CB C 2447 31.732 31.970 -0.238 1
1 235 . 13 1 1 A 25 25 ALA H H 2448 9.178 8.346 0.832 1
1 236 . 13 1 1 A 25 25 ALA HA H 2448 4.614 4.765 -0.151 1
1 240 . 13 1 1 A 25 25 ALA C C 2448 175.503 175.526 -0.023 1
1 241 . 13 1 1 A 25 25 ALA CA C 2448 50.526 50.559 -0.033 1
1 242 . 13 1 1 A 25 25 ALA CB C 2448 20.458 20.258 0.200 1
1 243 . 13 1 1 A 25 25 ALA N N 2448 132.079 125.473 6.606 1
1 244 . 13 1 1 A 26 26 GLU H H 2449 8.813 9.124 -0.311 1
1 245 . 13 1 1 A 26 26 GLU HA H 2449 5.830 5.226 0.604 1
1 250 . 13 1 1 A 26 26 GLU C C 2449 176.272 175.057 1.215 1
1 251 . 13 1 1 A 26 26 GLU CA C 2449 54.376 54.838 -0.462 1
1 252 . 13 1 1 A 26 26 GLU CB C 2449 35.463 33.522 1.941 1
1 254 . 13 1 1 A 26 26 GLU N N 2449 120.079 123.653 -3.574 1
1 255 . 13 1 1 A 27 27 PHE H H 2450 8.782 8.906 -0.124 1
1 256 . 13 1 1 A 27 27 PHE HA H 2450 5.021 5.220 -0.199 1
1 264 . 13 1 1 A 27 27 PHE C C 2450 171.205 172.447 -1.242 1
1 265 . 13 1 1 A 27 27 PHE CA C 2450 56.852 56.210 0.642 1
1 266 . 13 1 1 A 27 27 PHE CB C 2450 41.080 41.163 -0.083 1
1 270 . 13 1 1 A 27 27 PHE N N 2450 118.670 121.186 -2.516 1
1 271 . 13 1 1 A 28 28 VAL H H 2451 8.961 8.985 -0.024 1
1 272 . 13 1 1 A 28 28 VAL HA H 2451 4.761 4.750 0.011 1
1 280 . 13 1 1 A 28 28 VAL C C 2451 174.673 175.395 -0.722 1
1 281 . 13 1 1 A 28 28 VAL CA C 2451 60.619 60.886 -0.267 1
1 282 . 13 1 1 A 28 28 VAL CB C 2451 35.484 35.132 0.352 1
1 285 . 13 1 1 A 28 28 VAL N N 2451 121.552 119.559 1.993 1
1 286 . 13 1 1 A 29 29 VAL H H 2452 9.294 9.217 0.077 1
1 287 . 13 1 1 A 29 29 VAL HA H 2452 4.363 4.290 0.073 1
1 295 . 13 1 1 A 29 29 VAL C C 2452 174.218 175.245 -1.027 1
1 296 . 13 1 1 A 29 29 VAL CA C 2452 61.526 62.879 -1.353 1
1 297 . 13 1 1 A 29 29 VAL CB C 2452 32.666 31.117 1.549 1
1 300 . 13 1 1 A 29 29 VAL N N 2452 125.585 128.214 -2.629 1
1 301 . 13 1 1 A 30 30 ASN H H 2453 9.465 8.981 0.484 1
1 302 . 13 1 1 A 30 30 ASN HA H 2453 5.096 5.178 -0.082 1
1 307 . 13 1 1 A 30 30 ASN C C 2453 176.216 176.110 0.106 1
1 308 . 13 1 1 A 30 30 ASN CA C 2453 52.011 52.726 -0.715 1
1 309 . 13 1 1 A 30 30 ASN CB C 2453 39.057 38.586 0.471 1
1 310 . 13 1 1 A 30 30 ASN N N 2453 127.724 127.115 0.609 1
1 312 . 13 1 1 A 31 31 THR H H 2454 8.915 8.008 0.907 1
1 313 . 13 1 1 A 31 31 THR HA H 2454 4.342 4.407 -0.065 1
1 318 . 13 1 1 A 31 31 THR C C 2454 176.816 176.376 0.440 1
1 319 . 13 1 1 A 31 31 THR CA C 2454 61.117 62.141 -1.024 1
1 320 . 13 1 1 A 31 31 THR CB C 2454 68.209 69.719 -1.510 1
1 322 . 13 1 1 A 31 31 THR N N 2454 117.783 116.985 0.798 1
1 323 . 13 1 1 A 32 32 SER H H 2455 8.454 7.948 0.506 1
1 324 . 13 1 1 A 32 32 SER HA H 2455 4.155 4.241 -0.086 1
1 327 . 13 1 1 A 32 32 SER C C 2455 175.458 175.494 -0.036 1
1 328 . 13 1 1 A 32 32 SER CA C 2455 62.148 62.320 -0.172 1
1 329 . 13 1 1 A 32 32 SER CB C 2455 63.476 63.058 0.418 1
1 330 . 13 1 1 A 32 32 SER N N 2455 121.781 118.942 2.839 1
1 331 . 13 1 1 A 33 33 ASN H H 2456 8.845 8.091 0.754 1
1 332 . 13 1 1 A 33 33 ASN HA H 2456 5.064 4.527 0.537 1
1 337 . 13 1 1 A 33 33 ASN C C 2456 174.674 176.396 -1.722 1
1 338 . 13 1 1 A 33 33 ASN CA C 2456 53.067 54.956 -1.889 1
1 339 . 13 1 1 A 33 33 ASN CB C 2456 39.632 38.872 0.760 1
1 340 . 13 1 1 A 33 33 ASN N N 2456 120.176 118.063 2.113 1
1 342 . 13 1 1 A 34 34 ALA H H 2457 7.714 7.990 -0.276 1
1 343 . 13 1 1 A 34 34 ALA HA H 2457 4.482 4.500 -0.018 1
1 347 . 13 1 1 A 34 34 ALA C C 2457 177.582 178.036 -0.454 1
1 348 . 13 1 1 A 34 34 ALA CA C 2457 52.521 52.088 0.433 1
1 349 . 13 1 1 A 34 34 ALA CB C 2457 22.252 21.023 1.229 1
1 350 . 13 1 1 A 34 34 ALA N N 2457 123.065 119.110 3.955 1
1 351 . 13 1 1 A 35 35 GLY H H 2458 8.195 7.932 0.263 1
1 352 . 13 1 1 A 35 35 GLY HA2 H 2458 4.246 4.053 0.193 1
1 353 . 13 1 1 A 35 35 GLY HA3 H 2458 3.902 4.071 -0.169 1
1 354 . 13 1 1 A 35 35 GLY C C 2458 173.360 173.364 -0.004 1
1 355 . 13 1 1 A 35 35 GLY CA C 2458 44.486 45.975 -1.489 1
1 356 . 13 1 1 A 35 35 GLY N N 2458 108.472 105.401 3.071 1
1 357 . 13 1 1 A 36 36 ALA H H 2459 8.430 8.349 0.081 1
1 358 . 13 1 1 A 36 36 ALA HA H 2459 4.472 5.231 -0.759 1
1 362 . 13 1 1 A 36 36 ALA C C 2459 176.968 175.931 1.037 1
1 363 . 13 1 1 A 36 36 ALA CA C 2459 52.695 51.315 1.380 1
1 364 . 13 1 1 A 36 36 ALA CB C 2459 19.360 23.507 -4.147 1
1 365 . 13 1 1 A 36 36 ALA N N 2459 126.012 124.789 1.223 1
1 366 . 13 1 1 A 37 37 GLY H H 2460 7.781 8.493 -0.712 1
1 367 . 13 1 1 A 37 37 GLY HA2 H 2460 3.856 4.049 -0.193 1
1 368 . 13 1 1 A 37 37 GLY HA3 H 2460 3.164 4.110 -0.946 1
1 369 . 13 1 1 A 37 37 GLY C C 2460 170.730 171.812 -1.082 1
1 370 . 13 1 1 A 37 37 GLY CA C 2460 44.747 45.120 -0.373 1
1 371 . 13 1 1 A 37 37 GLY N N 2460 109.493 105.658 3.835 1
1 372 . 13 1 1 A 38 38 ALA H H 2461 8.055 7.988 0.067 1
1 373 . 13 1 1 A 38 38 ALA HA H 2461 4.389 4.663 -0.274 1
1 377 . 13 1 1 A 38 38 ALA C C 2461 176.609 176.091 0.518 1
1 378 . 13 1 1 A 38 38 ALA CA C 2461 51.419 51.441 -0.022 1
1 379 . 13 1 1 A 38 38 ALA CB C 2461 19.665 19.689 -0.024 1
1 380 . 13 1 1 A 38 38 ALA N N 2461 121.997 122.230 -0.233 1
1 381 . 13 1 1 A 39 39 LEU H H 2462 8.597 8.585 0.012 1
1 382 . 13 1 1 A 39 39 LEU HA H 2462 5.022 5.019 0.003 1
1 392 . 13 1 1 A 39 39 LEU C C 2462 175.883 173.985 1.898 1
1 393 . 13 1 1 A 39 39 LEU CA C 2462 53.907 53.566 0.341 1
1 394 . 13 1 1 A 39 39 LEU CB C 2462 44.576 46.173 -1.597 1
1 398 . 13 1 1 A 39 39 LEU N N 2462 126.664 122.214 4.450 1
1 399 . 13 1 1 A 40 40 SER H H 2463 8.898 9.210 -0.312 1
1 400 . 13 1 1 A 40 40 SER HA H 2463 4.732 5.387 -0.655 1
1 403 . 13 1 1 A 40 40 SER C C 2463 172.984 172.554 0.430 1
1 404 . 13 1 1 A 40 40 SER CA C 2463 56.730 56.382 0.348 1
1 405 . 13 1 1 A 40 40 SER CB C 2463 64.648 66.242 -1.594 1
1 406 . 13 1 1 A 40 40 SER N N 2463 122.932 120.884 2.048 1
1 407 . 13 1 1 A 41 41 VAL H H 2464 8.538 8.458 0.080 1
1 408 . 13 1 1 A 41 41 VAL HA H 2464 5.131 4.905 0.226 1
1 416 . 13 1 1 A 41 41 VAL C C 2464 174.812 173.430 1.382 1
1 417 . 13 1 1 A 41 41 VAL CA C 2464 60.784 60.615 0.169 1
1 418 . 13 1 1 A 41 41 VAL CB C 2464 34.262 34.825 -0.563 1
1 420 . 13 1 1 A 41 41 VAL N N 2464 129.161 122.929 6.232 1
1 421 . 13 1 1 A 42 42 THR H H 2465 8.807 8.490 0.317 1
1 422 . 13 1 1 A 42 42 THR HA H 2465 4.573 5.020 -0.447 1
1 427 . 13 1 1 A 42 42 THR CA C 2465 60.408 61.480 -1.072 1
1 428 . 13 1 1 A 42 42 THR CB C 2465 71.764 73.376 -1.612 1
1 430 . 13 1 1 A 42 42 THR N N 2465 120.898 122.446 -1.548 1
1 431 . 13 1 1 A 43 43 ILE H H 2466 8.648 9.027 -0.379 1
1 432 . 13 1 1 A 43 43 ILE HA H 2466 4.854 4.737 0.117 1
1 442 . 13 1 1 A 43 43 ILE C C 2466 174.073 174.159 -0.086 1
1 443 . 13 1 1 A 43 43 ILE CA C 2466 61.184 60.377 0.807 1
1 444 . 13 1 1 A 43 43 ILE CB C 2466 39.516 39.592 -0.076 1
1 448 . 13 1 1 A 43 43 ILE N N 2466 124.810 125.714 -0.904 1
1 449 . 13 1 1 A 44 44 ASP H H 2467 8.821 9.134 -0.313 1
1 450 . 13 1 1 A 44 44 ASP HA H 2467 5.217 5.383 -0.166 1
1 453 . 13 1 1 A 44 44 ASP C C 2467 175.002 175.255 -0.253 1
1 454 . 13 1 1 A 44 44 ASP CA C 2467 52.998 52.699 0.299 1
1 455 . 13 1 1 A 44 44 ASP CB C 2467 44.728 42.997 1.731 1
1 456 . 13 1 1 A 44 44 ASP N N 2467 129.093 129.144 -0.051 1
1 457 . 13 1 1 A 45 45 GLY H H 2468 8.535 8.290 0.245 1
1 458 . 13 1 1 A 45 45 GLY HA2 H 2468 3.954 3.787 0.167 1
1 459 . 13 1 1 A 45 45 GLY HA3 H 2468 3.561 4.036 -0.475 1
1 460 . 13 1 1 A 45 45 GLY CA C 2468 45.659 44.842 0.817 1
1 461 . 13 1 1 A 45 45 GLY N N 2468 112.751 109.834 2.917 1
1 462 . 13 1 1 A 46 46 PRO HA H 2469 4.318 4.376 -0.058 1
1 469 . 13 1 1 A 46 46 PRO C C 2469 176.086 176.147 -0.061 1
1 470 . 13 1 1 A 46 46 PRO CA C 2469 64.198 63.860 0.338 1
1 471 . 13 1 1 A 46 46 PRO CB C 2469 32.348 31.824 0.524 1
1 474 . 13 1 1 A 47 47 SER H H 2470 7.106 7.604 -0.498 1
1 475 . 13 1 1 A 47 47 SER HA H 2470 4.632 4.787 -0.155 1
1 478 . 13 1 1 A 47 47 SER C C 2470 172.969 173.149 -0.180 1
1 479 . 13 1 1 A 47 47 SER CA C 2470 57.106 57.364 -0.258 1
1 480 . 13 1 1 A 47 47 SER CB C 2470 66.262 67.253 -0.991 1
1 481 . 13 1 1 A 47 47 SER N N 2470 110.556 114.283 -3.727 1
1 482 . 13 1 1 A 48 48 LYS H H 2471 8.534 8.308 0.226 1
1 483 . 13 1 1 A 48 48 LYS HA H 2471 4.486 4.581 -0.095 1
1 492 . 13 1 1 A 48 48 LYS C C 2471 177.231 176.371 0.860 1
1 493 . 13 1 1 A 48 48 LYS CA C 2471 56.620 56.888 -0.268 1
1 494 . 13 1 1 A 48 48 LYS CB C 2471 32.379 33.830 -1.451 1
1 498 . 13 1 1 A 48 48 LYS N N 2471 124.055 122.132 1.923 1
1 499 . 13 1 1 A 49 49 VAL H H 2472 8.497 8.713 -0.216 1
1 500 . 13 1 1 A 49 49 VAL HA H 2472 4.552 4.871 -0.319 1
1 508 . 13 1 1 A 49 49 VAL C C 2472 175.292 174.342 0.950 1
1 509 . 13 1 1 A 49 49 VAL CA C 2472 60.142 58.926 1.216 1
1 510 . 13 1 1 A 49 49 VAL CB C 2472 33.464 35.645 -2.181 1
1 513 . 13 1 1 A 49 49 VAL N N 2472 121.233 117.979 3.254 1
1 514 . 13 1 1 A 50 50 LYS H H 2473 8.190 8.376 -0.186 1
1 515 . 13 1 1 A 50 50 LYS HA H 2473 4.522 4.429 0.093 1
1 518 . 13 1 1 A 50 50 LYS CA C 2473 55.952 55.834 0.118 1
1 519 . 13 1 1 A 50 50 LYS CB C 2473 32.896 31.335 1.561 1
1 520 . 13 1 1 A 50 50 LYS N N 2473 126.082 122.070 4.012 1
1 521 . 13 1 1 A 51 51 MET H H 2474 8.818 8.589 0.229 1
1 522 . 13 1 1 A 51 51 MET HA H 2474 5.324 4.571 0.753 1
1 530 . 13 1 1 A 51 51 MET C C 2474 173.933 174.826 -0.893 1
1 531 . 13 1 1 A 51 51 MET CA C 2474 54.848 56.185 -1.337 1
1 532 . 13 1 1 A 51 51 MET CB C 2474 37.043 33.353 3.690 1
1 535 . 13 1 1 A 51 51 MET N N 2474 126.911 122.687 4.224 1
1 536 . 13 1 1 A 52 52 ASP H H 2475 9.095 8.893 0.202 1
1 537 . 13 1 1 A 52 52 ASP HA H 2475 4.947 5.162 -0.215 1
1 540 . 13 1 1 A 52 52 ASP C C 2475 173.923 174.431 -0.508 1
1 541 . 13 1 1 A 52 52 ASP CA C 2475 53.487 52.923 0.564 1
1 542 . 13 1 1 A 52 52 ASP CB C 2475 44.765 44.533 0.232 1
1 543 . 13 1 1 A 52 52 ASP N N 2475 125.526 125.930 -0.404 1
1 544 . 13 1 1 A 53 53 CYS H H 2476 8.606 9.023 -0.417 1
1 545 . 13 1 1 A 53 53 CYS HA H 2476 5.145 5.402 -0.257 1
1 548 . 13 1 1 A 53 53 CYS C C 2476 173.330 174.225 -0.895 1
1 549 . 13 1 1 A 53 53 CYS CA C 2476 57.452 57.208 0.244 1
1 550 . 13 1 1 A 53 53 CYS CB C 2476 28.108 29.779 -1.671 1
1 551 . 13 1 1 A 53 53 CYS N N 2476 124.317 124.581 -0.264 1
1 552 . 13 1 1 A 54 54 GLN H H 2477 8.978 9.039 -0.061 1
1 553 . 13 1 1 A 54 54 GLN HA H 2477 4.884 4.907 -0.023 1
1 560 . 13 1 1 A 54 54 GLN C C 2477 174.854 173.671 1.183 1
1 561 . 13 1 1 A 54 54 GLN CA C 2477 53.891 54.587 -0.696 1
1 562 . 13 1 1 A 54 54 GLN CB C 2477 32.837 33.233 -0.396 1
1 564 . 13 1 1 A 54 54 GLN N N 2477 127.074 122.257 4.817 1
1 566 . 13 1 1 A 55 55 GLU H H 2478 9.065 8.617 0.448 1
1 567 . 13 1 1 A 55 55 GLU HA H 2478 4.280 4.839 -0.559 1
1 572 . 13 1 1 A 55 55 GLU C C 2478 175.383 175.432 -0.049 1
1 573 . 13 1 1 A 55 55 GLU CA C 2478 57.516 55.832 1.684 1
1 574 . 13 1 1 A 55 55 GLU CB C 2478 30.346 31.272 -0.926 1
1 576 . 13 1 1 A 55 55 GLU N N 2478 125.186 122.476 2.710 1
1 577 . 13 1 1 A 56 56 CYS H H 2479 8.407 8.234 0.173 1
1 578 . 13 1 1 A 56 56 CYS HA H 2479 5.056 4.919 0.137 1
1 581 . 13 1 1 A 56 56 CYS CA C 2479 55.858 56.650 -0.792 1
1 582 . 13 1 1 A 56 56 CYS CB C 2479 28.676 29.941 -1.265 1
1 583 . 13 1 1 A 56 56 CYS N N 2479 121.499 124.589 -3.090 1
1 584 . 13 1 1 A 57 57 PRO HA H 2480 4.159 4.250 -0.091 1
1 591 . 13 1 1 A 57 57 PRO C C 2480 177.964 177.796 0.168 1
1 592 . 13 1 1 A 57 57 PRO CA C 2480 66.877 65.026 1.851 1
1 593 . 13 1 1 A 57 57 PRO CB C 2480 31.709 31.834 -0.125 1
1 596 . 13 1 1 A 58 58 GLU H H 2481 8.900 8.191 0.709 1
1 597 . 13 1 1 A 58 58 GLU HA H 2481 4.201 4.318 -0.117 1
1 602 . 13 1 1 A 58 58 GLU C C 2481 175.129 176.497 -1.368 1
1 603 . 13 1 1 A 58 58 GLU CA C 2481 57.883 57.327 0.556 1
1 604 . 13 1 1 A 58 58 GLU CB C 2481 29.991 30.171 -0.180 1
1 606 . 13 1 1 A 58 58 GLU N N 2481 115.316 117.830 -2.514 1
1 607 . 13 1 1 A 59 59 GLY H H 2482 7.527 7.308 0.219 1
1 608 . 13 1 1 A 59 59 GLY HA2 H 2482 4.935 3.953 0.982 1
1 609 . 13 1 1 A 59 59 GLY HA3 H 2482 3.381 4.069 -0.688 1
1 610 . 13 1 1 A 59 59 GLY CA C 2482 47.809 44.088 3.721 1
1 611 . 13 1 1 A 59 59 GLY N N 2482 110.079 107.824 2.255 1
1 612 . 13 1 1 A 60 60 TYR H H 2483 8.990 8.103 0.887 1
1 613 . 13 1 1 A 60 60 TYR HA H 2483 5.157 4.621 0.536 1
1 618 . 13 1 1 A 60 60 TYR C C 2483 175.096 175.136 -0.040 1
1 619 . 13 1 1 A 60 60 TYR CA C 2483 57.375 58.948 -1.573 1
1 620 . 13 1 1 A 60 60 TYR CB C 2483 43.153 38.216 4.937 1
1 622 . 13 1 1 A 60 60 TYR N N 2483 125.900 121.546 4.354 1
1 623 . 13 1 1 A 61 61 ARG H H 2484 9.557 8.819 0.738 1
1 624 . 13 1 1 A 61 61 ARG HA H 2484 4.858 4.530 0.328 1
1 631 . 13 1 1 A 61 61 ARG CA C 2484 55.016 56.095 -1.079 1
1 632 . 13 1 1 A 61 61 ARG CB C 2484 32.128 31.134 0.994 1
1 635 . 13 1 1 A 61 61 ARG N N 2484 124.847 126.440 -1.593 1
1 636 . 13 1 1 A 62 62 VAL H H 2485 9.046 8.775 0.271 1
1 637 . 13 1 1 A 62 62 VAL HA H 2485 4.675 4.796 -0.121 1
1 645 . 13 1 1 A 62 62 VAL C C 2485 173.837 174.530 -0.693 1
1 646 . 13 1 1 A 62 62 VAL CA C 2485 60.752 60.678 0.074 1
1 647 . 13 1 1 A 62 62 VAL CB C 2485 32.459 34.197 -1.738 1
1 650 . 13 1 1 A 62 62 VAL N N 2485 132.205 125.677 6.528 1
1 651 . 13 1 1 A 63 63 THR H H 2486 8.474 8.853 -0.379 1
1 652 . 13 1 1 A 63 63 THR HA H 2486 5.392 5.512 -0.120 1
1 657 . 13 1 1 A 63 63 THR C C 2486 173.675 173.724 -0.049 1
1 658 . 13 1 1 A 63 63 THR CA C 2486 60.008 61.199 -1.191 1
1 659 . 13 1 1 A 63 63 THR CB C 2486 71.035 71.030 0.005 1
1 661 . 13 1 1 A 63 63 THR N N 2486 121.216 122.938 -1.722 1
1 662 . 13 1 1 A 64 64 TYR H H 2487 9.409 8.975 0.434 1
1 663 . 13 1 1 A 64 64 TYR HA H 2487 5.617 5.499 0.118 1
1 670 . 13 1 1 A 64 64 TYR C C 2487 172.847 172.693 0.154 1
1 671 . 13 1 1 A 64 64 TYR CA C 2487 55.557 55.848 -0.291 1
1 672 . 13 1 1 A 64 64 TYR CB C 2487 41.968 41.874 0.094 1
1 675 . 13 1 1 A 64 64 TYR N N 2487 124.061 121.959 2.102 1
1 676 . 13 1 1 A 65 65 THR H H 2488 8.145 8.831 -0.686 1
1 677 . 13 1 1 A 65 65 THR HA H 2488 4.959 4.596 0.363 1
1 682 . 13 1 1 A 65 65 THR CA C 2488 58.532 58.917 -0.385 1
1 683 . 13 1 1 A 65 65 THR CB C 2488 70.141 70.323 -0.182 1
1 685 . 13 1 1 A 65 65 THR N N 2488 117.924 116.958 0.966 1
1 686 . 13 1 1 A 66 66 PRO HA H 2489 4.602 4.836 -0.234 1
1 693 . 13 1 1 A 66 66 PRO C C 2489 176.647 176.632 0.015 1
1 694 . 13 1 1 A 66 66 PRO CA C 2489 61.442 62.313 -0.871 1
1 695 . 13 1 1 A 66 66 PRO CB C 2489 32.715 33.276 -0.561 1
1 698 . 13 1 1 A 67 67 MET H H 2490 8.832 8.321 0.511 1
1 699 . 13 1 1 A 67 67 MET HA H 2490 4.880 4.826 0.054 1
1 707 . 13 1 1 A 67 67 MET C C 2490 174.121 176.014 -1.893 1
1 708 . 13 1 1 A 67 67 MET CA C 2490 53.848 54.575 -0.727 1
1 709 . 13 1 1 A 67 67 MET CB C 2490 33.727 34.164 -0.437 1
1 712 . 13 1 1 A 67 67 MET N N 2490 119.212 117.009 2.203 1
1 713 . 13 1 1 A 68 68 ALA H H 2491 7.086 7.519 -0.433 1
1 714 . 13 1 1 A 68 68 ALA HA H 2491 4.851 4.835 0.016 1
1 718 . 13 1 1 A 68 68 ALA CA C 2491 49.222 49.856 -0.634 1
1 719 . 13 1 1 A 68 68 ALA CB C 2491 20.600 22.039 -1.439 1
1 720 . 13 1 1 A 68 68 ALA N N 2491 120.363 121.000 -0.637 1
1 721 . 13 1 1 A 69 69 PRO HA H 2492 4.263 4.582 -0.319 1
1 728 . 13 1 1 A 69 69 PRO C C 2492 174.370 176.156 -1.786 1
1 729 . 13 1 1 A 69 69 PRO CA C 2492 62.555 63.449 -0.894 1
1 730 . 13 1 1 A 69 69 PRO CB C 2492 32.752 32.845 -0.093 1
1 733 . 13 1 1 A 70 70 GLY H H 2493 8.858 8.291 0.567 1
1 734 . 13 1 1 A 70 70 GLY HA2 H 2493 4.544 4.061 0.483 1
1 735 . 13 1 1 A 70 70 GLY HA3 H 2493 3.849 4.112 -0.263 1
1 736 . 13 1 1 A 70 70 GLY C C 2493 172.182 172.193 -0.011 1
1 737 . 13 1 1 A 70 70 GLY CA C 2493 44.356 44.336 0.020 1
1 738 . 13 1 1 A 70 70 GLY N N 2493 106.539 109.281 -2.742 1
1 739 . 13 1 1 A 71 71 SER H H 2494 8.490 8.268 0.222 1
1 740 . 13 1 1 A 71 71 SER HA H 2494 5.280 5.172 0.108 1
1 743 . 13 1 1 A 71 71 SER C C 2494 173.512 173.548 -0.036 1
1 744 . 13 1 1 A 71 71 SER CA C 2494 57.674 58.358 -0.684 1
1 745 . 13 1 1 A 71 71 SER CB C 2494 63.799 64.287 -0.488 1
1 746 . 13 1 1 A 71 71 SER N N 2494 117.964 117.447 0.517 1
1 747 . 13 1 1 A 72 72 TYR H H 2495 9.320 9.522 -0.202 1
1 748 . 13 1 1 A 72 72 TYR HA H 2495 4.960 5.364 -0.404 1
1 755 . 13 1 1 A 72 72 TYR C C 2495 173.979 174.781 -0.802 1
1 756 . 13 1 1 A 72 72 TYR CA C 2495 56.384 56.922 -0.538 1
1 757 . 13 1 1 A 72 72 TYR CB C 2495 40.247 40.194 0.053 1
1 760 . 13 1 1 A 72 72 TYR N N 2495 126.442 125.989 0.453 1
1 761 . 13 1 1 A 73 73 LEU H H 2496 9.019 9.015 0.004 1
1 762 . 13 1 1 A 73 73 LEU HA H 2496 5.209 5.294 -0.085 1
1 772 . 13 1 1 A 73 73 LEU C C 2496 177.015 174.541 2.474 1
1 773 . 13 1 1 A 73 73 LEU CA C 2496 53.393 53.765 -0.372 1
1 774 . 13 1 1 A 73 73 LEU CB C 2496 43.918 44.729 -0.811 1
1 778 . 13 1 1 A 73 73 LEU N N 2496 125.439 125.316 0.123 1
1 779 . 13 1 1 A 74 74 ILE H H 2497 9.921 9.634 0.287 1
1 780 . 13 1 1 A 74 74 ILE HA H 2497 5.128 4.738 0.390 1
1 790 . 13 1 1 A 74 74 ILE C C 2497 175.730 174.808 0.922 1
1 791 . 13 1 1 A 74 74 ILE CA C 2497 60.930 60.113 0.817 1
1 792 . 13 1 1 A 74 74 ILE CB C 2497 39.488 37.809 1.679 1
1 796 . 13 1 1 A 74 74 ILE N N 2497 132.185 129.434 2.751 1
1 797 . 13 1 1 A 75 75 SER H H 2498 9.284 9.135 0.149 1
1 798 . 13 1 1 A 75 75 SER HA H 2498 5.111 5.037 0.074 1
1 801 . 13 1 1 A 75 75 SER C C 2498 173.449 173.683 -0.234 1
1 802 . 13 1 1 A 75 75 SER CA C 2498 58.260 58.114 0.146 1
1 803 . 13 1 1 A 75 75 SER CB C 2498 63.956 62.450 1.506 1
1 804 . 13 1 1 A 75 75 SER N N 2498 125.384 124.845 0.539 1
1 805 . 13 1 1 A 76 76 ILE H H 2499 9.861 8.902 0.959 1
1 806 . 13 1 1 A 76 76 ILE HA H 2499 4.814 4.726 0.088 1
1 816 . 13 1 1 A 76 76 ILE CA C 2499 61.034 60.620 0.414 1
1 817 . 13 1 1 A 76 76 ILE CB C 2499 40.387 38.085 2.302 1
1 821 . 13 1 1 A 76 76 ILE N N 2499 129.414 127.211 2.203 1
1 822 . 13 1 1 A 77 77 LYS H H 2500 8.827 8.975 -0.148 1
1 823 . 13 1 1 A 77 77 LYS HA H 2500 5.254 5.169 0.085 1
1 832 . 13 1 1 A 77 77 LYS C C 2500 175.245 174.369 0.876 1
1 833 . 13 1 1 A 77 77 LYS CA C 2500 54.388 54.897 -0.509 1
1 834 . 13 1 1 A 77 77 LYS CB C 2500 36.127 34.312 1.815 1
1 838 . 13 1 1 A 77 77 LYS N N 2500 126.922 127.978 -1.056 1
1 839 . 13 1 1 A 78 78 TYR H H 2501 8.408 9.021 -0.613 1
1 840 . 13 1 1 A 78 78 TYR HA H 2501 5.479 4.982 0.497 1
1 847 . 13 1 1 A 78 78 TYR C C 2501 174.792 176.264 -1.472 1
1 848 . 13 1 1 A 78 78 TYR CA C 2501 56.837 57.252 -0.415 1
1 849 . 13 1 1 A 78 78 TYR CB C 2501 44.008 41.036 2.972 1
1 852 . 13 1 1 A 78 78 TYR N N 2501 122.282 126.405 -4.123 1
1 853 . 13 1 1 A 79 79 GLY H H 2502 8.196 8.525 -0.329 1
1 854 . 13 1 1 A 79 79 GLY HA2 H 2502 4.040 3.765 0.275 1
1 855 . 13 1 1 A 79 79 GLY HA3 H 2502 3.465 3.958 -0.493 1
1 856 . 13 1 1 A 79 79 GLY C C 2502 173.932 173.546 0.386 1
1 857 . 13 1 1 A 79 79 GLY CA C 2502 45.741 45.767 -0.026 1
1 858 . 13 1 1 A 79 79 GLY N N 2502 113.451 114.509 -1.058 1
1 859 . 13 1 1 A 80 80 GLY H H 2503 7.589 7.852 -0.263 1
1 860 . 13 1 1 A 80 80 GLY HA2 H 2503 4.490 4.066 0.424 1
1 861 . 13 1 1 A 80 80 GLY HA3 H 2503 3.555 4.154 -0.599 1
1 862 . 13 1 1 A 80 80 GLY CA C 2503 43.540 44.670 -1.130 1
1 863 . 13 1 1 A 80 80 GLY N N 2503 107.293 107.199 0.094 1
1 864 . 13 1 1 A 81 81 PRO HA H 2504 4.320 4.337 -0.017 1
1 871 . 13 1 1 A 81 81 PRO C C 2504 175.311 175.295 0.016 1
1 872 . 13 1 1 A 81 81 PRO CA C 2504 62.722 63.517 -0.795 1
1 873 . 13 1 1 A 81 81 PRO CB C 2504 29.297 32.026 -2.729 1
1 876 . 13 1 1 A 82 82 TYR H H 2505 7.778 7.375 0.403 1
1 877 . 13 1 1 A 82 82 TYR HA H 2505 4.791 4.942 -0.151 1
1 884 . 13 1 1 A 82 82 TYR C C 2505 175.086 175.941 -0.855 1
1 885 . 13 1 1 A 82 82 TYR CA C 2505 56.111 56.501 -0.390 1
1 886 . 13 1 1 A 82 82 TYR CB C 2505 39.483 40.974 -1.491 1
1 889 . 13 1 1 A 82 82 TYR N N 2505 123.973 120.744 3.229 1
1 890 . 13 1 1 A 83 83 HIS H H 2506 8.625 8.954 -0.329 1
1 891 . 13 1 1 A 83 83 HIS HA H 2506 4.583 4.909 -0.326 1
1 896 . 13 1 1 A 83 83 HIS C C 2506 178.161 175.998 2.163 1
1 897 . 13 1 1 A 83 83 HIS CA C 2506 58.241 56.925 1.316 1
1 898 . 13 1 1 A 83 83 HIS CB C 2506 33.132 30.478 2.654 1
1 901 . 13 1 1 A 83 83 HIS N N 2506 124.092 121.189 2.903 1
1 902 . 13 1 1 A 84 84 ILE H H 2507 8.327 8.556 -0.229 1
1 903 . 13 1 1 A 84 84 ILE HA H 2507 4.553 4.293 0.260 1
1 913 . 13 1 1 A 84 84 ILE C C 2507 176.523 176.211 0.312 1
1 914 . 13 1 1 A 84 84 ILE CA C 2507 60.791 60.143 0.648 1
1 915 . 13 1 1 A 84 84 ILE CB C 2507 39.162 39.734 -0.572 1
1 919 . 13 1 1 A 84 84 ILE N N 2507 117.355 119.501 -2.146 1
1 920 . 13 1 1 A 85 85 GLY H H 2508 9.130 8.616 0.514 1
1 921 . 13 1 1 A 85 85 GLY HA2 H 2508 3.883 3.746 0.137 1
1 922 . 13 1 1 A 85 85 GLY HA3 H 2508 3.800 3.763 0.037 1
1 923 . 13 1 1 A 85 85 GLY C C 2508 174.438 175.441 -1.003 1
1 924 . 13 1 1 A 85 85 GLY CA C 2508 47.673 46.701 0.972 1
1 925 . 13 1 1 A 85 85 GLY N N 2508 111.346 109.649 1.697 1
1 926 . 13 1 1 A 86 86 GLY H H 2509 8.236 8.138 0.098 1
1 927 . 13 1 1 A 86 86 GLY HA2 H 2509 3.893 3.886 0.007 1
1 928 . 13 1 1 A 86 86 GLY HA3 H 2509 3.161 3.912 -0.751 1
1 929 . 13 1 1 A 86 86 GLY C C 2509 171.837 173.069 -1.232 1
1 930 . 13 1 1 A 86 86 GLY CA C 2509 44.844 45.383 -0.539 1
1 931 . 13 1 1 A 86 86 GLY N N 2509 115.594 118.073 -2.479 1
1 932 . 13 1 1 A 87 87 SER H H 2510 7.385 7.761 -0.376 1
1 933 . 13 1 1 A 87 87 SER HA H 2510 4.217 4.195 0.022 1
1 936 . 13 1 1 A 87 87 SER CA C 2510 54.783 55.229 -0.446 1
1 937 . 13 1 1 A 87 87 SER CB C 2510 62.683 64.138 -1.455 1
1 938 . 13 1 1 A 87 87 SER N N 2510 112.859 116.738 -3.879 1
1 939 . 13 1 1 A 88 88 PRO HA H 2511 5.532 4.751 0.781 1
1 946 . 13 1 1 A 88 88 PRO C C 2511 175.870 175.334 0.536 1
1 947 . 13 1 1 A 88 88 PRO CA C 2511 62.379 62.235 0.144 1
1 948 . 13 1 1 A 88 88 PRO CB C 2511 33.639 32.060 1.579 1
1 951 . 13 1 1 A 89 89 PHE H H 2512 9.359 8.459 0.900 1
1 952 . 13 1 1 A 89 89 PHE HA H 2512 4.467 4.796 -0.329 1
1 960 . 13 1 1 A 89 89 PHE C C 2512 175.152 176.067 -0.915 1
1 961 . 13 1 1 A 89 89 PHE CA C 2512 57.401 57.327 0.074 1
1 962 . 13 1 1 A 89 89 PHE CB C 2512 40.843 40.808 0.035 1
1 966 . 13 1 1 A 89 89 PHE N N 2512 124.789 119.837 4.952 1
1 967 . 13 1 1 A 90 90 LYS H H 2513 8.772 8.583 0.189 1
1 968 . 13 1 1 A 90 90 LYS HA H 2513 4.941 4.467 0.474 1
1 973 . 13 1 1 A 90 90 LYS C C 2513 174.183 176.512 -2.329 1
1 974 . 13 1 1 A 90 90 LYS CA C 2513 55.749 55.940 -0.191 1
1 975 . 13 1 1 A 90 90 LYS CB C 2513 32.817 31.958 0.859 1
1 978 . 13 1 1 A 90 90 LYS N N 2513 125.133 120.204 4.929 1
1 979 . 13 1 1 A 91 91 ALA H H 2514 9.158 7.430 1.728 1
1 980 . 13 1 1 A 91 91 ALA HA H 2514 4.510 4.266 0.244 1
1 984 . 13 1 1 A 91 91 ALA C C 2514 176.561 177.508 -0.947 1
1 985 . 13 1 1 A 91 91 ALA CA C 2514 50.528 53.080 -2.552 1
1 986 . 13 1 1 A 91 91 ALA CB C 2514 20.653 19.171 1.482 1
1 987 . 13 1 1 A 91 91 ALA N N 2514 131.989 123.501 8.488 1
1 988 . 13 1 1 A 92 92 LYS H H 2515 8.186 8.655 -0.469 1
1 989 . 13 1 1 A 92 92 LYS HA H 2515 4.926 4.919 0.007 1
1 998 . 13 1 1 A 92 92 LYS C C 2515 175.177 175.805 -0.628 1
1 999 . 13 1 1 A 92 92 LYS CA C 2515 55.725 55.522 0.203 1
1 1000 . 13 1 1 A 92 92 LYS CB C 2515 33.765 34.550 -0.785 1
1 1004 . 13 1 1 A 92 92 LYS N N 2515 124.887 124.369 0.518 1
1 1005 . 13 1 1 A 93 93 VAL H H 2516 9.362 9.220 0.142 1
1 1006 . 13 1 1 A 93 93 VAL HA H 2516 5.161 5.208 -0.047 1
1 1014 . 13 1 1 A 93 93 VAL C C 2516 176.988 175.511 1.477 1
1 1015 . 13 1 1 A 93 93 VAL CA C 2516 60.523 61.288 -0.765 1
1 1016 . 13 1 1 A 93 93 VAL CB C 2516 33.291 35.041 -1.750 1
1 1019 . 13 1 1 A 93 93 VAL N N 2516 129.943 123.909 6.034 1
1 1020 . 13 1 1 A 94 94 THR H H 2517 8.614 8.410 0.204 1
1 1021 . 13 1 1 A 94 94 THR HA H 2517 4.902 4.871 0.031 1
1 1026 . 13 1 1 A 94 94 THR C C 2517 172.759 173.459 -0.700 1
1 1027 . 13 1 1 A 94 94 THR CA C 2517 60.121 59.792 0.329 1
1 1028 . 13 1 1 A 94 94 THR CB C 2517 71.072 71.296 -0.224 1
1 1030 . 13 1 1 A 94 94 THR N N 2517 122.032 116.442 5.590 1
1 1031 . 13 1 1 A 95 95 GLY H H 2518 8.280 8.444 -0.164 1
1 1032 . 13 1 1 A 95 95 GLY HA2 H 2518 3.852 4.137 -0.285 1
1 1033 . 13 1 1 A 95 95 GLY HA3 H 2518 4.846 4.141 0.705 1
1 1034 . 13 1 1 A 95 95 GLY CA C 2518 43.955 44.495 -0.540 1
1 1035 . 13 1 1 A 95 95 GLY N N 2518 107.949 108.411 -0.462 1
1 1036 . 13 1 1 A 96 96 PRO HA H 2519 4.449 4.653 -0.204 1
1 1043 . 13 1 1 A 96 96 PRO C C 2519 176.892 176.247 0.645 1
1 1044 . 13 1 1 A 96 96 PRO CA C 2519 62.062 62.712 -0.650 1
1 1045 . 13 1 1 A 96 96 PRO CB C 2519 32.286 32.180 0.106 1
1 1048 . 13 1 1 A 97 97 ARG H H 2520 8.651 8.545 0.106 1
1 1049 . 13 1 1 A 97 97 ARG HA H 2520 4.348 4.488 -0.140 1
1 1056 . 13 1 1 A 97 97 ARG C C 2520 176.236 176.238 -0.002 1
1 1057 . 13 1 1 A 97 97 ARG CA C 2520 57.587 56.218 1.369 1
1 1058 . 13 1 1 A 97 97 ARG CB C 2520 30.472 30.480 -0.008 1
1 1061 . 13 1 1 A 97 97 ARG N N 2520 120.781 122.033 -1.252 1
1 1062 . 13 1 1 A 98 98 LEU H H 2521 8.545 8.943 -0.398 1
1 1063 . 13 1 1 A 98 98 LEU HA H 2521 4.577 4.254 0.323 1
1 1073 . 13 1 1 A 98 98 LEU C C 2521 175.880 178.208 -2.328 1
1 1074 . 13 1 1 A 98 98 LEU CA C 2521 55.068 56.438 -1.370 1
1 1075 . 13 1 1 A 98 98 LEU CB C 2521 43.082 42.097 0.985 1
1 1079 . 13 1 1 A 98 98 LEU N N 2521 128.715 127.803 0.912 1
1 4 . 14 1 1 A 2 2 ALA HA H -2 4.374 4.418 -0.044 1
1 8 . 14 1 1 A 2 2 ALA C C -2 177.865 178.231 -0.366 1
1 9 . 14 1 1 A 2 2 ALA CA C -2 52.670 51.414 1.256 1
1 10 . 14 1 1 A 2 2 ALA CB C -2 19.508 20.583 -1.075 1
1 32 . 14 1 1 A 5 5 ASP H H 2428 8.300 8.972 -0.672 1
1 33 . 14 1 1 A 5 5 ASP HA H 2428 5.082 5.015 0.067 1
1 36 . 14 1 1 A 5 5 ASP CA C 2428 51.517 51.940 -0.423 1
1 37 . 14 1 1 A 5 5 ASP CB C 2428 42.244 40.364 1.880 1
1 38 . 14 1 1 A 5 5 ASP N N 2428 122.879 125.922 -3.043 1
1 39 . 14 1 1 A 6 6 PRO HA H 2429 4.340 4.430 -0.090 1
1 46 . 14 1 1 A 6 6 PRO C C 2429 178.266 178.567 -0.301 1
1 47 . 14 1 1 A 6 6 PRO CA C 2429 64.494 64.659 -0.165 1
1 48 . 14 1 1 A 6 6 PRO CB C 2429 31.841 31.983 -0.142 1
1 51 . 14 1 1 A 7 7 GLY H H 2430 8.686 8.435 0.251 1
1 52 . 14 1 1 A 7 7 GLY HA2 H 2430 4.116 3.803 0.313 1
1 53 . 14 1 1 A 7 7 GLY HA3 H 2430 3.868 3.805 0.063 1
1 54 . 14 1 1 A 7 7 GLY C C 2430 174.567 175.408 -0.841 1
1 55 . 14 1 1 A 7 7 GLY CA C 2430 46.038 46.621 -0.583 1
1 56 . 14 1 1 A 7 7 GLY N N 2430 107.655 106.151 1.504 1
1 57 . 14 1 1 A 8 8 LEU H H 2431 7.692 7.495 0.197 1
1 58 . 14 1 1 A 8 8 LEU HA H 2431 4.507 4.390 0.117 1
1 68 . 14 1 1 A 8 8 LEU C C 2431 176.876 177.390 -0.514 1
1 69 . 14 1 1 A 8 8 LEU CA C 2431 54.307 56.018 -1.711 1
1 70 . 14 1 1 A 8 8 LEU CB C 2431 42.879 42.922 -0.043 1
1 74 . 14 1 1 A 8 8 LEU N N 2431 120.022 119.728 0.294 1
1 75 . 14 1 1 A 9 9 VAL H H 2432 7.378 7.400 -0.022 1
1 76 . 14 1 1 A 9 9 VAL HA H 2432 4.154 3.904 0.250 1
1 84 . 14 1 1 A 9 9 VAL C C 2432 174.703 175.756 -1.053 1
1 85 . 14 1 1 A 9 9 VAL CA C 2432 62.387 63.173 -0.786 1
1 86 . 14 1 1 A 9 9 VAL CB C 2432 32.519 31.513 1.006 1
1 89 . 14 1 1 A 9 9 VAL N N 2432 123.902 119.617 4.285 1
1 90 . 14 1 1 A 10 10 SER H H 2433 8.201 8.711 -0.510 1
1 91 . 14 1 1 A 10 10 SER HA H 2433 5.136 5.326 -0.190 1
1 94 . 14 1 1 A 10 10 SER CA C 2433 56.554 57.215 -0.661 1
1 95 . 14 1 1 A 10 10 SER CB C 2433 66.763 66.830 -0.067 1
1 96 . 14 1 1 A 10 10 SER N N 2433 121.921 122.948 -1.027 1
1 97 . 14 1 1 A 11 11 ALA H H 2434 8.670 8.359 0.311 1
1 98 . 14 1 1 A 11 11 ALA HA H 2434 5.632 5.313 0.319 1
1 102 . 14 1 1 A 11 11 ALA C C 2434 175.459 174.627 0.832 1
1 103 . 14 1 1 A 11 11 ALA CA C 2434 50.575 50.554 0.021 1
1 104 . 14 1 1 A 11 11 ALA CB C 2434 23.111 23.408 -0.297 1
1 105 . 14 1 1 A 11 11 ALA N N 2434 124.828 122.815 2.013 1
1 106 . 14 1 1 A 12 12 TYR H H 2435 8.609 8.660 -0.051 1
1 107 . 14 1 1 A 12 12 TYR HA H 2435 4.879 5.072 -0.193 1
1 114 . 14 1 1 A 12 12 TYR C C 2435 173.645 174.618 -0.973 1
1 115 . 14 1 1 A 12 12 TYR CA C 2435 56.268 56.603 -0.335 1
1 116 . 14 1 1 A 12 12 TYR CB C 2435 39.522 42.558 -3.036 1
1 119 . 14 1 1 A 12 12 TYR N N 2435 118.305 119.206 -0.901 1
1 120 . 14 1 1 A 13 13 GLY H H 2436 8.655 8.533 0.122 1
1 121 . 14 1 1 A 13 13 GLY HA2 H 2436 4.943 4.301 0.642 1
1 122 . 14 1 1 A 13 13 GLY HA3 H 2436 4.028 4.339 -0.311 1
1 123 . 14 1 1 A 13 13 GLY C C 2436 175.334 174.919 0.415 1
1 124 . 14 1 1 A 13 13 GLY CA C 2436 44.389 44.388 0.001 1
1 125 . 14 1 1 A 13 13 GLY N N 2436 110.710 110.413 0.297 1
1 126 . 14 1 1 A 14 14 ALA H H 2437 8.939 8.730 0.209 1
1 127 . 14 1 1 A 14 14 ALA HA H 2437 4.276 4.099 0.177 1
1 131 . 14 1 1 A 14 14 ALA C C 2437 180.524 179.170 1.354 1
1 132 . 14 1 1 A 14 14 ALA CA C 2437 55.551 55.081 0.470 1
1 133 . 14 1 1 A 14 14 ALA CB C 2437 18.411 18.391 0.020 1
1 134 . 14 1 1 A 14 14 ALA N N 2437 126.973 123.934 3.039 1
1 135 . 14 1 1 A 15 15 GLY H H 2438 8.933 8.690 0.243 1
1 136 . 14 1 1 A 15 15 GLY HA2 H 2438 4.531 4.033 0.498 1
1 137 . 14 1 1 A 15 15 GLY HA3 H 2438 3.576 4.234 -0.658 1
1 138 . 14 1 1 A 15 15 GLY C C 2438 174.323 175.400 -1.077 1
1 139 . 14 1 1 A 15 15 GLY CA C 2438 46.855 46.869 -0.014 1
1 140 . 14 1 1 A 15 15 GLY N N 2438 104.803 105.678 -0.875 1
1 141 . 14 1 1 A 16 16 LEU H H 2439 7.529 7.644 -0.115 1
1 142 . 14 1 1 A 16 16 LEU HA H 2439 3.768 3.878 -0.110 1
1 152 . 14 1 1 A 16 16 LEU C C 2439 176.388 178.657 -2.269 1
1 153 . 14 1 1 A 16 16 LEU CA C 2439 56.137 57.110 -0.973 1
1 154 . 14 1 1 A 16 16 LEU CB C 2439 41.621 41.122 0.499 1
1 158 . 14 1 1 A 16 16 LEU N N 2439 119.633 121.819 -2.186 1
1 159 . 14 1 1 A 17 17 GLU H H 2440 7.505 7.889 -0.384 1
1 160 . 14 1 1 A 17 17 GLU HA H 2440 4.663 4.410 0.253 1
1 165 . 14 1 1 A 17 17 GLU C C 2440 178.126 177.270 0.856 1
1 166 . 14 1 1 A 17 17 GLU CA C 2440 56.447 56.510 -0.063 1
1 167 . 14 1 1 A 17 17 GLU CB C 2440 31.485 30.689 0.796 1
1 169 . 14 1 1 A 17 17 GLU N N 2440 114.368 116.122 -1.754 1
1 170 . 14 1 1 A 18 18 GLY H H 2441 7.921 7.521 0.400 1
1 171 . 14 1 1 A 18 18 GLY HA2 H 2441 4.889 4.127 0.762 1
1 172 . 14 1 1 A 18 18 GLY HA3 H 2441 3.707 4.152 -0.445 1
1 173 . 14 1 1 A 18 18 GLY C C 2441 170.965 172.711 -1.746 1
1 174 . 14 1 1 A 18 18 GLY CA C 2441 45.549 44.430 1.119 1
1 175 . 14 1 1 A 18 18 GLY N N 2441 109.165 107.085 2.080 1
1 176 . 14 1 1 A 19 19 GLY H H 2442 7.540 7.942 -0.402 1
1 177 . 14 1 1 A 19 19 GLY HA2 H 2442 4.086 4.211 -0.125 1
1 178 . 14 1 1 A 19 19 GLY HA3 H 2442 4.086 4.226 -0.140 1
1 179 . 14 1 1 A 19 19 GLY C C 2442 171.051 172.432 -1.381 1
1 180 . 14 1 1 A 19 19 GLY CA C 2442 44.937 44.595 0.342 1
1 181 . 14 1 1 A 19 19 GLY N N 2442 105.460 107.747 -2.287 1
1 182 . 14 1 1 A 20 20 VAL H H 2443 8.899 8.236 0.663 1
1 183 . 14 1 1 A 20 20 VAL HA H 2443 5.062 4.403 0.659 1
1 191 . 14 1 1 A 20 20 VAL C C 2443 176.623 175.924 0.699 1
1 192 . 14 1 1 A 20 20 VAL CA C 2443 60.197 62.623 -2.426 1
1 193 . 14 1 1 A 20 20 VAL CB C 2443 35.107 31.956 3.151 1
1 196 . 14 1 1 A 20 20 VAL N N 2443 122.753 121.468 1.285 1
1 197 . 14 1 1 A 21 21 THR H H 2444 8.630 8.620 0.010 1
1 198 . 14 1 1 A 21 21 THR HA H 2444 3.773 4.327 -0.554 1
1 203 . 14 1 1 A 21 21 THR C C 2444 175.646 174.936 0.710 1
1 204 . 14 1 1 A 21 21 THR CA C 2444 62.732 62.408 0.324 1
1 205 . 14 1 1 A 21 21 THR CB C 2444 68.925 68.909 0.016 1
1 207 . 14 1 1 A 21 21 THR N N 2444 118.179 119.614 -1.435 1
1 208 . 14 1 1 A 22 22 GLY H H 2445 8.736 9.066 -0.330 1
1 209 . 14 1 1 A 22 22 GLY HA2 H 2445 3.412 3.994 -0.582 1
1 210 . 14 1 1 A 22 22 GLY HA3 H 2445 4.061 3.997 0.064 1
1 211 . 14 1 1 A 22 22 GLY C C 2445 172.973 173.888 -0.915 1
1 212 . 14 1 1 A 22 22 GLY CA C 2445 45.577 45.030 0.547 1
1 213 . 14 1 1 A 22 22 GLY N N 2445 107.888 113.680 -5.792 1
1 214 . 14 1 1 A 23 23 ASN H H 2446 7.877 7.923 -0.046 1
1 215 . 14 1 1 A 23 23 ASN HA H 2446 5.253 4.986 0.267 1
1 220 . 14 1 1 A 23 23 ASN CA C 2446 49.740 50.695 -0.955 1
1 221 . 14 1 1 A 23 23 ASN CB C 2446 40.198 38.754 1.444 1
1 222 . 14 1 1 A 23 23 ASN N N 2446 120.684 120.001 0.683 1
1 224 . 14 1 1 A 24 24 PRO HA H 2447 4.525 4.594 -0.069 1
1 231 . 14 1 1 A 24 24 PRO CA C 2447 62.766 62.421 0.345 1
1 232 . 14 1 1 A 24 24 PRO CB C 2447 31.732 32.582 -0.850 1
1 235 . 14 1 1 A 25 25 ALA H H 2448 9.178 8.274 0.904 1
1 236 . 14 1 1 A 25 25 ALA HA H 2448 4.614 5.044 -0.430 1
1 240 . 14 1 1 A 25 25 ALA C C 2448 175.503 175.585 -0.082 1
1 241 . 14 1 1 A 25 25 ALA CA C 2448 50.526 50.120 0.406 1
1 242 . 14 1 1 A 25 25 ALA CB C 2448 20.458 21.908 -1.450 1
1 243 . 14 1 1 A 25 25 ALA N N 2448 132.079 122.258 9.821 1
1 244 . 14 1 1 A 26 26 GLU H H 2449 8.813 8.781 0.032 1
1 245 . 14 1 1 A 26 26 GLU HA H 2449 5.830 5.140 0.690 1
1 250 . 14 1 1 A 26 26 GLU C C 2449 176.272 174.563 1.709 1
1 251 . 14 1 1 A 26 26 GLU CA C 2449 54.376 55.475 -1.099 1
1 252 . 14 1 1 A 26 26 GLU CB C 2449 35.463 33.175 2.288 1
1 254 . 14 1 1 A 26 26 GLU N N 2449 120.079 121.706 -1.627 1
1 255 . 14 1 1 A 27 27 PHE H H 2450 8.782 8.692 0.090 1
1 256 . 14 1 1 A 27 27 PHE HA H 2450 5.021 5.135 -0.114 1
1 264 . 14 1 1 A 27 27 PHE C C 2450 171.205 172.034 -0.829 1
1 265 . 14 1 1 A 27 27 PHE CA C 2450 56.852 56.343 0.509 1
1 266 . 14 1 1 A 27 27 PHE CB C 2450 41.080 41.075 0.005 1
1 270 . 14 1 1 A 27 27 PHE N N 2450 118.670 120.156 -1.486 1
1 271 . 14 1 1 A 28 28 VAL H H 2451 8.961 9.220 -0.259 1
1 272 . 14 1 1 A 28 28 VAL HA H 2451 4.761 4.688 0.073 1
1 280 . 14 1 1 A 28 28 VAL C C 2451 174.673 175.320 -0.647 1
1 281 . 14 1 1 A 28 28 VAL CA C 2451 60.619 60.970 -0.351 1
1 282 . 14 1 1 A 28 28 VAL CB C 2451 35.484 34.202 1.282 1
1 285 . 14 1 1 A 28 28 VAL N N 2451 121.552 120.361 1.191 1
1 286 . 14 1 1 A 29 29 VAL H H 2452 9.294 9.499 -0.205 1
1 287 . 14 1 1 A 29 29 VAL HA H 2452 4.363 4.464 -0.101 1
1 295 . 14 1 1 A 29 29 VAL C C 2452 174.218 174.998 -0.780 1
1 296 . 14 1 1 A 29 29 VAL CA C 2452 61.526 62.504 -0.978 1
1 297 . 14 1 1 A 29 29 VAL CB C 2452 32.666 31.154 1.512 1
1 300 . 14 1 1 A 29 29 VAL N N 2452 125.585 128.516 -2.931 1
1 301 . 14 1 1 A 30 30 ASN H H 2453 9.465 9.038 0.427 1
1 302 . 14 1 1 A 30 30 ASN HA H 2453 5.096 5.109 -0.013 1
1 307 . 14 1 1 A 30 30 ASN C C 2453 176.216 176.304 -0.088 1
1 308 . 14 1 1 A 30 30 ASN CA C 2453 52.011 52.636 -0.625 1
1 309 . 14 1 1 A 30 30 ASN CB C 2453 39.057 38.707 0.350 1
1 310 . 14 1 1 A 30 30 ASN N N 2453 127.724 127.057 0.667 1
1 312 . 14 1 1 A 31 31 THR H H 2454 8.915 8.506 0.409 1
1 313 . 14 1 1 A 31 31 THR HA H 2454 4.342 4.413 -0.071 1
1 318 . 14 1 1 A 31 31 THR C C 2454 176.816 176.273 0.543 1
1 319 . 14 1 1 A 31 31 THR CA C 2454 61.117 61.840 -0.723 1
1 320 . 14 1 1 A 31 31 THR CB C 2454 68.209 69.649 -1.440 1
1 322 . 14 1 1 A 31 31 THR N N 2454 117.783 116.920 0.863 1
1 323 . 14 1 1 A 32 32 SER H H 2455 8.454 7.907 0.547 1
1 324 . 14 1 1 A 32 32 SER HA H 2455 4.155 4.101 0.054 1
1 327 . 14 1 1 A 32 32 SER C C 2455 175.458 175.633 -0.175 1
1 328 . 14 1 1 A 32 32 SER CA C 2455 62.148 62.370 -0.222 1
1 329 . 14 1 1 A 32 32 SER CB C 2455 63.476 62.947 0.529 1
1 330 . 14 1 1 A 32 32 SER N N 2455 121.781 119.069 2.712 1
1 331 . 14 1 1 A 33 33 ASN H H 2456 8.845 8.091 0.754 1
1 332 . 14 1 1 A 33 33 ASN HA H 2456 5.064 4.571 0.493 1
1 337 . 14 1 1 A 33 33 ASN C C 2456 174.674 175.934 -1.260 1
1 338 . 14 1 1 A 33 33 ASN CA C 2456 53.067 54.712 -1.645 1
1 339 . 14 1 1 A 33 33 ASN CB C 2456 39.632 38.746 0.886 1
1 340 . 14 1 1 A 33 33 ASN N N 2456 120.176 118.065 2.111 1
1 342 . 14 1 1 A 34 34 ALA H H 2457 7.714 7.822 -0.108 1
1 343 . 14 1 1 A 34 34 ALA HA H 2457 4.482 4.439 0.043 1
1 347 . 14 1 1 A 34 34 ALA C C 2457 177.582 177.592 -0.010 1
1 348 . 14 1 1 A 34 34 ALA CA C 2457 52.521 53.164 -0.643 1
1 349 . 14 1 1 A 34 34 ALA CB C 2457 22.252 20.998 1.254 1
1 350 . 14 1 1 A 34 34 ALA N N 2457 123.065 120.401 2.664 1
1 351 . 14 1 1 A 35 35 GLY H H 2458 8.195 7.771 0.424 1
1 352 . 14 1 1 A 35 35 GLY HA2 H 2458 4.246 4.186 0.060 1
1 353 . 14 1 1 A 35 35 GLY HA3 H 2458 3.902 4.206 -0.304 1
1 354 . 14 1 1 A 35 35 GLY C C 2458 173.360 172.801 0.559 1
1 355 . 14 1 1 A 35 35 GLY CA C 2458 44.486 44.935 -0.449 1
1 356 . 14 1 1 A 35 35 GLY N N 2458 108.472 104.064 4.408 1
1 357 . 14 1 1 A 36 36 ALA H H 2459 8.430 8.457 -0.027 1
1 358 . 14 1 1 A 36 36 ALA HA H 2459 4.472 5.244 -0.772 1
1 362 . 14 1 1 A 36 36 ALA C C 2459 176.968 176.068 0.900 1
1 363 . 14 1 1 A 36 36 ALA CA C 2459 52.695 51.156 1.539 1
1 364 . 14 1 1 A 36 36 ALA CB C 2459 19.360 22.910 -3.550 1
1 365 . 14 1 1 A 36 36 ALA N N 2459 126.012 124.893 1.119 1
1 366 . 14 1 1 A 37 37 GLY H H 2460 7.781 8.364 -0.583 1
1 367 . 14 1 1 A 37 37 GLY HA2 H 2460 3.856 3.859 -0.003 1
1 368 . 14 1 1 A 37 37 GLY HA3 H 2460 3.164 4.038 -0.874 1
1 369 . 14 1 1 A 37 37 GLY C C 2460 170.730 171.940 -1.210 1
1 370 . 14 1 1 A 37 37 GLY CA C 2460 44.747 44.516 0.231 1
1 371 . 14 1 1 A 37 37 GLY N N 2460 109.493 105.298 4.195 1
1 372 . 14 1 1 A 38 38 ALA H H 2461 8.055 7.952 0.103 1
1 373 . 14 1 1 A 38 38 ALA HA H 2461 4.389 4.641 -0.252 1
1 377 . 14 1 1 A 38 38 ALA C C 2461 176.609 176.127 0.482 1
1 378 . 14 1 1 A 38 38 ALA CA C 2461 51.419 51.576 -0.157 1
1 379 . 14 1 1 A 38 38 ALA CB C 2461 19.665 19.610 0.055 1
1 380 . 14 1 1 A 38 38 ALA N N 2461 121.997 122.180 -0.183 1
1 381 . 14 1 1 A 39 39 LEU H H 2462 8.597 8.429 0.168 1
1 382 . 14 1 1 A 39 39 LEU HA H 2462 5.022 5.169 -0.147 1
1 392 . 14 1 1 A 39 39 LEU C C 2462 175.883 174.801 1.082 1
1 393 . 14 1 1 A 39 39 LEU CA C 2462 53.907 53.231 0.676 1
1 394 . 14 1 1 A 39 39 LEU CB C 2462 44.576 45.400 -0.824 1
1 398 . 14 1 1 A 39 39 LEU N N 2462 126.664 123.885 2.779 1
1 399 . 14 1 1 A 40 40 SER H H 2463 8.898 8.931 -0.033 1
1 400 . 14 1 1 A 40 40 SER HA H 2463 4.732 4.755 -0.023 1
1 403 . 14 1 1 A 40 40 SER C C 2463 172.984 172.982 0.002 1
1 404 . 14 1 1 A 40 40 SER CA C 2463 56.730 57.214 -0.484 1
1 405 . 14 1 1 A 40 40 SER CB C 2463 64.648 63.109 1.539 1
1 406 . 14 1 1 A 40 40 SER N N 2463 122.932 120.782 2.150 1
1 407 . 14 1 1 A 41 41 VAL H H 2464 8.538 8.447 0.091 1
1 408 . 14 1 1 A 41 41 VAL HA H 2464 5.131 4.308 0.823 1
1 416 . 14 1 1 A 41 41 VAL C C 2464 174.812 175.172 -0.360 1
1 417 . 14 1 1 A 41 41 VAL CA C 2464 60.784 62.612 -1.828 1
1 418 . 14 1 1 A 41 41 VAL CB C 2464 34.262 32.376 1.886 1
1 420 . 14 1 1 A 41 41 VAL N N 2464 129.161 125.613 3.548 1
1 421 . 14 1 1 A 42 42 THR H H 2465 8.807 8.705 0.102 1
1 422 . 14 1 1 A 42 42 THR HA H 2465 4.573 5.159 -0.586 1
1 427 . 14 1 1 A 42 42 THR CA C 2465 60.408 61.483 -1.075 1
1 428 . 14 1 1 A 42 42 THR CB C 2465 71.764 71.494 0.270 1
1 430 . 14 1 1 A 42 42 THR N N 2465 120.898 123.182 -2.284 1
1 431 . 14 1 1 A 43 43 ILE H H 2466 8.648 8.912 -0.264 1
1 432 . 14 1 1 A 43 43 ILE HA H 2466 4.854 5.001 -0.147 1
1 442 . 14 1 1 A 43 43 ILE C C 2466 174.073 174.115 -0.042 1
1 443 . 14 1 1 A 43 43 ILE CA C 2466 61.184 60.197 0.987 1
1 444 . 14 1 1 A 43 43 ILE CB C 2466 39.516 40.732 -1.216 1
1 448 . 14 1 1 A 43 43 ILE N N 2466 124.810 125.886 -1.076 1
1 449 . 14 1 1 A 44 44 ASP H H 2467 8.821 9.098 -0.277 1
1 450 . 14 1 1 A 44 44 ASP HA H 2467 5.217 5.607 -0.390 1
1 453 . 14 1 1 A 44 44 ASP C C 2467 175.002 175.221 -0.219 1
1 454 . 14 1 1 A 44 44 ASP CA C 2467 52.998 52.460 0.538 1
1 455 . 14 1 1 A 44 44 ASP CB C 2467 44.728 44.618 0.110 1
1 456 . 14 1 1 A 44 44 ASP N N 2467 129.093 128.330 0.763 1
1 457 . 14 1 1 A 45 45 GLY H H 2468 8.535 8.326 0.209 1
1 458 . 14 1 1 A 45 45 GLY HA2 H 2468 3.954 3.848 0.106 1
1 459 . 14 1 1 A 45 45 GLY HA3 H 2468 3.561 4.044 -0.483 1
1 460 . 14 1 1 A 45 45 GLY CA C 2468 45.659 45.055 0.604 1
1 461 . 14 1 1 A 45 45 GLY N N 2468 112.751 110.601 2.150 1
1 462 . 14 1 1 A 46 46 PRO HA H 2469 4.318 4.376 -0.058 1
1 469 . 14 1 1 A 46 46 PRO C C 2469 176.086 176.375 -0.289 1
1 470 . 14 1 1 A 46 46 PRO CA C 2469 64.198 63.999 0.199 1
1 471 . 14 1 1 A 46 46 PRO CB C 2469 32.348 32.066 0.282 1
1 474 . 14 1 1 A 47 47 SER H H 2470 7.106 7.816 -0.710 1
1 475 . 14 1 1 A 47 47 SER HA H 2470 4.632 4.875 -0.243 1
1 478 . 14 1 1 A 47 47 SER C C 2470 172.969 173.263 -0.294 1
1 479 . 14 1 1 A 47 47 SER CA C 2470 57.106 57.865 -0.759 1
1 480 . 14 1 1 A 47 47 SER CB C 2470 66.262 67.187 -0.925 1
1 481 . 14 1 1 A 47 47 SER N N 2470 110.556 114.018 -3.462 1
1 482 . 14 1 1 A 48 48 LYS H H 2471 8.534 8.531 0.003 1
1 483 . 14 1 1 A 48 48 LYS HA H 2471 4.486 4.423 0.063 1
1 492 . 14 1 1 A 48 48 LYS C C 2471 177.231 177.322 -0.091 1
1 493 . 14 1 1 A 48 48 LYS CA C 2471 56.620 57.044 -0.424 1
1 494 . 14 1 1 A 48 48 LYS CB C 2471 32.379 32.272 0.107 1
1 498 . 14 1 1 A 48 48 LYS N N 2471 124.055 124.807 -0.752 1
1 499 . 14 1 1 A 49 49 VAL H H 2472 8.497 8.396 0.101 1
1 500 . 14 1 1 A 49 49 VAL HA H 2472 4.552 4.265 0.287 1
1 508 . 14 1 1 A 49 49 VAL C C 2472 175.292 175.744 -0.452 1
1 509 . 14 1 1 A 49 49 VAL CA C 2472 60.142 61.819 -1.677 1
1 510 . 14 1 1 A 49 49 VAL CB C 2472 33.464 32.790 0.674 1
1 513 . 14 1 1 A 49 49 VAL N N 2472 121.233 121.285 -0.052 1
1 514 . 14 1 1 A 50 50 LYS H H 2473 8.190 8.508 -0.318 1
1 515 . 14 1 1 A 50 50 LYS HA H 2473 4.522 4.524 -0.002 1
1 518 . 14 1 1 A 50 50 LYS CA C 2473 55.952 56.700 -0.748 1
1 519 . 14 1 1 A 50 50 LYS CB C 2473 32.896 33.202 -0.306 1
1 520 . 14 1 1 A 50 50 LYS N N 2473 126.082 123.652 2.430 1
1 521 . 14 1 1 A 51 51 MET H H 2474 8.818 8.691 0.127 1
1 522 . 14 1 1 A 51 51 MET HA H 2474 5.324 5.089 0.235 1
1 530 . 14 1 1 A 51 51 MET C C 2474 173.933 173.647 0.286 1
1 531 . 14 1 1 A 51 51 MET CA C 2474 54.848 54.467 0.381 1
1 532 . 14 1 1 A 51 51 MET CB C 2474 37.043 35.831 1.212 1
1 535 . 14 1 1 A 51 51 MET N N 2474 126.911 122.450 4.461 1
1 536 . 14 1 1 A 52 52 ASP H H 2475 9.095 9.135 -0.040 1
1 537 . 14 1 1 A 52 52 ASP HA H 2475 4.947 5.432 -0.485 1
1 540 . 14 1 1 A 52 52 ASP C C 2475 173.923 174.709 -0.786 1
1 541 . 14 1 1 A 52 52 ASP CA C 2475 53.487 52.770 0.717 1
1 542 . 14 1 1 A 52 52 ASP CB C 2475 44.765 44.386 0.379 1
1 543 . 14 1 1 A 52 52 ASP N N 2475 125.526 124.755 0.771 1
1 544 . 14 1 1 A 53 53 CYS H H 2476 8.606 8.797 -0.191 1
1 545 . 14 1 1 A 53 53 CYS HA H 2476 5.145 5.269 -0.124 1
1 548 . 14 1 1 A 53 53 CYS C C 2476 173.330 172.860 0.470 1
1 549 . 14 1 1 A 53 53 CYS CA C 2476 57.452 58.065 -0.613 1
1 550 . 14 1 1 A 53 53 CYS CB C 2476 28.108 30.823 -2.715 1
1 551 . 14 1 1 A 53 53 CYS N N 2476 124.317 120.057 4.260 1
1 552 . 14 1 1 A 54 54 GLN H H 2477 8.978 8.748 0.230 1
1 553 . 14 1 1 A 54 54 GLN HA H 2477 4.884 4.703 0.181 1
1 560 . 14 1 1 A 54 54 GLN C C 2477 174.854 174.360 0.494 1
1 561 . 14 1 1 A 54 54 GLN CA C 2477 53.891 55.067 -1.176 1
1 562 . 14 1 1 A 54 54 GLN CB C 2477 32.837 33.185 -0.348 1
1 564 . 14 1 1 A 54 54 GLN N N 2477 127.074 125.070 2.004 1
1 566 . 14 1 1 A 55 55 GLU H H 2478 9.065 8.565 0.500 1
1 567 . 14 1 1 A 55 55 GLU HA H 2478 4.280 4.294 -0.014 1
1 572 . 14 1 1 A 55 55 GLU C C 2478 175.383 176.099 -0.716 1
1 573 . 14 1 1 A 55 55 GLU CA C 2478 57.516 56.538 0.978 1
1 574 . 14 1 1 A 55 55 GLU CB C 2478 30.346 29.695 0.651 1
1 576 . 14 1 1 A 55 55 GLU N N 2478 125.186 122.964 2.222 1
1 577 . 14 1 1 A 56 56 CYS H H 2479 8.407 8.206 0.201 1
1 578 . 14 1 1 A 56 56 CYS HA H 2479 5.056 4.879 0.177 1
1 581 . 14 1 1 A 56 56 CYS CA C 2479 55.858 56.492 -0.634 1
1 582 . 14 1 1 A 56 56 CYS CB C 2479 28.676 30.024 -1.348 1
1 583 . 14 1 1 A 56 56 CYS N N 2479 121.499 121.483 0.016 1
1 584 . 14 1 1 A 57 57 PRO HA H 2480 4.159 4.274 -0.115 1
1 591 . 14 1 1 A 57 57 PRO C C 2480 177.964 177.750 0.214 1
1 592 . 14 1 1 A 57 57 PRO CA C 2480 66.877 64.943 1.934 1
1 593 . 14 1 1 A 57 57 PRO CB C 2480 31.709 31.853 -0.144 1
1 596 . 14 1 1 A 58 58 GLU H H 2481 8.900 8.112 0.788 1
1 597 . 14 1 1 A 58 58 GLU HA H 2481 4.201 4.333 -0.132 1
1 602 . 14 1 1 A 58 58 GLU C C 2481 175.129 176.512 -1.383 1
1 603 . 14 1 1 A 58 58 GLU CA C 2481 57.883 57.074 0.809 1
1 604 . 14 1 1 A 58 58 GLU CB C 2481 29.991 30.255 -0.264 1
1 606 . 14 1 1 A 58 58 GLU N N 2481 115.316 117.646 -2.330 1
1 607 . 14 1 1 A 59 59 GLY H H 2482 7.527 7.405 0.122 1
1 608 . 14 1 1 A 59 59 GLY HA2 H 2482 4.935 3.971 0.964 1
1 609 . 14 1 1 A 59 59 GLY HA3 H 2482 3.381 4.056 -0.675 1
1 610 . 14 1 1 A 59 59 GLY CA C 2482 47.809 43.894 3.915 1
1 611 . 14 1 1 A 59 59 GLY N N 2482 110.079 107.878 2.201 1
1 612 . 14 1 1 A 60 60 TYR H H 2483 8.990 8.555 0.435 1
1 613 . 14 1 1 A 60 60 TYR HA H 2483 5.157 4.650 0.507 1
1 618 . 14 1 1 A 60 60 TYR C C 2483 175.096 175.212 -0.116 1
1 619 . 14 1 1 A 60 60 TYR CA C 2483 57.375 59.203 -1.828 1
1 620 . 14 1 1 A 60 60 TYR CB C 2483 43.153 38.748 4.405 1
1 622 . 14 1 1 A 60 60 TYR N N 2483 125.900 121.400 4.500 1
1 623 . 14 1 1 A 61 61 ARG H H 2484 9.557 9.024 0.533 1
1 624 . 14 1 1 A 61 61 ARG HA H 2484 4.858 4.766 0.092 1
1 631 . 14 1 1 A 61 61 ARG CA C 2484 55.016 55.278 -0.262 1
1 632 . 14 1 1 A 61 61 ARG CB C 2484 32.128 31.623 0.505 1
1 635 . 14 1 1 A 61 61 ARG N N 2484 124.847 126.158 -1.311 1
1 636 . 14 1 1 A 62 62 VAL H H 2485 9.046 8.954 0.092 1
1 637 . 14 1 1 A 62 62 VAL HA H 2485 4.675 4.726 -0.051 1
1 645 . 14 1 1 A 62 62 VAL C C 2485 173.837 174.675 -0.838 1
1 646 . 14 1 1 A 62 62 VAL CA C 2485 60.752 60.759 -0.007 1
1 647 . 14 1 1 A 62 62 VAL CB C 2485 32.459 33.807 -1.348 1
1 650 . 14 1 1 A 62 62 VAL N N 2485 132.205 126.339 5.866 1
1 651 . 14 1 1 A 63 63 THR H H 2486 8.474 8.895 -0.421 1
1 652 . 14 1 1 A 63 63 THR HA H 2486 5.392 5.299 0.093 1
1 657 . 14 1 1 A 63 63 THR C C 2486 173.675 173.742 -0.067 1
1 658 . 14 1 1 A 63 63 THR CA C 2486 60.008 61.257 -1.249 1
1 659 . 14 1 1 A 63 63 THR CB C 2486 71.035 70.784 0.251 1
1 661 . 14 1 1 A 63 63 THR N N 2486 121.216 123.295 -2.079 1
1 662 . 14 1 1 A 64 64 TYR H H 2487 9.409 9.100 0.309 1
1 663 . 14 1 1 A 64 64 TYR HA H 2487 5.617 5.676 -0.059 1
1 670 . 14 1 1 A 64 64 TYR C C 2487 172.847 172.798 0.049 1
1 671 . 14 1 1 A 64 64 TYR CA C 2487 55.557 55.669 -0.112 1
1 672 . 14 1 1 A 64 64 TYR CB C 2487 41.968 42.068 -0.100 1
1 675 . 14 1 1 A 64 64 TYR N N 2487 124.061 122.346 1.715 1
1 676 . 14 1 1 A 65 65 THR H H 2488 8.145 8.991 -0.846 1
1 677 . 14 1 1 A 65 65 THR HA H 2488 4.959 4.568 0.391 1
1 682 . 14 1 1 A 65 65 THR CA C 2488 58.532 59.105 -0.573 1
1 683 . 14 1 1 A 65 65 THR CB C 2488 70.141 70.255 -0.114 1
1 685 . 14 1 1 A 65 65 THR N N 2488 117.924 116.522 1.402 1
1 686 . 14 1 1 A 66 66 PRO HA H 2489 4.602 4.376 0.226 1
1 693 . 14 1 1 A 66 66 PRO C C 2489 176.647 176.767 -0.120 1
1 694 . 14 1 1 A 66 66 PRO CA C 2489 61.442 62.665 -1.223 1
1 695 . 14 1 1 A 66 66 PRO CB C 2489 32.715 32.010 0.705 1
1 698 . 14 1 1 A 67 67 MET H H 2490 8.832 8.310 0.522 1
1 699 . 14 1 1 A 67 67 MET HA H 2490 4.880 4.649 0.231 1
1 707 . 14 1 1 A 67 67 MET C C 2490 174.121 175.992 -1.871 1
1 708 . 14 1 1 A 67 67 MET CA C 2490 53.848 55.226 -1.378 1
1 709 . 14 1 1 A 67 67 MET CB C 2490 33.727 33.572 0.155 1
1 712 . 14 1 1 A 67 67 MET N N 2490 119.212 117.524 1.688 1
1 713 . 14 1 1 A 68 68 ALA H H 2491 7.086 7.900 -0.814 1
1 714 . 14 1 1 A 68 68 ALA HA H 2491 4.851 4.845 0.006 1
1 718 . 14 1 1 A 68 68 ALA CA C 2491 49.222 49.869 -0.647 1
1 719 . 14 1 1 A 68 68 ALA CB C 2491 20.600 21.898 -1.298 1
1 720 . 14 1 1 A 68 68 ALA N N 2491 120.363 120.482 -0.119 1
1 721 . 14 1 1 A 69 69 PRO HA H 2492 4.263 4.510 -0.247 1
1 728 . 14 1 1 A 69 69 PRO C C 2492 174.370 176.238 -1.868 1
1 729 . 14 1 1 A 69 69 PRO CA C 2492 62.555 63.438 -0.883 1
1 730 . 14 1 1 A 69 69 PRO CB C 2492 32.752 32.809 -0.057 1
1 733 . 14 1 1 A 70 70 GLY H H 2493 8.858 8.265 0.593 1
1 734 . 14 1 1 A 70 70 GLY HA2 H 2493 4.544 4.058 0.486 1
1 735 . 14 1 1 A 70 70 GLY HA3 H 2493 3.849 4.106 -0.257 1
1 736 . 14 1 1 A 70 70 GLY C C 2493 172.182 172.375 -0.193 1
1 737 . 14 1 1 A 70 70 GLY CA C 2493 44.356 44.382 -0.026 1
1 738 . 14 1 1 A 70 70 GLY N N 2493 106.539 110.125 -3.586 1
1 739 . 14 1 1 A 71 71 SER H H 2494 8.490 8.256 0.234 1
1 740 . 14 1 1 A 71 71 SER HA H 2494 5.280 5.212 0.068 1
1 743 . 14 1 1 A 71 71 SER C C 2494 173.512 173.143 0.369 1
1 744 . 14 1 1 A 71 71 SER CA C 2494 57.674 57.751 -0.077 1
1 745 . 14 1 1 A 71 71 SER CB C 2494 63.799 65.084 -1.285 1
1 746 . 14 1 1 A 71 71 SER N N 2494 117.964 117.415 0.549 1
1 747 . 14 1 1 A 72 72 TYR H H 2495 9.320 9.436 -0.116 1
1 748 . 14 1 1 A 72 72 TYR HA H 2495 4.960 5.406 -0.446 1
1 755 . 14 1 1 A 72 72 TYR C C 2495 173.979 174.869 -0.890 1
1 756 . 14 1 1 A 72 72 TYR CA C 2495 56.384 57.017 -0.633 1
1 757 . 14 1 1 A 72 72 TYR CB C 2495 40.247 40.078 0.169 1
1 760 . 14 1 1 A 72 72 TYR N N 2495 126.442 125.422 1.020 1
1 761 . 14 1 1 A 73 73 LEU H H 2496 9.019 9.133 -0.114 1
1 762 . 14 1 1 A 73 73 LEU HA H 2496 5.209 4.929 0.280 1
1 772 . 14 1 1 A 73 73 LEU C C 2496 177.015 174.781 2.234 1
1 773 . 14 1 1 A 73 73 LEU CA C 2496 53.393 54.208 -0.815 1
1 774 . 14 1 1 A 73 73 LEU CB C 2496 43.918 43.196 0.722 1
1 778 . 14 1 1 A 73 73 LEU N N 2496 125.439 126.369 -0.930 1
1 779 . 14 1 1 A 74 74 ILE H H 2497 9.921 9.765 0.156 1
1 780 . 14 1 1 A 74 74 ILE HA H 2497 5.128 4.646 0.482 1
1 790 . 14 1 1 A 74 74 ILE C C 2497 175.730 175.099 0.631 1
1 791 . 14 1 1 A 74 74 ILE CA C 2497 60.930 60.424 0.506 1
1 792 . 14 1 1 A 74 74 ILE CB C 2497 39.488 37.464 2.024 1
1 796 . 14 1 1 A 74 74 ILE N N 2497 132.185 130.415 1.770 1
1 797 . 14 1 1 A 75 75 SER H H 2498 9.284 9.143 0.141 1
1 798 . 14 1 1 A 75 75 SER HA H 2498 5.111 4.891 0.220 1
1 801 . 14 1 1 A 75 75 SER C C 2498 173.449 173.386 0.063 1
1 802 . 14 1 1 A 75 75 SER CA C 2498 58.260 58.137 0.123 1
1 803 . 14 1 1 A 75 75 SER CB C 2498 63.956 61.702 2.254 1
1 804 . 14 1 1 A 75 75 SER N N 2498 125.384 125.330 0.054 1
1 805 . 14 1 1 A 76 76 ILE H H 2499 9.861 8.359 1.502 1
1 806 . 14 1 1 A 76 76 ILE HA H 2499 4.814 4.446 0.368 1
1 816 . 14 1 1 A 76 76 ILE CA C 2499 61.034 61.607 -0.573 1
1 817 . 14 1 1 A 76 76 ILE CB C 2499 40.387 37.588 2.799 1
1 821 . 14 1 1 A 76 76 ILE N N 2499 129.414 126.325 3.089 1
1 822 . 14 1 1 A 77 77 LYS H H 2500 8.827 8.739 0.088 1
1 823 . 14 1 1 A 77 77 LYS HA H 2500 5.254 5.311 -0.057 1
1 832 . 14 1 1 A 77 77 LYS C C 2500 175.245 174.715 0.530 1
1 833 . 14 1 1 A 77 77 LYS CA C 2500 54.388 54.515 -0.127 1
1 834 . 14 1 1 A 77 77 LYS CB C 2500 36.127 35.969 0.158 1
1 838 . 14 1 1 A 77 77 LYS N N 2500 126.922 127.268 -0.346 1
1 839 . 14 1 1 A 78 78 TYR H H 2501 8.408 8.654 -0.246 1
1 840 . 14 1 1 A 78 78 TYR HA H 2501 5.479 5.009 0.470 1
1 847 . 14 1 1 A 78 78 TYR C C 2501 174.792 175.462 -0.670 1
1 848 . 14 1 1 A 78 78 TYR CA C 2501 56.837 57.409 -0.572 1
1 849 . 14 1 1 A 78 78 TYR CB C 2501 44.008 42.335 1.673 1
1 852 . 14 1 1 A 78 78 TYR N N 2501 122.282 124.311 -2.029 1
1 853 . 14 1 1 A 79 79 GLY H H 2502 8.196 8.682 -0.486 1
1 854 . 14 1 1 A 79 79 GLY HA2 H 2502 4.040 3.718 0.322 1
1 855 . 14 1 1 A 79 79 GLY HA3 H 2502 3.465 3.910 -0.445 1
1 856 . 14 1 1 A 79 79 GLY C C 2502 173.932 173.518 0.414 1
1 857 . 14 1 1 A 79 79 GLY CA C 2502 45.741 45.870 -0.129 1
1 858 . 14 1 1 A 79 79 GLY N N 2502 113.451 114.234 -0.783 1
1 859 . 14 1 1 A 80 80 GLY H H 2503 7.589 7.946 -0.357 1
1 860 . 14 1 1 A 80 80 GLY HA2 H 2503 4.490 4.038 0.452 1
1 861 . 14 1 1 A 80 80 GLY HA3 H 2503 3.555 4.102 -0.547 1
1 862 . 14 1 1 A 80 80 GLY CA C 2503 43.540 44.485 -0.945 1
1 863 . 14 1 1 A 80 80 GLY N N 2503 107.293 107.596 -0.303 1
1 864 . 14 1 1 A 81 81 PRO HA H 2504 4.320 4.348 -0.028 1
1 871 . 14 1 1 A 81 81 PRO C C 2504 175.311 175.374 -0.063 1
1 872 . 14 1 1 A 81 81 PRO CA C 2504 62.722 63.425 -0.703 1
1 873 . 14 1 1 A 81 81 PRO CB C 2504 29.297 31.979 -2.682 1
1 876 . 14 1 1 A 82 82 TYR H H 2505 7.778 7.321 0.457 1
1 877 . 14 1 1 A 82 82 TYR HA H 2505 4.791 4.910 -0.119 1
1 884 . 14 1 1 A 82 82 TYR C C 2505 175.086 175.906 -0.820 1
1 885 . 14 1 1 A 82 82 TYR CA C 2505 56.111 56.631 -0.520 1
1 886 . 14 1 1 A 82 82 TYR CB C 2505 39.483 40.876 -1.393 1
1 889 . 14 1 1 A 82 82 TYR N N 2505 123.973 120.606 3.367 1
1 890 . 14 1 1 A 83 83 HIS H H 2506 8.625 8.966 -0.341 1
1 891 . 14 1 1 A 83 83 HIS HA H 2506 4.583 4.915 -0.332 1
1 896 . 14 1 1 A 83 83 HIS C C 2506 178.161 176.121 2.040 1
1 897 . 14 1 1 A 83 83 HIS CA C 2506 58.241 57.188 1.053 1
1 898 . 14 1 1 A 83 83 HIS CB C 2506 33.132 30.404 2.728 1
1 901 . 14 1 1 A 83 83 HIS N N 2506 124.092 121.270 2.822 1
1 902 . 14 1 1 A 84 84 ILE H H 2507 8.327 8.524 -0.197 1
1 903 . 14 1 1 A 84 84 ILE HA H 2507 4.553 4.323 0.230 1
1 913 . 14 1 1 A 84 84 ILE C C 2507 176.523 176.177 0.346 1
1 914 . 14 1 1 A 84 84 ILE CA C 2507 60.791 59.858 0.933 1
1 915 . 14 1 1 A 84 84 ILE CB C 2507 39.162 39.959 -0.797 1
1 919 . 14 1 1 A 84 84 ILE N N 2507 117.355 118.848 -1.493 1
1 920 . 14 1 1 A 85 85 GLY H H 2508 9.130 8.453 0.677 1
1 921 . 14 1 1 A 85 85 GLY HA2 H 2508 3.883 3.758 0.125 1
1 922 . 14 1 1 A 85 85 GLY HA3 H 2508 3.800 3.772 0.028 1
1 923 . 14 1 1 A 85 85 GLY C C 2508 174.438 175.440 -1.002 1
1 924 . 14 1 1 A 85 85 GLY CA C 2508 47.673 46.776 0.897 1
1 925 . 14 1 1 A 85 85 GLY N N 2508 111.346 109.455 1.891 1
1 926 . 14 1 1 A 86 86 GLY H H 2509 8.236 8.444 -0.208 1
1 927 . 14 1 1 A 86 86 GLY HA2 H 2509 3.893 3.880 0.013 1
1 928 . 14 1 1 A 86 86 GLY HA3 H 2509 3.161 3.945 -0.784 1
1 929 . 14 1 1 A 86 86 GLY C C 2509 171.837 173.606 -1.769 1
1 930 . 14 1 1 A 86 86 GLY CA C 2509 44.844 45.240 -0.396 1
1 931 . 14 1 1 A 86 86 GLY N N 2509 115.594 116.752 -1.158 1
1 932 . 14 1 1 A 87 87 SER H H 2510 7.385 7.924 -0.539 1
1 933 . 14 1 1 A 87 87 SER HA H 2510 4.217 4.101 0.116 1
1 936 . 14 1 1 A 87 87 SER CA C 2510 54.783 55.327 -0.544 1
1 937 . 14 1 1 A 87 87 SER CB C 2510 62.683 64.022 -1.339 1
1 938 . 14 1 1 A 87 87 SER N N 2510 112.859 116.886 -4.027 1
1 939 . 14 1 1 A 88 88 PRO HA H 2511 5.532 4.786 0.746 1
1 946 . 14 1 1 A 88 88 PRO C C 2511 175.870 175.178 0.692 1
1 947 . 14 1 1 A 88 88 PRO CA C 2511 62.379 62.167 0.212 1
1 948 . 14 1 1 A 88 88 PRO CB C 2511 33.639 32.214 1.425 1
1 951 . 14 1 1 A 89 89 PHE H H 2512 9.359 8.432 0.927 1
1 952 . 14 1 1 A 89 89 PHE HA H 2512 4.467 4.782 -0.315 1
1 960 . 14 1 1 A 89 89 PHE C C 2512 175.152 175.765 -0.613 1
1 961 . 14 1 1 A 89 89 PHE CA C 2512 57.401 57.037 0.364 1
1 962 . 14 1 1 A 89 89 PHE CB C 2512 40.843 41.271 -0.428 1
1 966 . 14 1 1 A 89 89 PHE N N 2512 124.789 119.805 4.984 1
1 967 . 14 1 1 A 90 90 LYS H H 2513 8.772 8.588 0.184 1
1 968 . 14 1 1 A 90 90 LYS HA H 2513 4.941 4.442 0.499 1
1 973 . 14 1 1 A 90 90 LYS C C 2513 174.183 176.078 -1.895 1
1 974 . 14 1 1 A 90 90 LYS CA C 2513 55.749 56.697 -0.948 1
1 975 . 14 1 1 A 90 90 LYS CB C 2513 32.817 32.070 0.747 1
1 978 . 14 1 1 A 90 90 LYS N N 2513 125.133 120.910 4.223 1
1 979 . 14 1 1 A 91 91 ALA H H 2514 9.158 7.758 1.400 1
1 980 . 14 1 1 A 91 91 ALA HA H 2514 4.510 4.119 0.391 1
1 984 . 14 1 1 A 91 91 ALA C C 2514 176.561 177.257 -0.696 1
1 985 . 14 1 1 A 91 91 ALA CA C 2514 50.528 53.067 -2.539 1
1 986 . 14 1 1 A 91 91 ALA CB C 2514 20.653 18.543 2.110 1
1 987 . 14 1 1 A 91 91 ALA N N 2514 131.989 122.390 9.599 1
1 988 . 14 1 1 A 92 92 LYS H H 2515 8.186 8.721 -0.535 1
1 989 . 14 1 1 A 92 92 LYS HA H 2515 4.926 4.802 0.124 1
1 998 . 14 1 1 A 92 92 LYS C C 2515 175.177 176.321 -1.144 1
1 999 . 14 1 1 A 92 92 LYS CA C 2515 55.725 56.139 -0.414 1
1 1000 . 14 1 1 A 92 92 LYS CB C 2515 33.765 33.612 0.153 1
1 1004 . 14 1 1 A 92 92 LYS N N 2515 124.887 123.595 1.292 1
1 1005 . 14 1 1 A 93 93 VAL H H 2516 9.362 9.342 0.020 1
1 1006 . 14 1 1 A 93 93 VAL HA H 2516 5.161 5.244 -0.083 1
1 1014 . 14 1 1 A 93 93 VAL C C 2516 176.988 174.485 2.503 1
1 1015 . 14 1 1 A 93 93 VAL CA C 2516 60.523 59.762 0.761 1
1 1016 . 14 1 1 A 93 93 VAL CB C 2516 33.291 36.103 -2.812 1
1 1019 . 14 1 1 A 93 93 VAL N N 2516 129.943 118.095 11.848 1
1 1020 . 14 1 1 A 94 94 THR H H 2517 8.614 8.689 -0.075 1
1 1021 . 14 1 1 A 94 94 THR HA H 2517 4.902 4.929 -0.027 1
1 1026 . 14 1 1 A 94 94 THR C C 2517 172.759 173.199 -0.440 1
1 1027 . 14 1 1 A 94 94 THR CA C 2517 60.121 59.901 0.220 1
1 1028 . 14 1 1 A 94 94 THR CB C 2517 71.072 71.482 -0.410 1
1 1030 . 14 1 1 A 94 94 THR N N 2517 122.032 113.058 8.974 1
1 1031 . 14 1 1 A 95 95 GLY H H 2518 8.280 8.541 -0.261 1
1 1032 . 14 1 1 A 95 95 GLY HA2 H 2518 3.852 4.129 -0.277 1
1 1033 . 14 1 1 A 95 95 GLY HA3 H 2518 4.846 4.134 0.712 1
1 1034 . 14 1 1 A 95 95 GLY CA C 2518 43.955 43.893 0.062 1
1 1035 . 14 1 1 A 95 95 GLY N N 2518 107.949 106.357 1.592 1
1 1036 . 14 1 1 A 96 96 PRO HA H 2519 4.449 4.645 -0.196 1
1 1043 . 14 1 1 A 96 96 PRO C C 2519 176.892 176.262 0.630 1
1 1044 . 14 1 1 A 96 96 PRO CA C 2519 62.062 62.591 -0.529 1
1 1045 . 14 1 1 A 96 96 PRO CB C 2519 32.286 33.154 -0.868 1
1 1048 . 14 1 1 A 97 97 ARG H H 2520 8.651 8.534 0.117 1
1 1049 . 14 1 1 A 97 97 ARG HA H 2520 4.348 4.644 -0.296 1
1 1056 . 14 1 1 A 97 97 ARG C C 2520 176.236 176.032 0.204 1
1 1057 . 14 1 1 A 97 97 ARG CA C 2520 57.587 55.608 1.979 1
1 1058 . 14 1 1 A 97 97 ARG CB C 2520 30.472 31.820 -1.348 1
1 1061 . 14 1 1 A 97 97 ARG N N 2520 120.781 121.085 -0.304 1
1 1062 . 14 1 1 A 98 98 LEU H H 2521 8.545 9.013 -0.468 1
1 1063 . 14 1 1 A 98 98 LEU HA H 2521 4.577 4.564 0.013 1
1 1073 . 14 1 1 A 98 98 LEU C C 2521 175.880 175.319 0.561 1
1 1074 . 14 1 1 A 98 98 LEU CA C 2521 55.068 54.250 0.818 1
1 1075 . 14 1 1 A 98 98 LEU CB C 2521 43.082 40.903 2.179 1
1 1079 . 14 1 1 A 98 98 LEU N N 2521 128.715 129.550 -0.835 1
1 4 . 15 1 1 A 2 2 ALA HA H -2 4.374 5.007 -0.633 1
1 8 . 15 1 1 A 2 2 ALA C C -2 177.865 176.821 1.044 1
1 9 . 15 1 1 A 2 2 ALA CA C -2 52.670 51.219 1.451 1
1 10 . 15 1 1 A 2 2 ALA CB C -2 19.508 22.997 -3.489 1
1 32 . 15 1 1 A 5 5 ASP H H 2428 8.300 8.608 -0.308 1
1 33 . 15 1 1 A 5 5 ASP HA H 2428 5.082 4.923 0.159 1
1 36 . 15 1 1 A 5 5 ASP CA C 2428 51.517 51.853 -0.336 1
1 37 . 15 1 1 A 5 5 ASP CB C 2428 42.244 42.578 -0.334 1
1 38 . 15 1 1 A 5 5 ASP N N 2428 122.879 121.423 1.456 1
1 39 . 15 1 1 A 6 6 PRO HA H 2429 4.340 4.433 -0.093 1
1 46 . 15 1 1 A 6 6 PRO C C 2429 178.266 178.132 0.134 1
1 47 . 15 1 1 A 6 6 PRO CA C 2429 64.494 64.296 0.198 1
1 48 . 15 1 1 A 6 6 PRO CB C 2429 31.841 31.868 -0.027 1
1 51 . 15 1 1 A 7 7 GLY H H 2430 8.686 8.477 0.209 1
1 52 . 15 1 1 A 7 7 GLY HA2 H 2430 4.116 3.883 0.233 1
1 53 . 15 1 1 A 7 7 GLY HA3 H 2430 3.868 3.888 -0.020 1
1 54 . 15 1 1 A 7 7 GLY C C 2430 174.567 175.423 -0.856 1
1 55 . 15 1 1 A 7 7 GLY CA C 2430 46.038 46.388 -0.350 1
1 56 . 15 1 1 A 7 7 GLY N N 2430 107.655 106.923 0.732 1
1 57 . 15 1 1 A 8 8 LEU H H 2431 7.692 7.574 0.118 1
1 58 . 15 1 1 A 8 8 LEU HA H 2431 4.507 4.374 0.133 1
1 68 . 15 1 1 A 8 8 LEU C C 2431 176.876 177.385 -0.509 1
1 69 . 15 1 1 A 8 8 LEU CA C 2431 54.307 56.493 -2.186 1
1 70 . 15 1 1 A 8 8 LEU CB C 2431 42.879 42.953 -0.074 1
1 74 . 15 1 1 A 8 8 LEU N N 2431 120.022 119.953 0.069 1
1 75 . 15 1 1 A 9 9 VAL H H 2432 7.378 7.197 0.181 1
1 76 . 15 1 1 A 9 9 VAL HA H 2432 4.154 3.853 0.301 1
1 84 . 15 1 1 A 9 9 VAL C C 2432 174.703 175.652 -0.949 1
1 85 . 15 1 1 A 9 9 VAL CA C 2432 62.387 63.285 -0.898 1
1 86 . 15 1 1 A 9 9 VAL CB C 2432 32.519 31.620 0.899 1
1 89 . 15 1 1 A 9 9 VAL N N 2432 123.902 119.594 4.308 1
1 90 . 15 1 1 A 10 10 SER H H 2433 8.201 8.472 -0.271 1
1 91 . 15 1 1 A 10 10 SER HA H 2433 5.136 4.863 0.273 1
1 94 . 15 1 1 A 10 10 SER CA C 2433 56.554 55.670 0.884 1
1 95 . 15 1 1 A 10 10 SER CB C 2433 66.763 65.079 1.684 1
1 96 . 15 1 1 A 10 10 SER N N 2433 121.921 121.592 0.329 1
1 97 . 15 1 1 A 11 11 ALA H H 2434 8.670 8.243 0.427 1
1 98 . 15 1 1 A 11 11 ALA HA H 2434 5.632 5.210 0.422 1
1 102 . 15 1 1 A 11 11 ALA C C 2434 175.459 174.367 1.092 1
1 103 . 15 1 1 A 11 11 ALA CA C 2434 50.575 50.696 -0.121 1
1 104 . 15 1 1 A 11 11 ALA CB C 2434 23.111 23.106 0.005 1
1 105 . 15 1 1 A 11 11 ALA N N 2434 124.828 123.513 1.315 1
1 106 . 15 1 1 A 12 12 TYR H H 2435 8.609 8.700 -0.091 1
1 107 . 15 1 1 A 12 12 TYR HA H 2435 4.879 5.103 -0.224 1
1 114 . 15 1 1 A 12 12 TYR C C 2435 173.645 174.548 -0.903 1
1 115 . 15 1 1 A 12 12 TYR CA C 2435 56.268 56.656 -0.388 1
1 116 . 15 1 1 A 12 12 TYR CB C 2435 39.522 42.370 -2.848 1
1 119 . 15 1 1 A 12 12 TYR N N 2435 118.305 119.555 -1.250 1
1 120 . 15 1 1 A 13 13 GLY H H 2436 8.655 8.591 0.064 1
1 121 . 15 1 1 A 13 13 GLY HA2 H 2436 4.943 4.305 0.638 1
1 122 . 15 1 1 A 13 13 GLY HA3 H 2436 4.028 4.355 -0.327 1
1 123 . 15 1 1 A 13 13 GLY C C 2436 175.334 174.912 0.422 1
1 124 . 15 1 1 A 13 13 GLY CA C 2436 44.389 44.526 -0.137 1
1 125 . 15 1 1 A 13 13 GLY N N 2436 110.710 110.297 0.413 1
1 126 . 15 1 1 A 14 14 ALA H H 2437 8.939 8.806 0.133 1
1 127 . 15 1 1 A 14 14 ALA HA H 2437 4.276 4.094 0.182 1
1 131 . 15 1 1 A 14 14 ALA C C 2437 180.524 179.359 1.165 1
1 132 . 15 1 1 A 14 14 ALA CA C 2437 55.551 55.093 0.458 1
1 133 . 15 1 1 A 14 14 ALA CB C 2437 18.411 18.411 0.000 1
1 134 . 15 1 1 A 14 14 ALA N N 2437 126.973 123.852 3.121 1
1 135 . 15 1 1 A 15 15 GLY H H 2438 8.933 8.753 0.180 1
1 136 . 15 1 1 A 15 15 GLY HA2 H 2438 4.531 4.008 0.523 1
1 137 . 15 1 1 A 15 15 GLY HA3 H 2438 3.576 4.235 -0.659 1
1 138 . 15 1 1 A 15 15 GLY C C 2438 174.323 175.558 -1.235 1
1 139 . 15 1 1 A 15 15 GLY CA C 2438 46.855 46.987 -0.132 1
1 140 . 15 1 1 A 15 15 GLY N N 2438 104.803 105.549 -0.746 1
1 141 . 15 1 1 A 16 16 LEU H H 2439 7.529 7.659 -0.130 1
1 142 . 15 1 1 A 16 16 LEU HA H 2439 3.768 3.862 -0.094 1
1 152 . 15 1 1 A 16 16 LEU C C 2439 176.388 179.035 -2.647 1
1 153 . 15 1 1 A 16 16 LEU CA C 2439 56.137 57.314 -1.177 1
1 154 . 15 1 1 A 16 16 LEU CB C 2439 41.621 41.204 0.417 1
1 158 . 15 1 1 A 16 16 LEU N N 2439 119.633 121.803 -2.170 1
1 159 . 15 1 1 A 17 17 GLU H H 2440 7.505 7.841 -0.336 1
1 160 . 15 1 1 A 17 17 GLU HA H 2440 4.663 4.262 0.401 1
1 165 . 15 1 1 A 17 17 GLU C C 2440 178.126 176.672 1.454 1
1 166 . 15 1 1 A 17 17 GLU CA C 2440 56.447 56.946 -0.499 1
1 167 . 15 1 1 A 17 17 GLU CB C 2440 31.485 30.689 0.796 1
1 169 . 15 1 1 A 17 17 GLU N N 2440 114.368 116.367 -1.999 1
1 170 . 15 1 1 A 18 18 GLY H H 2441 7.921 7.357 0.564 1
1 171 . 15 1 1 A 18 18 GLY HA2 H 2441 4.889 4.187 0.702 1
1 172 . 15 1 1 A 18 18 GLY HA3 H 2441 3.707 4.229 -0.522 1
1 173 . 15 1 1 A 18 18 GLY C C 2441 170.965 171.526 -0.561 1
1 174 . 15 1 1 A 18 18 GLY CA C 2441 45.549 45.394 0.155 1
1 175 . 15 1 1 A 18 18 GLY N N 2441 109.165 105.124 4.041 1
1 176 . 15 1 1 A 19 19 GLY H H 2442 7.540 8.289 -0.749 1
1 177 . 15 1 1 A 19 19 GLY HA2 H 2442 4.086 4.209 -0.123 1
1 178 . 15 1 1 A 19 19 GLY HA3 H 2442 4.086 4.244 -0.158 1
1 179 . 15 1 1 A 19 19 GLY C C 2442 171.051 171.536 -0.485 1
1 180 . 15 1 1 A 19 19 GLY CA C 2442 44.937 46.228 -1.291 1
1 181 . 15 1 1 A 19 19 GLY N N 2442 105.460 108.336 -2.876 1
1 182 . 15 1 1 A 20 20 VAL H H 2443 8.899 8.229 0.670 1
1 183 . 15 1 1 A 20 20 VAL HA H 2443 5.062 5.026 0.036 1
1 191 . 15 1 1 A 20 20 VAL C C 2443 176.623 175.287 1.336 1
1 192 . 15 1 1 A 20 20 VAL CA C 2443 60.197 60.369 -0.172 1
1 193 . 15 1 1 A 20 20 VAL CB C 2443 35.107 35.026 0.081 1
1 196 . 15 1 1 A 20 20 VAL N N 2443 122.753 119.508 3.245 1
1 197 . 15 1 1 A 21 21 THR H H 2444 8.630 8.470 0.160 1
1 198 . 15 1 1 A 21 21 THR HA H 2444 3.773 4.135 -0.362 1
1 203 . 15 1 1 A 21 21 THR C C 2444 175.646 174.958 0.688 1
1 204 . 15 1 1 A 21 21 THR CA C 2444 62.732 63.337 -0.605 1
1 205 . 15 1 1 A 21 21 THR CB C 2444 68.925 68.416 0.509 1
1 207 . 15 1 1 A 21 21 THR N N 2444 118.179 120.322 -2.143 1
1 208 . 15 1 1 A 22 22 GLY H H 2445 8.736 9.055 -0.319 1
1 209 . 15 1 1 A 22 22 GLY HA2 H 2445 3.412 4.002 -0.590 1
1 210 . 15 1 1 A 22 22 GLY HA3 H 2445 4.061 4.005 0.056 1
1 211 . 15 1 1 A 22 22 GLY C C 2445 172.973 173.608 -0.635 1
1 212 . 15 1 1 A 22 22 GLY CA C 2445 45.577 45.157 0.420 1
1 213 . 15 1 1 A 22 22 GLY N N 2445 107.888 114.116 -6.228 1
1 214 . 15 1 1 A 23 23 ASN H H 2446 7.877 7.854 0.023 1
1 215 . 15 1 1 A 23 23 ASN HA H 2446 5.253 5.089 0.164 1
1 220 . 15 1 1 A 23 23 ASN CA C 2446 49.740 49.920 -0.180 1
1 221 . 15 1 1 A 23 23 ASN CB C 2446 40.198 39.165 1.033 1
1 222 . 15 1 1 A 23 23 ASN N N 2446 120.684 119.688 0.996 1
1 224 . 15 1 1 A 24 24 PRO HA H 2447 4.525 4.643 -0.118 1
1 231 . 15 1 1 A 24 24 PRO CA C 2447 62.766 62.405 0.361 1
1 232 . 15 1 1 A 24 24 PRO CB C 2447 31.732 32.443 -0.711 1
1 235 . 15 1 1 A 25 25 ALA H H 2448 9.178 8.238 0.940 1
1 236 . 15 1 1 A 25 25 ALA HA H 2448 4.614 5.034 -0.420 1
1 240 . 15 1 1 A 25 25 ALA C C 2448 175.503 175.424 0.079 1
1 241 . 15 1 1 A 25 25 ALA CA C 2448 50.526 50.394 0.132 1
1 242 . 15 1 1 A 25 25 ALA CB C 2448 20.458 22.978 -2.520 1
1 243 . 15 1 1 A 25 25 ALA N N 2448 132.079 122.453 9.626 1
1 244 . 15 1 1 A 26 26 GLU H H 2449 8.813 9.075 -0.262 1
1 245 . 15 1 1 A 26 26 GLU HA H 2449 5.830 5.363 0.467 1
1 250 . 15 1 1 A 26 26 GLU C C 2449 176.272 174.714 1.558 1
1 251 . 15 1 1 A 26 26 GLU CA C 2449 54.376 54.790 -0.414 1
1 252 . 15 1 1 A 26 26 GLU CB C 2449 35.463 34.079 1.384 1
1 254 . 15 1 1 A 26 26 GLU N N 2449 120.079 116.313 3.766 1
1 255 . 15 1 1 A 27 27 PHE H H 2450 8.782 8.711 0.071 1
1 256 . 15 1 1 A 27 27 PHE HA H 2450 5.021 5.094 -0.073 1
1 264 . 15 1 1 A 27 27 PHE C C 2450 171.205 172.062 -0.857 1
1 265 . 15 1 1 A 27 27 PHE CA C 2450 56.852 56.438 0.414 1
1 266 . 15 1 1 A 27 27 PHE CB C 2450 41.080 40.983 0.097 1
1 270 . 15 1 1 A 27 27 PHE N N 2450 118.670 117.196 1.474 1
1 271 . 15 1 1 A 28 28 VAL H H 2451 8.961 9.056 -0.095 1
1 272 . 15 1 1 A 28 28 VAL HA H 2451 4.761 4.647 0.114 1
1 280 . 15 1 1 A 28 28 VAL C C 2451 174.673 175.580 -0.907 1
1 281 . 15 1 1 A 28 28 VAL CA C 2451 60.619 60.970 -0.351 1
1 282 . 15 1 1 A 28 28 VAL CB C 2451 35.484 34.314 1.170 1
1 285 . 15 1 1 A 28 28 VAL N N 2451 121.552 120.254 1.298 1
1 286 . 15 1 1 A 29 29 VAL H H 2452 9.294 9.250 0.044 1
1 287 . 15 1 1 A 29 29 VAL HA H 2452 4.363 4.295 0.068 1
1 295 . 15 1 1 A 29 29 VAL C C 2452 174.218 175.177 -0.959 1
1 296 . 15 1 1 A 29 29 VAL CA C 2452 61.526 62.726 -1.200 1
1 297 . 15 1 1 A 29 29 VAL CB C 2452 32.666 31.079 1.587 1
1 300 . 15 1 1 A 29 29 VAL N N 2452 125.585 128.423 -2.838 1
1 301 . 15 1 1 A 30 30 ASN H H 2453 9.465 8.923 0.542 1
1 302 . 15 1 1 A 30 30 ASN HA H 2453 5.096 5.222 -0.126 1
1 307 . 15 1 1 A 30 30 ASN C C 2453 176.216 176.189 0.027 1
1 308 . 15 1 1 A 30 30 ASN CA C 2453 52.011 52.726 -0.715 1
1 309 . 15 1 1 A 30 30 ASN CB C 2453 39.057 38.546 0.511 1
1 310 . 15 1 1 A 30 30 ASN N N 2453 127.724 127.065 0.659 1
1 312 . 15 1 1 A 31 31 THR H H 2454 8.915 8.204 0.711 1
1 313 . 15 1 1 A 31 31 THR HA H 2454 4.342 4.398 -0.056 1
1 318 . 15 1 1 A 31 31 THR C C 2454 176.816 176.349 0.467 1
1 319 . 15 1 1 A 31 31 THR CA C 2454 61.117 62.393 -1.276 1
1 320 . 15 1 1 A 31 31 THR CB C 2454 68.209 69.531 -1.322 1
1 322 . 15 1 1 A 31 31 THR N N 2454 117.783 116.806 0.977 1
1 323 . 15 1 1 A 32 32 SER H H 2455 8.454 7.944 0.510 1
1 324 . 15 1 1 A 32 32 SER HA H 2455 4.155 4.131 0.024 1
1 327 . 15 1 1 A 32 32 SER C C 2455 175.458 175.739 -0.281 1
1 328 . 15 1 1 A 32 32 SER CA C 2455 62.148 62.418 -0.270 1
1 329 . 15 1 1 A 32 32 SER CB C 2455 63.476 63.087 0.389 1
1 330 . 15 1 1 A 32 32 SER N N 2455 121.781 118.979 2.802 1
1 331 . 15 1 1 A 33 33 ASN H H 2456 8.845 8.062 0.783 1
1 332 . 15 1 1 A 33 33 ASN HA H 2456 5.064 4.547 0.517 1
1 337 . 15 1 1 A 33 33 ASN C C 2456 174.674 176.035 -1.361 1
1 338 . 15 1 1 A 33 33 ASN CA C 2456 53.067 55.045 -1.978 1
1 339 . 15 1 1 A 33 33 ASN CB C 2456 39.632 38.854 0.778 1
1 340 . 15 1 1 A 33 33 ASN N N 2456 120.176 118.372 1.804 1
1 342 . 15 1 1 A 34 34 ALA H H 2457 7.714 7.850 -0.136 1
1 343 . 15 1 1 A 34 34 ALA HA H 2457 4.482 4.447 0.035 1
1 347 . 15 1 1 A 34 34 ALA C C 2457 177.582 177.717 -0.135 1
1 348 . 15 1 1 A 34 34 ALA CA C 2457 52.521 52.785 -0.264 1
1 349 . 15 1 1 A 34 34 ALA CB C 2457 22.252 20.905 1.347 1
1 350 . 15 1 1 A 34 34 ALA N N 2457 123.065 120.237 2.828 1
1 351 . 15 1 1 A 35 35 GLY H H 2458 8.195 7.790 0.405 1
1 352 . 15 1 1 A 35 35 GLY HA2 H 2458 4.246 4.120 0.126 1
1 353 . 15 1 1 A 35 35 GLY HA3 H 2458 3.902 4.141 -0.239 1
1 354 . 15 1 1 A 35 35 GLY C C 2458 173.360 173.094 0.266 1
1 355 . 15 1 1 A 35 35 GLY CA C 2458 44.486 44.374 0.112 1
1 356 . 15 1 1 A 35 35 GLY N N 2458 108.472 104.086 4.386 1
1 357 . 15 1 1 A 36 36 ALA H H 2459 8.430 8.358 0.072 1
1 358 . 15 1 1 A 36 36 ALA HA H 2459 4.472 5.003 -0.531 1
1 362 . 15 1 1 A 36 36 ALA C C 2459 176.968 177.033 -0.065 1
1 363 . 15 1 1 A 36 36 ALA CA C 2459 52.695 51.071 1.624 1
1 364 . 15 1 1 A 36 36 ALA CB C 2459 19.360 21.300 -1.940 1
1 365 . 15 1 1 A 36 36 ALA N N 2459 126.012 124.864 1.148 1
1 366 . 15 1 1 A 37 37 GLY H H 2460 7.781 8.494 -0.713 1
1 367 . 15 1 1 A 37 37 GLY HA2 H 2460 3.856 3.870 -0.014 1
1 368 . 15 1 1 A 37 37 GLY HA3 H 2460 3.164 4.058 -0.894 1
1 369 . 15 1 1 A 37 37 GLY C C 2460 170.730 172.113 -1.383 1
1 370 . 15 1 1 A 37 37 GLY CA C 2460 44.747 44.276 0.471 1
1 371 . 15 1 1 A 37 37 GLY N N 2460 109.493 105.749 3.744 1
1 372 . 15 1 1 A 38 38 ALA H H 2461 8.055 7.998 0.057 1
1 373 . 15 1 1 A 38 38 ALA HA H 2461 4.389 4.618 -0.229 1
1 377 . 15 1 1 A 38 38 ALA C C 2461 176.609 176.244 0.365 1
1 378 . 15 1 1 A 38 38 ALA CA C 2461 51.419 51.638 -0.219 1
1 379 . 15 1 1 A 38 38 ALA CB C 2461 19.665 19.492 0.173 1
1 380 . 15 1 1 A 38 38 ALA N N 2461 121.997 123.073 -1.076 1
1 381 . 15 1 1 A 39 39 LEU H H 2462 8.597 8.423 0.174 1
1 382 . 15 1 1 A 39 39 LEU HA H 2462 5.022 5.175 -0.153 1
1 392 . 15 1 1 A 39 39 LEU C C 2462 175.883 174.572 1.311 1
1 393 . 15 1 1 A 39 39 LEU CA C 2462 53.907 53.337 0.570 1
1 394 . 15 1 1 A 39 39 LEU CB C 2462 44.576 44.881 -0.305 1
1 398 . 15 1 1 A 39 39 LEU N N 2462 126.664 124.195 2.469 1
1 399 . 15 1 1 A 40 40 SER H H 2463 8.898 9.353 -0.455 1
1 400 . 15 1 1 A 40 40 SER HA H 2463 4.732 5.382 -0.650 1
1 403 . 15 1 1 A 40 40 SER C C 2463 172.984 172.690 0.294 1
1 404 . 15 1 1 A 40 40 SER CA C 2463 56.730 56.520 0.210 1
1 405 . 15 1 1 A 40 40 SER CB C 2463 64.648 66.038 -1.390 1
1 406 . 15 1 1 A 40 40 SER N N 2463 122.932 120.751 2.181 1
1 407 . 15 1 1 A 41 41 VAL H H 2464 8.538 8.462 0.076 1
1 408 . 15 1 1 A 41 41 VAL HA H 2464 5.131 4.846 0.285 1
1 416 . 15 1 1 A 41 41 VAL C C 2464 174.812 173.865 0.947 1
1 417 . 15 1 1 A 41 41 VAL CA C 2464 60.784 60.616 0.168 1
1 418 . 15 1 1 A 41 41 VAL CB C 2464 34.262 34.913 -0.651 1
1 420 . 15 1 1 A 41 41 VAL N N 2464 129.161 122.791 6.370 1
1 421 . 15 1 1 A 42 42 THR H H 2465 8.807 8.549 0.258 1
1 422 . 15 1 1 A 42 42 THR HA H 2465 4.573 4.795 -0.222 1
1 427 . 15 1 1 A 42 42 THR CA C 2465 60.408 60.628 -0.220 1
1 428 . 15 1 1 A 42 42 THR CB C 2465 71.764 70.168 1.596 1
1 430 . 15 1 1 A 42 42 THR N N 2465 120.898 120.353 0.545 1
1 431 . 15 1 1 A 43 43 ILE H H 2466 8.648 8.539 0.109 1
1 432 . 15 1 1 A 43 43 ILE HA H 2466 4.854 4.950 -0.096 1
1 442 . 15 1 1 A 43 43 ILE C C 2466 174.073 173.623 0.450 1
1 443 . 15 1 1 A 43 43 ILE CA C 2466 61.184 60.496 0.688 1
1 444 . 15 1 1 A 43 43 ILE CB C 2466 39.516 40.998 -1.482 1
1 448 . 15 1 1 A 43 43 ILE N N 2466 124.810 124.021 0.789 1
1 449 . 15 1 1 A 44 44 ASP H H 2467 8.821 9.197 -0.376 1
1 450 . 15 1 1 A 44 44 ASP HA H 2467 5.217 5.462 -0.245 1
1 453 . 15 1 1 A 44 44 ASP C C 2467 175.002 175.361 -0.359 1
1 454 . 15 1 1 A 44 44 ASP CA C 2467 52.998 52.617 0.381 1
1 455 . 15 1 1 A 44 44 ASP CB C 2467 44.728 43.200 1.528 1
1 456 . 15 1 1 A 44 44 ASP N N 2467 129.093 128.729 0.364 1
1 457 . 15 1 1 A 45 45 GLY H H 2468 8.535 8.238 0.297 1
1 458 . 15 1 1 A 45 45 GLY HA2 H 2468 3.954 3.833 0.121 1
1 459 . 15 1 1 A 45 45 GLY HA3 H 2468 3.561 4.011 -0.450 1
1 460 . 15 1 1 A 45 45 GLY CA C 2468 45.659 45.058 0.601 1
1 461 . 15 1 1 A 45 45 GLY N N 2468 112.751 109.992 2.759 1
1 462 . 15 1 1 A 46 46 PRO HA H 2469 4.318 4.408 -0.090 1
1 469 . 15 1 1 A 46 46 PRO C C 2469 176.086 176.160 -0.074 1
1 470 . 15 1 1 A 46 46 PRO CA C 2469 64.198 63.887 0.311 1
1 471 . 15 1 1 A 46 46 PRO CB C 2469 32.348 31.821 0.527 1
1 474 . 15 1 1 A 47 47 SER H H 2470 7.106 7.646 -0.540 1
1 475 . 15 1 1 A 47 47 SER HA H 2470 4.632 4.875 -0.243 1
1 478 . 15 1 1 A 47 47 SER C C 2470 172.969 173.229 -0.260 1
1 479 . 15 1 1 A 47 47 SER CA C 2470 57.106 57.478 -0.372 1
1 480 . 15 1 1 A 47 47 SER CB C 2470 66.262 67.418 -1.156 1
1 481 . 15 1 1 A 47 47 SER N N 2470 110.556 114.421 -3.865 1
1 482 . 15 1 1 A 48 48 LYS H H 2471 8.534 8.340 0.194 1
1 483 . 15 1 1 A 48 48 LYS HA H 2471 4.486 4.578 -0.092 1
1 492 . 15 1 1 A 48 48 LYS C C 2471 177.231 176.385 0.846 1
1 493 . 15 1 1 A 48 48 LYS CA C 2471 56.620 56.974 -0.354 1
1 494 . 15 1 1 A 48 48 LYS CB C 2471 32.379 33.662 -1.283 1
1 498 . 15 1 1 A 48 48 LYS N N 2471 124.055 122.192 1.863 1
1 499 . 15 1 1 A 49 49 VAL H H 2472 8.497 8.777 -0.280 1
1 500 . 15 1 1 A 49 49 VAL HA H 2472 4.552 4.904 -0.352 1
1 508 . 15 1 1 A 49 49 VAL C C 2472 175.292 174.199 1.093 1
1 509 . 15 1 1 A 49 49 VAL CA C 2472 60.142 59.050 1.092 1
1 510 . 15 1 1 A 49 49 VAL CB C 2472 33.464 35.732 -2.268 1
1 513 . 15 1 1 A 49 49 VAL N N 2472 121.233 118.108 3.125 1
1 514 . 15 1 1 A 50 50 LYS H H 2473 8.190 8.560 -0.370 1
1 515 . 15 1 1 A 50 50 LYS HA H 2473 4.522 4.613 -0.091 1
1 518 . 15 1 1 A 50 50 LYS CA C 2473 55.952 55.623 0.329 1
1 519 . 15 1 1 A 50 50 LYS CB C 2473 32.896 32.111 0.785 1
1 520 . 15 1 1 A 50 50 LYS N N 2473 126.082 122.592 3.490 1
1 521 . 15 1 1 A 51 51 MET H H 2474 8.818 8.336 0.482 1
1 522 . 15 1 1 A 51 51 MET HA H 2474 5.324 5.042 0.282 1
1 530 . 15 1 1 A 51 51 MET C C 2474 173.933 175.312 -1.379 1
1 531 . 15 1 1 A 51 51 MET CA C 2474 54.848 54.554 0.294 1
1 532 . 15 1 1 A 51 51 MET CB C 2474 37.043 31.986 5.057 1
1 535 . 15 1 1 A 51 51 MET N N 2474 126.911 124.618 2.293 1
1 536 . 15 1 1 A 52 52 ASP H H 2475 9.095 9.309 -0.214 1
1 537 . 15 1 1 A 52 52 ASP HA H 2475 4.947 5.327 -0.380 1
1 540 . 15 1 1 A 52 52 ASP C C 2475 173.923 174.530 -0.607 1
1 541 . 15 1 1 A 52 52 ASP CA C 2475 53.487 52.548 0.939 1
1 542 . 15 1 1 A 52 52 ASP CB C 2475 44.765 43.694 1.071 1
1 543 . 15 1 1 A 52 52 ASP N N 2475 125.526 123.661 1.865 1
1 544 . 15 1 1 A 53 53 CYS H H 2476 8.606 9.041 -0.435 1
1 545 . 15 1 1 A 53 53 CYS HA H 2476 5.145 5.362 -0.217 1
1 548 . 15 1 1 A 53 53 CYS C C 2476 173.330 173.856 -0.526 1
1 549 . 15 1 1 A 53 53 CYS CA C 2476 57.452 57.354 0.098 1
1 550 . 15 1 1 A 53 53 CYS CB C 2476 28.108 29.590 -1.482 1
1 551 . 15 1 1 A 53 53 CYS N N 2476 124.317 125.242 -0.925 1
1 552 . 15 1 1 A 54 54 GLN H H 2477 8.978 9.041 -0.063 1
1 553 . 15 1 1 A 54 54 GLN HA H 2477 4.884 5.083 -0.199 1
1 560 . 15 1 1 A 54 54 GLN C C 2477 174.854 173.377 1.477 1
1 561 . 15 1 1 A 54 54 GLN CA C 2477 53.891 54.424 -0.533 1
1 562 . 15 1 1 A 54 54 GLN CB C 2477 32.837 32.670 0.167 1
1 564 . 15 1 1 A 54 54 GLN N N 2477 127.074 121.067 6.007 1
1 566 . 15 1 1 A 55 55 GLU H H 2478 9.065 8.708 0.357 1
1 567 . 15 1 1 A 55 55 GLU HA H 2478 4.280 4.988 -0.708 1
1 572 . 15 1 1 A 55 55 GLU C C 2478 175.383 175.672 -0.289 1
1 573 . 15 1 1 A 55 55 GLU CA C 2478 57.516 55.867 1.649 1
1 574 . 15 1 1 A 55 55 GLU CB C 2478 30.346 31.443 -1.097 1
1 576 . 15 1 1 A 55 55 GLU N N 2478 125.186 122.969 2.217 1
1 577 . 15 1 1 A 56 56 CYS H H 2479 8.407 8.592 -0.185 1
1 578 . 15 1 1 A 56 56 CYS HA H 2479 5.056 4.860 0.196 1
1 581 . 15 1 1 A 56 56 CYS CA C 2479 55.858 56.695 -0.837 1
1 582 . 15 1 1 A 56 56 CYS CB C 2479 28.676 30.287 -1.611 1
1 583 . 15 1 1 A 56 56 CYS N N 2479 121.499 125.367 -3.868 1
1 584 . 15 1 1 A 57 57 PRO HA H 2480 4.159 4.285 -0.126 1
1 591 . 15 1 1 A 57 57 PRO C C 2480 177.964 177.733 0.231 1
1 592 . 15 1 1 A 57 57 PRO CA C 2480 66.877 64.794 2.083 1
1 593 . 15 1 1 A 57 57 PRO CB C 2480 31.709 31.895 -0.186 1
1 596 . 15 1 1 A 58 58 GLU H H 2481 8.900 8.253 0.647 1
1 597 . 15 1 1 A 58 58 GLU HA H 2481 4.201 4.410 -0.209 1
1 602 . 15 1 1 A 58 58 GLU C C 2481 175.129 176.434 -1.305 1
1 603 . 15 1 1 A 58 58 GLU CA C 2481 57.883 57.233 0.650 1
1 604 . 15 1 1 A 58 58 GLU CB C 2481 29.991 30.334 -0.343 1
1 606 . 15 1 1 A 58 58 GLU N N 2481 115.316 118.188 -2.872 1
1 607 . 15 1 1 A 59 59 GLY H H 2482 7.527 7.127 0.400 1
1 608 . 15 1 1 A 59 59 GLY HA2 H 2482 4.935 4.008 0.927 1
1 609 . 15 1 1 A 59 59 GLY HA3 H 2482 3.381 4.111 -0.730 1
1 610 . 15 1 1 A 59 59 GLY CA C 2482 47.809 44.550 3.259 1
1 611 . 15 1 1 A 59 59 GLY N N 2482 110.079 107.180 2.899 1
1 612 . 15 1 1 A 60 60 TYR H H 2483 8.990 8.114 0.876 1
1 613 . 15 1 1 A 60 60 TYR HA H 2483 5.157 4.769 0.388 1
1 618 . 15 1 1 A 60 60 TYR C C 2483 175.096 174.823 0.273 1
1 619 . 15 1 1 A 60 60 TYR CA C 2483 57.375 58.319 -0.944 1
1 620 . 15 1 1 A 60 60 TYR CB C 2483 43.153 39.726 3.427 1
1 622 . 15 1 1 A 60 60 TYR N N 2483 125.900 122.133 3.767 1
1 623 . 15 1 1 A 61 61 ARG H H 2484 9.557 9.035 0.522 1
1 624 . 15 1 1 A 61 61 ARG HA H 2484 4.858 4.770 0.088 1
1 631 . 15 1 1 A 61 61 ARG CA C 2484 55.016 55.449 -0.433 1
1 632 . 15 1 1 A 61 61 ARG CB C 2484 32.128 31.523 0.605 1
1 635 . 15 1 1 A 61 61 ARG N N 2484 124.847 125.885 -1.038 1
1 636 . 15 1 1 A 62 62 VAL H H 2485 9.046 8.754 0.292 1
1 637 . 15 1 1 A 62 62 VAL HA H 2485 4.675 4.834 -0.159 1
1 645 . 15 1 1 A 62 62 VAL C C 2485 173.837 174.497 -0.660 1
1 646 . 15 1 1 A 62 62 VAL CA C 2485 60.752 60.770 -0.018 1
1 647 . 15 1 1 A 62 62 VAL CB C 2485 32.459 34.060 -1.601 1
1 650 . 15 1 1 A 62 62 VAL N N 2485 132.205 125.498 6.707 1
1 651 . 15 1 1 A 63 63 THR H H 2486 8.474 8.841 -0.367 1
1 652 . 15 1 1 A 63 63 THR HA H 2486 5.392 5.343 0.049 1
1 657 . 15 1 1 A 63 63 THR C C 2486 173.675 173.684 -0.009 1
1 658 . 15 1 1 A 63 63 THR CA C 2486 60.008 61.427 -1.419 1
1 659 . 15 1 1 A 63 63 THR CB C 2486 71.035 70.939 0.096 1
1 661 . 15 1 1 A 63 63 THR N N 2486 121.216 123.041 -1.825 1
1 662 . 15 1 1 A 64 64 TYR H H 2487 9.409 9.163 0.246 1
1 663 . 15 1 1 A 64 64 TYR HA H 2487 5.617 5.451 0.166 1
1 670 . 15 1 1 A 64 64 TYR C C 2487 172.847 172.505 0.342 1
1 671 . 15 1 1 A 64 64 TYR CA C 2487 55.557 55.851 -0.294 1
1 672 . 15 1 1 A 64 64 TYR CB C 2487 41.968 41.599 0.369 1
1 675 . 15 1 1 A 64 64 TYR N N 2487 124.061 122.113 1.948 1
1 676 . 15 1 1 A 65 65 THR H H 2488 8.145 8.769 -0.624 1
1 677 . 15 1 1 A 65 65 THR HA H 2488 4.959 4.569 0.390 1
1 682 . 15 1 1 A 65 65 THR CA C 2488 58.532 58.942 -0.410 1
1 683 . 15 1 1 A 65 65 THR CB C 2488 70.141 70.151 -0.010 1
1 685 . 15 1 1 A 65 65 THR N N 2488 117.924 116.921 1.003 1
1 686 . 15 1 1 A 66 66 PRO HA H 2489 4.602 4.765 -0.163 1
1 693 . 15 1 1 A 66 66 PRO C C 2489 176.647 176.589 0.058 1
1 694 . 15 1 1 A 66 66 PRO CA C 2489 61.442 62.351 -0.909 1
1 695 . 15 1 1 A 66 66 PRO CB C 2489 32.715 33.331 -0.616 1
1 698 . 15 1 1 A 67 67 MET H H 2490 8.832 8.473 0.359 1
1 699 . 15 1 1 A 67 67 MET HA H 2490 4.880 4.873 0.007 1
1 707 . 15 1 1 A 67 67 MET C C 2490 174.121 176.046 -1.925 1
1 708 . 15 1 1 A 67 67 MET CA C 2490 53.848 54.794 -0.946 1
1 709 . 15 1 1 A 67 67 MET CB C 2490 33.727 34.429 -0.702 1
1 712 . 15 1 1 A 67 67 MET N N 2490 119.212 117.064 2.148 1
1 713 . 15 1 1 A 68 68 ALA H H 2491 7.086 7.757 -0.671 1
1 714 . 15 1 1 A 68 68 ALA HA H 2491 4.851 4.837 0.014 1
1 718 . 15 1 1 A 68 68 ALA CA C 2491 49.222 49.840 -0.618 1
1 719 . 15 1 1 A 68 68 ALA CB C 2491 20.600 22.102 -1.502 1
1 720 . 15 1 1 A 68 68 ALA N N 2491 120.363 120.890 -0.527 1
1 721 . 15 1 1 A 69 69 PRO HA H 2492 4.263 4.631 -0.368 1
1 728 . 15 1 1 A 69 69 PRO C C 2492 174.370 176.207 -1.837 1
1 729 . 15 1 1 A 69 69 PRO CA C 2492 62.555 63.480 -0.925 1
1 730 . 15 1 1 A 69 69 PRO CB C 2492 32.752 32.484 0.268 1
1 733 . 15 1 1 A 70 70 GLY H H 2493 8.858 8.275 0.583 1
1 734 . 15 1 1 A 70 70 GLY HA2 H 2493 4.544 4.045 0.499 1
1 735 . 15 1 1 A 70 70 GLY HA3 H 2493 3.849 4.100 -0.251 1
1 736 . 15 1 1 A 70 70 GLY C C 2493 172.182 172.257 -0.075 1
1 737 . 15 1 1 A 70 70 GLY CA C 2493 44.356 44.423 -0.067 1
1 738 . 15 1 1 A 70 70 GLY N N 2493 106.539 109.176 -2.637 1
1 739 . 15 1 1 A 71 71 SER H H 2494 8.490 8.304 0.186 1
1 740 . 15 1 1 A 71 71 SER HA H 2494 5.280 5.046 0.234 1
1 743 . 15 1 1 A 71 71 SER C C 2494 173.512 173.447 0.065 1
1 744 . 15 1 1 A 71 71 SER CA C 2494 57.674 58.790 -1.116 1
1 745 . 15 1 1 A 71 71 SER CB C 2494 63.799 64.002 -0.203 1
1 746 . 15 1 1 A 71 71 SER N N 2494 117.964 117.251 0.713 1
1 747 . 15 1 1 A 72 72 TYR H H 2495 9.320 9.525 -0.205 1
1 748 . 15 1 1 A 72 72 TYR HA H 2495 4.960 5.347 -0.387 1
1 755 . 15 1 1 A 72 72 TYR C C 2495 173.979 174.825 -0.846 1
1 756 . 15 1 1 A 72 72 TYR CA C 2495 56.384 57.147 -0.763 1
1 757 . 15 1 1 A 72 72 TYR CB C 2495 40.247 40.101 0.146 1
1 760 . 15 1 1 A 72 72 TYR N N 2495 126.442 126.219 0.223 1
1 761 . 15 1 1 A 73 73 LEU H H 2496 9.019 9.067 -0.048 1
1 762 . 15 1 1 A 73 73 LEU HA H 2496 5.209 4.920 0.289 1
1 772 . 15 1 1 A 73 73 LEU C C 2496 177.015 174.634 2.381 1
1 773 . 15 1 1 A 73 73 LEU CA C 2496 53.393 54.147 -0.754 1
1 774 . 15 1 1 A 73 73 LEU CB C 2496 43.918 43.453 0.465 1
1 778 . 15 1 1 A 73 73 LEU N N 2496 125.439 126.380 -0.941 1
1 779 . 15 1 1 A 74 74 ILE H H 2497 9.921 9.536 0.385 1
1 780 . 15 1 1 A 74 74 ILE HA H 2497 5.128 4.693 0.435 1
1 790 . 15 1 1 A 74 74 ILE C C 2497 175.730 175.139 0.591 1
1 791 . 15 1 1 A 74 74 ILE CA C 2497 60.930 59.910 1.020 1
1 792 . 15 1 1 A 74 74 ILE CB C 2497 39.488 38.370 1.118 1
1 796 . 15 1 1 A 74 74 ILE N N 2497 132.185 129.708 2.477 1
1 797 . 15 1 1 A 75 75 SER H H 2498 9.284 8.953 0.331 1
1 798 . 15 1 1 A 75 75 SER HA H 2498 5.111 5.269 -0.158 1
1 801 . 15 1 1 A 75 75 SER C C 2498 173.449 173.994 -0.545 1
1 802 . 15 1 1 A 75 75 SER CA C 2498 58.260 57.981 0.279 1
1 803 . 15 1 1 A 75 75 SER CB C 2498 63.956 64.472 -0.516 1
1 804 . 15 1 1 A 75 75 SER N N 2498 125.384 124.540 0.844 1
1 805 . 15 1 1 A 76 76 ILE H H 2499 9.861 9.366 0.495 1
1 806 . 15 1 1 A 76 76 ILE HA H 2499 4.814 4.875 -0.061 1
1 816 . 15 1 1 A 76 76 ILE CA C 2499 61.034 61.054 -0.020 1
1 817 . 15 1 1 A 76 76 ILE CB C 2499 40.387 40.476 -0.089 1
1 821 . 15 1 1 A 76 76 ILE N N 2499 129.414 127.251 2.163 1
1 822 . 15 1 1 A 77 77 LYS H H 2500 8.827 9.147 -0.320 1
1 823 . 15 1 1 A 77 77 LYS HA H 2500 5.254 5.455 -0.201 1
1 832 . 15 1 1 A 77 77 LYS C C 2500 175.245 175.004 0.241 1
1 833 . 15 1 1 A 77 77 LYS CA C 2500 54.388 54.556 -0.168 1
1 834 . 15 1 1 A 77 77 LYS CB C 2500 36.127 36.029 0.098 1
1 838 . 15 1 1 A 77 77 LYS N N 2500 126.922 126.296 0.626 1
1 839 . 15 1 1 A 78 78 TYR H H 2501 8.408 8.904 -0.496 1
1 840 . 15 1 1 A 78 78 TYR HA H 2501 5.479 5.155 0.324 1
1 847 . 15 1 1 A 78 78 TYR C C 2501 174.792 175.579 -0.787 1
1 848 . 15 1 1 A 78 78 TYR CA C 2501 56.837 57.342 -0.505 1
1 849 . 15 1 1 A 78 78 TYR CB C 2501 44.008 42.239 1.769 1
1 852 . 15 1 1 A 78 78 TYR N N 2501 122.282 124.431 -2.149 1
1 853 . 15 1 1 A 79 79 GLY H H 2502 8.196 8.419 -0.223 1
1 854 . 15 1 1 A 79 79 GLY HA2 H 2502 4.040 3.750 0.290 1
1 855 . 15 1 1 A 79 79 GLY HA3 H 2502 3.465 3.931 -0.466 1
1 856 . 15 1 1 A 79 79 GLY C C 2502 173.932 173.702 0.230 1
1 857 . 15 1 1 A 79 79 GLY CA C 2502 45.741 46.031 -0.290 1
1 858 . 15 1 1 A 79 79 GLY N N 2502 113.451 114.283 -0.832 1
1 859 . 15 1 1 A 80 80 GLY H H 2503 7.589 8.246 -0.657 1
1 860 . 15 1 1 A 80 80 GLY HA2 H 2503 4.490 4.020 0.470 1
1 861 . 15 1 1 A 80 80 GLY HA3 H 2503 3.555 4.144 -0.589 1
1 862 . 15 1 1 A 80 80 GLY CA C 2503 43.540 44.157 -0.617 1
1 863 . 15 1 1 A 80 80 GLY N N 2503 107.293 107.605 -0.312 1
1 864 . 15 1 1 A 81 81 PRO HA H 2504 4.320 4.384 -0.064 1
1 871 . 15 1 1 A 81 81 PRO C C 2504 175.311 175.031 0.280 1
1 872 . 15 1 1 A 81 81 PRO CA C 2504 62.722 62.865 -0.143 1
1 873 . 15 1 1 A 81 81 PRO CB C 2504 29.297 29.862 -0.565 1
1 876 . 15 1 1 A 82 82 TYR H H 2505 7.778 7.510 0.268 1
1 877 . 15 1 1 A 82 82 TYR HA H 2505 4.791 5.000 -0.209 1
1 884 . 15 1 1 A 82 82 TYR C C 2505 175.086 175.665 -0.579 1
1 885 . 15 1 1 A 82 82 TYR CA C 2505 56.111 56.674 -0.563 1
1 886 . 15 1 1 A 82 82 TYR CB C 2505 39.483 41.678 -2.195 1
1 889 . 15 1 1 A 82 82 TYR N N 2505 123.973 121.380 2.593 1
1 890 . 15 1 1 A 83 83 HIS H H 2506 8.625 9.046 -0.421 1
1 891 . 15 1 1 A 83 83 HIS HA H 2506 4.583 4.920 -0.337 1
1 896 . 15 1 1 A 83 83 HIS C C 2506 178.161 175.715 2.446 1
1 897 . 15 1 1 A 83 83 HIS CA C 2506 58.241 57.657 0.584 1
1 898 . 15 1 1 A 83 83 HIS CB C 2506 33.132 30.747 2.385 1
1 901 . 15 1 1 A 83 83 HIS N N 2506 124.092 121.738 2.354 1
1 902 . 15 1 1 A 84 84 ILE H H 2507 8.327 8.530 -0.203 1
1 903 . 15 1 1 A 84 84 ILE HA H 2507 4.553 4.466 0.087 1
1 913 . 15 1 1 A 84 84 ILE C C 2507 176.523 176.518 0.005 1
1 914 . 15 1 1 A 84 84 ILE CA C 2507 60.791 60.337 0.454 1
1 915 . 15 1 1 A 84 84 ILE CB C 2507 39.162 39.571 -0.409 1
1 919 . 15 1 1 A 84 84 ILE N N 2507 117.355 119.671 -2.316 1
1 920 . 15 1 1 A 85 85 GLY H H 2508 9.130 8.667 0.463 1
1 921 . 15 1 1 A 85 85 GLY HA2 H 2508 3.883 3.867 0.016 1
1 922 . 15 1 1 A 85 85 GLY HA3 H 2508 3.800 3.894 -0.094 1
1 923 . 15 1 1 A 85 85 GLY C C 2508 174.438 174.927 -0.489 1
1 924 . 15 1 1 A 85 85 GLY CA C 2508 47.673 47.220 0.453 1
1 925 . 15 1 1 A 85 85 GLY N N 2508 111.346 112.816 -1.470 1
1 926 . 15 1 1 A 86 86 GLY H H 2509 8.236 9.096 -0.860 1
1 927 . 15 1 1 A 86 86 GLY HA2 H 2509 3.893 3.731 0.162 1
1 928 . 15 1 1 A 86 86 GLY HA3 H 2509 3.161 3.767 -0.606 1
1 929 . 15 1 1 A 86 86 GLY C C 2509 171.837 173.392 -1.555 1
1 930 . 15 1 1 A 86 86 GLY CA C 2509 44.844 44.903 -0.059 1
1 931 . 15 1 1 A 86 86 GLY N N 2509 115.594 115.902 -0.308 1
1 932 . 15 1 1 A 87 87 SER H H 2510 7.385 7.735 -0.350 1
1 933 . 15 1 1 A 87 87 SER HA H 2510 4.217 3.879 0.338 1
1 936 . 15 1 1 A 87 87 SER CA C 2510 54.783 55.629 -0.846 1
1 937 . 15 1 1 A 87 87 SER CB C 2510 62.683 63.733 -1.050 1
1 938 . 15 1 1 A 87 87 SER N N 2510 112.859 116.305 -3.446 1
1 939 . 15 1 1 A 88 88 PRO HA H 2511 5.532 4.731 0.801 1
1 946 . 15 1 1 A 88 88 PRO C C 2511 175.870 175.258 0.612 1
1 947 . 15 1 1 A 88 88 PRO CA C 2511 62.379 62.205 0.174 1
1 948 . 15 1 1 A 88 88 PRO CB C 2511 33.639 32.284 1.355 1
1 951 . 15 1 1 A 89 89 PHE H H 2512 9.359 8.516 0.843 1
1 952 . 15 1 1 A 89 89 PHE HA H 2512 4.467 4.788 -0.321 1
1 960 . 15 1 1 A 89 89 PHE C C 2512 175.152 175.877 -0.725 1
1 961 . 15 1 1 A 89 89 PHE CA C 2512 57.401 57.163 0.238 1
1 962 . 15 1 1 A 89 89 PHE CB C 2512 40.843 41.083 -0.240 1
1 966 . 15 1 1 A 89 89 PHE N N 2512 124.789 119.858 4.931 1
1 967 . 15 1 1 A 90 90 LYS H H 2513 8.772 8.617 0.155 1
1 968 . 15 1 1 A 90 90 LYS HA H 2513 4.941 4.467 0.474 1
1 973 . 15 1 1 A 90 90 LYS C C 2513 174.183 176.026 -1.843 1
1 974 . 15 1 1 A 90 90 LYS CA C 2513 55.749 56.376 -0.627 1
1 975 . 15 1 1 A 90 90 LYS CB C 2513 32.817 32.071 0.746 1
1 978 . 15 1 1 A 90 90 LYS N N 2513 125.133 120.583 4.550 1
1 979 . 15 1 1 A 91 91 ALA H H 2514 9.158 7.708 1.450 1
1 980 . 15 1 1 A 91 91 ALA HA H 2514 4.510 4.207 0.303 1
1 984 . 15 1 1 A 91 91 ALA C C 2514 176.561 177.352 -0.791 1
1 985 . 15 1 1 A 91 91 ALA CA C 2514 50.528 52.993 -2.465 1
1 986 . 15 1 1 A 91 91 ALA CB C 2514 20.653 18.720 1.933 1
1 987 . 15 1 1 A 91 91 ALA N N 2514 131.989 122.453 9.536 1
1 988 . 15 1 1 A 92 92 LYS H H 2515 8.186 8.720 -0.534 1
1 989 . 15 1 1 A 92 92 LYS HA H 2515 4.926 4.725 0.201 1
1 998 . 15 1 1 A 92 92 LYS C C 2515 175.177 175.524 -0.347 1
1 999 . 15 1 1 A 92 92 LYS CA C 2515 55.725 55.978 -0.253 1
1 1000 . 15 1 1 A 92 92 LYS CB C 2515 33.765 33.305 0.460 1
1 1004 . 15 1 1 A 92 92 LYS N N 2515 124.887 123.837 1.050 1
1 1005 . 15 1 1 A 93 93 VAL H H 2516 9.362 9.489 -0.127 1
1 1006 . 15 1 1 A 93 93 VAL HA H 2516 5.161 5.066 0.095 1
1 1014 . 15 1 1 A 93 93 VAL C C 2516 176.988 175.036 1.952 1
1 1015 . 15 1 1 A 93 93 VAL CA C 2516 60.523 61.145 -0.622 1
1 1016 . 15 1 1 A 93 93 VAL CB C 2516 33.291 34.372 -1.081 1
1 1019 . 15 1 1 A 93 93 VAL N N 2516 129.943 125.417 4.526 1
1 1020 . 15 1 1 A 94 94 THR H H 2517 8.614 8.511 0.103 1
1 1021 . 15 1 1 A 94 94 THR HA H 2517 4.902 4.902 0.000 1
1 1026 . 15 1 1 A 94 94 THR C C 2517 172.759 173.107 -0.348 1
1 1027 . 15 1 1 A 94 94 THR CA C 2517 60.121 59.827 0.294 1
1 1028 . 15 1 1 A 94 94 THR CB C 2517 71.072 71.650 -0.578 1
1 1030 . 15 1 1 A 94 94 THR N N 2517 122.032 116.107 5.925 1
1 1031 . 15 1 1 A 95 95 GLY H H 2518 8.280 8.465 -0.185 1
1 1032 . 15 1 1 A 95 95 GLY HA2 H 2518 3.852 4.141 -0.289 1
1 1033 . 15 1 1 A 95 95 GLY HA3 H 2518 4.846 4.144 0.702 1
1 1034 . 15 1 1 A 95 95 GLY CA C 2518 43.955 44.441 -0.486 1
1 1035 . 15 1 1 A 95 95 GLY N N 2518 107.949 107.809 0.140 1
1 1036 . 15 1 1 A 96 96 PRO HA H 2519 4.449 4.638 -0.189 1
1 1043 . 15 1 1 A 96 96 PRO C C 2519 176.892 176.446 0.446 1
1 1044 . 15 1 1 A 96 96 PRO CA C 2519 62.062 62.839 -0.777 1
1 1045 . 15 1 1 A 96 96 PRO CB C 2519 32.286 31.901 0.385 1
1 1048 . 15 1 1 A 97 97 ARG H H 2520 8.651 8.510 0.141 1
1 1049 . 15 1 1 A 97 97 ARG HA H 2520 4.348 4.446 -0.098 1
1 1056 . 15 1 1 A 97 97 ARG C C 2520 176.236 176.621 -0.385 1
1 1057 . 15 1 1 A 97 97 ARG CA C 2520 57.587 56.390 1.197 1
1 1058 . 15 1 1 A 97 97 ARG CB C 2520 30.472 30.378 0.094 1
1 1061 . 15 1 1 A 97 97 ARG N N 2520 120.781 122.419 -1.638 1
1 1062 . 15 1 1 A 98 98 LEU H H 2521 8.545 9.177 -0.632 1
1 1063 . 15 1 1 A 98 98 LEU HA H 2521 4.577 4.614 -0.037 1
1 1073 . 15 1 1 A 98 98 LEU C C 2521 175.880 175.840 0.040 1
1 1074 . 15 1 1 A 98 98 LEU CA C 2521 55.068 54.308 0.760 1
1 1075 . 15 1 1 A 98 98 LEU CB C 2521 43.082 41.752 1.330 1
1 1079 . 15 1 1 A 98 98 LEU N N 2521 128.715 128.256 0.459 1
1 4 . 16 1 1 A 2 2 ALA HA H -2 4.374 4.253 0.121 1
1 8 . 16 1 1 A 2 2 ALA C C -2 177.865 177.112 0.753 1
1 9 . 16 1 1 A 2 2 ALA CA C -2 52.670 53.360 -0.690 1
1 10 . 16 1 1 A 2 2 ALA CB C -2 19.508 19.646 -0.138 1
1 32 . 16 1 1 A 5 5 ASP H H 2428 8.300 8.842 -0.542 1
1 33 . 16 1 1 A 5 5 ASP HA H 2428 5.082 5.160 -0.078 1
1 36 . 16 1 1 A 5 5 ASP CA C 2428 51.517 51.159 0.358 1
1 37 . 16 1 1 A 5 5 ASP CB C 2428 42.244 41.014 1.230 1
1 38 . 16 1 1 A 5 5 ASP N N 2428 122.879 119.718 3.161 1
1 39 . 16 1 1 A 6 6 PRO HA H 2429 4.340 4.447 -0.107 1
1 46 . 16 1 1 A 6 6 PRO C C 2429 178.266 178.870 -0.604 1
1 47 . 16 1 1 A 6 6 PRO CA C 2429 64.494 65.074 -0.580 1
1 48 . 16 1 1 A 6 6 PRO CB C 2429 31.841 31.955 -0.114 1
1 51 . 16 1 1 A 7 7 GLY H H 2430 8.686 8.432 0.254 1
1 52 . 16 1 1 A 7 7 GLY HA2 H 2430 4.116 3.903 0.213 1
1 53 . 16 1 1 A 7 7 GLY HA3 H 2430 3.868 3.904 -0.036 1
1 54 . 16 1 1 A 7 7 GLY C C 2430 174.567 175.461 -0.894 1
1 55 . 16 1 1 A 7 7 GLY CA C 2430 46.038 46.562 -0.524 1
1 56 . 16 1 1 A 7 7 GLY N N 2430 107.655 105.467 2.188 1
1 57 . 16 1 1 A 8 8 LEU H H 2431 7.692 7.503 0.189 1
1 58 . 16 1 1 A 8 8 LEU HA H 2431 4.507 4.391 0.116 1
1 68 . 16 1 1 A 8 8 LEU C C 2431 176.876 177.526 -0.650 1
1 69 . 16 1 1 A 8 8 LEU CA C 2431 54.307 56.261 -1.954 1
1 70 . 16 1 1 A 8 8 LEU CB C 2431 42.879 42.817 0.062 1
1 74 . 16 1 1 A 8 8 LEU N N 2431 120.022 119.748 0.274 1
1 75 . 16 1 1 A 9 9 VAL H H 2432 7.378 7.396 -0.018 1
1 76 . 16 1 1 A 9 9 VAL HA H 2432 4.154 3.921 0.233 1
1 84 . 16 1 1 A 9 9 VAL C C 2432 174.703 175.679 -0.976 1
1 85 . 16 1 1 A 9 9 VAL CA C 2432 62.387 63.195 -0.808 1
1 86 . 16 1 1 A 9 9 VAL CB C 2432 32.519 31.505 1.014 1
1 89 . 16 1 1 A 9 9 VAL N N 2432 123.902 119.683 4.219 1
1 90 . 16 1 1 A 10 10 SER H H 2433 8.201 8.438 -0.237 1
1 91 . 16 1 1 A 10 10 SER HA H 2433 5.136 5.110 0.026 1
1 94 . 16 1 1 A 10 10 SER CA C 2433 56.554 57.336 -0.782 1
1 95 . 16 1 1 A 10 10 SER CB C 2433 66.763 66.109 0.654 1
1 96 . 16 1 1 A 10 10 SER N N 2433 121.921 123.448 -1.527 1
1 97 . 16 1 1 A 11 11 ALA H H 2434 8.670 8.517 0.153 1
1 98 . 16 1 1 A 11 11 ALA HA H 2434 5.632 5.394 0.238 1
1 102 . 16 1 1 A 11 11 ALA C C 2434 175.459 175.935 -0.476 1
1 103 . 16 1 1 A 11 11 ALA CA C 2434 50.575 50.325 0.250 1
1 104 . 16 1 1 A 11 11 ALA CB C 2434 23.111 21.727 1.384 1
1 105 . 16 1 1 A 11 11 ALA N N 2434 124.828 126.056 -1.228 1
1 106 . 16 1 1 A 12 12 TYR H H 2435 8.609 8.903 -0.294 1
1 107 . 16 1 1 A 12 12 TYR HA H 2435 4.879 5.065 -0.186 1
1 114 . 16 1 1 A 12 12 TYR C C 2435 173.645 174.603 -0.958 1
1 115 . 16 1 1 A 12 12 TYR CA C 2435 56.268 56.975 -0.707 1
1 116 . 16 1 1 A 12 12 TYR CB C 2435 39.522 42.265 -2.743 1
1 119 . 16 1 1 A 12 12 TYR N N 2435 118.305 119.427 -1.122 1
1 120 . 16 1 1 A 13 13 GLY H H 2436 8.655 8.457 0.198 1
1 121 . 16 1 1 A 13 13 GLY HA2 H 2436 4.943 4.278 0.665 1
1 122 . 16 1 1 A 13 13 GLY HA3 H 2436 4.028 4.319 -0.291 1
1 123 . 16 1 1 A 13 13 GLY C C 2436 175.334 174.874 0.460 1
1 124 . 16 1 1 A 13 13 GLY CA C 2436 44.389 44.370 0.019 1
1 125 . 16 1 1 A 13 13 GLY N N 2436 110.710 110.288 0.422 1
1 126 . 16 1 1 A 14 14 ALA H H 2437 8.939 8.737 0.202 1
1 127 . 16 1 1 A 14 14 ALA HA H 2437 4.276 4.077 0.199 1
1 131 . 16 1 1 A 14 14 ALA C C 2437 180.524 179.158 1.366 1
1 132 . 16 1 1 A 14 14 ALA CA C 2437 55.551 55.079 0.472 1
1 133 . 16 1 1 A 14 14 ALA CB C 2437 18.411 18.498 -0.087 1
1 134 . 16 1 1 A 14 14 ALA N N 2437 126.973 123.681 3.292 1
1 135 . 16 1 1 A 15 15 GLY H H 2438 8.933 8.736 0.197 1
1 136 . 16 1 1 A 15 15 GLY HA2 H 2438 4.531 3.969 0.562 1
1 137 . 16 1 1 A 15 15 GLY HA3 H 2438 3.576 4.176 -0.600 1
1 138 . 16 1 1 A 15 15 GLY C C 2438 174.323 175.387 -1.064 1
1 139 . 16 1 1 A 15 15 GLY CA C 2438 46.855 46.814 0.041 1
1 140 . 16 1 1 A 15 15 GLY N N 2438 104.803 105.385 -0.582 1
1 141 . 16 1 1 A 16 16 LEU H H 2439 7.529 7.632 -0.103 1
1 142 . 16 1 1 A 16 16 LEU HA H 2439 3.768 3.832 -0.064 1
1 152 . 16 1 1 A 16 16 LEU C C 2439 176.388 178.569 -2.181 1
1 153 . 16 1 1 A 16 16 LEU CA C 2439 56.137 57.081 -0.944 1
1 154 . 16 1 1 A 16 16 LEU CB C 2439 41.621 41.217 0.404 1
1 158 . 16 1 1 A 16 16 LEU N N 2439 119.633 121.726 -2.093 1
1 159 . 16 1 1 A 17 17 GLU H H 2440 7.505 8.013 -0.508 1
1 160 . 16 1 1 A 17 17 GLU HA H 2440 4.663 4.321 0.342 1
1 165 . 16 1 1 A 17 17 GLU C C 2440 178.126 176.593 1.533 1
1 166 . 16 1 1 A 17 17 GLU CA C 2440 56.447 56.802 -0.355 1
1 167 . 16 1 1 A 17 17 GLU CB C 2440 31.485 30.924 0.561 1
1 169 . 16 1 1 A 17 17 GLU N N 2440 114.368 116.206 -1.838 1
1 170 . 16 1 1 A 18 18 GLY H H 2441 7.921 7.252 0.669 1
1 171 . 16 1 1 A 18 18 GLY HA2 H 2441 4.889 4.192 0.697 1
1 172 . 16 1 1 A 18 18 GLY HA3 H 2441 3.707 4.229 -0.522 1
1 173 . 16 1 1 A 18 18 GLY C C 2441 170.965 171.518 -0.553 1
1 174 . 16 1 1 A 18 18 GLY CA C 2441 45.549 45.374 0.175 1
1 175 . 16 1 1 A 18 18 GLY N N 2441 109.165 105.289 3.876 1
1 176 . 16 1 1 A 19 19 GLY H H 2442 7.540 7.815 -0.275 1
1 177 . 16 1 1 A 19 19 GLY HA2 H 2442 4.086 4.205 -0.119 1
1 178 . 16 1 1 A 19 19 GLY HA3 H 2442 4.086 4.232 -0.146 1
1 179 . 16 1 1 A 19 19 GLY C C 2442 171.051 171.476 -0.425 1
1 180 . 16 1 1 A 19 19 GLY CA C 2442 44.937 46.255 -1.318 1
1 181 . 16 1 1 A 19 19 GLY N N 2442 105.460 108.583 -3.123 1
1 182 . 16 1 1 A 20 20 VAL H H 2443 8.899 8.260 0.639 1
1 183 . 16 1 1 A 20 20 VAL HA H 2443 5.062 5.043 0.019 1
1 191 . 16 1 1 A 20 20 VAL C C 2443 176.623 175.169 1.454 1
1 192 . 16 1 1 A 20 20 VAL CA C 2443 60.197 60.293 -0.096 1
1 193 . 16 1 1 A 20 20 VAL CB C 2443 35.107 35.275 -0.168 1
1 196 . 16 1 1 A 20 20 VAL N N 2443 122.753 119.571 3.182 1
1 197 . 16 1 1 A 21 21 THR H H 2444 8.630 8.561 0.069 1
1 198 . 16 1 1 A 21 21 THR HA H 2444 3.773 4.263 -0.490 1
1 203 . 16 1 1 A 21 21 THR C C 2444 175.646 174.902 0.744 1
1 204 . 16 1 1 A 21 21 THR CA C 2444 62.732 62.902 -0.170 1
1 205 . 16 1 1 A 21 21 THR CB C 2444 68.925 68.597 0.328 1
1 207 . 16 1 1 A 21 21 THR N N 2444 118.179 119.205 -1.026 1
1 208 . 16 1 1 A 22 22 GLY H H 2445 8.736 8.792 -0.056 1
1 209 . 16 1 1 A 22 22 GLY HA2 H 2445 3.412 3.984 -0.572 1
1 210 . 16 1 1 A 22 22 GLY HA3 H 2445 4.061 3.985 0.076 1
1 211 . 16 1 1 A 22 22 GLY C C 2445 172.973 173.239 -0.266 1
1 212 . 16 1 1 A 22 22 GLY CA C 2445 45.577 45.299 0.278 1
1 213 . 16 1 1 A 22 22 GLY N N 2445 107.888 113.887 -5.999 1
1 214 . 16 1 1 A 23 23 ASN H H 2446 7.877 7.778 0.099 1
1 215 . 16 1 1 A 23 23 ASN HA H 2446 5.253 5.163 0.090 1
1 220 . 16 1 1 A 23 23 ASN CA C 2446 49.740 49.797 -0.057 1
1 221 . 16 1 1 A 23 23 ASN CB C 2446 40.198 39.320 0.878 1
1 222 . 16 1 1 A 23 23 ASN N N 2446 120.684 119.608 1.076 1
1 224 . 16 1 1 A 24 24 PRO HA H 2447 4.525 4.824 -0.299 1
1 231 . 16 1 1 A 24 24 PRO CA C 2447 62.766 62.508 0.258 1
1 232 . 16 1 1 A 24 24 PRO CB C 2447 31.732 32.581 -0.849 1
1 235 . 16 1 1 A 25 25 ALA H H 2448 9.178 8.171 1.007 1
1 236 . 16 1 1 A 25 25 ALA HA H 2448 4.614 4.903 -0.289 1
1 240 . 16 1 1 A 25 25 ALA C C 2448 175.503 175.344 0.159 1
1 241 . 16 1 1 A 25 25 ALA CA C 2448 50.526 50.493 0.033 1
1 242 . 16 1 1 A 25 25 ALA CB C 2448 20.458 23.110 -2.652 1
1 243 . 16 1 1 A 25 25 ALA N N 2448 132.079 120.828 11.251 1
1 244 . 16 1 1 A 26 26 GLU H H 2449 8.813 9.004 -0.191 1
1 245 . 16 1 1 A 26 26 GLU HA H 2449 5.830 5.307 0.523 1
1 250 . 16 1 1 A 26 26 GLU C C 2449 176.272 174.654 1.618 1
1 251 . 16 1 1 A 26 26 GLU CA C 2449 54.376 54.497 -0.121 1
1 252 . 16 1 1 A 26 26 GLU CB C 2449 35.463 34.145 1.318 1
1 254 . 16 1 1 A 26 26 GLU N N 2449 120.079 117.720 2.359 1
1 255 . 16 1 1 A 27 27 PHE H H 2450 8.782 8.891 -0.109 1
1 256 . 16 1 1 A 27 27 PHE HA H 2450 5.021 5.159 -0.138 1
1 264 . 16 1 1 A 27 27 PHE C C 2450 171.205 171.981 -0.776 1
1 265 . 16 1 1 A 27 27 PHE CA C 2450 56.852 56.374 0.478 1
1 266 . 16 1 1 A 27 27 PHE CB C 2450 41.080 41.120 -0.040 1
1 270 . 16 1 1 A 27 27 PHE N N 2450 118.670 117.197 1.473 1
1 271 . 16 1 1 A 28 28 VAL H H 2451 8.961 9.278 -0.317 1
1 272 . 16 1 1 A 28 28 VAL HA H 2451 4.761 5.109 -0.348 1
1 280 . 16 1 1 A 28 28 VAL C C 2451 174.673 173.826 0.847 1
1 281 . 16 1 1 A 28 28 VAL CA C 2451 60.619 59.438 1.181 1
1 282 . 16 1 1 A 28 28 VAL CB C 2451 35.484 34.873 0.611 1
1 285 . 16 1 1 A 28 28 VAL N N 2451 121.552 120.217 1.335 1
1 286 . 16 1 1 A 29 29 VAL H H 2452 9.294 9.444 -0.150 1
1 287 . 16 1 1 A 29 29 VAL HA H 2452 4.363 4.569 -0.206 1
1 295 . 16 1 1 A 29 29 VAL C C 2452 174.218 174.909 -0.691 1
1 296 . 16 1 1 A 29 29 VAL CA C 2452 61.526 61.977 -0.451 1
1 297 . 16 1 1 A 29 29 VAL CB C 2452 32.666 31.298 1.368 1
1 300 . 16 1 1 A 29 29 VAL N N 2452 125.585 128.276 -2.691 1
1 301 . 16 1 1 A 30 30 ASN H H 2453 9.465 9.085 0.380 1
1 302 . 16 1 1 A 30 30 ASN HA H 2453 5.096 5.176 -0.080 1
1 307 . 16 1 1 A 30 30 ASN C C 2453 176.216 176.523 -0.307 1
1 308 . 16 1 1 A 30 30 ASN CA C 2453 52.011 52.664 -0.653 1
1 309 . 16 1 1 A 30 30 ASN CB C 2453 39.057 38.665 0.392 1
1 310 . 16 1 1 A 30 30 ASN N N 2453 127.724 126.954 0.770 1
1 312 . 16 1 1 A 31 31 THR H H 2454 8.915 8.596 0.319 1
1 313 . 16 1 1 A 31 31 THR HA H 2454 4.342 4.436 -0.094 1
1 318 . 16 1 1 A 31 31 THR C C 2454 176.816 176.416 0.400 1
1 319 . 16 1 1 A 31 31 THR CA C 2454 61.117 62.706 -1.589 1
1 320 . 16 1 1 A 31 31 THR CB C 2454 68.209 69.463 -1.254 1
1 322 . 16 1 1 A 31 31 THR N N 2454 117.783 117.217 0.566 1
1 323 . 16 1 1 A 32 32 SER H H 2455 8.454 7.956 0.498 1
1 324 . 16 1 1 A 32 32 SER HA H 2455 4.155 4.245 -0.090 1
1 327 . 16 1 1 A 32 32 SER C C 2455 175.458 175.764 -0.306 1
1 328 . 16 1 1 A 32 32 SER CA C 2455 62.148 62.364 -0.216 1
1 329 . 16 1 1 A 32 32 SER CB C 2455 63.476 63.079 0.397 1
1 330 . 16 1 1 A 32 32 SER N N 2455 121.781 118.802 2.979 1
1 331 . 16 1 1 A 33 33 ASN H H 2456 8.845 8.170 0.675 1
1 332 . 16 1 1 A 33 33 ASN HA H 2456 5.064 4.530 0.534 1
1 337 . 16 1 1 A 33 33 ASN C C 2456 174.674 176.586 -1.912 1
1 338 . 16 1 1 A 33 33 ASN CA C 2456 53.067 55.056 -1.989 1
1 339 . 16 1 1 A 33 33 ASN CB C 2456 39.632 38.907 0.725 1
1 340 . 16 1 1 A 33 33 ASN N N 2456 120.176 118.416 1.760 1
1 342 . 16 1 1 A 34 34 ALA H H 2457 7.714 8.060 -0.346 1
1 343 . 16 1 1 A 34 34 ALA HA H 2457 4.482 4.563 -0.081 1
1 347 . 16 1 1 A 34 34 ALA C C 2457 177.582 178.090 -0.508 1
1 348 . 16 1 1 A 34 34 ALA CA C 2457 52.521 52.050 0.471 1
1 349 . 16 1 1 A 34 34 ALA CB C 2457 22.252 21.037 1.215 1
1 350 . 16 1 1 A 34 34 ALA N N 2457 123.065 119.258 3.807 1
1 351 . 16 1 1 A 35 35 GLY H H 2458 8.195 8.380 -0.185 1
1 352 . 16 1 1 A 35 35 GLY HA2 H 2458 4.246 4.059 0.187 1
1 353 . 16 1 1 A 35 35 GLY HA3 H 2458 3.902 4.077 -0.175 1
1 354 . 16 1 1 A 35 35 GLY C C 2458 173.360 173.244 0.116 1
1 355 . 16 1 1 A 35 35 GLY CA C 2458 44.486 46.242 -1.756 1
1 356 . 16 1 1 A 35 35 GLY N N 2458 108.472 105.913 2.559 1
1 357 . 16 1 1 A 36 36 ALA H H 2459 8.430 8.188 0.242 1
1 358 . 16 1 1 A 36 36 ALA HA H 2459 4.472 5.009 -0.537 1
1 362 . 16 1 1 A 36 36 ALA C C 2459 176.968 175.973 0.995 1
1 363 . 16 1 1 A 36 36 ALA CA C 2459 52.695 51.526 1.169 1
1 364 . 16 1 1 A 36 36 ALA CB C 2459 19.360 22.794 -3.434 1
1 365 . 16 1 1 A 36 36 ALA N N 2459 126.012 124.826 1.186 1
1 366 . 16 1 1 A 37 37 GLY H H 2460 7.781 8.596 -0.815 1
1 367 . 16 1 1 A 37 37 GLY HA2 H 2460 3.856 4.005 -0.149 1
1 368 . 16 1 1 A 37 37 GLY HA3 H 2460 3.164 4.124 -0.960 1
1 369 . 16 1 1 A 37 37 GLY C C 2460 170.730 171.834 -1.104 1
1 370 . 16 1 1 A 37 37 GLY CA C 2460 44.747 45.622 -0.875 1
1 371 . 16 1 1 A 37 37 GLY N N 2460 109.493 105.211 4.282 1
1 372 . 16 1 1 A 38 38 ALA H H 2461 8.055 7.558 0.497 1
1 373 . 16 1 1 A 38 38 ALA HA H 2461 4.389 4.606 -0.217 1
1 377 . 16 1 1 A 38 38 ALA C C 2461 176.609 176.452 0.157 1
1 378 . 16 1 1 A 38 38 ALA CA C 2461 51.419 51.773 -0.354 1
1 379 . 16 1 1 A 38 38 ALA CB C 2461 19.665 19.212 0.453 1
1 380 . 16 1 1 A 38 38 ALA N N 2461 121.997 123.007 -1.010 1
1 381 . 16 1 1 A 39 39 LEU H H 2462 8.597 8.605 -0.008 1
1 382 . 16 1 1 A 39 39 LEU HA H 2462 5.022 5.263 -0.241 1
1 392 . 16 1 1 A 39 39 LEU C C 2462 175.883 175.369 0.514 1
1 393 . 16 1 1 A 39 39 LEU CA C 2462 53.907 53.389 0.518 1
1 394 . 16 1 1 A 39 39 LEU CB C 2462 44.576 45.059 -0.483 1
1 398 . 16 1 1 A 39 39 LEU N N 2462 126.664 125.579 1.085 1
1 399 . 16 1 1 A 40 40 SER H H 2463 8.898 9.204 -0.306 1
1 400 . 16 1 1 A 40 40 SER HA H 2463 4.732 4.753 -0.021 1
1 403 . 16 1 1 A 40 40 SER C C 2463 172.984 172.900 0.084 1
1 404 . 16 1 1 A 40 40 SER CA C 2463 56.730 56.936 -0.206 1
1 405 . 16 1 1 A 40 40 SER CB C 2463 64.648 64.352 0.296 1
1 406 . 16 1 1 A 40 40 SER N N 2463 122.932 122.004 0.928 1
1 407 . 16 1 1 A 41 41 VAL H H 2464 8.538 7.428 1.110 1
1 408 . 16 1 1 A 41 41 VAL HA H 2464 5.131 4.168 0.963 1
1 416 . 16 1 1 A 41 41 VAL C C 2464 174.812 174.653 0.159 1
1 417 . 16 1 1 A 41 41 VAL CA C 2464 60.784 62.873 -2.089 1
1 418 . 16 1 1 A 41 41 VAL CB C 2464 34.262 32.302 1.960 1
1 420 . 16 1 1 A 41 41 VAL N N 2464 129.161 123.391 5.770 1
1 421 . 16 1 1 A 42 42 THR H H 2465 8.807 9.045 -0.238 1
1 422 . 16 1 1 A 42 42 THR HA H 2465 4.573 5.135 -0.562 1
1 427 . 16 1 1 A 42 42 THR CA C 2465 60.408 61.469 -1.061 1
1 428 . 16 1 1 A 42 42 THR CB C 2465 71.764 72.237 -0.473 1
1 430 . 16 1 1 A 42 42 THR N N 2465 120.898 124.443 -3.545 1
1 431 . 16 1 1 A 43 43 ILE H H 2466 8.648 8.883 -0.235 1
1 432 . 16 1 1 A 43 43 ILE HA H 2466 4.854 4.793 0.061 1
1 442 . 16 1 1 A 43 43 ILE C C 2466 174.073 174.158 -0.085 1
1 443 . 16 1 1 A 43 43 ILE CA C 2466 61.184 60.236 0.948 1
1 444 . 16 1 1 A 43 43 ILE CB C 2466 39.516 40.256 -0.740 1
1 448 . 16 1 1 A 43 43 ILE N N 2466 124.810 125.777 -0.967 1
1 449 . 16 1 1 A 44 44 ASP H H 2467 8.821 9.259 -0.438 1
1 450 . 16 1 1 A 44 44 ASP HA H 2467 5.217 5.538 -0.321 1
1 453 . 16 1 1 A 44 44 ASP C C 2467 175.002 175.336 -0.334 1
1 454 . 16 1 1 A 44 44 ASP CA C 2467 52.998 52.329 0.669 1
1 455 . 16 1 1 A 44 44 ASP CB C 2467 44.728 44.350 0.378 1
1 456 . 16 1 1 A 44 44 ASP N N 2467 129.093 128.469 0.624 1
1 457 . 16 1 1 A 45 45 GLY H H 2468 8.535 8.257 0.278 1
1 458 . 16 1 1 A 45 45 GLY HA2 H 2468 3.954 3.739 0.215 1
1 459 . 16 1 1 A 45 45 GLY HA3 H 2468 3.561 3.951 -0.390 1
1 460 . 16 1 1 A 45 45 GLY CA C 2468 45.659 45.026 0.633 1
1 461 . 16 1 1 A 45 45 GLY N N 2468 112.751 109.643 3.108 1
1 462 . 16 1 1 A 46 46 PRO HA H 2469 4.318 4.321 -0.003 1
1 469 . 16 1 1 A 46 46 PRO C C 2469 176.086 176.280 -0.194 1
1 470 . 16 1 1 A 46 46 PRO CA C 2469 64.198 64.149 0.049 1
1 471 . 16 1 1 A 46 46 PRO CB C 2469 32.348 32.107 0.241 1
1 474 . 16 1 1 A 47 47 SER H H 2470 7.106 7.615 -0.509 1
1 475 . 16 1 1 A 47 47 SER HA H 2470 4.632 4.930 -0.298 1
1 478 . 16 1 1 A 47 47 SER C C 2470 172.969 173.114 -0.145 1
1 479 . 16 1 1 A 47 47 SER CA C 2470 57.106 57.496 -0.390 1
1 480 . 16 1 1 A 47 47 SER CB C 2470 66.262 67.550 -1.288 1
1 481 . 16 1 1 A 47 47 SER N N 2470 110.556 114.136 -3.580 1
1 482 . 16 1 1 A 48 48 LYS H H 2471 8.534 8.208 0.326 1
1 483 . 16 1 1 A 48 48 LYS HA H 2471 4.486 4.483 0.003 1
1 492 . 16 1 1 A 48 48 LYS C C 2471 177.231 177.519 -0.288 1
1 493 . 16 1 1 A 48 48 LYS CA C 2471 56.620 56.767 -0.147 1
1 494 . 16 1 1 A 48 48 LYS CB C 2471 32.379 33.092 -0.713 1
1 498 . 16 1 1 A 48 48 LYS N N 2471 124.055 123.047 1.008 1
1 499 . 16 1 1 A 49 49 VAL H H 2472 8.497 8.634 -0.137 1
1 500 . 16 1 1 A 49 49 VAL HA H 2472 4.552 4.536 0.016 1
1 508 . 16 1 1 A 49 49 VAL C C 2472 175.292 175.525 -0.233 1
1 509 . 16 1 1 A 49 49 VAL CA C 2472 60.142 61.133 -0.991 1
1 510 . 16 1 1 A 49 49 VAL CB C 2472 33.464 32.967 0.497 1
1 513 . 16 1 1 A 49 49 VAL N N 2472 121.233 120.630 0.603 1
1 514 . 16 1 1 A 50 50 LYS H H 2473 8.190 8.492 -0.302 1
1 515 . 16 1 1 A 50 50 LYS HA H 2473 4.522 4.432 0.090 1
1 518 . 16 1 1 A 50 50 LYS CA C 2473 55.952 55.566 0.386 1
1 519 . 16 1 1 A 50 50 LYS CB C 2473 32.896 31.040 1.856 1
1 520 . 16 1 1 A 50 50 LYS N N 2473 126.082 122.473 3.609 1
1 521 . 16 1 1 A 51 51 MET H H 2474 8.818 8.791 0.027 1
1 522 . 16 1 1 A 51 51 MET HA H 2474 5.324 4.739 0.585 1
1 530 . 16 1 1 A 51 51 MET C C 2474 173.933 175.384 -1.451 1
1 531 . 16 1 1 A 51 51 MET CA C 2474 54.848 55.666 -0.818 1
1 532 . 16 1 1 A 51 51 MET CB C 2474 37.043 33.404 3.639 1
1 535 . 16 1 1 A 51 51 MET N N 2474 126.911 123.340 3.571 1
1 536 . 16 1 1 A 52 52 ASP H H 2475 9.095 9.135 -0.040 1
1 537 . 16 1 1 A 52 52 ASP HA H 2475 4.947 5.335 -0.388 1
1 540 . 16 1 1 A 52 52 ASP C C 2475 173.923 174.435 -0.512 1
1 541 . 16 1 1 A 52 52 ASP CA C 2475 53.487 53.376 0.111 1
1 542 . 16 1 1 A 52 52 ASP CB C 2475 44.765 45.161 -0.396 1
1 543 . 16 1 1 A 52 52 ASP N N 2475 125.526 124.471 1.055 1
1 544 . 16 1 1 A 53 53 CYS H H 2476 8.606 8.993 -0.387 1
1 545 . 16 1 1 A 53 53 CYS HA H 2476 5.145 5.325 -0.180 1
1 548 . 16 1 1 A 53 53 CYS C C 2476 173.330 173.239 0.091 1
1 549 . 16 1 1 A 53 53 CYS CA C 2476 57.452 57.401 0.051 1
1 550 . 16 1 1 A 53 53 CYS CB C 2476 28.108 30.405 -2.297 1
1 551 . 16 1 1 A 53 53 CYS N N 2476 124.317 124.191 0.126 1
1 552 . 16 1 1 A 54 54 GLN H H 2477 8.978 9.056 -0.078 1
1 553 . 16 1 1 A 54 54 GLN HA H 2477 4.884 5.011 -0.127 1
1 560 . 16 1 1 A 54 54 GLN C C 2477 174.854 174.119 0.735 1
1 561 . 16 1 1 A 54 54 GLN CA C 2477 53.891 54.504 -0.613 1
1 562 . 16 1 1 A 54 54 GLN CB C 2477 32.837 32.921 -0.084 1
1 564 . 16 1 1 A 54 54 GLN N N 2477 127.074 126.073 1.001 1
1 566 . 16 1 1 A 55 55 GLU H H 2478 9.065 8.776 0.289 1
1 567 . 16 1 1 A 55 55 GLU HA H 2478 4.280 4.683 -0.403 1
1 572 . 16 1 1 A 55 55 GLU C C 2478 175.383 175.754 -0.371 1
1 573 . 16 1 1 A 55 55 GLU CA C 2478 57.516 56.291 1.225 1
1 574 . 16 1 1 A 55 55 GLU CB C 2478 30.346 30.752 -0.406 1
1 576 . 16 1 1 A 55 55 GLU N N 2478 125.186 122.628 2.558 1
1 577 . 16 1 1 A 56 56 CYS H H 2479 8.407 8.482 -0.075 1
1 578 . 16 1 1 A 56 56 CYS HA H 2479 5.056 4.640 0.416 1
1 581 . 16 1 1 A 56 56 CYS CA C 2479 55.858 56.954 -1.096 1
1 582 . 16 1 1 A 56 56 CYS CB C 2479 28.676 30.198 -1.522 1
1 583 . 16 1 1 A 56 56 CYS N N 2479 121.499 123.946 -2.447 1
1 584 . 16 1 1 A 57 57 PRO HA H 2480 4.159 4.294 -0.135 1
1 591 . 16 1 1 A 57 57 PRO C C 2480 177.964 177.520 0.444 1
1 592 . 16 1 1 A 57 57 PRO CA C 2480 66.877 64.630 2.247 1
1 593 . 16 1 1 A 57 57 PRO CB C 2480 31.709 31.932 -0.223 1
1 596 . 16 1 1 A 58 58 GLU H H 2481 8.900 8.090 0.810 1
1 597 . 16 1 1 A 58 58 GLU HA H 2481 4.201 4.436 -0.235 1
1 602 . 16 1 1 A 58 58 GLU C C 2481 175.129 176.477 -1.348 1
1 603 . 16 1 1 A 58 58 GLU CA C 2481 57.883 56.406 1.477 1
1 604 . 16 1 1 A 58 58 GLU CB C 2481 29.991 30.331 -0.340 1
1 606 . 16 1 1 A 58 58 GLU N N 2481 115.316 117.909 -2.593 1
1 607 . 16 1 1 A 59 59 GLY H H 2482 7.527 7.402 0.125 1
1 608 . 16 1 1 A 59 59 GLY HA2 H 2482 4.935 3.913 1.022 1
1 609 . 16 1 1 A 59 59 GLY HA3 H 2482 3.381 4.038 -0.657 1
1 610 . 16 1 1 A 59 59 GLY CA C 2482 47.809 44.557 3.252 1
1 611 . 16 1 1 A 59 59 GLY N N 2482 110.079 108.137 1.942 1
1 612 . 16 1 1 A 60 60 TYR H H 2483 8.990 8.457 0.533 1
1 613 . 16 1 1 A 60 60 TYR HA H 2483 5.157 5.306 -0.149 1
1 618 . 16 1 1 A 60 60 TYR C C 2483 175.096 174.265 0.831 1
1 619 . 16 1 1 A 60 60 TYR CA C 2483 57.375 56.749 0.626 1
1 620 . 16 1 1 A 60 60 TYR CB C 2483 43.153 40.721 2.432 1
1 622 . 16 1 1 A 60 60 TYR N N 2483 125.900 121.850 4.050 1
1 623 . 16 1 1 A 61 61 ARG H H 2484 9.557 9.140 0.417 1
1 624 . 16 1 1 A 61 61 ARG HA H 2484 4.858 4.773 0.085 1
1 631 . 16 1 1 A 61 61 ARG CA C 2484 55.016 55.342 -0.326 1
1 632 . 16 1 1 A 61 61 ARG CB C 2484 32.128 31.590 0.538 1
1 635 . 16 1 1 A 61 61 ARG N N 2484 124.847 125.969 -1.122 1
1 636 . 16 1 1 A 62 62 VAL H H 2485 9.046 8.974 0.072 1
1 637 . 16 1 1 A 62 62 VAL HA H 2485 4.675 4.791 -0.116 1
1 645 . 16 1 1 A 62 62 VAL C C 2485 173.837 174.634 -0.797 1
1 646 . 16 1 1 A 62 62 VAL CA C 2485 60.752 60.914 -0.162 1
1 647 . 16 1 1 A 62 62 VAL CB C 2485 32.459 33.581 -1.122 1
1 650 . 16 1 1 A 62 62 VAL N N 2485 132.205 126.148 6.057 1
1 651 . 16 1 1 A 63 63 THR H H 2486 8.474 8.880 -0.406 1
1 652 . 16 1 1 A 63 63 THR HA H 2486 5.392 5.333 0.059 1
1 657 . 16 1 1 A 63 63 THR C C 2486 173.675 173.347 0.328 1
1 658 . 16 1 1 A 63 63 THR CA C 2486 60.008 61.105 -1.097 1
1 659 . 16 1 1 A 63 63 THR CB C 2486 71.035 71.817 -0.782 1
1 661 . 16 1 1 A 63 63 THR N N 2486 121.216 122.859 -1.643 1
1 662 . 16 1 1 A 64 64 TYR H H 2487 9.409 8.887 0.522 1
1 663 . 16 1 1 A 64 64 TYR HA H 2487 5.617 5.478 0.139 1
1 670 . 16 1 1 A 64 64 TYR C C 2487 172.847 172.504 0.343 1
1 671 . 16 1 1 A 64 64 TYR CA C 2487 55.557 55.874 -0.317 1
1 672 . 16 1 1 A 64 64 TYR CB C 2487 41.968 41.587 0.381 1
1 675 . 16 1 1 A 64 64 TYR N N 2487 124.061 121.834 2.227 1
1 676 . 16 1 1 A 65 65 THR H H 2488 8.145 8.448 -0.303 1
1 677 . 16 1 1 A 65 65 THR HA H 2488 4.959 4.653 0.306 1
1 682 . 16 1 1 A 65 65 THR CA C 2488 58.532 59.073 -0.541 1
1 683 . 16 1 1 A 65 65 THR CB C 2488 70.141 69.962 0.179 1
1 685 . 16 1 1 A 65 65 THR N N 2488 117.924 117.189 0.735 1
1 686 . 16 1 1 A 66 66 PRO HA H 2489 4.602 4.863 -0.261 1
1 693 . 16 1 1 A 66 66 PRO C C 2489 176.647 176.549 0.098 1
1 694 . 16 1 1 A 66 66 PRO CA C 2489 61.442 62.274 -0.832 1
1 695 . 16 1 1 A 66 66 PRO CB C 2489 32.715 32.783 -0.068 1
1 698 . 16 1 1 A 67 67 MET H H 2490 8.832 8.483 0.349 1
1 699 . 16 1 1 A 67 67 MET HA H 2490 4.880 4.758 0.122 1
1 707 . 16 1 1 A 67 67 MET C C 2490 174.121 175.652 -1.531 1
1 708 . 16 1 1 A 67 67 MET CA C 2490 53.848 54.796 -0.948 1
1 709 . 16 1 1 A 67 67 MET CB C 2490 33.727 33.705 0.022 1
1 712 . 16 1 1 A 67 67 MET N N 2490 119.212 117.544 1.668 1
1 713 . 16 1 1 A 68 68 ALA H H 2491 7.086 7.355 -0.269 1
1 714 . 16 1 1 A 68 68 ALA HA H 2491 4.851 4.859 -0.008 1
1 718 . 16 1 1 A 68 68 ALA CA C 2491 49.222 50.012 -0.790 1
1 719 . 16 1 1 A 68 68 ALA CB C 2491 20.600 22.457 -1.857 1
1 720 . 16 1 1 A 68 68 ALA N N 2491 120.363 120.598 -0.235 1
1 721 . 16 1 1 A 69 69 PRO HA H 2492 4.263 4.779 -0.516 1
1 728 . 16 1 1 A 69 69 PRO C C 2492 174.370 176.326 -1.956 1
1 729 . 16 1 1 A 69 69 PRO CA C 2492 62.555 62.981 -0.426 1
1 730 . 16 1 1 A 69 69 PRO CB C 2492 32.752 32.996 -0.244 1
1 733 . 16 1 1 A 70 70 GLY H H 2493 8.858 8.263 0.595 1
1 734 . 16 1 1 A 70 70 GLY HA2 H 2493 4.544 4.095 0.449 1
1 735 . 16 1 1 A 70 70 GLY HA3 H 2493 3.849 4.146 -0.297 1
1 736 . 16 1 1 A 70 70 GLY C C 2493 172.182 173.238 -1.056 1
1 737 . 16 1 1 A 70 70 GLY CA C 2493 44.356 44.208 0.148 1
1 738 . 16 1 1 A 70 70 GLY N N 2493 106.539 107.505 -0.966 1
1 739 . 16 1 1 A 71 71 SER H H 2494 8.490 8.343 0.147 1
1 740 . 16 1 1 A 71 71 SER HA H 2494 5.280 5.079 0.201 1
1 743 . 16 1 1 A 71 71 SER C C 2494 173.512 173.568 -0.056 1
1 744 . 16 1 1 A 71 71 SER CA C 2494 57.674 57.582 0.092 1
1 745 . 16 1 1 A 71 71 SER CB C 2494 63.799 64.601 -0.802 1
1 746 . 16 1 1 A 71 71 SER N N 2494 117.964 113.355 4.609 1
1 747 . 16 1 1 A 72 72 TYR H H 2495 9.320 9.592 -0.272 1
1 748 . 16 1 1 A 72 72 TYR HA H 2495 4.960 5.268 -0.308 1
1 755 . 16 1 1 A 72 72 TYR C C 2495 173.979 174.835 -0.856 1
1 756 . 16 1 1 A 72 72 TYR CA C 2495 56.384 56.657 -0.273 1
1 757 . 16 1 1 A 72 72 TYR CB C 2495 40.247 40.209 0.038 1
1 760 . 16 1 1 A 72 72 TYR N N 2495 126.442 122.774 3.668 1
1 761 . 16 1 1 A 73 73 LEU H H 2496 9.019 8.912 0.107 1
1 762 . 16 1 1 A 73 73 LEU HA H 2496 5.209 4.952 0.257 1
1 772 . 16 1 1 A 73 73 LEU C C 2496 177.015 174.824 2.191 1
1 773 . 16 1 1 A 73 73 LEU CA C 2496 53.393 54.146 -0.753 1
1 774 . 16 1 1 A 73 73 LEU CB C 2496 43.918 43.399 0.519 1
1 778 . 16 1 1 A 73 73 LEU N N 2496 125.439 126.075 -0.636 1
1 779 . 16 1 1 A 74 74 ILE H H 2497 9.921 9.588 0.333 1
1 780 . 16 1 1 A 74 74 ILE HA H 2497 5.128 4.687 0.441 1
1 790 . 16 1 1 A 74 74 ILE C C 2497 175.730 175.127 0.603 1
1 791 . 16 1 1 A 74 74 ILE CA C 2497 60.930 60.704 0.226 1
1 792 . 16 1 1 A 74 74 ILE CB C 2497 39.488 37.694 1.794 1
1 796 . 16 1 1 A 74 74 ILE N N 2497 132.185 129.762 2.423 1
1 797 . 16 1 1 A 75 75 SER H H 2498 9.284 9.051 0.233 1
1 798 . 16 1 1 A 75 75 SER HA H 2498 5.111 5.133 -0.022 1
1 801 . 16 1 1 A 75 75 SER C C 2498 173.449 173.450 -0.001 1
1 802 . 16 1 1 A 75 75 SER CA C 2498 58.260 58.288 -0.028 1
1 803 . 16 1 1 A 75 75 SER CB C 2498 63.956 63.303 0.653 1
1 804 . 16 1 1 A 75 75 SER N N 2498 125.384 124.897 0.487 1
1 805 . 16 1 1 A 76 76 ILE H H 2499 9.861 9.165 0.696 1
1 806 . 16 1 1 A 76 76 ILE HA H 2499 4.814 4.660 0.154 1
1 816 . 16 1 1 A 76 76 ILE CA C 2499 61.034 60.982 0.052 1
1 817 . 16 1 1 A 76 76 ILE CB C 2499 40.387 36.931 3.456 1
1 821 . 16 1 1 A 76 76 ILE N N 2499 129.414 127.565 1.849 1
1 822 . 16 1 1 A 77 77 LYS H H 2500 8.827 8.951 -0.124 1
1 823 . 16 1 1 A 77 77 LYS HA H 2500 5.254 5.179 0.075 1
1 832 . 16 1 1 A 77 77 LYS C C 2500 175.245 175.620 -0.375 1
1 833 . 16 1 1 A 77 77 LYS CA C 2500 54.388 55.248 -0.860 1
1 834 . 16 1 1 A 77 77 LYS CB C 2500 36.127 34.931 1.196 1
1 838 . 16 1 1 A 77 77 LYS N N 2500 126.922 127.357 -0.435 1
1 839 . 16 1 1 A 78 78 TYR H H 2501 8.408 9.119 -0.711 1
1 840 . 16 1 1 A 78 78 TYR HA H 2501 5.479 4.989 0.490 1
1 847 . 16 1 1 A 78 78 TYR C C 2501 174.792 175.595 -0.803 1
1 848 . 16 1 1 A 78 78 TYR CA C 2501 56.837 57.368 -0.531 1
1 849 . 16 1 1 A 78 78 TYR CB C 2501 44.008 41.991 2.017 1
1 852 . 16 1 1 A 78 78 TYR N N 2501 122.282 123.913 -1.631 1
1 853 . 16 1 1 A 79 79 GLY H H 2502 8.196 8.733 -0.537 1
1 854 . 16 1 1 A 79 79 GLY HA2 H 2502 4.040 3.659 0.381 1
1 855 . 16 1 1 A 79 79 GLY HA3 H 2502 3.465 3.740 -0.275 1
1 856 . 16 1 1 A 79 79 GLY C C 2502 173.932 173.640 0.292 1
1 857 . 16 1 1 A 79 79 GLY CA C 2502 45.741 45.781 -0.040 1
1 858 . 16 1 1 A 79 79 GLY N N 2502 113.451 114.042 -0.591 1
1 859 . 16 1 1 A 80 80 GLY H H 2503 7.589 8.279 -0.690 1
1 860 . 16 1 1 A 80 80 GLY HA2 H 2503 4.490 4.033 0.457 1
1 861 . 16 1 1 A 80 80 GLY HA3 H 2503 3.555 4.074 -0.519 1
1 862 . 16 1 1 A 80 80 GLY CA C 2503 43.540 44.239 -0.699 1
1 863 . 16 1 1 A 80 80 GLY N N 2503 107.293 107.478 -0.185 1
1 864 . 16 1 1 A 81 81 PRO HA H 2504 4.320 4.347 -0.027 1
1 871 . 16 1 1 A 81 81 PRO C C 2504 175.311 175.513 -0.202 1
1 872 . 16 1 1 A 81 81 PRO CA C 2504 62.722 63.433 -0.711 1
1 873 . 16 1 1 A 81 81 PRO CB C 2504 29.297 31.950 -2.653 1
1 876 . 16 1 1 A 82 82 TYR H H 2505 7.778 7.353 0.425 1
1 877 . 16 1 1 A 82 82 TYR HA H 2505 4.791 4.924 -0.133 1
1 884 . 16 1 1 A 82 82 TYR C C 2505 175.086 175.819 -0.733 1
1 885 . 16 1 1 A 82 82 TYR CA C 2505 56.111 57.427 -1.316 1
1 886 . 16 1 1 A 82 82 TYR CB C 2505 39.483 40.034 -0.551 1
1 889 . 16 1 1 A 82 82 TYR N N 2505 123.973 120.490 3.483 1
1 890 . 16 1 1 A 83 83 HIS H H 2506 8.625 9.049 -0.424 1
1 891 . 16 1 1 A 83 83 HIS HA H 2506 4.583 4.887 -0.304 1
1 896 . 16 1 1 A 83 83 HIS C C 2506 178.161 176.084 2.077 1
1 897 . 16 1 1 A 83 83 HIS CA C 2506 58.241 56.853 1.388 1
1 898 . 16 1 1 A 83 83 HIS CB C 2506 33.132 30.467 2.665 1
1 901 . 16 1 1 A 83 83 HIS N N 2506 124.092 121.484 2.608 1
1 902 . 16 1 1 A 84 84 ILE H H 2507 8.327 8.701 -0.374 1
1 903 . 16 1 1 A 84 84 ILE HA H 2507 4.553 4.258 0.295 1
1 913 . 16 1 1 A 84 84 ILE C C 2507 176.523 176.328 0.195 1
1 914 . 16 1 1 A 84 84 ILE CA C 2507 60.791 60.172 0.619 1
1 915 . 16 1 1 A 84 84 ILE CB C 2507 39.162 39.727 -0.565 1
1 919 . 16 1 1 A 84 84 ILE N N 2507 117.355 119.506 -2.151 1
1 920 . 16 1 1 A 85 85 GLY H H 2508 9.130 8.578 0.552 1
1 921 . 16 1 1 A 85 85 GLY HA2 H 2508 3.883 3.733 0.150 1
1 922 . 16 1 1 A 85 85 GLY HA3 H 2508 3.800 3.745 0.055 1
1 923 . 16 1 1 A 85 85 GLY C C 2508 174.438 175.429 -0.991 1
1 924 . 16 1 1 A 85 85 GLY CA C 2508 47.673 46.708 0.965 1
1 925 . 16 1 1 A 85 85 GLY N N 2508 111.346 109.881 1.465 1
1 926 . 16 1 1 A 86 86 GLY H H 2509 8.236 8.132 0.104 1
1 927 . 16 1 1 A 86 86 GLY HA2 H 2509 3.893 3.942 -0.049 1
1 928 . 16 1 1 A 86 86 GLY HA3 H 2509 3.161 4.014 -0.853 1
1 929 . 16 1 1 A 86 86 GLY C C 2509 171.837 173.404 -1.567 1
1 930 . 16 1 1 A 86 86 GLY CA C 2509 44.844 45.475 -0.631 1
1 931 . 16 1 1 A 86 86 GLY N N 2509 115.594 118.392 -2.798 1
1 932 . 16 1 1 A 87 87 SER H H 2510 7.385 7.714 -0.329 1
1 933 . 16 1 1 A 87 87 SER HA H 2510 4.217 4.140 0.077 1
1 936 . 16 1 1 A 87 87 SER CA C 2510 54.783 55.308 -0.525 1
1 937 . 16 1 1 A 87 87 SER CB C 2510 62.683 64.209 -1.526 1
1 938 . 16 1 1 A 87 87 SER N N 2510 112.859 116.847 -3.988 1
1 939 . 16 1 1 A 88 88 PRO HA H 2511 5.532 4.766 0.766 1
1 946 . 16 1 1 A 88 88 PRO C C 2511 175.870 174.947 0.923 1
1 947 . 16 1 1 A 88 88 PRO CA C 2511 62.379 62.258 0.121 1
1 948 . 16 1 1 A 88 88 PRO CB C 2511 33.639 32.245 1.394 1
1 951 . 16 1 1 A 89 89 PHE H H 2512 9.359 8.500 0.859 1
1 952 . 16 1 1 A 89 89 PHE HA H 2512 4.467 4.859 -0.392 1
1 960 . 16 1 1 A 89 89 PHE C C 2512 175.152 176.155 -1.003 1
1 961 . 16 1 1 A 89 89 PHE CA C 2512 57.401 56.955 0.446 1
1 962 . 16 1 1 A 89 89 PHE CB C 2512 40.843 41.651 -0.808 1
1 966 . 16 1 1 A 89 89 PHE N N 2512 124.789 119.637 5.152 1
1 967 . 16 1 1 A 90 90 LYS H H 2513 8.772 8.566 0.206 1
1 968 . 16 1 1 A 90 90 LYS HA H 2513 4.941 4.555 0.386 1
1 973 . 16 1 1 A 90 90 LYS C C 2513 174.183 176.397 -2.214 1
1 974 . 16 1 1 A 90 90 LYS CA C 2513 55.749 55.822 -0.073 1
1 975 . 16 1 1 A 90 90 LYS CB C 2513 32.817 32.161 0.656 1
1 978 . 16 1 1 A 90 90 LYS N N 2513 125.133 120.089 5.044 1
1 979 . 16 1 1 A 91 91 ALA H H 2514 9.158 7.513 1.645 1
1 980 . 16 1 1 A 91 91 ALA HA H 2514 4.510 4.220 0.290 1
1 984 . 16 1 1 A 91 91 ALA C C 2514 176.561 177.484 -0.923 1
1 985 . 16 1 1 A 91 91 ALA CA C 2514 50.528 53.023 -2.495 1
1 986 . 16 1 1 A 91 91 ALA CB C 2514 20.653 19.145 1.508 1
1 987 . 16 1 1 A 91 91 ALA N N 2514 131.989 123.297 8.692 1
1 988 . 16 1 1 A 92 92 LYS H H 2515 8.186 8.837 -0.651 1
1 989 . 16 1 1 A 92 92 LYS HA H 2515 4.926 4.742 0.184 1
1 998 . 16 1 1 A 92 92 LYS C C 2515 175.177 175.194 -0.017 1
1 999 . 16 1 1 A 92 92 LYS CA C 2515 55.725 55.785 -0.060 1
1 1000 . 16 1 1 A 92 92 LYS CB C 2515 33.765 33.053 0.712 1
1 1004 . 16 1 1 A 92 92 LYS N N 2515 124.887 124.524 0.363 1
1 1005 . 16 1 1 A 93 93 VAL H H 2516 9.362 9.153 0.209 1
1 1006 . 16 1 1 A 93 93 VAL HA H 2516 5.161 4.993 0.168 1
1 1014 . 16 1 1 A 93 93 VAL C C 2516 176.988 175.589 1.399 1
1 1015 . 16 1 1 A 93 93 VAL CA C 2516 60.523 61.483 -0.960 1
1 1016 . 16 1 1 A 93 93 VAL CB C 2516 33.291 33.183 0.108 1
1 1019 . 16 1 1 A 93 93 VAL N N 2516 129.943 125.753 4.190 1
1 1020 . 16 1 1 A 94 94 THR H H 2517 8.614 8.584 0.030 1
1 1021 . 16 1 1 A 94 94 THR HA H 2517 4.902 4.879 0.023 1
1 1026 . 16 1 1 A 94 94 THR C C 2517 172.759 173.446 -0.687 1
1 1027 . 16 1 1 A 94 94 THR CA C 2517 60.121 59.797 0.324 1
1 1028 . 16 1 1 A 94 94 THR CB C 2517 71.072 71.368 -0.296 1
1 1030 . 16 1 1 A 94 94 THR N N 2517 122.032 116.552 5.480 1
1 1031 . 16 1 1 A 95 95 GLY H H 2518 8.280 8.445 -0.165 1
1 1032 . 16 1 1 A 95 95 GLY HA2 H 2518 3.852 4.137 -0.285 1
1 1033 . 16 1 1 A 95 95 GLY HA3 H 2518 4.846 4.141 0.705 1
1 1034 . 16 1 1 A 95 95 GLY CA C 2518 43.955 44.506 -0.551 1
1 1035 . 16 1 1 A 95 95 GLY N N 2518 107.949 108.435 -0.486 1
1 1036 . 16 1 1 A 96 96 PRO HA H 2519 4.449 4.638 -0.189 1
1 1043 . 16 1 1 A 96 96 PRO C C 2519 176.892 176.328 0.564 1
1 1044 . 16 1 1 A 96 96 PRO CA C 2519 62.062 62.703 -0.641 1
1 1045 . 16 1 1 A 96 96 PRO CB C 2519 32.286 32.087 0.199 1
1 1048 . 16 1 1 A 97 97 ARG H H 2520 8.651 8.544 0.107 1
1 1049 . 16 1 1 A 97 97 ARG HA H 2520 4.348 4.490 -0.142 1
1 1056 . 16 1 1 A 97 97 ARG C C 2520 176.236 176.557 -0.321 1
1 1057 . 16 1 1 A 97 97 ARG CA C 2520 57.587 56.303 1.284 1
1 1058 . 16 1 1 A 97 97 ARG CB C 2520 30.472 30.810 -0.338 1
1 1061 . 16 1 1 A 97 97 ARG N N 2520 120.781 122.014 -1.233 1
1 1062 . 16 1 1 A 98 98 LEU H H 2521 8.545 8.953 -0.408 1
1 1063 . 16 1 1 A 98 98 LEU HA H 2521 4.577 4.238 0.339 1
1 1073 . 16 1 1 A 98 98 LEU C C 2521 175.880 177.591 -1.711 1
1 1074 . 16 1 1 A 98 98 LEU CA C 2521 55.068 56.597 -1.529 1
1 1075 . 16 1 1 A 98 98 LEU CB C 2521 43.082 42.076 1.006 1
1 1079 . 16 1 1 A 98 98 LEU N N 2521 128.715 127.468 1.247 1
1 4 . 17 1 1 A 2 2 ALA HA H -2 4.374 4.876 -0.502 1
1 8 . 17 1 1 A 2 2 ALA C C -2 177.865 176.381 1.484 1
1 9 . 17 1 1 A 2 2 ALA CA C -2 52.670 51.209 1.461 1
1 10 . 17 1 1 A 2 2 ALA CB C -2 19.508 23.024 -3.516 1
1 32 . 17 1 1 A 5 5 ASP H H 2428 8.300 8.893 -0.593 1
1 33 . 17 1 1 A 5 5 ASP HA H 2428 5.082 5.083 -0.001 1
1 36 . 17 1 1 A 5 5 ASP CA C 2428 51.517 51.537 -0.020 1
1 37 . 17 1 1 A 5 5 ASP CB C 2428 42.244 40.722 1.522 1
1 38 . 17 1 1 A 5 5 ASP N N 2428 122.879 120.701 2.178 1
1 39 . 17 1 1 A 6 6 PRO HA H 2429 4.340 4.405 -0.065 1
1 46 . 17 1 1 A 6 6 PRO C C 2429 178.266 178.724 -0.458 1
1 47 . 17 1 1 A 6 6 PRO CA C 2429 64.494 64.940 -0.446 1
1 48 . 17 1 1 A 6 6 PRO CB C 2429 31.841 31.932 -0.091 1
1 51 . 17 1 1 A 7 7 GLY H H 2430 8.686 8.440 0.246 1
1 52 . 17 1 1 A 7 7 GLY HA2 H 2430 4.116 3.885 0.231 1
1 53 . 17 1 1 A 7 7 GLY HA3 H 2430 3.868 3.886 -0.018 1
1 54 . 17 1 1 A 7 7 GLY C C 2430 174.567 175.456 -0.889 1
1 55 . 17 1 1 A 7 7 GLY CA C 2430 46.038 46.547 -0.509 1
1 56 . 17 1 1 A 7 7 GLY N N 2430 107.655 105.943 1.712 1
1 57 . 17 1 1 A 8 8 LEU H H 2431 7.692 7.498 0.194 1
1 58 . 17 1 1 A 8 8 LEU HA H 2431 4.507 4.407 0.100 1
1 68 . 17 1 1 A 8 8 LEU C C 2431 176.876 177.400 -0.524 1
1 69 . 17 1 1 A 8 8 LEU CA C 2431 54.307 56.551 -2.244 1
1 70 . 17 1 1 A 8 8 LEU CB C 2431 42.879 42.698 0.181 1
1 74 . 17 1 1 A 8 8 LEU N N 2431 120.022 119.780 0.242 1
1 75 . 17 1 1 A 9 9 VAL H H 2432 7.378 7.499 -0.121 1
1 76 . 17 1 1 A 9 9 VAL HA H 2432 4.154 3.934 0.220 1
1 84 . 17 1 1 A 9 9 VAL C C 2432 174.703 175.811 -1.108 1
1 85 . 17 1 1 A 9 9 VAL CA C 2432 62.387 63.246 -0.859 1
1 86 . 17 1 1 A 9 9 VAL CB C 2432 32.519 31.434 1.085 1
1 89 . 17 1 1 A 9 9 VAL N N 2432 123.902 119.688 4.214 1
1 90 . 17 1 1 A 10 10 SER H H 2433 8.201 8.575 -0.374 1
1 91 . 17 1 1 A 10 10 SER HA H 2433 5.136 5.325 -0.189 1
1 94 . 17 1 1 A 10 10 SER CA C 2433 56.554 57.484 -0.930 1
1 95 . 17 1 1 A 10 10 SER CB C 2433 66.763 66.657 0.106 1
1 96 . 17 1 1 A 10 10 SER N N 2433 121.921 123.189 -1.268 1
1 97 . 17 1 1 A 11 11 ALA H H 2434 8.670 8.551 0.119 1
1 98 . 17 1 1 A 11 11 ALA HA H 2434 5.632 5.359 0.273 1
1 102 . 17 1 1 A 11 11 ALA C C 2434 175.459 174.641 0.818 1
1 103 . 17 1 1 A 11 11 ALA CA C 2434 50.575 50.320 0.255 1
1 104 . 17 1 1 A 11 11 ALA CB C 2434 23.111 22.659 0.452 1
1 105 . 17 1 1 A 11 11 ALA N N 2434 124.828 123.627 1.201 1
1 106 . 17 1 1 A 12 12 TYR H H 2435 8.609 8.749 -0.140 1
1 107 . 17 1 1 A 12 12 TYR HA H 2435 4.879 5.076 -0.197 1
1 114 . 17 1 1 A 12 12 TYR C C 2435 173.645 174.633 -0.988 1
1 115 . 17 1 1 A 12 12 TYR CA C 2435 56.268 56.841 -0.573 1
1 116 . 17 1 1 A 12 12 TYR CB C 2435 39.522 42.280 -2.758 1
1 119 . 17 1 1 A 12 12 TYR N N 2435 118.305 119.579 -1.274 1
1 120 . 17 1 1 A 13 13 GLY H H 2436 8.655 8.482 0.173 1
1 121 . 17 1 1 A 13 13 GLY HA2 H 2436 4.943 4.287 0.656 1
1 122 . 17 1 1 A 13 13 GLY HA3 H 2436 4.028 4.333 -0.305 1
1 123 . 17 1 1 A 13 13 GLY C C 2436 175.334 174.908 0.426 1
1 124 . 17 1 1 A 13 13 GLY CA C 2436 44.389 44.331 0.058 1
1 125 . 17 1 1 A 13 13 GLY N N 2436 110.710 110.375 0.335 1
1 126 . 17 1 1 A 14 14 ALA H H 2437 8.939 8.719 0.220 1
1 127 . 17 1 1 A 14 14 ALA HA H 2437 4.276 4.087 0.189 1
1 131 . 17 1 1 A 14 14 ALA C C 2437 180.524 179.321 1.203 1
1 132 . 17 1 1 A 14 14 ALA CA C 2437 55.551 55.082 0.469 1
1 133 . 17 1 1 A 14 14 ALA CB C 2437 18.411 18.407 0.004 1
1 134 . 17 1 1 A 14 14 ALA N N 2437 126.973 123.697 3.276 1
1 135 . 17 1 1 A 15 15 GLY H H 2438 8.933 8.777 0.156 1
1 136 . 17 1 1 A 15 15 GLY HA2 H 2438 4.531 4.014 0.517 1
1 137 . 17 1 1 A 15 15 GLY HA3 H 2438 3.576 4.269 -0.693 1
1 138 . 17 1 1 A 15 15 GLY C C 2438 174.323 175.473 -1.150 1
1 139 . 17 1 1 A 15 15 GLY CA C 2438 46.855 47.074 -0.219 1
1 140 . 17 1 1 A 15 15 GLY N N 2438 104.803 105.722 -0.919 1
1 141 . 17 1 1 A 16 16 LEU H H 2439 7.529 7.631 -0.102 1
1 142 . 17 1 1 A 16 16 LEU HA H 2439 3.768 3.851 -0.083 1
1 152 . 17 1 1 A 16 16 LEU C C 2439 176.388 178.867 -2.479 1
1 153 . 17 1 1 A 16 16 LEU CA C 2439 56.137 57.171 -1.034 1
1 154 . 17 1 1 A 16 16 LEU CB C 2439 41.621 41.141 0.480 1
1 158 . 17 1 1 A 16 16 LEU N N 2439 119.633 122.097 -2.464 1
1 159 . 17 1 1 A 17 17 GLU H H 2440 7.505 7.816 -0.311 1
1 160 . 17 1 1 A 17 17 GLU HA H 2440 4.663 4.354 0.309 1
1 165 . 17 1 1 A 17 17 GLU C C 2440 178.126 177.255 0.871 1
1 166 . 17 1 1 A 17 17 GLU CA C 2440 56.447 56.603 -0.156 1
1 167 . 17 1 1 A 17 17 GLU CB C 2440 31.485 30.547 0.938 1
1 169 . 17 1 1 A 17 17 GLU N N 2440 114.368 116.090 -1.722 1
1 170 . 17 1 1 A 18 18 GLY H H 2441 7.921 7.369 0.552 1
1 171 . 17 1 1 A 18 18 GLY HA2 H 2441 4.889 4.116 0.773 1
1 172 . 17 1 1 A 18 18 GLY HA3 H 2441 3.707 4.143 -0.436 1
1 173 . 17 1 1 A 18 18 GLY C C 2441 170.965 172.299 -1.334 1
1 174 . 17 1 1 A 18 18 GLY CA C 2441 45.549 44.242 1.307 1
1 175 . 17 1 1 A 18 18 GLY N N 2441 109.165 106.805 2.360 1
1 176 . 17 1 1 A 19 19 GLY H H 2442 7.540 7.766 -0.226 1
1 177 . 17 1 1 A 19 19 GLY HA2 H 2442 4.086 4.218 -0.132 1
1 178 . 17 1 1 A 19 19 GLY HA3 H 2442 4.086 4.248 -0.162 1
1 179 . 17 1 1 A 19 19 GLY C C 2442 171.051 171.870 -0.819 1
1 180 . 17 1 1 A 19 19 GLY CA C 2442 44.937 45.498 -0.561 1
1 181 . 17 1 1 A 19 19 GLY N N 2442 105.460 107.929 -2.469 1
1 182 . 17 1 1 A 20 20 VAL H H 2443 8.899 8.220 0.679 1
1 183 . 17 1 1 A 20 20 VAL HA H 2443 5.062 4.880 0.182 1
1 191 . 17 1 1 A 20 20 VAL C C 2443 176.623 175.407 1.216 1
1 192 . 17 1 1 A 20 20 VAL CA C 2443 60.197 61.013 -0.816 1
1 193 . 17 1 1 A 20 20 VAL CB C 2443 35.107 34.103 1.004 1
1 196 . 17 1 1 A 20 20 VAL N N 2443 122.753 121.554 1.199 1
1 197 . 17 1 1 A 21 21 THR H H 2444 8.630 8.577 0.053 1
1 198 . 17 1 1 A 21 21 THR HA H 2444 3.773 4.160 -0.387 1
1 203 . 17 1 1 A 21 21 THR C C 2444 175.646 174.921 0.725 1
1 204 . 17 1 1 A 21 21 THR CA C 2444 62.732 62.586 0.146 1
1 205 . 17 1 1 A 21 21 THR CB C 2444 68.925 68.627 0.298 1
1 207 . 17 1 1 A 21 21 THR N N 2444 118.179 119.073 -0.894 1
1 208 . 17 1 1 A 22 22 GLY H H 2445 8.736 9.021 -0.285 1
1 209 . 17 1 1 A 22 22 GLY HA2 H 2445 3.412 3.982 -0.570 1
1 210 . 17 1 1 A 22 22 GLY HA3 H 2445 4.061 3.984 0.077 1
1 211 . 17 1 1 A 22 22 GLY C C 2445 172.973 173.686 -0.713 1
1 212 . 17 1 1 A 22 22 GLY CA C 2445 45.577 45.181 0.396 1
1 213 . 17 1 1 A 22 22 GLY N N 2445 107.888 113.864 -5.976 1
1 214 . 17 1 1 A 23 23 ASN H H 2446 7.877 7.604 0.273 1
1 215 . 17 1 1 A 23 23 ASN HA H 2446 5.253 5.083 0.170 1
1 220 . 17 1 1 A 23 23 ASN CA C 2446 49.740 50.030 -0.290 1
1 221 . 17 1 1 A 23 23 ASN CB C 2446 40.198 39.117 1.081 1
1 222 . 17 1 1 A 23 23 ASN N N 2446 120.684 119.816 0.868 1
1 224 . 17 1 1 A 24 24 PRO HA H 2447 4.525 4.648 -0.123 1
1 231 . 17 1 1 A 24 24 PRO CA C 2447 62.766 62.236 0.530 1
1 232 . 17 1 1 A 24 24 PRO CB C 2447 31.732 32.401 -0.669 1
1 235 . 17 1 1 A 25 25 ALA H H 2448 9.178 8.236 0.942 1
1 236 . 17 1 1 A 25 25 ALA HA H 2448 4.614 4.955 -0.341 1
1 240 . 17 1 1 A 25 25 ALA C C 2448 175.503 175.305 0.198 1
1 241 . 17 1 1 A 25 25 ALA CA C 2448 50.526 50.432 0.094 1
1 242 . 17 1 1 A 25 25 ALA CB C 2448 20.458 23.866 -3.408 1
1 243 . 17 1 1 A 25 25 ALA N N 2448 132.079 121.819 10.260 1
1 244 . 17 1 1 A 26 26 GLU H H 2449 8.813 9.032 -0.219 1
1 245 . 17 1 1 A 26 26 GLU HA H 2449 5.830 5.449 0.381 1
1 250 . 17 1 1 A 26 26 GLU C C 2449 176.272 174.695 1.577 1
1 251 . 17 1 1 A 26 26 GLU CA C 2449 54.376 54.678 -0.302 1
1 252 . 17 1 1 A 26 26 GLU CB C 2449 35.463 33.827 1.636 1
1 254 . 17 1 1 A 26 26 GLU N N 2449 120.079 116.284 3.795 1
1 255 . 17 1 1 A 27 27 PHE H H 2450 8.782 8.808 -0.026 1
1 256 . 17 1 1 A 27 27 PHE HA H 2450 5.021 5.074 -0.053 1
1 264 . 17 1 1 A 27 27 PHE C C 2450 171.205 171.856 -0.651 1
1 265 . 17 1 1 A 27 27 PHE CA C 2450 56.852 56.387 0.465 1
1 266 . 17 1 1 A 27 27 PHE CB C 2450 41.080 41.615 -0.535 1
1 270 . 17 1 1 A 27 27 PHE N N 2450 118.670 117.110 1.560 1
1 271 . 17 1 1 A 28 28 VAL H H 2451 8.961 9.334 -0.373 1
1 272 . 17 1 1 A 28 28 VAL HA H 2451 4.761 4.875 -0.114 1
1 280 . 17 1 1 A 28 28 VAL C C 2451 174.673 174.258 0.415 1
1 281 . 17 1 1 A 28 28 VAL CA C 2451 60.619 59.786 0.833 1
1 282 . 17 1 1 A 28 28 VAL CB C 2451 35.484 34.306 1.178 1
1 285 . 17 1 1 A 28 28 VAL N N 2451 121.552 120.683 0.869 1
1 286 . 17 1 1 A 29 29 VAL H H 2452 9.294 9.409 -0.115 1
1 287 . 17 1 1 A 29 29 VAL HA H 2452 4.363 4.495 -0.132 1
1 295 . 17 1 1 A 29 29 VAL C C 2452 174.218 174.951 -0.733 1
1 296 . 17 1 1 A 29 29 VAL CA C 2452 61.526 62.251 -0.725 1
1 297 . 17 1 1 A 29 29 VAL CB C 2452 32.666 31.243 1.423 1
1 300 . 17 1 1 A 29 29 VAL N N 2452 125.585 128.801 -3.216 1
1 301 . 17 1 1 A 30 30 ASN H H 2453 9.465 9.054 0.411 1
1 302 . 17 1 1 A 30 30 ASN HA H 2453 5.096 5.129 -0.033 1
1 307 . 17 1 1 A 30 30 ASN C C 2453 176.216 176.127 0.089 1
1 308 . 17 1 1 A 30 30 ASN CA C 2453 52.011 52.736 -0.725 1
1 309 . 17 1 1 A 30 30 ASN CB C 2453 39.057 38.623 0.434 1
1 310 . 17 1 1 A 30 30 ASN N N 2453 127.724 127.040 0.684 1
1 312 . 17 1 1 A 31 31 THR H H 2454 8.915 8.556 0.359 1
1 313 . 17 1 1 A 31 31 THR HA H 2454 4.342 4.309 0.033 1
1 318 . 17 1 1 A 31 31 THR C C 2454 176.816 175.728 1.088 1
1 319 . 17 1 1 A 31 31 THR CA C 2454 61.117 62.402 -1.285 1
1 320 . 17 1 1 A 31 31 THR CB C 2454 68.209 69.762 -1.553 1
1 322 . 17 1 1 A 31 31 THR N N 2454 117.783 117.121 0.662 1
1 323 . 17 1 1 A 32 32 SER H H 2455 8.454 8.501 -0.047 1
1 324 . 17 1 1 A 32 32 SER HA H 2455 4.155 4.281 -0.126 1
1 327 . 17 1 1 A 32 32 SER C C 2455 175.458 176.499 -1.041 1
1 328 . 17 1 1 A 32 32 SER CA C 2455 62.148 61.274 0.874 1
1 329 . 17 1 1 A 32 32 SER CB C 2455 63.476 62.818 0.658 1
1 330 . 17 1 1 A 32 32 SER N N 2455 121.781 118.028 3.753 1
1 331 . 17 1 1 A 33 33 ASN H H 2456 8.845 8.280 0.565 1
1 332 . 17 1 1 A 33 33 ASN HA H 2456 5.064 4.597 0.467 1
1 337 . 17 1 1 A 33 33 ASN C C 2456 174.674 176.175 -1.501 1
1 338 . 17 1 1 A 33 33 ASN CA C 2456 53.067 55.144 -2.077 1
1 339 . 17 1 1 A 33 33 ASN CB C 2456 39.632 38.796 0.836 1
1 340 . 17 1 1 A 33 33 ASN N N 2456 120.176 119.409 0.767 1
1 342 . 17 1 1 A 34 34 ALA H H 2457 7.714 7.841 -0.127 1
1 343 . 17 1 1 A 34 34 ALA HA H 2457 4.482 4.503 -0.021 1
1 347 . 17 1 1 A 34 34 ALA C C 2457 177.582 177.796 -0.214 1
1 348 . 17 1 1 A 34 34 ALA CA C 2457 52.521 52.307 0.214 1
1 349 . 17 1 1 A 34 34 ALA CB C 2457 22.252 20.728 1.524 1
1 350 . 17 1 1 A 34 34 ALA N N 2457 123.065 119.676 3.389 1
1 351 . 17 1 1 A 35 35 GLY H H 2458 8.195 7.783 0.412 1
1 352 . 17 1 1 A 35 35 GLY HA2 H 2458 4.246 4.087 0.159 1
1 353 . 17 1 1 A 35 35 GLY HA3 H 2458 3.902 4.108 -0.206 1
1 354 . 17 1 1 A 35 35 GLY C C 2458 173.360 173.096 0.264 1
1 355 . 17 1 1 A 35 35 GLY CA C 2458 44.486 45.312 -0.826 1
1 356 . 17 1 1 A 35 35 GLY N N 2458 108.472 105.122 3.350 1
1 357 . 17 1 1 A 36 36 ALA H H 2459 8.430 8.330 0.100 1
1 358 . 17 1 1 A 36 36 ALA HA H 2459 4.472 5.266 -0.794 1
1 362 . 17 1 1 A 36 36 ALA C C 2459 176.968 175.912 1.056 1
1 363 . 17 1 1 A 36 36 ALA CA C 2459 52.695 51.489 1.206 1
1 364 . 17 1 1 A 36 36 ALA CB C 2459 19.360 23.179 -3.819 1
1 365 . 17 1 1 A 36 36 ALA N N 2459 126.012 124.809 1.203 1
1 366 . 17 1 1 A 37 37 GLY H H 2460 7.781 8.508 -0.727 1
1 367 . 17 1 1 A 37 37 GLY HA2 H 2460 3.856 3.876 -0.020 1
1 368 . 17 1 1 A 37 37 GLY HA3 H 2460 3.164 4.065 -0.901 1
1 369 . 17 1 1 A 37 37 GLY C C 2460 170.730 171.967 -1.237 1
1 370 . 17 1 1 A 37 37 GLY CA C 2460 44.747 45.196 -0.449 1
1 371 . 17 1 1 A 37 37 GLY N N 2460 109.493 105.878 3.615 1
1 372 . 17 1 1 A 38 38 ALA H H 2461 8.055 8.036 0.019 1
1 373 . 17 1 1 A 38 38 ALA HA H 2461 4.389 4.560 -0.171 1
1 377 . 17 1 1 A 38 38 ALA C C 2461 176.609 176.596 0.013 1
1 378 . 17 1 1 A 38 38 ALA CA C 2461 51.419 51.850 -0.431 1
1 379 . 17 1 1 A 38 38 ALA CB C 2461 19.665 19.467 0.198 1
1 380 . 17 1 1 A 38 38 ALA N N 2461 121.997 122.575 -0.578 1
1 381 . 17 1 1 A 39 39 LEU H H 2462 8.597 8.822 -0.225 1
1 382 . 17 1 1 A 39 39 LEU HA H 2462 5.022 5.364 -0.342 1
1 392 . 17 1 1 A 39 39 LEU C C 2462 175.883 174.274 1.609 1
1 393 . 17 1 1 A 39 39 LEU CA C 2462 53.907 53.346 0.561 1
1 394 . 17 1 1 A 39 39 LEU CB C 2462 44.576 46.207 -1.631 1
1 398 . 17 1 1 A 39 39 LEU N N 2462 126.664 123.999 2.665 1
1 399 . 17 1 1 A 40 40 SER H H 2463 8.898 9.517 -0.619 1
1 400 . 17 1 1 A 40 40 SER HA H 2463 4.732 5.481 -0.749 1
1 403 . 17 1 1 A 40 40 SER C C 2463 172.984 172.369 0.615 1
1 404 . 17 1 1 A 40 40 SER CA C 2463 56.730 56.314 0.416 1
1 405 . 17 1 1 A 40 40 SER CB C 2463 64.648 66.996 -2.348 1
1 406 . 17 1 1 A 40 40 SER N N 2463 122.932 120.274 2.658 1
1 407 . 17 1 1 A 41 41 VAL H H 2464 8.538 8.546 -0.008 1
1 408 . 17 1 1 A 41 41 VAL HA H 2464 5.131 4.859 0.272 1
1 416 . 17 1 1 A 41 41 VAL C C 2464 174.812 173.721 1.091 1
1 417 . 17 1 1 A 41 41 VAL CA C 2464 60.784 60.608 0.176 1
1 418 . 17 1 1 A 41 41 VAL CB C 2464 34.262 34.866 -0.604 1
1 420 . 17 1 1 A 41 41 VAL N N 2464 129.161 122.481 6.680 1
1 421 . 17 1 1 A 42 42 THR H H 2465 8.807 8.595 0.212 1
1 422 . 17 1 1 A 42 42 THR HA H 2465 4.573 5.193 -0.620 1
1 427 . 17 1 1 A 42 42 THR CA C 2465 60.408 61.656 -1.248 1
1 428 . 17 1 1 A 42 42 THR CB C 2465 71.764 72.615 -0.851 1
1 430 . 17 1 1 A 42 42 THR N N 2465 120.898 122.825 -1.927 1
1 431 . 17 1 1 A 43 43 ILE H H 2466 8.648 8.900 -0.252 1
1 432 . 17 1 1 A 43 43 ILE HA H 2466 4.854 4.777 0.077 1
1 442 . 17 1 1 A 43 43 ILE C C 2466 174.073 174.203 -0.130 1
1 443 . 17 1 1 A 43 43 ILE CA C 2466 61.184 60.531 0.653 1
1 444 . 17 1 1 A 43 43 ILE CB C 2466 39.516 39.977 -0.461 1
1 448 . 17 1 1 A 43 43 ILE N N 2466 124.810 126.475 -1.665 1
1 449 . 17 1 1 A 44 44 ASP H H 2467 8.821 9.155 -0.334 1
1 450 . 17 1 1 A 44 44 ASP HA H 2467 5.217 5.446 -0.229 1
1 453 . 17 1 1 A 44 44 ASP C C 2467 175.002 175.200 -0.198 1
1 454 . 17 1 1 A 44 44 ASP CA C 2467 52.998 52.596 0.402 1
1 455 . 17 1 1 A 44 44 ASP CB C 2467 44.728 43.098 1.630 1
1 456 . 17 1 1 A 44 44 ASP N N 2467 129.093 129.103 -0.010 1
1 457 . 17 1 1 A 45 45 GLY H H 2468 8.535 8.249 0.286 1
1 458 . 17 1 1 A 45 45 GLY HA2 H 2468 3.954 3.676 0.278 1
1 459 . 17 1 1 A 45 45 GLY HA3 H 2468 3.561 4.000 -0.439 1
1 460 . 17 1 1 A 45 45 GLY CA C 2468 45.659 44.928 0.731 1
1 461 . 17 1 1 A 45 45 GLY N N 2468 112.751 109.425 3.326 1
1 462 . 17 1 1 A 46 46 PRO HA H 2469 4.318 4.341 -0.023 1
1 469 . 17 1 1 A 46 46 PRO C C 2469 176.086 176.143 -0.057 1
1 470 . 17 1 1 A 46 46 PRO CA C 2469 64.198 63.822 0.376 1
1 471 . 17 1 1 A 46 46 PRO CB C 2469 32.348 31.870 0.478 1
1 474 . 17 1 1 A 47 47 SER H H 2470 7.106 7.610 -0.504 1
1 475 . 17 1 1 A 47 47 SER HA H 2470 4.632 4.857 -0.225 1
1 478 . 17 1 1 A 47 47 SER C C 2470 172.969 173.213 -0.244 1
1 479 . 17 1 1 A 47 47 SER CA C 2470 57.106 57.432 -0.326 1
1 480 . 17 1 1 A 47 47 SER CB C 2470 66.262 67.495 -1.233 1
1 481 . 17 1 1 A 47 47 SER N N 2470 110.556 114.412 -3.856 1
1 482 . 17 1 1 A 48 48 LYS H H 2471 8.534 8.294 0.240 1
1 483 . 17 1 1 A 48 48 LYS HA H 2471 4.486 4.570 -0.084 1
1 492 . 17 1 1 A 48 48 LYS C C 2471 177.231 176.476 0.755 1
1 493 . 17 1 1 A 48 48 LYS CA C 2471 56.620 56.892 -0.272 1
1 494 . 17 1 1 A 48 48 LYS CB C 2471 32.379 33.548 -1.169 1
1 498 . 17 1 1 A 48 48 LYS N N 2471 124.055 122.126 1.929 1
1 499 . 17 1 1 A 49 49 VAL H H 2472 8.497 8.842 -0.345 1
1 500 . 17 1 1 A 49 49 VAL HA H 2472 4.552 5.002 -0.450 1
1 508 . 17 1 1 A 49 49 VAL C C 2472 175.292 174.017 1.275 1
1 509 . 17 1 1 A 49 49 VAL CA C 2472 60.142 58.927 1.215 1
1 510 . 17 1 1 A 49 49 VAL CB C 2472 33.464 35.462 -1.998 1
1 513 . 17 1 1 A 49 49 VAL N N 2472 121.233 119.092 2.141 1
1 514 . 17 1 1 A 50 50 LYS H H 2473 8.190 8.436 -0.246 1
1 515 . 17 1 1 A 50 50 LYS HA H 2473 4.522 4.851 -0.329 1
1 518 . 17 1 1 A 50 50 LYS CA C 2473 55.952 55.466 0.486 1
1 519 . 17 1 1 A 50 50 LYS CB C 2473 32.896 33.905 -1.009 1
1 520 . 17 1 1 A 50 50 LYS N N 2473 126.082 123.431 2.651 1
1 521 . 17 1 1 A 51 51 MET H H 2474 8.818 9.059 -0.241 1
1 522 . 17 1 1 A 51 51 MET HA H 2474 5.324 5.542 -0.218 1
1 530 . 17 1 1 A 51 51 MET C C 2474 173.933 174.887 -0.954 1
1 531 . 17 1 1 A 51 51 MET CA C 2474 54.848 54.007 0.841 1
1 532 . 17 1 1 A 51 51 MET CB C 2474 37.043 36.926 0.117 1
1 535 . 17 1 1 A 51 51 MET N N 2474 126.911 125.651 1.260 1
1 536 . 17 1 1 A 52 52 ASP H H 2475 9.095 9.132 -0.037 1
1 537 . 17 1 1 A 52 52 ASP HA H 2475 4.947 5.040 -0.093 1
1 540 . 17 1 1 A 52 52 ASP C C 2475 173.923 174.701 -0.778 1
1 541 . 17 1 1 A 52 52 ASP CA C 2475 53.487 53.127 0.360 1
1 542 . 17 1 1 A 52 52 ASP CB C 2475 44.765 41.066 3.699 1
1 543 . 17 1 1 A 52 52 ASP N N 2475 125.526 122.674 2.852 1
1 544 . 17 1 1 A 53 53 CYS H H 2476 8.606 8.966 -0.360 1
1 545 . 17 1 1 A 53 53 CYS HA H 2476 5.145 4.557 0.588 1
1 548 . 17 1 1 A 53 53 CYS C C 2476 173.330 174.804 -1.474 1
1 549 . 17 1 1 A 53 53 CYS CA C 2476 57.452 59.269 -1.817 1
1 550 . 17 1 1 A 53 53 CYS CB C 2476 28.108 28.248 -0.140 1
1 551 . 17 1 1 A 53 53 CYS N N 2476 124.317 126.035 -1.718 1
1 552 . 17 1 1 A 54 54 GLN H H 2477 8.978 8.862 0.116 1
1 553 . 17 1 1 A 54 54 GLN HA H 2477 4.884 5.026 -0.142 1
1 560 . 17 1 1 A 54 54 GLN C C 2477 174.854 174.505 0.349 1
1 561 . 17 1 1 A 54 54 GLN CA C 2477 53.891 53.998 -0.107 1
1 562 . 17 1 1 A 54 54 GLN CB C 2477 32.837 33.295 -0.458 1
1 564 . 17 1 1 A 54 54 GLN N N 2477 127.074 125.386 1.688 1
1 566 . 17 1 1 A 55 55 GLU H H 2478 9.065 9.045 0.020 1
1 567 . 17 1 1 A 55 55 GLU HA H 2478 4.280 5.294 -1.014 1
1 572 . 17 1 1 A 55 55 GLU C C 2478 175.383 174.510 0.873 1
1 573 . 17 1 1 A 55 55 GLU CA C 2478 57.516 54.562 2.954 1
1 574 . 17 1 1 A 55 55 GLU CB C 2478 30.346 33.714 -3.368 1
1 576 . 17 1 1 A 55 55 GLU N N 2478 125.186 117.390 7.796 1
1 577 . 17 1 1 A 56 56 CYS H H 2479 8.407 8.479 -0.072 1
1 578 . 17 1 1 A 56 56 CYS HA H 2479 5.056 4.608 0.448 1
1 581 . 17 1 1 A 56 56 CYS CA C 2479 55.858 56.978 -1.120 1
1 582 . 17 1 1 A 56 56 CYS CB C 2479 28.676 30.390 -1.714 1
1 583 . 17 1 1 A 56 56 CYS N N 2479 121.499 117.488 4.011 1
1 584 . 17 1 1 A 57 57 PRO HA H 2480 4.159 4.295 -0.136 1
1 591 . 17 1 1 A 57 57 PRO C C 2480 177.964 177.709 0.255 1
1 592 . 17 1 1 A 57 57 PRO CA C 2480 66.877 64.623 2.254 1
1 593 . 17 1 1 A 57 57 PRO CB C 2480 31.709 32.016 -0.307 1
1 596 . 17 1 1 A 58 58 GLU H H 2481 8.900 8.175 0.725 1
1 597 . 17 1 1 A 58 58 GLU HA H 2481 4.201 4.316 -0.115 1
1 602 . 17 1 1 A 58 58 GLU C C 2481 175.129 176.595 -1.466 1
1 603 . 17 1 1 A 58 58 GLU CA C 2481 57.883 57.322 0.561 1
1 604 . 17 1 1 A 58 58 GLU CB C 2481 29.991 30.339 -0.348 1
1 606 . 17 1 1 A 58 58 GLU N N 2481 115.316 117.929 -2.613 1
1 607 . 17 1 1 A 59 59 GLY H H 2482 7.527 7.172 0.355 1
1 608 . 17 1 1 A 59 59 GLY HA2 H 2482 4.935 4.004 0.931 1
1 609 . 17 1 1 A 59 59 GLY HA3 H 2482 3.381 4.118 -0.737 1
1 610 . 17 1 1 A 59 59 GLY CA C 2482 47.809 44.388 3.421 1
1 611 . 17 1 1 A 59 59 GLY N N 2482 110.079 107.214 2.865 1
1 612 . 17 1 1 A 60 60 TYR H H 2483 8.990 8.200 0.790 1
1 613 . 17 1 1 A 60 60 TYR HA H 2483 5.157 4.747 0.410 1
1 618 . 17 1 1 A 60 60 TYR C C 2483 175.096 174.930 0.166 1
1 619 . 17 1 1 A 60 60 TYR CA C 2483 57.375 58.405 -1.030 1
1 620 . 17 1 1 A 60 60 TYR CB C 2483 43.153 39.148 4.005 1
1 622 . 17 1 1 A 60 60 TYR N N 2483 125.900 121.598 4.302 1
1 623 . 17 1 1 A 61 61 ARG H H 2484 9.557 8.666 0.891 1
1 624 . 17 1 1 A 61 61 ARG HA H 2484 4.858 4.762 0.096 1
1 631 . 17 1 1 A 61 61 ARG CA C 2484 55.016 55.296 -0.280 1
1 632 . 17 1 1 A 61 61 ARG CB C 2484 32.128 31.614 0.514 1
1 635 . 17 1 1 A 61 61 ARG N N 2484 124.847 126.183 -1.336 1
1 636 . 17 1 1 A 62 62 VAL H H 2485 9.046 8.790 0.256 1
1 637 . 17 1 1 A 62 62 VAL HA H 2485 4.675 4.655 0.020 1
1 645 . 17 1 1 A 62 62 VAL C C 2485 173.837 174.814 -0.977 1
1 646 . 17 1 1 A 62 62 VAL CA C 2485 60.752 60.959 -0.207 1
1 647 . 17 1 1 A 62 62 VAL CB C 2485 32.459 32.769 -0.310 1
1 650 . 17 1 1 A 62 62 VAL N N 2485 132.205 127.453 4.752 1
1 651 . 17 1 1 A 63 63 THR H H 2486 8.474 8.470 0.004 1
1 652 . 17 1 1 A 63 63 THR HA H 2486 5.392 5.238 0.154 1
1 657 . 17 1 1 A 63 63 THR C C 2486 173.675 173.658 0.017 1
1 658 . 17 1 1 A 63 63 THR CA C 2486 60.008 61.885 -1.877 1
1 659 . 17 1 1 A 63 63 THR CB C 2486 71.035 70.867 0.168 1
1 661 . 17 1 1 A 63 63 THR N N 2486 121.216 123.018 -1.802 1
1 662 . 17 1 1 A 64 64 TYR H H 2487 9.409 9.101 0.308 1
1 663 . 17 1 1 A 64 64 TYR HA H 2487 5.617 5.567 0.050 1
1 670 . 17 1 1 A 64 64 TYR C C 2487 172.847 172.437 0.410 1
1 671 . 17 1 1 A 64 64 TYR CA C 2487 55.557 55.892 -0.335 1
1 672 . 17 1 1 A 64 64 TYR CB C 2487 41.968 41.408 0.560 1
1 675 . 17 1 1 A 64 64 TYR N N 2487 124.061 121.942 2.119 1
1 676 . 17 1 1 A 65 65 THR H H 2488 8.145 8.779 -0.634 1
1 677 . 17 1 1 A 65 65 THR HA H 2488 4.959 4.589 0.370 1
1 682 . 17 1 1 A 65 65 THR CA C 2488 58.532 58.928 -0.396 1
1 683 . 17 1 1 A 65 65 THR CB C 2488 70.141 70.596 -0.455 1
1 685 . 17 1 1 A 65 65 THR N N 2488 117.924 116.536 1.388 1
1 686 . 17 1 1 A 66 66 PRO HA H 2489 4.602 4.792 -0.190 1
1 693 . 17 1 1 A 66 66 PRO C C 2489 176.647 176.614 0.033 1
1 694 . 17 1 1 A 66 66 PRO CA C 2489 61.442 62.248 -0.806 1
1 695 . 17 1 1 A 66 66 PRO CB C 2489 32.715 33.038 -0.323 1
1 698 . 17 1 1 A 67 67 MET H H 2490 8.832 8.501 0.331 1
1 699 . 17 1 1 A 67 67 MET HA H 2490 4.880 4.858 0.022 1
1 707 . 17 1 1 A 67 67 MET C C 2490 174.121 175.953 -1.832 1
1 708 . 17 1 1 A 67 67 MET CA C 2490 53.848 54.759 -0.911 1
1 709 . 17 1 1 A 67 67 MET CB C 2490 33.727 34.271 -0.544 1
1 712 . 17 1 1 A 67 67 MET N N 2490 119.212 116.983 2.229 1
1 713 . 17 1 1 A 68 68 ALA H H 2491 7.086 7.645 -0.559 1
1 714 . 17 1 1 A 68 68 ALA HA H 2491 4.851 4.819 0.032 1
1 718 . 17 1 1 A 68 68 ALA CA C 2491 49.222 49.931 -0.709 1
1 719 . 17 1 1 A 68 68 ALA CB C 2491 20.600 21.991 -1.391 1
1 720 . 17 1 1 A 68 68 ALA N N 2491 120.363 121.241 -0.878 1
1 721 . 17 1 1 A 69 69 PRO HA H 2492 4.263 4.663 -0.400 1
1 728 . 17 1 1 A 69 69 PRO C C 2492 174.370 176.216 -1.846 1
1 729 . 17 1 1 A 69 69 PRO CA C 2492 62.555 63.472 -0.917 1
1 730 . 17 1 1 A 69 69 PRO CB C 2492 32.752 32.363 0.389 1
1 733 . 17 1 1 A 70 70 GLY H H 2493 8.858 8.293 0.565 1
1 734 . 17 1 1 A 70 70 GLY HA2 H 2493 4.544 4.056 0.488 1
1 735 . 17 1 1 A 70 70 GLY HA3 H 2493 3.849 4.106 -0.257 1
1 736 . 17 1 1 A 70 70 GLY C C 2493 172.182 172.107 0.075 1
1 737 . 17 1 1 A 70 70 GLY CA C 2493 44.356 44.438 -0.082 1
1 738 . 17 1 1 A 70 70 GLY N N 2493 106.539 109.256 -2.717 1
1 739 . 17 1 1 A 71 71 SER H H 2494 8.490 8.309 0.181 1
1 740 . 17 1 1 A 71 71 SER HA H 2494 5.280 5.142 0.138 1
1 743 . 17 1 1 A 71 71 SER C C 2494 173.512 173.606 -0.094 1
1 744 . 17 1 1 A 71 71 SER CA C 2494 57.674 58.445 -0.771 1
1 745 . 17 1 1 A 71 71 SER CB C 2494 63.799 64.054 -0.255 1
1 746 . 17 1 1 A 71 71 SER N N 2494 117.964 117.346 0.618 1
1 747 . 17 1 1 A 72 72 TYR H H 2495 9.320 9.568 -0.248 1
1 748 . 17 1 1 A 72 72 TYR HA H 2495 4.960 5.305 -0.345 1
1 755 . 17 1 1 A 72 72 TYR C C 2495 173.979 174.898 -0.919 1
1 756 . 17 1 1 A 72 72 TYR CA C 2495 56.384 57.388 -1.004 1
1 757 . 17 1 1 A 72 72 TYR CB C 2495 40.247 40.391 -0.144 1
1 760 . 17 1 1 A 72 72 TYR N N 2495 126.442 126.729 -0.287 1
1 761 . 17 1 1 A 73 73 LEU H H 2496 9.019 8.938 0.081 1
1 762 . 17 1 1 A 73 73 LEU HA H 2496 5.209 5.014 0.195 1
1 772 . 17 1 1 A 73 73 LEU C C 2496 177.015 174.788 2.227 1
1 773 . 17 1 1 A 73 73 LEU CA C 2496 53.393 54.098 -0.705 1
1 774 . 17 1 1 A 73 73 LEU CB C 2496 43.918 43.575 0.343 1
1 778 . 17 1 1 A 73 73 LEU N N 2496 125.439 126.045 -0.606 1
1 779 . 17 1 1 A 74 74 ILE H H 2497 9.921 9.716 0.205 1
1 780 . 17 1 1 A 74 74 ILE HA H 2497 5.128 4.701 0.427 1
1 790 . 17 1 1 A 74 74 ILE C C 2497 175.730 174.808 0.922 1
1 791 . 17 1 1 A 74 74 ILE CA C 2497 60.930 60.362 0.568 1
1 792 . 17 1 1 A 74 74 ILE CB C 2497 39.488 37.703 1.785 1
1 796 . 17 1 1 A 74 74 ILE N N 2497 132.185 130.332 1.853 1
1 797 . 17 1 1 A 75 75 SER H H 2498 9.284 9.146 0.138 1
1 798 . 17 1 1 A 75 75 SER HA H 2498 5.111 5.089 0.022 1
1 801 . 17 1 1 A 75 75 SER C C 2498 173.449 174.003 -0.554 1
1 802 . 17 1 1 A 75 75 SER CA C 2498 58.260 58.269 -0.009 1
1 803 . 17 1 1 A 75 75 SER CB C 2498 63.956 63.122 0.834 1
1 804 . 17 1 1 A 75 75 SER N N 2498 125.384 124.925 0.459 1
1 805 . 17 1 1 A 76 76 ILE H H 2499 9.861 9.034 0.827 1
1 806 . 17 1 1 A 76 76 ILE HA H 2499 4.814 4.838 -0.024 1
1 816 . 17 1 1 A 76 76 ILE CA C 2499 61.034 60.577 0.457 1
1 817 . 17 1 1 A 76 76 ILE CB C 2499 40.387 38.874 1.513 1
1 821 . 17 1 1 A 76 76 ILE N N 2499 129.414 127.402 2.012 1
1 822 . 17 1 1 A 77 77 LYS H H 2500 8.827 8.992 -0.165 1
1 823 . 17 1 1 A 77 77 LYS HA H 2500 5.254 5.345 -0.091 1
1 832 . 17 1 1 A 77 77 LYS C C 2500 175.245 174.517 0.728 1
1 833 . 17 1 1 A 77 77 LYS CA C 2500 54.388 55.062 -0.674 1
1 834 . 17 1 1 A 77 77 LYS CB C 2500 36.127 35.718 0.409 1
1 838 . 17 1 1 A 77 77 LYS N N 2500 126.922 126.885 0.037 1
1 839 . 17 1 1 A 78 78 TYR H H 2501 8.408 9.039 -0.631 1
1 840 . 17 1 1 A 78 78 TYR HA H 2501 5.479 5.179 0.300 1
1 847 . 17 1 1 A 78 78 TYR C C 2501 174.792 175.647 -0.855 1
1 848 . 17 1 1 A 78 78 TYR CA C 2501 56.837 56.699 0.138 1
1 849 . 17 1 1 A 78 78 TYR CB C 2501 44.008 41.965 2.043 1
1 852 . 17 1 1 A 78 78 TYR N N 2501 122.282 124.868 -2.586 1
1 853 . 17 1 1 A 79 79 GLY H H 2502 8.196 8.474 -0.278 1
1 854 . 17 1 1 A 79 79 GLY HA2 H 2502 4.040 3.644 0.396 1
1 855 . 17 1 1 A 79 79 GLY HA3 H 2502 3.465 3.800 -0.335 1
1 856 . 17 1 1 A 79 79 GLY C C 2502 173.932 173.715 0.217 1
1 857 . 17 1 1 A 79 79 GLY CA C 2502 45.741 46.104 -0.363 1
1 858 . 17 1 1 A 79 79 GLY N N 2502 113.451 113.729 -0.278 1
1 859 . 17 1 1 A 80 80 GLY H H 2503 7.589 8.276 -0.687 1
1 860 . 17 1 1 A 80 80 GLY HA2 H 2503 4.490 4.006 0.484 1
1 861 . 17 1 1 A 80 80 GLY HA3 H 2503 3.555 4.100 -0.545 1
1 862 . 17 1 1 A 80 80 GLY CA C 2503 43.540 44.018 -0.478 1
1 863 . 17 1 1 A 80 80 GLY N N 2503 107.293 107.384 -0.091 1
1 864 . 17 1 1 A 81 81 PRO HA H 2504 4.320 4.363 -0.043 1
1 871 . 17 1 1 A 81 81 PRO C C 2504 175.311 175.274 0.037 1
1 872 . 17 1 1 A 81 81 PRO CA C 2504 62.722 63.447 -0.725 1
1 873 . 17 1 1 A 81 81 PRO CB C 2504 29.297 31.366 -2.069 1
1 876 . 17 1 1 A 82 82 TYR H H 2505 7.778 7.199 0.579 1
1 877 . 17 1 1 A 82 82 TYR HA H 2505 4.791 4.931 -0.140 1
1 884 . 17 1 1 A 82 82 TYR C C 2505 175.086 175.746 -0.660 1
1 885 . 17 1 1 A 82 82 TYR CA C 2505 56.111 56.610 -0.499 1
1 886 . 17 1 1 A 82 82 TYR CB C 2505 39.483 40.676 -1.193 1
1 889 . 17 1 1 A 82 82 TYR N N 2505 123.973 121.347 2.626 1
1 890 . 17 1 1 A 83 83 HIS H H 2506 8.625 8.988 -0.363 1
1 891 . 17 1 1 A 83 83 HIS HA H 2506 4.583 4.928 -0.345 1
1 896 . 17 1 1 A 83 83 HIS C C 2506 178.161 175.869 2.292 1
1 897 . 17 1 1 A 83 83 HIS CA C 2506 58.241 57.599 0.642 1
1 898 . 17 1 1 A 83 83 HIS CB C 2506 33.132 30.698 2.434 1
1 901 . 17 1 1 A 83 83 HIS N N 2506 124.092 121.759 2.333 1
1 902 . 17 1 1 A 84 84 ILE H H 2507 8.327 8.289 0.038 1
1 903 . 17 1 1 A 84 84 ILE HA H 2507 4.553 4.364 0.189 1
1 913 . 17 1 1 A 84 84 ILE C C 2507 176.523 176.564 -0.041 1
1 914 . 17 1 1 A 84 84 ILE CA C 2507 60.791 60.424 0.367 1
1 915 . 17 1 1 A 84 84 ILE CB C 2507 39.162 39.693 -0.531 1
1 919 . 17 1 1 A 84 84 ILE N N 2507 117.355 120.426 -3.071 1
1 920 . 17 1 1 A 85 85 GLY H H 2508 9.130 8.944 0.186 1
1 921 . 17 1 1 A 85 85 GLY HA2 H 2508 3.883 3.863 0.020 1
1 922 . 17 1 1 A 85 85 GLY HA3 H 2508 3.800 3.883 -0.083 1
1 923 . 17 1 1 A 85 85 GLY C C 2508 174.438 175.023 -0.585 1
1 924 . 17 1 1 A 85 85 GLY CA C 2508 47.673 47.206 0.467 1
1 925 . 17 1 1 A 85 85 GLY N N 2508 111.346 112.707 -1.361 1
1 926 . 17 1 1 A 86 86 GLY H H 2509 8.236 8.899 -0.663 1
1 927 . 17 1 1 A 86 86 GLY HA2 H 2509 3.893 3.807 0.086 1
1 928 . 17 1 1 A 86 86 GLY HA3 H 2509 3.161 3.827 -0.666 1
1 929 . 17 1 1 A 86 86 GLY C C 2509 171.837 173.197 -1.360 1
1 930 . 17 1 1 A 86 86 GLY CA C 2509 44.844 44.839 0.005 1
1 931 . 17 1 1 A 86 86 GLY N N 2509 115.594 115.237 0.357 1
1 932 . 17 1 1 A 87 87 SER H H 2510 7.385 7.699 -0.314 1
1 933 . 17 1 1 A 87 87 SER HA H 2510 4.217 4.007 0.210 1
1 936 . 17 1 1 A 87 87 SER CA C 2510 54.783 55.414 -0.631 1
1 937 . 17 1 1 A 87 87 SER CB C 2510 62.683 63.542 -0.859 1
1 938 . 17 1 1 A 87 87 SER N N 2510 112.859 116.233 -3.374 1
1 939 . 17 1 1 A 88 88 PRO HA H 2511 5.532 4.714 0.818 1
1 946 . 17 1 1 A 88 88 PRO C C 2511 175.870 175.070 0.800 1
1 947 . 17 1 1 A 88 88 PRO CA C 2511 62.379 62.184 0.195 1
1 948 . 17 1 1 A 88 88 PRO CB C 2511 33.639 32.189 1.450 1
1 951 . 17 1 1 A 89 89 PHE H H 2512 9.359 8.425 0.934 1
1 952 . 17 1 1 A 89 89 PHE HA H 2512 4.467 4.865 -0.398 1
1 960 . 17 1 1 A 89 89 PHE C C 2512 175.152 176.131 -0.979 1
1 961 . 17 1 1 A 89 89 PHE CA C 2512 57.401 56.992 0.409 1
1 962 . 17 1 1 A 89 89 PHE CB C 2512 40.843 41.338 -0.495 1
1 966 . 17 1 1 A 89 89 PHE N N 2512 124.789 119.706 5.083 1
1 967 . 17 1 1 A 90 90 LYS H H 2513 8.772 8.603 0.169 1
1 968 . 17 1 1 A 90 90 LYS HA H 2513 4.941 4.536 0.405 1
1 973 . 17 1 1 A 90 90 LYS C C 2513 174.183 175.936 -1.753 1
1 974 . 17 1 1 A 90 90 LYS CA C 2513 55.749 55.996 -0.247 1
1 975 . 17 1 1 A 90 90 LYS CB C 2513 32.817 32.117 0.700 1
1 978 . 17 1 1 A 90 90 LYS N N 2513 125.133 120.550 4.583 1
1 979 . 17 1 1 A 91 91 ALA H H 2514 9.158 7.597 1.561 1
1 980 . 17 1 1 A 91 91 ALA HA H 2514 4.510 4.211 0.299 1
1 984 . 17 1 1 A 91 91 ALA C C 2514 176.561 177.340 -0.779 1
1 985 . 17 1 1 A 91 91 ALA CA C 2514 50.528 52.928 -2.400 1
1 986 . 17 1 1 A 91 91 ALA CB C 2514 20.653 18.698 1.955 1
1 987 . 17 1 1 A 91 91 ALA N N 2514 131.989 122.433 9.556 1
1 988 . 17 1 1 A 92 92 LYS H H 2515 8.186 8.720 -0.534 1
1 989 . 17 1 1 A 92 92 LYS HA H 2515 4.926 4.740 0.186 1
1 998 . 17 1 1 A 92 92 LYS C C 2515 175.177 175.557 -0.380 1
1 999 . 17 1 1 A 92 92 LYS CA C 2515 55.725 55.977 -0.252 1
1 1000 . 17 1 1 A 92 92 LYS CB C 2515 33.765 33.292 0.473 1
1 1004 . 17 1 1 A 92 92 LYS N N 2515 124.887 124.008 0.879 1
1 1005 . 17 1 1 A 93 93 VAL H H 2516 9.362 9.545 -0.183 1
1 1006 . 17 1 1 A 93 93 VAL HA H 2516 5.161 5.194 -0.033 1
1 1014 . 17 1 1 A 93 93 VAL C C 2516 176.988 175.203 1.785 1
1 1015 . 17 1 1 A 93 93 VAL CA C 2516 60.523 61.182 -0.659 1
1 1016 . 17 1 1 A 93 93 VAL CB C 2516 33.291 34.458 -1.167 1
1 1019 . 17 1 1 A 93 93 VAL N N 2516 129.943 125.179 4.764 1
1 1020 . 17 1 1 A 94 94 THR H H 2517 8.614 8.842 -0.228 1
1 1021 . 17 1 1 A 94 94 THR HA H 2517 4.902 4.876 0.026 1
1 1026 . 17 1 1 A 94 94 THR C C 2517 172.759 173.199 -0.440 1
1 1027 . 17 1 1 A 94 94 THR CA C 2517 60.121 59.796 0.325 1
1 1028 . 17 1 1 A 94 94 THR CB C 2517 71.072 71.506 -0.434 1
1 1030 . 17 1 1 A 94 94 THR N N 2517 122.032 115.757 6.275 1
1 1031 . 17 1 1 A 95 95 GLY H H 2518 8.280 8.479 -0.199 1
1 1032 . 17 1 1 A 95 95 GLY HA2 H 2518 3.852 4.140 -0.288 1
1 1033 . 17 1 1 A 95 95 GLY HA3 H 2518 4.846 4.143 0.703 1
1 1034 . 17 1 1 A 95 95 GLY CA C 2518 43.955 44.345 -0.390 1
1 1035 . 17 1 1 A 95 95 GLY N N 2518 107.949 107.706 0.243 1
1 1036 . 17 1 1 A 96 96 PRO HA H 2519 4.449 4.647 -0.198 1
1 1043 . 17 1 1 A 96 96 PRO C C 2519 176.892 176.018 0.874 1
1 1044 . 17 1 1 A 96 96 PRO CA C 2519 62.062 62.746 -0.684 1
1 1045 . 17 1 1 A 96 96 PRO CB C 2519 32.286 32.531 -0.245 1
1 1048 . 17 1 1 A 97 97 ARG H H 2520 8.651 8.554 0.097 1
1 1049 . 17 1 1 A 97 97 ARG HA H 2520 4.348 4.568 -0.220 1
1 1056 . 17 1 1 A 97 97 ARG C C 2520 176.236 175.536 0.700 1
1 1057 . 17 1 1 A 97 97 ARG CA C 2520 57.587 55.878 1.709 1
1 1058 . 17 1 1 A 97 97 ARG CB C 2520 30.472 30.796 -0.324 1
1 1061 . 17 1 1 A 97 97 ARG N N 2520 120.781 121.979 -1.198 1
1 1062 . 17 1 1 A 98 98 LEU H H 2521 8.545 8.832 -0.287 1
1 1063 . 17 1 1 A 98 98 LEU HA H 2521 4.577 4.280 0.297 1
1 1073 . 17 1 1 A 98 98 LEU C C 2521 175.880 178.516 -2.636 1
1 1074 . 17 1 1 A 98 98 LEU CA C 2521 55.068 56.334 -1.266 1
1 1075 . 17 1 1 A 98 98 LEU CB C 2521 43.082 42.085 0.997 1
1 1079 . 17 1 1 A 98 98 LEU N N 2521 128.715 127.715 1.000 1
1 4 . 18 1 1 A 2 2 ALA HA H -2 4.374 4.880 -0.506 1
1 8 . 18 1 1 A 2 2 ALA C C -2 177.865 175.939 1.926 1
1 9 . 18 1 1 A 2 2 ALA CA C -2 52.670 51.266 1.404 1
1 10 . 18 1 1 A 2 2 ALA CB C -2 19.508 22.348 -2.840 1
1 32 . 18 1 1 A 5 5 ASP H H 2428 8.300 8.930 -0.630 1
1 33 . 18 1 1 A 5 5 ASP HA H 2428 5.082 5.087 -0.005 1
1 36 . 18 1 1 A 5 5 ASP CA C 2428 51.517 51.589 -0.072 1
1 37 . 18 1 1 A 5 5 ASP CB C 2428 42.244 40.727 1.517 1
1 38 . 18 1 1 A 5 5 ASP N N 2428 122.879 121.604 1.275 1
1 39 . 18 1 1 A 6 6 PRO HA H 2429 4.340 4.338 0.002 1
1 46 . 18 1 1 A 6 6 PRO C C 2429 178.266 178.401 -0.135 1
1 47 . 18 1 1 A 6 6 PRO CA C 2429 64.494 64.874 -0.380 1
1 48 . 18 1 1 A 6 6 PRO CB C 2429 31.841 31.897 -0.056 1
1 51 . 18 1 1 A 7 7 GLY H H 2430 8.686 8.428 0.258 1
1 52 . 18 1 1 A 7 7 GLY HA2 H 2430 4.116 3.866 0.250 1
1 53 . 18 1 1 A 7 7 GLY HA3 H 2430 3.868 3.869 -0.001 1
1 54 . 18 1 1 A 7 7 GLY C C 2430 174.567 175.603 -1.036 1
1 55 . 18 1 1 A 7 7 GLY CA C 2430 46.038 46.537 -0.499 1
1 56 . 18 1 1 A 7 7 GLY N N 2430 107.655 106.043 1.612 1
1 57 . 18 1 1 A 8 8 LEU H H 2431 7.692 7.457 0.235 1
1 58 . 18 1 1 A 8 8 LEU HA H 2431 4.507 4.374 0.133 1
1 68 . 18 1 1 A 8 8 LEU C C 2431 176.876 177.436 -0.560 1
1 69 . 18 1 1 A 8 8 LEU CA C 2431 54.307 56.564 -2.257 1
1 70 . 18 1 1 A 8 8 LEU CB C 2431 42.879 42.668 0.211 1
1 74 . 18 1 1 A 8 8 LEU N N 2431 120.022 120.125 -0.103 1
1 75 . 18 1 1 A 9 9 VAL H H 2432 7.378 7.605 -0.227 1
1 76 . 18 1 1 A 9 9 VAL HA H 2432 4.154 3.887 0.267 1
1 84 . 18 1 1 A 9 9 VAL C C 2432 174.703 175.532 -0.829 1
1 85 . 18 1 1 A 9 9 VAL CA C 2432 62.387 63.341 -0.954 1
1 86 . 18 1 1 A 9 9 VAL CB C 2432 32.519 31.481 1.038 1
1 89 . 18 1 1 A 9 9 VAL N N 2432 123.902 119.228 4.674 1
1 90 . 18 1 1 A 10 10 SER H H 2433 8.201 8.722 -0.521 1
1 91 . 18 1 1 A 10 10 SER HA H 2433 5.136 4.870 0.266 1
1 94 . 18 1 1 A 10 10 SER CA C 2433 56.554 55.519 1.035 1
1 95 . 18 1 1 A 10 10 SER CB C 2433 66.763 65.149 1.614 1
1 96 . 18 1 1 A 10 10 SER N N 2433 121.921 121.924 -0.003 1
1 97 . 18 1 1 A 11 11 ALA H H 2434 8.670 8.199 0.471 1
1 98 . 18 1 1 A 11 11 ALA HA H 2434 5.632 5.242 0.390 1
1 102 . 18 1 1 A 11 11 ALA C C 2434 175.459 174.407 1.052 1
1 103 . 18 1 1 A 11 11 ALA CA C 2434 50.575 50.723 -0.148 1
1 104 . 18 1 1 A 11 11 ALA CB C 2434 23.111 23.058 0.053 1
1 105 . 18 1 1 A 11 11 ALA N N 2434 124.828 123.655 1.173 1
1 106 . 18 1 1 A 12 12 TYR H H 2435 8.609 8.642 -0.033 1
1 107 . 18 1 1 A 12 12 TYR HA H 2435 4.879 5.097 -0.218 1
1 114 . 18 1 1 A 12 12 TYR C C 2435 173.645 174.617 -0.972 1
1 115 . 18 1 1 A 12 12 TYR CA C 2435 56.268 56.766 -0.498 1
1 116 . 18 1 1 A 12 12 TYR CB C 2435 39.522 42.389 -2.867 1
1 119 . 18 1 1 A 12 12 TYR N N 2435 118.305 119.554 -1.249 1
1 120 . 18 1 1 A 13 13 GLY H H 2436 8.655 8.491 0.164 1
1 121 . 18 1 1 A 13 13 GLY HA2 H 2436 4.943 4.296 0.647 1
1 122 . 18 1 1 A 13 13 GLY HA3 H 2436 4.028 4.344 -0.316 1
1 123 . 18 1 1 A 13 13 GLY C C 2436 175.334 174.923 0.411 1
1 124 . 18 1 1 A 13 13 GLY CA C 2436 44.389 44.422 -0.033 1
1 125 . 18 1 1 A 13 13 GLY N N 2436 110.710 110.289 0.421 1
1 126 . 18 1 1 A 14 14 ALA H H 2437 8.939 8.791 0.148 1
1 127 . 18 1 1 A 14 14 ALA HA H 2437 4.276 4.098 0.178 1
1 131 . 18 1 1 A 14 14 ALA C C 2437 180.524 179.054 1.470 1
1 132 . 18 1 1 A 14 14 ALA CA C 2437 55.551 55.098 0.453 1
1 133 . 18 1 1 A 14 14 ALA CB C 2437 18.411 18.520 -0.109 1
1 134 . 18 1 1 A 14 14 ALA N N 2437 126.973 123.846 3.127 1
1 135 . 18 1 1 A 15 15 GLY H H 2438 8.933 8.708 0.225 1
1 136 . 18 1 1 A 15 15 GLY HA2 H 2438 4.531 4.049 0.482 1
1 137 . 18 1 1 A 15 15 GLY HA3 H 2438 3.576 4.272 -0.696 1
1 138 . 18 1 1 A 15 15 GLY C C 2438 174.323 175.478 -1.155 1
1 139 . 18 1 1 A 15 15 GLY CA C 2438 46.855 46.707 0.148 1
1 140 . 18 1 1 A 15 15 GLY N N 2438 104.803 105.437 -0.634 1
1 141 . 18 1 1 A 16 16 LEU H H 2439 7.529 7.707 -0.178 1
1 142 . 18 1 1 A 16 16 LEU HA H 2439 3.768 3.822 -0.054 1
1 152 . 18 1 1 A 16 16 LEU C C 2439 176.388 178.522 -2.134 1
1 153 . 18 1 1 A 16 16 LEU CA C 2439 56.137 57.183 -1.046 1
1 154 . 18 1 1 A 16 16 LEU CB C 2439 41.621 41.185 0.436 1
1 158 . 18 1 1 A 16 16 LEU N N 2439 119.633 121.762 -2.129 1
1 159 . 18 1 1 A 17 17 GLU H H 2440 7.505 8.080 -0.575 1
1 160 . 18 1 1 A 17 17 GLU HA H 2440 4.663 4.371 0.292 1
1 165 . 18 1 1 A 17 17 GLU C C 2440 178.126 176.582 1.544 1
1 166 . 18 1 1 A 17 17 GLU CA C 2440 56.447 56.923 -0.476 1
1 167 . 18 1 1 A 17 17 GLU CB C 2440 31.485 31.023 0.462 1
1 169 . 18 1 1 A 17 17 GLU N N 2440 114.368 116.335 -1.967 1
1 170 . 18 1 1 A 18 18 GLY H H 2441 7.921 7.388 0.533 1
1 171 . 18 1 1 A 18 18 GLY HA2 H 2441 4.889 4.198 0.691 1
1 172 . 18 1 1 A 18 18 GLY HA3 H 2441 3.707 4.235 -0.528 1
1 173 . 18 1 1 A 18 18 GLY C C 2441 170.965 171.586 -0.621 1
1 174 . 18 1 1 A 18 18 GLY CA C 2441 45.549 45.343 0.206 1
1 175 . 18 1 1 A 18 18 GLY N N 2441 109.165 105.202 3.963 1
1 176 . 18 1 1 A 19 19 GLY H H 2442 7.540 8.328 -0.788 1
1 177 . 18 1 1 A 19 19 GLY HA2 H 2442 4.086 4.110 -0.024 1
1 178 . 18 1 1 A 19 19 GLY HA3 H 2442 4.086 4.142 -0.056 1
1 179 . 18 1 1 A 19 19 GLY C C 2442 171.051 171.877 -0.826 1
1 180 . 18 1 1 A 19 19 GLY CA C 2442 44.937 44.966 -0.029 1
1 181 . 18 1 1 A 19 19 GLY N N 2442 105.460 107.684 -2.224 1
1 182 . 18 1 1 A 20 20 VAL H H 2443 8.899 8.268 0.631 1
1 183 . 18 1 1 A 20 20 VAL HA H 2443 5.062 4.793 0.269 1
1 191 . 18 1 1 A 20 20 VAL C C 2443 176.623 175.575 1.048 1
1 192 . 18 1 1 A 20 20 VAL CA C 2443 60.197 61.491 -1.294 1
1 193 . 18 1 1 A 20 20 VAL CB C 2443 35.107 33.825 1.282 1
1 196 . 18 1 1 A 20 20 VAL N N 2443 122.753 120.119 2.634 1
1 197 . 18 1 1 A 21 21 THR H H 2444 8.630 8.641 -0.011 1
1 198 . 18 1 1 A 21 21 THR HA H 2444 3.773 4.255 -0.482 1
1 203 . 18 1 1 A 21 21 THR C C 2444 175.646 174.936 0.710 1
1 204 . 18 1 1 A 21 21 THR CA C 2444 62.732 62.917 -0.185 1
1 205 . 18 1 1 A 21 21 THR CB C 2444 68.925 68.653 0.272 1
1 207 . 18 1 1 A 21 21 THR N N 2444 118.179 119.828 -1.649 1
1 208 . 18 1 1 A 22 22 GLY H H 2445 8.736 8.781 -0.045 1
1 209 . 18 1 1 A 22 22 GLY HA2 H 2445 3.412 3.990 -0.578 1
1 210 . 18 1 1 A 22 22 GLY HA3 H 2445 4.061 3.991 0.070 1
1 211 . 18 1 1 A 22 22 GLY C C 2445 172.973 173.475 -0.502 1
1 212 . 18 1 1 A 22 22 GLY CA C 2445 45.577 45.243 0.334 1
1 213 . 18 1 1 A 22 22 GLY N N 2445 107.888 113.932 -6.044 1
1 214 . 18 1 1 A 23 23 ASN H H 2446 7.877 7.754 0.123 1
1 215 . 18 1 1 A 23 23 ASN HA H 2446 5.253 5.127 0.126 1
1 220 . 18 1 1 A 23 23 ASN CA C 2446 49.740 49.779 -0.039 1
1 221 . 18 1 1 A 23 23 ASN CB C 2446 40.198 39.208 0.990 1
1 222 . 18 1 1 A 23 23 ASN N N 2446 120.684 119.545 1.139 1
1 224 . 18 1 1 A 24 24 PRO HA H 2447 4.525 4.620 -0.095 1
1 231 . 18 1 1 A 24 24 PRO CA C 2447 62.766 62.329 0.437 1
1 232 . 18 1 1 A 24 24 PRO CB C 2447 31.732 32.078 -0.346 1
1 235 . 18 1 1 A 25 25 ALA H H 2448 9.178 8.224 0.954 1
1 236 . 18 1 1 A 25 25 ALA HA H 2448 4.614 4.903 -0.289 1
1 240 . 18 1 1 A 25 25 ALA C C 2448 175.503 176.047 -0.544 1
1 241 . 18 1 1 A 25 25 ALA CA C 2448 50.526 50.200 0.326 1
1 242 . 18 1 1 A 25 25 ALA CB C 2448 20.458 22.536 -2.078 1
1 243 . 18 1 1 A 25 25 ALA N N 2448 132.079 123.594 8.485 1
1 244 . 18 1 1 A 26 26 GLU H H 2449 8.813 9.060 -0.247 1
1 245 . 18 1 1 A 26 26 GLU HA H 2449 5.830 5.317 0.513 1
1 250 . 18 1 1 A 26 26 GLU C C 2449 176.272 174.587 1.685 1
1 251 . 18 1 1 A 26 26 GLU CA C 2449 54.376 54.807 -0.431 1
1 252 . 18 1 1 A 26 26 GLU CB C 2449 35.463 33.788 1.675 1
1 254 . 18 1 1 A 26 26 GLU N N 2449 120.079 116.396 3.683 1
1 255 . 18 1 1 A 27 27 PHE H H 2450 8.782 8.605 0.177 1
1 256 . 18 1 1 A 27 27 PHE HA H 2450 5.021 5.105 -0.084 1
1 264 . 18 1 1 A 27 27 PHE C C 2450 171.205 171.905 -0.700 1
1 265 . 18 1 1 A 27 27 PHE CA C 2450 56.852 56.403 0.449 1
1 266 . 18 1 1 A 27 27 PHE CB C 2450 41.080 41.020 0.060 1
1 270 . 18 1 1 A 27 27 PHE N N 2450 118.670 117.263 1.407 1
1 271 . 18 1 1 A 28 28 VAL H H 2451 8.961 9.294 -0.333 1
1 272 . 18 1 1 A 28 28 VAL HA H 2451 4.761 4.983 -0.222 1
1 280 . 18 1 1 A 28 28 VAL C C 2451 174.673 174.039 0.634 1
1 281 . 18 1 1 A 28 28 VAL CA C 2451 60.619 59.610 1.009 1
1 282 . 18 1 1 A 28 28 VAL CB C 2451 35.484 34.371 1.113 1
1 285 . 18 1 1 A 28 28 VAL N N 2451 121.552 120.421 1.131 1
1 286 . 18 1 1 A 29 29 VAL H H 2452 9.294 9.386 -0.092 1
1 287 . 18 1 1 A 29 29 VAL HA H 2452 4.363 4.468 -0.105 1
1 295 . 18 1 1 A 29 29 VAL C C 2452 174.218 175.019 -0.801 1
1 296 . 18 1 1 A 29 29 VAL CA C 2452 61.526 62.460 -0.934 1
1 297 . 18 1 1 A 29 29 VAL CB C 2452 32.666 31.157 1.509 1
1 300 . 18 1 1 A 29 29 VAL N N 2452 125.585 128.070 -2.485 1
1 301 . 18 1 1 A 30 30 ASN H H 2453 9.465 9.060 0.405 1
1 302 . 18 1 1 A 30 30 ASN HA H 2453 5.096 5.165 -0.069 1
1 307 . 18 1 1 A 30 30 ASN C C 2453 176.216 176.301 -0.085 1
1 308 . 18 1 1 A 30 30 ASN CA C 2453 52.011 52.570 -0.559 1
1 309 . 18 1 1 A 30 30 ASN CB C 2453 39.057 39.262 -0.205 1
1 310 . 18 1 1 A 30 30 ASN N N 2453 127.724 126.929 0.795 1
1 312 . 18 1 1 A 31 31 THR H H 2454 8.915 8.460 0.455 1
1 313 . 18 1 1 A 31 31 THR HA H 2454 4.342 4.594 -0.252 1
1 318 . 18 1 1 A 31 31 THR C C 2454 176.816 175.940 0.876 1
1 319 . 18 1 1 A 31 31 THR CA C 2454 61.117 61.407 -0.290 1
1 320 . 18 1 1 A 31 31 THR CB C 2454 68.209 69.572 -1.363 1
1 322 . 18 1 1 A 31 31 THR N N 2454 117.783 116.216 1.567 1
1 323 . 18 1 1 A 32 32 SER H H 2455 8.454 7.902 0.552 1
1 324 . 18 1 1 A 32 32 SER HA H 2455 4.155 4.154 0.001 1
1 327 . 18 1 1 A 32 32 SER C C 2455 175.458 175.330 0.128 1
1 328 . 18 1 1 A 32 32 SER CA C 2455 62.148 62.381 -0.233 1
1 329 . 18 1 1 A 32 32 SER CB C 2455 63.476 63.023 0.453 1
1 330 . 18 1 1 A 32 32 SER N N 2455 121.781 119.010 2.771 1
1 331 . 18 1 1 A 33 33 ASN H H 2456 8.845 8.031 0.814 1
1 332 . 18 1 1 A 33 33 ASN HA H 2456 5.064 4.591 0.473 1
1 337 . 18 1 1 A 33 33 ASN C C 2456 174.674 175.926 -1.252 1
1 338 . 18 1 1 A 33 33 ASN CA C 2456 53.067 54.679 -1.612 1
1 339 . 18 1 1 A 33 33 ASN CB C 2456 39.632 38.896 0.736 1
1 340 . 18 1 1 A 33 33 ASN N N 2456 120.176 117.682 2.494 1
1 342 . 18 1 1 A 34 34 ALA H H 2457 7.714 8.056 -0.342 1
1 343 . 18 1 1 A 34 34 ALA HA H 2457 4.482 4.545 -0.063 1
1 347 . 18 1 1 A 34 34 ALA C C 2457 177.582 178.087 -0.505 1
1 348 . 18 1 1 A 34 34 ALA CA C 2457 52.521 52.855 -0.334 1
1 349 . 18 1 1 A 34 34 ALA CB C 2457 22.252 21.056 1.196 1
1 350 . 18 1 1 A 34 34 ALA N N 2457 123.065 120.098 2.967 1
1 351 . 18 1 1 A 35 35 GLY H H 2458 8.195 7.937 0.258 1
1 352 . 18 1 1 A 35 35 GLY HA2 H 2458 4.246 4.123 0.123 1
1 353 . 18 1 1 A 35 35 GLY HA3 H 2458 3.902 4.136 -0.234 1
1 354 . 18 1 1 A 35 35 GLY C C 2458 173.360 173.516 -0.156 1
1 355 . 18 1 1 A 35 35 GLY CA C 2458 44.486 44.011 0.475 1
1 356 . 18 1 1 A 35 35 GLY N N 2458 108.472 104.198 4.274 1
1 357 . 18 1 1 A 36 36 ALA H H 2459 8.430 8.172 0.258 1
1 358 . 18 1 1 A 36 36 ALA HA H 2459 4.472 4.700 -0.228 1
1 362 . 18 1 1 A 36 36 ALA C C 2459 176.968 177.429 -0.461 1
1 363 . 18 1 1 A 36 36 ALA CA C 2459 52.695 52.117 0.578 1
1 364 . 18 1 1 A 36 36 ALA CB C 2459 19.360 20.133 -0.773 1
1 365 . 18 1 1 A 36 36 ALA N N 2459 126.012 123.943 2.069 1
1 366 . 18 1 1 A 37 37 GLY H H 2460 7.781 8.432 -0.651 1
1 367 . 18 1 1 A 37 37 GLY HA2 H 2460 3.856 4.032 -0.176 1
1 368 . 18 1 1 A 37 37 GLY HA3 H 2460 3.164 4.108 -0.944 1
1 369 . 18 1 1 A 37 37 GLY C C 2460 170.730 171.535 -0.805 1
1 370 . 18 1 1 A 37 37 GLY CA C 2460 44.747 45.098 -0.351 1
1 371 . 18 1 1 A 37 37 GLY N N 2460 109.493 107.021 2.472 1
1 372 . 18 1 1 A 38 38 ALA H H 2461 8.055 7.766 0.289 1
1 373 . 18 1 1 A 38 38 ALA HA H 2461 4.389 4.998 -0.609 1
1 377 . 18 1 1 A 38 38 ALA C C 2461 176.609 175.163 1.446 1
1 378 . 18 1 1 A 38 38 ALA CA C 2461 51.419 50.425 0.994 1
1 379 . 18 1 1 A 38 38 ALA CB C 2461 19.665 21.332 -1.667 1
1 380 . 18 1 1 A 38 38 ALA N N 2461 121.997 122.361 -0.364 1
1 381 . 18 1 1 A 39 39 LEU H H 2462 8.597 8.348 0.249 1
1 382 . 18 1 1 A 39 39 LEU HA H 2462 5.022 4.948 0.074 1
1 392 . 18 1 1 A 39 39 LEU C C 2462 175.883 175.477 0.406 1
1 393 . 18 1 1 A 39 39 LEU CA C 2462 53.907 53.234 0.673 1
1 394 . 18 1 1 A 39 39 LEU CB C 2462 44.576 44.766 -0.190 1
1 398 . 18 1 1 A 39 39 LEU N N 2462 126.664 123.963 2.701 1
1 399 . 18 1 1 A 40 40 SER H H 2463 8.898 9.066 -0.168 1
1 400 . 18 1 1 A 40 40 SER HA H 2463 4.732 4.703 0.029 1
1 403 . 18 1 1 A 40 40 SER C C 2463 172.984 172.809 0.175 1
1 404 . 18 1 1 A 40 40 SER CA C 2463 56.730 57.005 -0.275 1
1 405 . 18 1 1 A 40 40 SER CB C 2463 64.648 64.181 0.467 1
1 406 . 18 1 1 A 40 40 SER N N 2463 122.932 121.761 1.171 1
1 407 . 18 1 1 A 41 41 VAL H H 2464 8.538 7.385 1.153 1
1 408 . 18 1 1 A 41 41 VAL HA H 2464 5.131 4.181 0.950 1
1 416 . 18 1 1 A 41 41 VAL C C 2464 174.812 174.817 -0.005 1
1 417 . 18 1 1 A 41 41 VAL CA C 2464 60.784 62.840 -2.056 1
1 418 . 18 1 1 A 41 41 VAL CB C 2464 34.262 32.431 1.831 1
1 420 . 18 1 1 A 41 41 VAL N N 2464 129.161 123.160 6.001 1
1 421 . 18 1 1 A 42 42 THR H H 2465 8.807 8.845 -0.038 1
1 422 . 18 1 1 A 42 42 THR HA H 2465 4.573 5.080 -0.507 1
1 427 . 18 1 1 A 42 42 THR CA C 2465 60.408 61.386 -0.978 1
1 428 . 18 1 1 A 42 42 THR CB C 2465 71.764 72.318 -0.554 1
1 430 . 18 1 1 A 42 42 THR N N 2465 120.898 123.900 -3.002 1
1 431 . 18 1 1 A 43 43 ILE H H 2466 8.648 8.807 -0.159 1
1 432 . 18 1 1 A 43 43 ILE HA H 2466 4.854 4.840 0.014 1
1 442 . 18 1 1 A 43 43 ILE C C 2466 174.073 174.031 0.042 1
1 443 . 18 1 1 A 43 43 ILE CA C 2466 61.184 60.030 1.154 1
1 444 . 18 1 1 A 43 43 ILE CB C 2466 39.516 40.669 -1.153 1
1 448 . 18 1 1 A 43 43 ILE N N 2466 124.810 126.014 -1.204 1
1 449 . 18 1 1 A 44 44 ASP H H 2467 8.821 9.244 -0.423 1
1 450 . 18 1 1 A 44 44 ASP HA H 2467 5.217 5.534 -0.317 1
1 453 . 18 1 1 A 44 44 ASP C C 2467 175.002 175.178 -0.176 1
1 454 . 18 1 1 A 44 44 ASP CA C 2467 52.998 52.261 0.737 1
1 455 . 18 1 1 A 44 44 ASP CB C 2467 44.728 44.129 0.599 1
1 456 . 18 1 1 A 44 44 ASP N N 2467 129.093 128.543 0.550 1
1 457 . 18 1 1 A 45 45 GLY H H 2468 8.535 8.243 0.292 1
1 458 . 18 1 1 A 45 45 GLY HA2 H 2468 3.954 3.686 0.268 1
1 459 . 18 1 1 A 45 45 GLY HA3 H 2468 3.561 4.024 -0.463 1
1 460 . 18 1 1 A 45 45 GLY CA C 2468 45.659 44.932 0.727 1
1 461 . 18 1 1 A 45 45 GLY N N 2468 112.751 109.448 3.303 1
1 462 . 18 1 1 A 46 46 PRO HA H 2469 4.318 4.359 -0.041 1
1 469 . 18 1 1 A 46 46 PRO C C 2469 176.086 176.118 -0.032 1
1 470 . 18 1 1 A 46 46 PRO CA C 2469 64.198 63.800 0.398 1
1 471 . 18 1 1 A 46 46 PRO CB C 2469 32.348 31.886 0.462 1
1 474 . 18 1 1 A 47 47 SER H H 2470 7.106 7.509 -0.403 1
1 475 . 18 1 1 A 47 47 SER HA H 2470 4.632 4.815 -0.183 1
1 478 . 18 1 1 A 47 47 SER C C 2470 172.969 173.059 -0.090 1
1 479 . 18 1 1 A 47 47 SER CA C 2470 57.106 57.246 -0.140 1
1 480 . 18 1 1 A 47 47 SER CB C 2470 66.262 66.913 -0.651 1
1 481 . 18 1 1 A 47 47 SER N N 2470 110.556 113.639 -3.083 1
1 482 . 18 1 1 A 48 48 LYS H H 2471 8.534 8.302 0.232 1
1 483 . 18 1 1 A 48 48 LYS HA H 2471 4.486 4.628 -0.142 1
1 492 . 18 1 1 A 48 48 LYS C C 2471 177.231 176.094 1.137 1
1 493 . 18 1 1 A 48 48 LYS CA C 2471 56.620 56.500 0.120 1
1 494 . 18 1 1 A 48 48 LYS CB C 2471 32.379 34.147 -1.768 1
1 498 . 18 1 1 A 48 48 LYS N N 2471 124.055 121.709 2.346 1
1 499 . 18 1 1 A 49 49 VAL H H 2472 8.497 8.698 -0.201 1
1 500 . 18 1 1 A 49 49 VAL HA H 2472 4.552 4.925 -0.373 1
1 508 . 18 1 1 A 49 49 VAL C C 2472 175.292 173.998 1.294 1
1 509 . 18 1 1 A 49 49 VAL CA C 2472 60.142 58.902 1.240 1
1 510 . 18 1 1 A 49 49 VAL CB C 2472 33.464 35.562 -2.098 1
1 513 . 18 1 1 A 49 49 VAL N N 2472 121.233 118.041 3.192 1
1 514 . 18 1 1 A 50 50 LYS H H 2473 8.190 8.764 -0.574 1
1 515 . 18 1 1 A 50 50 LYS HA H 2473 4.522 4.782 -0.260 1
1 518 . 18 1 1 A 50 50 LYS CA C 2473 55.952 55.311 0.641 1
1 519 . 18 1 1 A 50 50 LYS CB C 2473 32.896 33.670 -0.774 1
1 520 . 18 1 1 A 50 50 LYS N N 2473 126.082 123.687 2.395 1
1 521 . 18 1 1 A 51 51 MET H H 2474 8.818 9.126 -0.308 1
1 522 . 18 1 1 A 51 51 MET HA H 2474 5.324 5.390 -0.066 1
1 530 . 18 1 1 A 51 51 MET C C 2474 173.933 173.881 0.052 1
1 531 . 18 1 1 A 51 51 MET CA C 2474 54.848 54.074 0.774 1
1 532 . 18 1 1 A 51 51 MET CB C 2474 37.043 35.799 1.244 1
1 535 . 18 1 1 A 51 51 MET N N 2474 126.911 127.661 -0.750 1
1 536 . 18 1 1 A 52 52 ASP H H 2475 9.095 9.174 -0.079 1
1 537 . 18 1 1 A 52 52 ASP HA H 2475 4.947 5.400 -0.453 1
1 540 . 18 1 1 A 52 52 ASP C C 2475 173.923 173.693 0.230 1
1 541 . 18 1 1 A 52 52 ASP CA C 2475 53.487 52.715 0.772 1
1 542 . 18 1 1 A 52 52 ASP CB C 2475 44.765 44.727 0.038 1
1 543 . 18 1 1 A 52 52 ASP N N 2475 125.526 124.977 0.549 1
1 544 . 18 1 1 A 53 53 CYS H H 2476 8.606 8.935 -0.329 1
1 545 . 18 1 1 A 53 53 CYS HA H 2476 5.145 5.232 -0.087 1
1 548 . 18 1 1 A 53 53 CYS C C 2476 173.330 173.503 -0.173 1
1 549 . 18 1 1 A 53 53 CYS CA C 2476 57.452 57.145 0.307 1
1 550 . 18 1 1 A 53 53 CYS CB C 2476 28.108 30.727 -2.619 1
1 551 . 18 1 1 A 53 53 CYS N N 2476 124.317 125.660 -1.343 1
1 552 . 18 1 1 A 54 54 GLN H H 2477 8.978 9.077 -0.099 1
1 553 . 18 1 1 A 54 54 GLN HA H 2477 4.884 5.073 -0.189 1
1 560 . 18 1 1 A 54 54 GLN C C 2477 174.854 174.531 0.323 1
1 561 . 18 1 1 A 54 54 GLN CA C 2477 53.891 54.337 -0.446 1
1 562 . 18 1 1 A 54 54 GLN CB C 2477 32.837 32.022 0.815 1
1 564 . 18 1 1 A 54 54 GLN N N 2477 127.074 125.968 1.106 1
1 566 . 18 1 1 A 55 55 GLU H H 2478 9.065 9.083 -0.018 1
1 567 . 18 1 1 A 55 55 GLU HA H 2478 4.280 4.605 -0.325 1
1 572 . 18 1 1 A 55 55 GLU C C 2478 175.383 175.767 -0.384 1
1 573 . 18 1 1 A 55 55 GLU CA C 2478 57.516 56.684 0.832 1
1 574 . 18 1 1 A 55 55 GLU CB C 2478 30.346 30.611 -0.265 1
1 576 . 18 1 1 A 55 55 GLU N N 2478 125.186 125.177 0.009 1
1 577 . 18 1 1 A 56 56 CYS H H 2479 8.407 8.434 -0.027 1
1 578 . 18 1 1 A 56 56 CYS HA H 2479 5.056 4.631 0.425 1
1 581 . 18 1 1 A 56 56 CYS CA C 2479 55.858 56.921 -1.063 1
1 582 . 18 1 1 A 56 56 CYS CB C 2479 28.676 30.091 -1.415 1
1 583 . 18 1 1 A 56 56 CYS N N 2479 121.499 123.032 -1.533 1
1 584 . 18 1 1 A 57 57 PRO HA H 2480 4.159 4.351 -0.192 1
1 591 . 18 1 1 A 57 57 PRO C C 2480 177.964 177.612 0.352 1
1 592 . 18 1 1 A 57 57 PRO CA C 2480 66.877 64.501 2.376 1
1 593 . 18 1 1 A 57 57 PRO CB C 2480 31.709 31.871 -0.162 1
1 596 . 18 1 1 A 58 58 GLU H H 2481 8.900 8.039 0.861 1
1 597 . 18 1 1 A 58 58 GLU HA H 2481 4.201 4.348 -0.147 1
1 602 . 18 1 1 A 58 58 GLU C C 2481 175.129 176.421 -1.292 1
1 603 . 18 1 1 A 58 58 GLU CA C 2481 57.883 57.228 0.655 1
1 604 . 18 1 1 A 58 58 GLU CB C 2481 29.991 30.159 -0.168 1
1 606 . 18 1 1 A 58 58 GLU N N 2481 115.316 117.837 -2.521 1
1 607 . 18 1 1 A 59 59 GLY H H 2482 7.527 7.446 0.081 1
1 608 . 18 1 1 A 59 59 GLY HA2 H 2482 4.935 3.992 0.943 1
1 609 . 18 1 1 A 59 59 GLY HA3 H 2482 3.381 4.103 -0.722 1
1 610 . 18 1 1 A 59 59 GLY CA C 2482 47.809 44.540 3.269 1
1 611 . 18 1 1 A 59 59 GLY N N 2482 110.079 107.837 2.242 1
1 612 . 18 1 1 A 60 60 TYR H H 2483 8.990 8.483 0.507 1
1 613 . 18 1 1 A 60 60 TYR HA H 2483 5.157 5.135 0.022 1
1 618 . 18 1 1 A 60 60 TYR C C 2483 175.096 174.442 0.654 1
1 619 . 18 1 1 A 60 60 TYR CA C 2483 57.375 56.887 0.488 1
1 620 . 18 1 1 A 60 60 TYR CB C 2483 43.153 40.188 2.965 1
1 622 . 18 1 1 A 60 60 TYR N N 2483 125.900 122.036 3.864 1
1 623 . 18 1 1 A 61 61 ARG H H 2484 9.557 8.831 0.726 1
1 624 . 18 1 1 A 61 61 ARG HA H 2484 4.858 4.725 0.133 1
1 631 . 18 1 1 A 61 61 ARG CA C 2484 55.016 55.459 -0.443 1
1 632 . 18 1 1 A 61 61 ARG CB C 2484 32.128 31.571 0.557 1
1 635 . 18 1 1 A 61 61 ARG N N 2484 124.847 126.560 -1.713 1
1 636 . 18 1 1 A 62 62 VAL H H 2485 9.046 8.948 0.098 1
1 637 . 18 1 1 A 62 62 VAL HA H 2485 4.675 4.970 -0.295 1
1 645 . 18 1 1 A 62 62 VAL C C 2485 173.837 174.328 -0.491 1
1 646 . 18 1 1 A 62 62 VAL CA C 2485 60.752 59.727 1.025 1
1 647 . 18 1 1 A 62 62 VAL CB C 2485 32.459 34.039 -1.580 1
1 650 . 18 1 1 A 62 62 VAL N N 2485 132.205 121.095 11.110 1
1 651 . 18 1 1 A 63 63 THR H H 2486 8.474 8.685 -0.211 1
1 652 . 18 1 1 A 63 63 THR HA H 2486 5.392 5.357 0.035 1
1 657 . 18 1 1 A 63 63 THR C C 2486 173.675 173.751 -0.076 1
1 658 . 18 1 1 A 63 63 THR CA C 2486 60.008 61.277 -1.269 1
1 659 . 18 1 1 A 63 63 THR CB C 2486 71.035 70.876 0.159 1
1 661 . 18 1 1 A 63 63 THR N N 2486 121.216 118.876 2.340 1
1 662 . 18 1 1 A 64 64 TYR H H 2487 9.409 9.109 0.300 1
1 663 . 18 1 1 A 64 64 TYR HA H 2487 5.617 5.660 -0.043 1
1 670 . 18 1 1 A 64 64 TYR C C 2487 172.847 172.664 0.183 1
1 671 . 18 1 1 A 64 64 TYR CA C 2487 55.557 55.633 -0.076 1
1 672 . 18 1 1 A 64 64 TYR CB C 2487 41.968 42.037 -0.069 1
1 675 . 18 1 1 A 64 64 TYR N N 2487 124.061 122.596 1.465 1
1 676 . 18 1 1 A 65 65 THR H H 2488 8.145 8.966 -0.821 1
1 677 . 18 1 1 A 65 65 THR HA H 2488 4.959 4.612 0.347 1
1 682 . 18 1 1 A 65 65 THR CA C 2488 58.532 59.037 -0.505 1
1 683 . 18 1 1 A 65 65 THR CB C 2488 70.141 69.973 0.168 1
1 685 . 18 1 1 A 65 65 THR N N 2488 117.924 117.019 0.905 1
1 686 . 18 1 1 A 66 66 PRO HA H 2489 4.602 4.765 -0.163 1
1 693 . 18 1 1 A 66 66 PRO C C 2489 176.647 176.438 0.209 1
1 694 . 18 1 1 A 66 66 PRO CA C 2489 61.442 62.245 -0.803 1
1 695 . 18 1 1 A 66 66 PRO CB C 2489 32.715 32.854 -0.139 1
1 698 . 18 1 1 A 67 67 MET H H 2490 8.832 8.227 0.605 1
1 699 . 18 1 1 A 67 67 MET HA H 2490 4.880 4.690 0.190 1
1 707 . 18 1 1 A 67 67 MET C C 2490 174.121 176.023 -1.902 1
1 708 . 18 1 1 A 67 67 MET CA C 2490 53.848 55.056 -1.208 1
1 709 . 18 1 1 A 67 67 MET CB C 2490 33.727 33.922 -0.195 1
1 712 . 18 1 1 A 67 67 MET N N 2490 119.212 117.694 1.518 1
1 713 . 18 1 1 A 68 68 ALA H H 2491 7.086 7.867 -0.781 1
1 714 . 18 1 1 A 68 68 ALA HA H 2491 4.851 4.847 0.004 1
1 718 . 18 1 1 A 68 68 ALA CA C 2491 49.222 49.830 -0.608 1
1 719 . 18 1 1 A 68 68 ALA CB C 2491 20.600 21.699 -1.099 1
1 720 . 18 1 1 A 68 68 ALA N N 2491 120.363 120.501 -0.138 1
1 721 . 18 1 1 A 69 69 PRO HA H 2492 4.263 4.456 -0.193 1
1 728 . 18 1 1 A 69 69 PRO C C 2492 174.370 176.220 -1.850 1
1 729 . 18 1 1 A 69 69 PRO CA C 2492 62.555 63.566 -1.011 1
1 730 . 18 1 1 A 69 69 PRO CB C 2492 32.752 32.849 -0.097 1
1 733 . 18 1 1 A 70 70 GLY H H 2493 8.858 8.254 0.604 1
1 734 . 18 1 1 A 70 70 GLY HA2 H 2493 4.544 4.103 0.441 1
1 735 . 18 1 1 A 70 70 GLY HA3 H 2493 3.849 4.136 -0.287 1
1 736 . 18 1 1 A 70 70 GLY C C 2493 172.182 172.397 -0.215 1
1 737 . 18 1 1 A 70 70 GLY CA C 2493 44.356 44.162 0.194 1
1 738 . 18 1 1 A 70 70 GLY N N 2493 106.539 109.300 -2.761 1
1 739 . 18 1 1 A 71 71 SER H H 2494 8.490 8.222 0.268 1
1 740 . 18 1 1 A 71 71 SER HA H 2494 5.280 5.305 -0.025 1
1 743 . 18 1 1 A 71 71 SER C C 2494 173.512 173.463 0.049 1
1 744 . 18 1 1 A 71 71 SER CA C 2494 57.674 58.141 -0.467 1
1 745 . 18 1 1 A 71 71 SER CB C 2494 63.799 64.111 -0.312 1
1 746 . 18 1 1 A 71 71 SER N N 2494 117.964 117.541 0.423 1
1 747 . 18 1 1 A 72 72 TYR H H 2495 9.320 9.342 -0.022 1
1 748 . 18 1 1 A 72 72 TYR HA H 2495 4.960 5.136 -0.176 1
1 755 . 18 1 1 A 72 72 TYR C C 2495 173.979 174.991 -1.012 1
1 756 . 18 1 1 A 72 72 TYR CA C 2495 56.384 57.431 -1.047 1
1 757 . 18 1 1 A 72 72 TYR CB C 2495 40.247 40.065 0.182 1
1 760 . 18 1 1 A 72 72 TYR N N 2495 126.442 127.423 -0.981 1
1 761 . 18 1 1 A 73 73 LEU H H 2496 9.019 8.980 0.039 1
1 762 . 18 1 1 A 73 73 LEU HA H 2496 5.209 5.026 0.183 1
1 772 . 18 1 1 A 73 73 LEU C C 2496 177.015 174.507 2.508 1
1 773 . 18 1 1 A 73 73 LEU CA C 2496 53.393 54.020 -0.627 1
1 774 . 18 1 1 A 73 73 LEU CB C 2496 43.918 43.990 -0.072 1
1 778 . 18 1 1 A 73 73 LEU N N 2496 125.439 126.137 -0.698 1
1 779 . 18 1 1 A 74 74 ILE H H 2497 9.921 9.672 0.249 1
1 780 . 18 1 1 A 74 74 ILE HA H 2497 5.128 4.609 0.519 1
1 790 . 18 1 1 A 74 74 ILE C C 2497 175.730 175.112 0.618 1
1 791 . 18 1 1 A 74 74 ILE CA C 2497 60.930 60.409 0.521 1
1 792 . 18 1 1 A 74 74 ILE CB C 2497 39.488 37.899 1.589 1
1 796 . 18 1 1 A 74 74 ILE N N 2497 132.185 129.562 2.623 1
1 797 . 18 1 1 A 75 75 SER H H 2498 9.284 9.109 0.175 1
1 798 . 18 1 1 A 75 75 SER HA H 2498 5.111 4.946 0.165 1
1 801 . 18 1 1 A 75 75 SER C C 2498 173.449 173.535 -0.086 1
1 802 . 18 1 1 A 75 75 SER CA C 2498 58.260 58.266 -0.006 1
1 803 . 18 1 1 A 75 75 SER CB C 2498 63.956 61.971 1.985 1
1 804 . 18 1 1 A 75 75 SER N N 2498 125.384 124.989 0.395 1
1 805 . 18 1 1 A 76 76 ILE H H 2499 9.861 8.628 1.233 1
1 806 . 18 1 1 A 76 76 ILE HA H 2499 4.814 4.536 0.278 1
1 816 . 18 1 1 A 76 76 ILE CA C 2499 61.034 61.735 -0.701 1
1 817 . 18 1 1 A 76 76 ILE CB C 2499 40.387 37.257 3.130 1
1 821 . 18 1 1 A 76 76 ILE N N 2499 129.414 126.768 2.646 1
1 822 . 18 1 1 A 77 77 LYS H H 2500 8.827 8.877 -0.050 1
1 823 . 18 1 1 A 77 77 LYS HA H 2500 5.254 5.390 -0.136 1
1 832 . 18 1 1 A 77 77 LYS C C 2500 175.245 174.972 0.273 1
1 833 . 18 1 1 A 77 77 LYS CA C 2500 54.388 54.337 0.051 1
1 834 . 18 1 1 A 77 77 LYS CB C 2500 36.127 35.615 0.512 1
1 838 . 18 1 1 A 77 77 LYS N N 2500 126.922 127.191 -0.269 1
1 839 . 18 1 1 A 78 78 TYR H H 2501 8.408 9.002 -0.594 1
1 840 . 18 1 1 A 78 78 TYR HA H 2501 5.479 5.057 0.422 1
1 847 . 18 1 1 A 78 78 TYR C C 2501 174.792 175.582 -0.790 1
1 848 . 18 1 1 A 78 78 TYR CA C 2501 56.837 57.338 -0.501 1
1 849 . 18 1 1 A 78 78 TYR CB C 2501 44.008 42.335 1.673 1
1 852 . 18 1 1 A 78 78 TYR N N 2501 122.282 124.168 -1.886 1
1 853 . 18 1 1 A 79 79 GLY H H 2502 8.196 8.480 -0.284 1
1 854 . 18 1 1 A 79 79 GLY HA2 H 2502 4.040 3.717 0.323 1
1 855 . 18 1 1 A 79 79 GLY HA3 H 2502 3.465 3.918 -0.453 1
1 856 . 18 1 1 A 79 79 GLY C C 2502 173.932 173.706 0.226 1
1 857 . 18 1 1 A 79 79 GLY CA C 2502 45.741 46.139 -0.398 1
1 858 . 18 1 1 A 79 79 GLY N N 2502 113.451 113.869 -0.418 1
1 859 . 18 1 1 A 80 80 GLY H H 2503 7.589 8.247 -0.658 1
1 860 . 18 1 1 A 80 80 GLY HA2 H 2503 4.490 3.993 0.497 1
1 861 . 18 1 1 A 80 80 GLY HA3 H 2503 3.555 4.081 -0.526 1
1 862 . 18 1 1 A 80 80 GLY CA C 2503 43.540 44.027 -0.487 1
1 863 . 18 1 1 A 80 80 GLY N N 2503 107.293 107.361 -0.068 1
1 864 . 18 1 1 A 81 81 PRO HA H 2504 4.320 4.310 0.010 1
1 871 . 18 1 1 A 81 81 PRO C C 2504 175.311 175.315 -0.004 1
1 872 . 18 1 1 A 81 81 PRO CA C 2504 62.722 63.504 -0.782 1
1 873 . 18 1 1 A 81 81 PRO CB C 2504 29.297 31.732 -2.435 1
1 876 . 18 1 1 A 82 82 TYR H H 2505 7.778 7.362 0.416 1
1 877 . 18 1 1 A 82 82 TYR HA H 2505 4.791 4.947 -0.156 1
1 884 . 18 1 1 A 82 82 TYR C C 2505 175.086 175.813 -0.727 1
1 885 . 18 1 1 A 82 82 TYR CA C 2505 56.111 56.766 -0.655 1
1 886 . 18 1 1 A 82 82 TYR CB C 2505 39.483 40.815 -1.332 1
1 889 . 18 1 1 A 82 82 TYR N N 2505 123.973 121.254 2.719 1
1 890 . 18 1 1 A 83 83 HIS H H 2506 8.625 9.020 -0.395 1
1 891 . 18 1 1 A 83 83 HIS HA H 2506 4.583 4.974 -0.391 1
1 896 . 18 1 1 A 83 83 HIS C C 2506 178.161 176.038 2.123 1
1 897 . 18 1 1 A 83 83 HIS CA C 2506 58.241 57.173 1.068 1
1 898 . 18 1 1 A 83 83 HIS CB C 2506 33.132 30.612 2.520 1
1 901 . 18 1 1 A 83 83 HIS N N 2506 124.092 121.390 2.702 1
1 902 . 18 1 1 A 84 84 ILE H H 2507 8.327 8.455 -0.128 1
1 903 . 18 1 1 A 84 84 ILE HA H 2507 4.553 4.366 0.187 1
1 913 . 18 1 1 A 84 84 ILE C C 2507 176.523 176.226 0.297 1
1 914 . 18 1 1 A 84 84 ILE CA C 2507 60.791 59.728 1.063 1
1 915 . 18 1 1 A 84 84 ILE CB C 2507 39.162 39.946 -0.784 1
1 919 . 18 1 1 A 84 84 ILE N N 2507 117.355 118.339 -0.984 1
1 920 . 18 1 1 A 85 85 GLY H H 2508 9.130 8.480 0.650 1
1 921 . 18 1 1 A 85 85 GLY HA2 H 2508 3.883 3.758 0.125 1
1 922 . 18 1 1 A 85 85 GLY HA3 H 2508 3.800 3.770 0.030 1
1 923 . 18 1 1 A 85 85 GLY C C 2508 174.438 175.466 -1.028 1
1 924 . 18 1 1 A 85 85 GLY CA C 2508 47.673 46.725 0.948 1
1 925 . 18 1 1 A 85 85 GLY N N 2508 111.346 109.617 1.729 1
1 926 . 18 1 1 A 86 86 GLY H H 2509 8.236 8.378 -0.142 1
1 927 . 18 1 1 A 86 86 GLY HA2 H 2509 3.893 3.875 0.018 1
1 928 . 18 1 1 A 86 86 GLY HA3 H 2509 3.161 3.914 -0.753 1
1 929 . 18 1 1 A 86 86 GLY C C 2509 171.837 173.632 -1.795 1
1 930 . 18 1 1 A 86 86 GLY CA C 2509 44.844 45.313 -0.469 1
1 931 . 18 1 1 A 86 86 GLY N N 2509 115.594 117.189 -1.595 1
1 932 . 18 1 1 A 87 87 SER H H 2510 7.385 7.961 -0.576 1
1 933 . 18 1 1 A 87 87 SER HA H 2510 4.217 4.288 -0.071 1
1 936 . 18 1 1 A 87 87 SER CA C 2510 54.783 55.415 -0.632 1
1 937 . 18 1 1 A 87 87 SER CB C 2510 62.683 64.049 -1.366 1
1 938 . 18 1 1 A 87 87 SER N N 2510 112.859 116.573 -3.714 1
1 939 . 18 1 1 A 88 88 PRO HA H 2511 5.532 4.852 0.680 1
1 946 . 18 1 1 A 88 88 PRO C C 2511 175.870 175.137 0.733 1
1 947 . 18 1 1 A 88 88 PRO CA C 2511 62.379 62.279 0.100 1
1 948 . 18 1 1 A 88 88 PRO CB C 2511 33.639 32.251 1.388 1
1 951 . 18 1 1 A 89 89 PHE H H 2512 9.359 8.678 0.681 1
1 952 . 18 1 1 A 89 89 PHE HA H 2512 4.467 4.925 -0.458 1
1 960 . 18 1 1 A 89 89 PHE C C 2512 175.152 174.463 0.689 1
1 961 . 18 1 1 A 89 89 PHE CA C 2512 57.401 57.052 0.349 1
1 962 . 18 1 1 A 89 89 PHE CB C 2512 40.843 41.397 -0.554 1
1 966 . 18 1 1 A 89 89 PHE N N 2512 124.789 118.639 6.150 1
1 967 . 18 1 1 A 90 90 LYS H H 2513 8.772 9.031 -0.259 1
1 968 . 18 1 1 A 90 90 LYS HA H 2513 4.941 4.833 0.108 1
1 973 . 18 1 1 A 90 90 LYS C C 2513 174.183 174.917 -0.734 1
1 974 . 18 1 1 A 90 90 LYS CA C 2513 55.749 55.524 0.225 1
1 975 . 18 1 1 A 90 90 LYS CB C 2513 32.817 33.576 -0.759 1
1 978 . 18 1 1 A 90 90 LYS N N 2513 125.133 124.292 0.841 1
1 979 . 18 1 1 A 91 91 ALA H H 2514 9.158 8.889 0.269 1
1 980 . 18 1 1 A 91 91 ALA HA H 2514 4.510 4.734 -0.224 1
1 984 . 18 1 1 A 91 91 ALA C C 2514 176.561 176.578 -0.017 1
1 985 . 18 1 1 A 91 91 ALA CA C 2514 50.528 51.934 -1.406 1
1 986 . 18 1 1 A 91 91 ALA CB C 2514 20.653 19.453 1.200 1
1 987 . 18 1 1 A 91 91 ALA N N 2514 131.989 129.901 2.088 1
1 988 . 18 1 1 A 92 92 LYS H H 2515 8.186 9.091 -0.905 1
1 989 . 18 1 1 A 92 92 LYS HA H 2515 4.926 4.672 0.254 1
1 998 . 18 1 1 A 92 92 LYS C C 2515 175.177 176.209 -1.032 1
1 999 . 18 1 1 A 92 92 LYS CA C 2515 55.725 55.109 0.616 1
1 1000 . 18 1 1 A 92 92 LYS CB C 2515 33.765 31.309 2.456 1
1 1004 . 18 1 1 A 92 92 LYS N N 2515 124.887 123.907 0.980 1
1 1005 . 18 1 1 A 93 93 VAL H H 2516 9.362 8.538 0.824 1
1 1006 . 18 1 1 A 93 93 VAL HA H 2516 5.161 4.606 0.555 1
1 1014 . 18 1 1 A 93 93 VAL C C 2516 176.988 175.539 1.449 1
1 1015 . 18 1 1 A 93 93 VAL CA C 2516 60.523 61.422 -0.899 1
1 1016 . 18 1 1 A 93 93 VAL CB C 2516 33.291 33.135 0.156 1
1 1019 . 18 1 1 A 93 93 VAL N N 2516 129.943 121.272 8.671 1
1 1020 . 18 1 1 A 94 94 THR H H 2517 8.614 8.876 -0.262 1
1 1021 . 18 1 1 A 94 94 THR HA H 2517 4.902 4.867 0.035 1
1 1026 . 18 1 1 A 94 94 THR C C 2517 172.759 172.925 -0.166 1
1 1027 . 18 1 1 A 94 94 THR CA C 2517 60.121 60.017 0.104 1
1 1028 . 18 1 1 A 94 94 THR CB C 2517 71.072 71.592 -0.520 1
1 1030 . 18 1 1 A 94 94 THR N N 2517 122.032 112.929 9.103 1
1 1031 . 18 1 1 A 95 95 GLY H H 2518 8.280 8.426 -0.146 1
1 1032 . 18 1 1 A 95 95 GLY HA2 H 2518 3.852 4.139 -0.287 1
1 1033 . 18 1 1 A 95 95 GLY HA3 H 2518 4.846 4.143 0.703 1
1 1034 . 18 1 1 A 95 95 GLY CA C 2518 43.955 44.397 -0.442 1
1 1035 . 18 1 1 A 95 95 GLY N N 2518 107.949 108.263 -0.314 1
1 1036 . 18 1 1 A 96 96 PRO HA H 2519 4.449 4.746 -0.297 1
1 1043 . 18 1 1 A 96 96 PRO C C 2519 176.892 176.726 0.166 1
1 1044 . 18 1 1 A 96 96 PRO CA C 2519 62.062 62.590 -0.528 1
1 1045 . 18 1 1 A 96 96 PRO CB C 2519 32.286 32.512 -0.226 1
1 1048 . 18 1 1 A 97 97 ARG H H 2520 8.651 8.897 -0.246 1
1 1049 . 18 1 1 A 97 97 ARG HA H 2520 4.348 4.279 0.069 1
1 1056 . 18 1 1 A 97 97 ARG C C 2520 176.236 176.226 0.010 1
1 1057 . 18 1 1 A 97 97 ARG CA C 2520 57.587 59.084 -1.497 1
1 1058 . 18 1 1 A 97 97 ARG CB C 2520 30.472 31.158 -0.686 1
1 1061 . 18 1 1 A 97 97 ARG N N 2520 120.781 122.669 -1.888 1
1 1062 . 18 1 1 A 98 98 LEU H H 2521 8.545 8.012 0.533 1
1 1063 . 18 1 1 A 98 98 LEU HA H 2521 4.577 3.973 0.604 1
1 1073 . 18 1 1 A 98 98 LEU C C 2521 175.880 175.424 0.456 1
1 1074 . 18 1 1 A 98 98 LEU CA C 2521 55.068 56.594 -1.526 1
1 1075 . 18 1 1 A 98 98 LEU CB C 2521 43.082 40.236 2.846 1
1 1079 . 18 1 1 A 98 98 LEU N N 2521 128.715 119.613 9.102 1
1 4 . 19 1 1 A 2 2 ALA HA H -2 4.374 4.484 -0.110 1
1 8 . 19 1 1 A 2 2 ALA C C -2 177.865 178.394 -0.529 1
1 9 . 19 1 1 A 2 2 ALA CA C -2 52.670 51.210 1.460 1
1 10 . 19 1 1 A 2 2 ALA CB C -2 19.508 20.248 -0.740 1
1 32 . 19 1 1 A 5 5 ASP H H 2428 8.300 8.646 -0.346 1
1 33 . 19 1 1 A 5 5 ASP HA H 2428 5.082 5.163 -0.081 1
1 36 . 19 1 1 A 5 5 ASP CA C 2428 51.517 50.955 0.562 1
1 37 . 19 1 1 A 5 5 ASP CB C 2428 42.244 42.792 -0.548 1
1 38 . 19 1 1 A 5 5 ASP N N 2428 122.879 121.529 1.350 1
1 39 . 19 1 1 A 6 6 PRO HA H 2429 4.340 4.355 -0.015 1
1 46 . 19 1 1 A 6 6 PRO C C 2429 178.266 178.123 0.143 1
1 47 . 19 1 1 A 6 6 PRO CA C 2429 64.494 64.824 -0.330 1
1 48 . 19 1 1 A 6 6 PRO CB C 2429 31.841 31.923 -0.082 1
1 51 . 19 1 1 A 7 7 GLY H H 2430 8.686 8.533 0.153 1
1 52 . 19 1 1 A 7 7 GLY HA2 H 2430 4.116 3.846 0.270 1
1 53 . 19 1 1 A 7 7 GLY HA3 H 2430 3.868 3.848 0.020 1
1 54 . 19 1 1 A 7 7 GLY C C 2430 174.567 175.711 -1.144 1
1 55 . 19 1 1 A 7 7 GLY CA C 2430 46.038 46.502 -0.464 1
1 56 . 19 1 1 A 7 7 GLY N N 2430 107.655 106.238 1.417 1
1 57 . 19 1 1 A 8 8 LEU H H 2431 7.692 7.459 0.233 1
1 58 . 19 1 1 A 8 8 LEU HA H 2431 4.507 4.385 0.122 1
1 68 . 19 1 1 A 8 8 LEU C C 2431 176.876 177.438 -0.562 1
1 69 . 19 1 1 A 8 8 LEU CA C 2431 54.307 56.612 -2.305 1
1 70 . 19 1 1 A 8 8 LEU CB C 2431 42.879 42.955 -0.076 1
1 74 . 19 1 1 A 8 8 LEU N N 2431 120.022 120.145 -0.123 1
1 75 . 19 1 1 A 9 9 VAL H H 2432 7.378 7.644 -0.266 1
1 76 . 19 1 1 A 9 9 VAL HA H 2432 4.154 3.918 0.236 1
1 84 . 19 1 1 A 9 9 VAL C C 2432 174.703 175.562 -0.859 1
1 85 . 19 1 1 A 9 9 VAL CA C 2432 62.387 63.225 -0.838 1
1 86 . 19 1 1 A 9 9 VAL CB C 2432 32.519 31.459 1.060 1
1 89 . 19 1 1 A 9 9 VAL N N 2432 123.902 119.224 4.678 1
1 90 . 19 1 1 A 10 10 SER H H 2433 8.201 8.783 -0.582 1
1 91 . 19 1 1 A 10 10 SER HA H 2433 5.136 4.885 0.251 1
1 94 . 19 1 1 A 10 10 SER CA C 2433 56.554 55.592 0.962 1
1 95 . 19 1 1 A 10 10 SER CB C 2433 66.763 65.125 1.638 1
1 96 . 19 1 1 A 10 10 SER N N 2433 121.921 121.858 0.063 1
1 97 . 19 1 1 A 11 11 ALA H H 2434 8.670 8.180 0.490 1
1 98 . 19 1 1 A 11 11 ALA HA H 2434 5.632 5.235 0.397 1
1 102 . 19 1 1 A 11 11 ALA C C 2434 175.459 174.576 0.883 1
1 103 . 19 1 1 A 11 11 ALA CA C 2434 50.575 50.771 -0.196 1
1 104 . 19 1 1 A 11 11 ALA CB C 2434 23.111 23.199 -0.088 1
1 105 . 19 1 1 A 11 11 ALA N N 2434 124.828 123.624 1.204 1
1 106 . 19 1 1 A 12 12 TYR H H 2435 8.609 8.686 -0.077 1
1 107 . 19 1 1 A 12 12 TYR HA H 2435 4.879 5.040 -0.161 1
1 114 . 19 1 1 A 12 12 TYR C C 2435 173.645 174.631 -0.986 1
1 115 . 19 1 1 A 12 12 TYR CA C 2435 56.268 56.871 -0.603 1
1 116 . 19 1 1 A 12 12 TYR CB C 2435 39.522 42.625 -3.103 1
1 119 . 19 1 1 A 12 12 TYR N N 2435 118.305 119.288 -0.983 1
1 120 . 19 1 1 A 13 13 GLY H H 2436 8.655 8.515 0.140 1
1 121 . 19 1 1 A 13 13 GLY HA2 H 2436 4.943 4.288 0.655 1
1 122 . 19 1 1 A 13 13 GLY HA3 H 2436 4.028 4.334 -0.306 1
1 123 . 19 1 1 A 13 13 GLY C C 2436 175.334 174.995 0.339 1
1 124 . 19 1 1 A 13 13 GLY CA C 2436 44.389 44.324 0.065 1
1 125 . 19 1 1 A 13 13 GLY N N 2436 110.710 110.451 0.259 1
1 126 . 19 1 1 A 14 14 ALA H H 2437 8.939 8.719 0.220 1
1 127 . 19 1 1 A 14 14 ALA HA H 2437 4.276 4.087 0.189 1
1 131 . 19 1 1 A 14 14 ALA C C 2437 180.524 179.182 1.342 1
1 132 . 19 1 1 A 14 14 ALA CA C 2437 55.551 55.084 0.467 1
1 133 . 19 1 1 A 14 14 ALA CB C 2437 18.411 18.413 -0.002 1
1 134 . 19 1 1 A 14 14 ALA N N 2437 126.973 123.704 3.269 1
1 135 . 19 1 1 A 15 15 GLY H H 2438 8.933 8.711 0.222 1
1 136 . 19 1 1 A 15 15 GLY HA2 H 2438 4.531 4.010 0.521 1
1 137 . 19 1 1 A 15 15 GLY HA3 H 2438 3.576 4.243 -0.667 1
1 138 . 19 1 1 A 15 15 GLY C C 2438 174.323 175.528 -1.205 1
1 139 . 19 1 1 A 15 15 GLY CA C 2438 46.855 46.993 -0.138 1
1 140 . 19 1 1 A 15 15 GLY N N 2438 104.803 105.558 -0.755 1
1 141 . 19 1 1 A 16 16 LEU H H 2439 7.529 7.630 -0.101 1
1 142 . 19 1 1 A 16 16 LEU HA H 2439 3.768 3.833 -0.065 1
1 152 . 19 1 1 A 16 16 LEU C C 2439 176.388 178.691 -2.303 1
1 153 . 19 1 1 A 16 16 LEU CA C 2439 56.137 57.265 -1.128 1
1 154 . 19 1 1 A 16 16 LEU CB C 2439 41.621 41.108 0.513 1
1 158 . 19 1 1 A 16 16 LEU N N 2439 119.633 122.173 -2.540 1
1 159 . 19 1 1 A 17 17 GLU H H 2440 7.505 7.798 -0.293 1
1 160 . 19 1 1 A 17 17 GLU HA H 2440 4.663 4.370 0.293 1
1 165 . 19 1 1 A 17 17 GLU C C 2440 178.126 177.329 0.797 1
1 166 . 19 1 1 A 17 17 GLU CA C 2440 56.447 56.559 -0.112 1
1 167 . 19 1 1 A 17 17 GLU CB C 2440 31.485 30.624 0.861 1
1 169 . 19 1 1 A 17 17 GLU N N 2440 114.368 116.160 -1.792 1
1 170 . 19 1 1 A 18 18 GLY H H 2441 7.921 7.596 0.325 1
1 171 . 19 1 1 A 18 18 GLY HA2 H 2441 4.889 4.138 0.751 1
1 172 . 19 1 1 A 18 18 GLY HA3 H 2441 3.707 4.170 -0.463 1
1 173 . 19 1 1 A 18 18 GLY C C 2441 170.965 172.716 -1.751 1
1 174 . 19 1 1 A 18 18 GLY CA C 2441 45.549 44.429 1.120 1
1 175 . 19 1 1 A 18 18 GLY N N 2441 109.165 106.895 2.270 1
1 176 . 19 1 1 A 19 19 GLY H H 2442 7.540 8.105 -0.565 1
1 177 . 19 1 1 A 19 19 GLY HA2 H 2442 4.086 4.207 -0.121 1
1 178 . 19 1 1 A 19 19 GLY HA3 H 2442 4.086 4.224 -0.138 1
1 179 . 19 1 1 A 19 19 GLY C C 2442 171.051 172.553 -1.502 1
1 180 . 19 1 1 A 19 19 GLY CA C 2442 44.937 44.448 0.489 1
1 181 . 19 1 1 A 19 19 GLY N N 2442 105.460 107.751 -2.291 1
1 182 . 19 1 1 A 20 20 VAL H H 2443 8.899 8.255 0.644 1
1 183 . 19 1 1 A 20 20 VAL HA H 2443 5.062 4.338 0.724 1
1 191 . 19 1 1 A 20 20 VAL C C 2443 176.623 175.736 0.887 1
1 192 . 19 1 1 A 20 20 VAL CA C 2443 60.197 62.443 -2.246 1
1 193 . 19 1 1 A 20 20 VAL CB C 2443 35.107 31.815 3.292 1
1 196 . 19 1 1 A 20 20 VAL N N 2443 122.753 121.429 1.324 1
1 197 . 19 1 1 A 21 21 THR H H 2444 8.630 8.620 0.010 1
1 198 . 19 1 1 A 21 21 THR HA H 2444 3.773 4.167 -0.394 1
1 203 . 19 1 1 A 21 21 THR C C 2444 175.646 175.009 0.637 1
1 204 . 19 1 1 A 21 21 THR CA C 2444 62.732 63.327 -0.595 1
1 205 . 19 1 1 A 21 21 THR CB C 2444 68.925 68.518 0.407 1
1 207 . 19 1 1 A 21 21 THR N N 2444 118.179 120.038 -1.859 1
1 208 . 19 1 1 A 22 22 GLY H H 2445 8.736 8.885 -0.149 1
1 209 . 19 1 1 A 22 22 GLY HA2 H 2445 3.412 4.028 -0.616 1
1 210 . 19 1 1 A 22 22 GLY HA3 H 2445 4.061 4.030 0.031 1
1 211 . 19 1 1 A 22 22 GLY C C 2445 172.973 174.162 -1.189 1
1 212 . 19 1 1 A 22 22 GLY CA C 2445 45.577 45.205 0.372 1
1 213 . 19 1 1 A 22 22 GLY N N 2445 107.888 114.078 -6.190 1
1 214 . 19 1 1 A 23 23 ASN H H 2446 7.877 7.727 0.150 1
1 215 . 19 1 1 A 23 23 ASN HA H 2446 5.253 4.862 0.391 1
1 220 . 19 1 1 A 23 23 ASN CA C 2446 49.740 51.425 -1.685 1
1 221 . 19 1 1 A 23 23 ASN CB C 2446 40.198 39.126 1.072 1
1 222 . 19 1 1 A 23 23 ASN N N 2446 120.684 119.758 0.926 1
1 224 . 19 1 1 A 24 24 PRO HA H 2447 4.525 4.724 -0.199 1
1 231 . 19 1 1 A 24 24 PRO CA C 2447 62.766 62.174 0.592 1
1 232 . 19 1 1 A 24 24 PRO CB C 2447 31.732 30.373 1.359 1
1 235 . 19 1 1 A 25 25 ALA H H 2448 9.178 7.746 1.432 1
1 236 . 19 1 1 A 25 25 ALA HA H 2448 4.614 4.340 0.274 1
1 240 . 19 1 1 A 25 25 ALA C C 2448 175.503 176.943 -1.440 1
1 241 . 19 1 1 A 25 25 ALA CA C 2448 50.526 52.390 -1.864 1
1 242 . 19 1 1 A 25 25 ALA CB C 2448 20.458 19.342 1.116 1
1 243 . 19 1 1 A 25 25 ALA N N 2448 132.079 125.370 6.709 1
1 244 . 19 1 1 A 26 26 GLU H H 2449 8.813 8.611 0.202 1
1 245 . 19 1 1 A 26 26 GLU HA H 2449 5.830 5.383 0.447 1
1 250 . 19 1 1 A 26 26 GLU C C 2449 176.272 174.581 1.691 1
1 251 . 19 1 1 A 26 26 GLU CA C 2449 54.376 54.919 -0.543 1
1 252 . 19 1 1 A 26 26 GLU CB C 2449 35.463 33.701 1.762 1
1 254 . 19 1 1 A 26 26 GLU N N 2449 120.079 118.190 1.889 1
1 255 . 19 1 1 A 27 27 PHE H H 2450 8.782 8.618 0.164 1
1 256 . 19 1 1 A 27 27 PHE HA H 2450 5.021 5.150 -0.129 1
1 264 . 19 1 1 A 27 27 PHE C C 2450 171.205 172.122 -0.917 1
1 265 . 19 1 1 A 27 27 PHE CA C 2450 56.852 56.277 0.575 1
1 266 . 19 1 1 A 27 27 PHE CB C 2450 41.080 41.147 -0.067 1
1 270 . 19 1 1 A 27 27 PHE N N 2450 118.670 117.204 1.466 1
1 271 . 19 1 1 A 28 28 VAL H H 2451 8.961 9.216 -0.255 1
1 272 . 19 1 1 A 28 28 VAL HA H 2451 4.761 4.700 0.061 1
1 280 . 19 1 1 A 28 28 VAL C C 2451 174.673 175.636 -0.963 1
1 281 . 19 1 1 A 28 28 VAL CA C 2451 60.619 61.054 -0.435 1
1 282 . 19 1 1 A 28 28 VAL CB C 2451 35.484 34.191 1.293 1
1 285 . 19 1 1 A 28 28 VAL N N 2451 121.552 120.030 1.522 1
1 286 . 19 1 1 A 29 29 VAL H H 2452 9.294 9.073 0.221 1
1 287 . 19 1 1 A 29 29 VAL HA H 2452 4.363 4.276 0.087 1
1 295 . 19 1 1 A 29 29 VAL C C 2452 174.218 174.974 -0.756 1
1 296 . 19 1 1 A 29 29 VAL CA C 2452 61.526 62.813 -1.287 1
1 297 . 19 1 1 A 29 29 VAL CB C 2452 32.666 31.840 0.826 1
1 300 . 19 1 1 A 29 29 VAL N N 2452 125.585 128.460 -2.875 1
1 301 . 19 1 1 A 30 30 ASN H H 2453 9.465 9.076 0.389 1
1 302 . 19 1 1 A 30 30 ASN HA H 2453 5.096 5.170 -0.074 1
1 307 . 19 1 1 A 30 30 ASN C C 2453 176.216 176.095 0.121 1
1 308 . 19 1 1 A 30 30 ASN CA C 2453 52.011 52.637 -0.626 1
1 309 . 19 1 1 A 30 30 ASN CB C 2453 39.057 38.665 0.392 1
1 310 . 19 1 1 A 30 30 ASN N N 2453 127.724 127.043 0.681 1
1 312 . 19 1 1 A 31 31 THR H H 2454 8.915 8.037 0.878 1
1 313 . 19 1 1 A 31 31 THR HA H 2454 4.342 4.494 -0.152 1
1 318 . 19 1 1 A 31 31 THR C C 2454 176.816 176.246 0.570 1
1 319 . 19 1 1 A 31 31 THR CA C 2454 61.117 61.595 -0.478 1
1 320 . 19 1 1 A 31 31 THR CB C 2454 68.209 69.951 -1.742 1
1 322 . 19 1 1 A 31 31 THR N N 2454 117.783 116.660 1.123 1
1 323 . 19 1 1 A 32 32 SER H H 2455 8.454 7.916 0.538 1
1 324 . 19 1 1 A 32 32 SER HA H 2455 4.155 4.228 -0.073 1
1 327 . 19 1 1 A 32 32 SER C C 2455 175.458 175.589 -0.131 1
1 328 . 19 1 1 A 32 32 SER CA C 2455 62.148 62.355 -0.207 1
1 329 . 19 1 1 A 32 32 SER CB C 2455 63.476 63.026 0.450 1
1 330 . 19 1 1 A 32 32 SER N N 2455 121.781 119.005 2.776 1
1 331 . 19 1 1 A 33 33 ASN H H 2456 8.845 8.132 0.713 1
1 332 . 19 1 1 A 33 33 ASN HA H 2456 5.064 4.541 0.523 1
1 337 . 19 1 1 A 33 33 ASN C C 2456 174.674 175.961 -1.287 1
1 338 . 19 1 1 A 33 33 ASN CA C 2456 53.067 55.012 -1.945 1
1 339 . 19 1 1 A 33 33 ASN CB C 2456 39.632 38.713 0.919 1
1 340 . 19 1 1 A 33 33 ASN N N 2456 120.176 118.559 1.617 1
1 342 . 19 1 1 A 34 34 ALA H H 2457 7.714 7.894 -0.180 1
1 343 . 19 1 1 A 34 34 ALA HA H 2457 4.482 4.545 -0.063 1
1 347 . 19 1 1 A 34 34 ALA C C 2457 177.582 177.773 -0.191 1
1 348 . 19 1 1 A 34 34 ALA CA C 2457 52.521 52.740 -0.219 1
1 349 . 19 1 1 A 34 34 ALA CB C 2457 22.252 21.322 0.930 1
1 350 . 19 1 1 A 34 34 ALA N N 2457 123.065 119.915 3.150 1
1 351 . 19 1 1 A 35 35 GLY H H 2458 8.195 7.709 0.486 1
1 352 . 19 1 1 A 35 35 GLY HA2 H 2458 4.246 4.149 0.097 1
1 353 . 19 1 1 A 35 35 GLY HA3 H 2458 3.902 4.165 -0.263 1
1 354 . 19 1 1 A 35 35 GLY C C 2458 173.360 172.970 0.390 1
1 355 . 19 1 1 A 35 35 GLY CA C 2458 44.486 44.128 0.358 1
1 356 . 19 1 1 A 35 35 GLY N N 2458 108.472 103.841 4.631 1
1 357 . 19 1 1 A 36 36 ALA H H 2459 8.430 8.289 0.141 1
1 358 . 19 1 1 A 36 36 ALA HA H 2459 4.472 4.927 -0.455 1
1 362 . 19 1 1 A 36 36 ALA C C 2459 176.968 177.104 -0.136 1
1 363 . 19 1 1 A 36 36 ALA CA C 2459 52.695 51.117 1.578 1
1 364 . 19 1 1 A 36 36 ALA CB C 2459 19.360 20.863 -1.503 1
1 365 . 19 1 1 A 36 36 ALA N N 2459 126.012 124.521 1.491 1
1 366 . 19 1 1 A 37 37 GLY H H 2460 7.781 8.536 -0.755 1
1 367 . 19 1 1 A 37 37 GLY HA2 H 2460 3.856 3.911 -0.055 1
1 368 . 19 1 1 A 37 37 GLY HA3 H 2460 3.164 4.045 -0.881 1
1 369 . 19 1 1 A 37 37 GLY C C 2460 170.730 171.992 -1.262 1
1 370 . 19 1 1 A 37 37 GLY CA C 2460 44.747 45.056 -0.309 1
1 371 . 19 1 1 A 37 37 GLY N N 2460 109.493 106.194 3.299 1
1 372 . 19 1 1 A 38 38 ALA H H 2461 8.055 7.936 0.119 1
1 373 . 19 1 1 A 38 38 ALA HA H 2461 4.389 4.599 -0.210 1
1 377 . 19 1 1 A 38 38 ALA C C 2461 176.609 176.353 0.256 1
1 378 . 19 1 1 A 38 38 ALA CA C 2461 51.419 51.656 -0.237 1
1 379 . 19 1 1 A 38 38 ALA CB C 2461 19.665 19.477 0.188 1
1 380 . 19 1 1 A 38 38 ALA N N 2461 121.997 122.867 -0.870 1
1 381 . 19 1 1 A 39 39 LEU H H 2462 8.597 8.548 0.049 1
1 382 . 19 1 1 A 39 39 LEU HA H 2462 5.022 5.233 -0.211 1
1 392 . 19 1 1 A 39 39 LEU C C 2462 175.883 174.738 1.145 1
1 393 . 19 1 1 A 39 39 LEU CA C 2462 53.907 53.228 0.679 1
1 394 . 19 1 1 A 39 39 LEU CB C 2462 44.576 45.569 -0.993 1
1 398 . 19 1 1 A 39 39 LEU N N 2462 126.664 123.777 2.887 1
1 399 . 19 1 1 A 40 40 SER H H 2463 8.898 9.006 -0.108 1
1 400 . 19 1 1 A 40 40 SER HA H 2463 4.732 4.869 -0.137 1
1 403 . 19 1 1 A 40 40 SER C C 2463 172.984 172.927 0.057 1
1 404 . 19 1 1 A 40 40 SER CA C 2463 56.730 56.951 -0.221 1
1 405 . 19 1 1 A 40 40 SER CB C 2463 64.648 64.456 0.192 1
1 406 . 19 1 1 A 40 40 SER N N 2463 122.932 120.378 2.554 1
1 407 . 19 1 1 A 41 41 VAL H H 2464 8.538 9.180 -0.642 1
1 408 . 19 1 1 A 41 41 VAL HA H 2464 5.131 4.810 0.321 1
1 416 . 19 1 1 A 41 41 VAL C C 2464 174.812 175.160 -0.348 1
1 417 . 19 1 1 A 41 41 VAL CA C 2464 60.784 61.400 -0.616 1
1 418 . 19 1 1 A 41 41 VAL CB C 2464 34.262 33.277 0.985 1
1 420 . 19 1 1 A 41 41 VAL N N 2464 129.161 127.243 1.918 1
1 421 . 19 1 1 A 42 42 THR H H 2465 8.807 9.256 -0.449 1
1 422 . 19 1 1 A 42 42 THR HA H 2465 4.573 5.097 -0.524 1
1 427 . 19 1 1 A 42 42 THR CA C 2465 60.408 61.609 -1.201 1
1 428 . 19 1 1 A 42 42 THR CB C 2465 71.764 70.620 1.144 1
1 430 . 19 1 1 A 42 42 THR N N 2465 120.898 124.139 -3.241 1
1 431 . 19 1 1 A 43 43 ILE H H 2466 8.648 9.020 -0.372 1
1 432 . 19 1 1 A 43 43 ILE HA H 2466 4.854 5.000 -0.146 1
1 442 . 19 1 1 A 43 43 ILE C C 2466 174.073 174.797 -0.724 1
1 443 . 19 1 1 A 43 43 ILE CA C 2466 61.184 60.249 0.935 1
1 444 . 19 1 1 A 43 43 ILE CB C 2466 39.516 40.515 -0.999 1
1 448 . 19 1 1 A 43 43 ILE N N 2466 124.810 126.355 -1.545 1
1 449 . 19 1 1 A 44 44 ASP H H 2467 8.821 8.746 0.075 1
1 450 . 19 1 1 A 44 44 ASP HA H 2467 5.217 5.401 -0.184 1
1 453 . 19 1 1 A 44 44 ASP C C 2467 175.002 175.694 -0.692 1
1 454 . 19 1 1 A 44 44 ASP CA C 2467 52.998 52.666 0.332 1
1 455 . 19 1 1 A 44 44 ASP CB C 2467 44.728 43.745 0.983 1
1 456 . 19 1 1 A 44 44 ASP N N 2467 129.093 126.566 2.527 1
1 457 . 19 1 1 A 45 45 GLY H H 2468 8.535 8.307 0.228 1
1 458 . 19 1 1 A 45 45 GLY HA2 H 2468 3.954 3.714 0.240 1
1 459 . 19 1 1 A 45 45 GLY HA3 H 2468 3.561 4.054 -0.493 1
1 460 . 19 1 1 A 45 45 GLY CA C 2468 45.659 44.901 0.758 1
1 461 . 19 1 1 A 45 45 GLY N N 2468 112.751 108.262 4.489 1
1 462 . 19 1 1 A 46 46 PRO HA H 2469 4.318 4.348 -0.030 1
1 469 . 19 1 1 A 46 46 PRO C C 2469 176.086 176.127 -0.041 1
1 470 . 19 1 1 A 46 46 PRO CA C 2469 64.198 63.812 0.386 1
1 471 . 19 1 1 A 46 46 PRO CB C 2469 32.348 31.875 0.473 1
1 474 . 19 1 1 A 47 47 SER H H 2470 7.106 7.591 -0.485 1
1 475 . 19 1 1 A 47 47 SER HA H 2470 4.632 4.814 -0.182 1
1 478 . 19 1 1 A 47 47 SER C C 2470 172.969 173.003 -0.034 1
1 479 . 19 1 1 A 47 47 SER CA C 2470 57.106 57.228 -0.122 1
1 480 . 19 1 1 A 47 47 SER CB C 2470 66.262 66.711 -0.449 1
1 481 . 19 1 1 A 47 47 SER N N 2470 110.556 113.514 -2.958 1
1 482 . 19 1 1 A 48 48 LYS H H 2471 8.534 8.309 0.225 1
1 483 . 19 1 1 A 48 48 LYS HA H 2471 4.486 4.657 -0.171 1
1 492 . 19 1 1 A 48 48 LYS C C 2471 177.231 175.860 1.371 1
1 493 . 19 1 1 A 48 48 LYS CA C 2471 56.620 56.088 0.532 1
1 494 . 19 1 1 A 48 48 LYS CB C 2471 32.379 33.852 -1.473 1
1 498 . 19 1 1 A 48 48 LYS N N 2471 124.055 121.645 2.410 1
1 499 . 19 1 1 A 49 49 VAL H H 2472 8.497 8.562 -0.065 1
1 500 . 19 1 1 A 49 49 VAL HA H 2472 4.552 4.827 -0.275 1
1 508 . 19 1 1 A 49 49 VAL C C 2472 175.292 174.315 0.977 1
1 509 . 19 1 1 A 49 49 VAL CA C 2472 60.142 58.928 1.214 1
1 510 . 19 1 1 A 49 49 VAL CB C 2472 33.464 35.767 -2.303 1
1 513 . 19 1 1 A 49 49 VAL N N 2472 121.233 117.879 3.354 1
1 514 . 19 1 1 A 50 50 LYS H H 2473 8.190 8.096 0.094 1
1 515 . 19 1 1 A 50 50 LYS HA H 2473 4.522 4.566 -0.044 1
1 518 . 19 1 1 A 50 50 LYS CA C 2473 55.952 55.573 0.379 1
1 519 . 19 1 1 A 50 50 LYS CB C 2473 32.896 32.011 0.885 1
1 520 . 19 1 1 A 50 50 LYS N N 2473 126.082 122.074 4.008 1
1 521 . 19 1 1 A 51 51 MET H H 2474 8.818 9.075 -0.257 1
1 522 . 19 1 1 A 51 51 MET HA H 2474 5.324 4.814 0.510 1
1 530 . 19 1 1 A 51 51 MET C C 2474 173.933 175.225 -1.292 1
1 531 . 19 1 1 A 51 51 MET CA C 2474 54.848 55.651 -0.803 1
1 532 . 19 1 1 A 51 51 MET CB C 2474 37.043 33.495 3.548 1
1 535 . 19 1 1 A 51 51 MET N N 2474 126.911 124.730 2.181 1
1 536 . 19 1 1 A 52 52 ASP H H 2475 9.095 8.989 0.106 1
1 537 . 19 1 1 A 52 52 ASP HA H 2475 4.947 5.051 -0.104 1
1 540 . 19 1 1 A 52 52 ASP C C 2475 173.923 174.180 -0.257 1
1 541 . 19 1 1 A 52 52 ASP CA C 2475 53.487 53.043 0.444 1
1 542 . 19 1 1 A 52 52 ASP CB C 2475 44.765 42.952 1.813 1
1 543 . 19 1 1 A 52 52 ASP N N 2475 125.526 125.373 0.153 1
1 544 . 19 1 1 A 53 53 CYS H H 2476 8.606 9.128 -0.522 1
1 545 . 19 1 1 A 53 53 CYS HA H 2476 5.145 5.310 -0.165 1
1 548 . 19 1 1 A 53 53 CYS C C 2476 173.330 174.083 -0.753 1
1 549 . 19 1 1 A 53 53 CYS CA C 2476 57.452 57.301 0.151 1
1 550 . 19 1 1 A 53 53 CYS CB C 2476 28.108 29.796 -1.688 1
1 551 . 19 1 1 A 53 53 CYS N N 2476 124.317 126.945 -2.628 1
1 552 . 19 1 1 A 54 54 GLN H H 2477 8.978 8.942 0.036 1
1 553 . 19 1 1 A 54 54 GLN HA H 2477 4.884 4.864 0.020 1
1 560 . 19 1 1 A 54 54 GLN C C 2477 174.854 175.417 -0.563 1
1 561 . 19 1 1 A 54 54 GLN CA C 2477 53.891 54.447 -0.556 1
1 562 . 19 1 1 A 54 54 GLN CB C 2477 32.837 33.070 -0.233 1
1 564 . 19 1 1 A 54 54 GLN N N 2477 127.074 125.637 1.437 1
1 566 . 19 1 1 A 55 55 GLU H H 2478 9.065 8.568 0.497 1
1 567 . 19 1 1 A 55 55 GLU HA H 2478 4.280 4.290 -0.010 1
1 572 . 19 1 1 A 55 55 GLU C C 2478 175.383 176.061 -0.678 1
1 573 . 19 1 1 A 55 55 GLU CA C 2478 57.516 56.356 1.160 1
1 574 . 19 1 1 A 55 55 GLU CB C 2478 30.346 30.218 0.128 1
1 576 . 19 1 1 A 55 55 GLU N N 2478 125.186 120.618 4.568 1
1 577 . 19 1 1 A 56 56 CYS H H 2479 8.407 8.548 -0.141 1
1 578 . 19 1 1 A 56 56 CYS HA H 2479 5.056 4.650 0.406 1
1 581 . 19 1 1 A 56 56 CYS CA C 2479 55.858 56.903 -1.045 1
1 582 . 19 1 1 A 56 56 CYS CB C 2479 28.676 30.056 -1.380 1
1 583 . 19 1 1 A 56 56 CYS N N 2479 121.499 117.298 4.201 1
1 584 . 19 1 1 A 57 57 PRO HA H 2480 4.159 4.389 -0.230 1
1 591 . 19 1 1 A 57 57 PRO C C 2480 177.964 177.527 0.437 1
1 592 . 19 1 1 A 57 57 PRO CA C 2480 66.877 64.472 2.405 1
1 593 . 19 1 1 A 57 57 PRO CB C 2480 31.709 31.905 -0.196 1
1 596 . 19 1 1 A 58 58 GLU H H 2481 8.900 8.248 0.652 1
1 597 . 19 1 1 A 58 58 GLU HA H 2481 4.201 4.512 -0.311 1
1 602 . 19 1 1 A 58 58 GLU C C 2481 175.129 176.439 -1.310 1
1 603 . 19 1 1 A 58 58 GLU CA C 2481 57.883 56.421 1.462 1
1 604 . 19 1 1 A 58 58 GLU CB C 2481 29.991 30.522 -0.531 1
1 606 . 19 1 1 A 58 58 GLU N N 2481 115.316 117.845 -2.529 1
1 607 . 19 1 1 A 59 59 GLY H H 2482 7.527 7.325 0.202 1
1 608 . 19 1 1 A 59 59 GLY HA2 H 2482 4.935 4.011 0.924 1
1 609 . 19 1 1 A 59 59 GLY HA3 H 2482 3.381 4.133 -0.752 1
1 610 . 19 1 1 A 59 59 GLY CA C 2482 47.809 45.069 2.740 1
1 611 . 19 1 1 A 59 59 GLY N N 2482 110.079 107.839 2.240 1
1 612 . 19 1 1 A 60 60 TYR H H 2483 8.990 8.493 0.497 1
1 613 . 19 1 1 A 60 60 TYR HA H 2483 5.157 5.320 -0.163 1
1 618 . 19 1 1 A 60 60 TYR C C 2483 175.096 174.577 0.519 1
1 619 . 19 1 1 A 60 60 TYR CA C 2483 57.375 56.729 0.646 1
1 620 . 19 1 1 A 60 60 TYR CB C 2483 43.153 41.187 1.966 1
1 622 . 19 1 1 A 60 60 TYR N N 2483 125.900 121.684 4.216 1
1 623 . 19 1 1 A 61 61 ARG H H 2484 9.557 8.681 0.876 1
1 624 . 19 1 1 A 61 61 ARG HA H 2484 4.858 4.614 0.244 1
1 631 . 19 1 1 A 61 61 ARG CA C 2484 55.016 55.924 -0.908 1
1 632 . 19 1 1 A 61 61 ARG CB C 2484 32.128 31.188 0.940 1
1 635 . 19 1 1 A 61 61 ARG N N 2484 124.847 125.360 -0.513 1
1 636 . 19 1 1 A 62 62 VAL H H 2485 9.046 8.903 0.143 1
1 637 . 19 1 1 A 62 62 VAL HA H 2485 4.675 4.608 0.067 1
1 645 . 19 1 1 A 62 62 VAL C C 2485 173.837 174.799 -0.962 1
1 646 . 19 1 1 A 62 62 VAL CA C 2485 60.752 60.956 -0.204 1
1 647 . 19 1 1 A 62 62 VAL CB C 2485 32.459 32.989 -0.530 1
1 650 . 19 1 1 A 62 62 VAL N N 2485 132.205 126.001 6.204 1
1 651 . 19 1 1 A 63 63 THR H H 2486 8.474 8.944 -0.470 1
1 652 . 19 1 1 A 63 63 THR HA H 2486 5.392 5.101 0.291 1
1 657 . 19 1 1 A 63 63 THR C C 2486 173.675 173.626 0.049 1
1 658 . 19 1 1 A 63 63 THR CA C 2486 60.008 62.206 -2.198 1
1 659 . 19 1 1 A 63 63 THR CB C 2486 71.035 71.028 0.007 1
1 661 . 19 1 1 A 63 63 THR N N 2486 121.216 122.616 -1.400 1
1 662 . 19 1 1 A 64 64 TYR H H 2487 9.409 8.990 0.419 1
1 663 . 19 1 1 A 64 64 TYR HA H 2487 5.617 5.417 0.200 1
1 670 . 19 1 1 A 64 64 TYR C C 2487 172.847 172.276 0.571 1
1 671 . 19 1 1 A 64 64 TYR CA C 2487 55.557 55.830 -0.273 1
1 672 . 19 1 1 A 64 64 TYR CB C 2487 41.968 41.176 0.792 1
1 675 . 19 1 1 A 64 64 TYR N N 2487 124.061 121.247 2.814 1
1 676 . 19 1 1 A 65 65 THR H H 2488 8.145 8.419 -0.274 1
1 677 . 19 1 1 A 65 65 THR HA H 2488 4.959 4.648 0.311 1
1 682 . 19 1 1 A 65 65 THR CA C 2488 58.532 58.990 -0.458 1
1 683 . 19 1 1 A 65 65 THR CB C 2488 70.141 70.067 0.074 1
1 685 . 19 1 1 A 65 65 THR N N 2488 117.924 116.773 1.151 1
1 686 . 19 1 1 A 66 66 PRO HA H 2489 4.602 4.529 0.073 1
1 693 . 19 1 1 A 66 66 PRO C C 2489 176.647 177.171 -0.524 1
1 694 . 19 1 1 A 66 66 PRO CA C 2489 61.442 62.311 -0.869 1
1 695 . 19 1 1 A 66 66 PRO CB C 2489 32.715 31.755 0.960 1
1 698 . 19 1 1 A 67 67 MET H H 2490 8.832 8.168 0.664 1
1 699 . 19 1 1 A 67 67 MET HA H 2490 4.880 4.468 0.412 1
1 707 . 19 1 1 A 67 67 MET C C 2490 174.121 175.803 -1.682 1
1 708 . 19 1 1 A 67 67 MET CA C 2490 53.848 55.813 -1.965 1
1 709 . 19 1 1 A 67 67 MET CB C 2490 33.727 32.823 0.904 1
1 712 . 19 1 1 A 67 67 MET N N 2490 119.212 120.571 -1.359 1
1 713 . 19 1 1 A 68 68 ALA H H 2491 7.086 7.850 -0.764 1
1 714 . 19 1 1 A 68 68 ALA HA H 2491 4.851 4.824 0.027 1
1 718 . 19 1 1 A 68 68 ALA CA C 2491 49.222 49.954 -0.732 1
1 719 . 19 1 1 A 68 68 ALA CB C 2491 20.600 21.837 -1.237 1
1 720 . 19 1 1 A 68 68 ALA N N 2491 120.363 120.388 -0.025 1
1 721 . 19 1 1 A 69 69 PRO HA H 2492 4.263 4.565 -0.302 1
1 728 . 19 1 1 A 69 69 PRO C C 2492 174.370 176.319 -1.949 1
1 729 . 19 1 1 A 69 69 PRO CA C 2492 62.555 63.516 -0.961 1
1 730 . 19 1 1 A 69 69 PRO CB C 2492 32.752 32.916 -0.164 1
1 733 . 19 1 1 A 70 70 GLY H H 2493 8.858 8.323 0.535 1
1 734 . 19 1 1 A 70 70 GLY HA2 H 2493 4.544 4.073 0.471 1
1 735 . 19 1 1 A 70 70 GLY HA3 H 2493 3.849 4.115 -0.266 1
1 736 . 19 1 1 A 70 70 GLY C C 2493 172.182 172.319 -0.137 1
1 737 . 19 1 1 A 70 70 GLY CA C 2493 44.356 44.421 -0.065 1
1 738 . 19 1 1 A 70 70 GLY N N 2493 106.539 109.802 -3.263 1
1 739 . 19 1 1 A 71 71 SER H H 2494 8.490 8.296 0.194 1
1 740 . 19 1 1 A 71 71 SER HA H 2494 5.280 5.325 -0.045 1
1 743 . 19 1 1 A 71 71 SER C C 2494 173.512 172.912 0.600 1
1 744 . 19 1 1 A 71 71 SER CA C 2494 57.674 57.611 0.063 1
1 745 . 19 1 1 A 71 71 SER CB C 2494 63.799 65.465 -1.666 1
1 746 . 19 1 1 A 71 71 SER N N 2494 117.964 117.383 0.581 1
1 747 . 19 1 1 A 72 72 TYR H H 2495 9.320 9.281 0.039 1
1 748 . 19 1 1 A 72 72 TYR HA H 2495 4.960 5.390 -0.430 1
1 755 . 19 1 1 A 72 72 TYR C C 2495 173.979 174.810 -0.831 1
1 756 . 19 1 1 A 72 72 TYR CA C 2495 56.384 57.059 -0.675 1
1 757 . 19 1 1 A 72 72 TYR CB C 2495 40.247 40.070 0.177 1
1 760 . 19 1 1 A 72 72 TYR N N 2495 126.442 125.466 0.976 1
1 761 . 19 1 1 A 73 73 LEU H H 2496 9.019 9.033 -0.014 1
1 762 . 19 1 1 A 73 73 LEU HA H 2496 5.209 4.961 0.248 1
1 772 . 19 1 1 A 73 73 LEU C C 2496 177.015 174.674 2.341 1
1 773 . 19 1 1 A 73 73 LEU CA C 2496 53.393 54.081 -0.688 1
1 774 . 19 1 1 A 73 73 LEU CB C 2496 43.918 43.883 0.035 1
1 778 . 19 1 1 A 73 73 LEU N N 2496 125.439 125.945 -0.506 1
1 779 . 19 1 1 A 74 74 ILE H H 2497 9.921 9.666 0.255 1
1 780 . 19 1 1 A 74 74 ILE HA H 2497 5.128 4.693 0.435 1
1 790 . 19 1 1 A 74 74 ILE C C 2497 175.730 174.638 1.092 1
1 791 . 19 1 1 A 74 74 ILE CA C 2497 60.930 60.376 0.554 1
1 792 . 19 1 1 A 74 74 ILE CB C 2497 39.488 37.817 1.671 1
1 796 . 19 1 1 A 74 74 ILE N N 2497 132.185 129.669 2.516 1
1 797 . 19 1 1 A 75 75 SER H H 2498 9.284 9.161 0.123 1
1 798 . 19 1 1 A 75 75 SER HA H 2498 5.111 5.141 -0.030 1
1 801 . 19 1 1 A 75 75 SER C C 2498 173.449 173.886 -0.437 1
1 802 . 19 1 1 A 75 75 SER CA C 2498 58.260 58.218 0.042 1
1 803 . 19 1 1 A 75 75 SER CB C 2498 63.956 63.922 0.034 1
1 804 . 19 1 1 A 75 75 SER N N 2498 125.384 124.417 0.967 1
1 805 . 19 1 1 A 76 76 ILE H H 2499 9.861 9.514 0.347 1
1 806 . 19 1 1 A 76 76 ILE HA H 2499 4.814 4.719 0.095 1
1 816 . 19 1 1 A 76 76 ILE CA C 2499 61.034 60.715 0.319 1
1 817 . 19 1 1 A 76 76 ILE CB C 2499 40.387 38.315 2.072 1
1 821 . 19 1 1 A 76 76 ILE N N 2499 129.414 127.937 1.477 1
1 822 . 19 1 1 A 77 77 LYS H H 2500 8.827 8.941 -0.114 1
1 823 . 19 1 1 A 77 77 LYS HA H 2500 5.254 5.133 0.121 1
1 832 . 19 1 1 A 77 77 LYS C C 2500 175.245 175.300 -0.055 1
1 833 . 19 1 1 A 77 77 LYS CA C 2500 54.388 54.845 -0.457 1
1 834 . 19 1 1 A 77 77 LYS CB C 2500 36.127 35.370 0.757 1
1 838 . 19 1 1 A 77 77 LYS N N 2500 126.922 127.310 -0.388 1
1 839 . 19 1 1 A 78 78 TYR H H 2501 8.408 8.734 -0.326 1
1 840 . 19 1 1 A 78 78 TYR HA H 2501 5.479 5.069 0.410 1
1 847 . 19 1 1 A 78 78 TYR C C 2501 174.792 175.653 -0.861 1
1 848 . 19 1 1 A 78 78 TYR CA C 2501 56.837 57.319 -0.482 1
1 849 . 19 1 1 A 78 78 TYR CB C 2501 44.008 41.958 2.050 1
1 852 . 19 1 1 A 78 78 TYR N N 2501 122.282 124.340 -2.058 1
1 853 . 19 1 1 A 79 79 GLY H H 2502 8.196 8.694 -0.498 1
1 854 . 19 1 1 A 79 79 GLY HA2 H 2502 4.040 3.663 0.377 1
1 855 . 19 1 1 A 79 79 GLY HA3 H 2502 3.465 3.824 -0.359 1
1 856 . 19 1 1 A 79 79 GLY C C 2502 173.932 173.493 0.439 1
1 857 . 19 1 1 A 79 79 GLY CA C 2502 45.741 45.841 -0.100 1
1 858 . 19 1 1 A 79 79 GLY N N 2502 113.451 114.324 -0.873 1
1 859 . 19 1 1 A 80 80 GLY H H 2503 7.589 7.841 -0.252 1
1 860 . 19 1 1 A 80 80 GLY HA2 H 2503 4.490 4.029 0.461 1
1 861 . 19 1 1 A 80 80 GLY HA3 H 2503 3.555 4.098 -0.543 1
1 862 . 19 1 1 A 80 80 GLY CA C 2503 43.540 44.715 -1.175 1
1 863 . 19 1 1 A 80 80 GLY N N 2503 107.293 107.457 -0.164 1
1 864 . 19 1 1 A 81 81 PRO HA H 2504 4.320 4.349 -0.029 1
1 871 . 19 1 1 A 81 81 PRO C C 2504 175.311 175.467 -0.156 1
1 872 . 19 1 1 A 81 81 PRO CA C 2504 62.722 63.476 -0.754 1
1 873 . 19 1 1 A 81 81 PRO CB C 2504 29.297 31.915 -2.618 1
1 876 . 19 1 1 A 82 82 TYR H H 2505 7.778 7.294 0.484 1
1 877 . 19 1 1 A 82 82 TYR HA H 2505 4.791 4.882 -0.091 1
1 884 . 19 1 1 A 82 82 TYR C C 2505 175.086 175.899 -0.813 1
1 885 . 19 1 1 A 82 82 TYR CA C 2505 56.111 57.403 -1.292 1
1 886 . 19 1 1 A 82 82 TYR CB C 2505 39.483 40.265 -0.782 1
1 889 . 19 1 1 A 82 82 TYR N N 2505 123.973 120.231 3.742 1
1 890 . 19 1 1 A 83 83 HIS H H 2506 8.625 9.024 -0.399 1
1 891 . 19 1 1 A 83 83 HIS HA H 2506 4.583 4.935 -0.352 1
1 896 . 19 1 1 A 83 83 HIS C C 2506 178.161 175.950 2.211 1
1 897 . 19 1 1 A 83 83 HIS CA C 2506 58.241 56.718 1.523 1
1 898 . 19 1 1 A 83 83 HIS CB C 2506 33.132 30.564 2.568 1
1 901 . 19 1 1 A 83 83 HIS N N 2506 124.092 121.216 2.876 1
1 902 . 19 1 1 A 84 84 ILE H H 2507 8.327 8.716 -0.389 1
1 903 . 19 1 1 A 84 84 ILE HA H 2507 4.553 4.256 0.297 1
1 913 . 19 1 1 A 84 84 ILE C C 2507 176.523 176.323 0.200 1
1 914 . 19 1 1 A 84 84 ILE CA C 2507 60.791 60.153 0.638 1
1 915 . 19 1 1 A 84 84 ILE CB C 2507 39.162 39.518 -0.356 1
1 919 . 19 1 1 A 84 84 ILE N N 2507 117.355 119.628 -2.273 1
1 920 . 19 1 1 A 85 85 GLY H H 2508 9.130 8.646 0.484 1
1 921 . 19 1 1 A 85 85 GLY HA2 H 2508 3.883 3.705 0.178 1
1 922 . 19 1 1 A 85 85 GLY HA3 H 2508 3.800 3.725 0.075 1
1 923 . 19 1 1 A 85 85 GLY C C 2508 174.438 175.415 -0.977 1
1 924 . 19 1 1 A 85 85 GLY CA C 2508 47.673 46.722 0.951 1
1 925 . 19 1 1 A 85 85 GLY N N 2508 111.346 110.022 1.324 1
1 926 . 19 1 1 A 86 86 GLY H H 2509 8.236 8.126 0.110 1
1 927 . 19 1 1 A 86 86 GLY HA2 H 2509 3.893 3.931 -0.038 1
1 928 . 19 1 1 A 86 86 GLY HA3 H 2509 3.161 3.975 -0.814 1
1 929 . 19 1 1 A 86 86 GLY C C 2509 171.837 172.951 -1.114 1
1 930 . 19 1 1 A 86 86 GLY CA C 2509 44.844 45.414 -0.570 1
1 931 . 19 1 1 A 86 86 GLY N N 2509 115.594 118.485 -2.891 1
1 932 . 19 1 1 A 87 87 SER H H 2510 7.385 7.650 -0.265 1
1 933 . 19 1 1 A 87 87 SER HA H 2510 4.217 3.924 0.293 1
1 936 . 19 1 1 A 87 87 SER CA C 2510 54.783 55.063 -0.280 1
1 937 . 19 1 1 A 87 87 SER CB C 2510 62.683 64.175 -1.492 1
1 938 . 19 1 1 A 87 87 SER N N 2510 112.859 116.689 -3.830 1
1 939 . 19 1 1 A 88 88 PRO HA H 2511 5.532 4.710 0.822 1
1 946 . 19 1 1 A 88 88 PRO C C 2511 175.870 175.359 0.511 1
1 947 . 19 1 1 A 88 88 PRO CA C 2511 62.379 62.266 0.113 1
1 948 . 19 1 1 A 88 88 PRO CB C 2511 33.639 32.195 1.444 1
1 951 . 19 1 1 A 89 89 PHE H H 2512 9.359 8.786 0.573 1
1 952 . 19 1 1 A 89 89 PHE HA H 2512 4.467 4.752 -0.285 1
1 960 . 19 1 1 A 89 89 PHE C C 2512 175.152 174.822 0.330 1
1 961 . 19 1 1 A 89 89 PHE CA C 2512 57.401 57.373 0.028 1
1 962 . 19 1 1 A 89 89 PHE CB C 2512 40.843 41.001 -0.158 1
1 966 . 19 1 1 A 89 89 PHE N N 2512 124.789 119.513 5.276 1
1 967 . 19 1 1 A 90 90 LYS H H 2513 8.772 8.859 -0.087 1
1 968 . 19 1 1 A 90 90 LYS HA H 2513 4.941 4.842 0.099 1
1 973 . 19 1 1 A 90 90 LYS C C 2513 174.183 175.443 -1.260 1
1 974 . 19 1 1 A 90 90 LYS CA C 2513 55.749 55.560 0.189 1
1 975 . 19 1 1 A 90 90 LYS CB C 2513 32.817 33.075 -0.258 1
1 978 . 19 1 1 A 90 90 LYS N N 2513 125.133 121.720 3.413 1
1 979 . 19 1 1 A 91 91 ALA H H 2514 9.158 9.201 -0.043 1
1 980 . 19 1 1 A 91 91 ALA HA H 2514 4.510 5.065 -0.555 1
1 984 . 19 1 1 A 91 91 ALA C C 2514 176.561 176.512 0.049 1
1 985 . 19 1 1 A 91 91 ALA CA C 2514 50.528 51.127 -0.599 1
1 986 . 19 1 1 A 91 91 ALA CB C 2514 20.653 20.234 0.419 1
1 987 . 19 1 1 A 91 91 ALA N N 2514 131.989 128.657 3.332 1
1 988 . 19 1 1 A 92 92 LYS H H 2515 8.186 8.890 -0.704 1
1 989 . 19 1 1 A 92 92 LYS HA H 2515 4.926 4.894 0.032 1
1 998 . 19 1 1 A 92 92 LYS C C 2515 175.177 176.198 -1.021 1
1 999 . 19 1 1 A 92 92 LYS CA C 2515 55.725 55.618 0.107 1
1 1000 . 19 1 1 A 92 92 LYS CB C 2515 33.765 34.294 -0.529 1
1 1004 . 19 1 1 A 92 92 LYS N N 2515 124.887 123.400 1.487 1
1 1005 . 19 1 1 A 93 93 VAL H H 2516 9.362 9.298 0.064 1
1 1006 . 19 1 1 A 93 93 VAL HA H 2516 5.161 5.223 -0.062 1
1 1014 . 19 1 1 A 93 93 VAL C C 2516 176.988 174.571 2.417 1
1 1015 . 19 1 1 A 93 93 VAL CA C 2516 60.523 59.823 0.700 1
1 1016 . 19 1 1 A 93 93 VAL CB C 2516 33.291 35.798 -2.507 1
1 1019 . 19 1 1 A 93 93 VAL N N 2516 129.943 117.927 12.016 1
1 1020 . 19 1 1 A 94 94 THR H H 2517 8.614 8.603 0.011 1
1 1021 . 19 1 1 A 94 94 THR HA H 2517 4.902 4.938 -0.036 1
1 1026 . 19 1 1 A 94 94 THR C C 2517 172.759 173.119 -0.360 1
1 1027 . 19 1 1 A 94 94 THR CA C 2517 60.121 60.040 0.081 1
1 1028 . 19 1 1 A 94 94 THR CB C 2517 71.072 71.608 -0.536 1
1 1030 . 19 1 1 A 94 94 THR N N 2517 122.032 113.232 8.800 1
1 1031 . 19 1 1 A 95 95 GLY H H 2518 8.280 8.477 -0.197 1
1 1032 . 19 1 1 A 95 95 GLY HA2 H 2518 3.852 4.155 -0.303 1
1 1033 . 19 1 1 A 95 95 GLY HA3 H 2518 4.846 4.159 0.687 1
1 1034 . 19 1 1 A 95 95 GLY CA C 2518 43.955 44.363 -0.408 1
1 1035 . 19 1 1 A 95 95 GLY N N 2518 107.949 107.426 0.523 1
1 1036 . 19 1 1 A 96 96 PRO HA H 2519 4.449 4.752 -0.303 1
1 1043 . 19 1 1 A 96 96 PRO C C 2519 176.892 177.530 -0.638 1
1 1044 . 19 1 1 A 96 96 PRO CA C 2519 62.062 62.686 -0.624 1
1 1045 . 19 1 1 A 96 96 PRO CB C 2519 32.286 32.140 0.146 1
1 1048 . 19 1 1 A 97 97 ARG H H 2520 8.651 8.961 -0.310 1
1 1049 . 19 1 1 A 97 97 ARG HA H 2520 4.348 3.948 0.400 1
1 1056 . 19 1 1 A 97 97 ARG C C 2520 176.236 176.349 -0.113 1
1 1057 . 19 1 1 A 97 97 ARG CA C 2520 57.587 59.346 -1.759 1
1 1058 . 19 1 1 A 97 97 ARG CB C 2520 30.472 29.536 0.936 1
1 1061 . 19 1 1 A 97 97 ARG N N 2520 120.781 124.652 -3.871 1
1 1062 . 19 1 1 A 98 98 LEU H H 2521 8.545 7.920 0.625 1
1 1063 . 19 1 1 A 98 98 LEU HA H 2521 4.577 3.952 0.625 1
1 1073 . 19 1 1 A 98 98 LEU C C 2521 175.880 176.498 -0.618 1
1 1074 . 19 1 1 A 98 98 LEU CA C 2521 55.068 57.370 -2.302 1
1 1075 . 19 1 1 A 98 98 LEU CB C 2521 43.082 39.804 3.278 1
1 1079 . 19 1 1 A 98 98 LEU N N 2521 128.715 119.734 8.981 1
1 4 . 20 1 1 A 2 2 ALA HA H -2 4.374 4.388 -0.014 1
1 8 . 20 1 1 A 2 2 ALA C C -2 177.865 177.530 0.335 1
1 9 . 20 1 1 A 2 2 ALA CA C -2 52.670 52.275 0.395 1
1 10 . 20 1 1 A 2 2 ALA CB C -2 19.508 19.382 0.126 1
1 32 . 20 1 1 A 5 5 ASP H H 2428 8.300 8.522 -0.222 1
1 33 . 20 1 1 A 5 5 ASP HA H 2428 5.082 5.264 -0.182 1
1 36 . 20 1 1 A 5 5 ASP CA C 2428 51.517 50.759 0.758 1
1 37 . 20 1 1 A 5 5 ASP CB C 2428 42.244 42.798 -0.554 1
1 38 . 20 1 1 A 5 5 ASP N N 2428 122.879 120.574 2.305 1
1 39 . 20 1 1 A 6 6 PRO HA H 2429 4.340 4.446 -0.106 1
1 46 . 20 1 1 A 6 6 PRO C C 2429 178.266 178.371 -0.105 1
1 47 . 20 1 1 A 6 6 PRO CA C 2429 64.494 64.569 -0.075 1
1 48 . 20 1 1 A 6 6 PRO CB C 2429 31.841 32.013 -0.172 1
1 51 . 20 1 1 A 7 7 GLY H H 2430 8.686 8.484 0.202 1
1 52 . 20 1 1 A 7 7 GLY HA2 H 2430 4.116 3.804 0.312 1
1 53 . 20 1 1 A 7 7 GLY HA3 H 2430 3.868 3.809 0.059 1
1 54 . 20 1 1 A 7 7 GLY C C 2430 174.567 175.781 -1.214 1
1 55 . 20 1 1 A 7 7 GLY CA C 2430 46.038 46.634 -0.596 1
1 56 . 20 1 1 A 7 7 GLY N N 2430 107.655 106.584 1.071 1
1 57 . 20 1 1 A 8 8 LEU H H 2431 7.692 7.474 0.218 1
1 58 . 20 1 1 A 8 8 LEU HA H 2431 4.507 4.397 0.110 1
1 68 . 20 1 1 A 8 8 LEU C C 2431 176.876 177.610 -0.734 1
1 69 . 20 1 1 A 8 8 LEU CA C 2431 54.307 57.075 -2.768 1
1 70 . 20 1 1 A 8 8 LEU CB C 2431 42.879 42.946 -0.067 1
1 74 . 20 1 1 A 8 8 LEU N N 2431 120.022 120.195 -0.173 1
1 75 . 20 1 1 A 9 9 VAL H H 2432 7.378 7.534 -0.156 1
1 76 . 20 1 1 A 9 9 VAL HA H 2432 4.154 3.863 0.291 1
1 84 . 20 1 1 A 9 9 VAL C C 2432 174.703 175.473 -0.770 1
1 85 . 20 1 1 A 9 9 VAL CA C 2432 62.387 63.496 -1.109 1
1 86 . 20 1 1 A 9 9 VAL CB C 2432 32.519 31.461 1.058 1
1 89 . 20 1 1 A 9 9 VAL N N 2432 123.902 119.367 4.535 1
1 90 . 20 1 1 A 10 10 SER H H 2433 8.201 8.518 -0.317 1
1 91 . 20 1 1 A 10 10 SER HA H 2433 5.136 5.115 0.021 1
1 94 . 20 1 1 A 10 10 SER CA C 2433 56.554 55.653 0.901 1
1 95 . 20 1 1 A 10 10 SER CB C 2433 66.763 65.560 1.203 1
1 96 . 20 1 1 A 10 10 SER N N 2433 121.921 122.045 -0.124 1
1 97 . 20 1 1 A 11 11 ALA H H 2434 8.670 8.279 0.391 1
1 98 . 20 1 1 A 11 11 ALA HA H 2434 5.632 5.272 0.360 1
1 102 . 20 1 1 A 11 11 ALA C C 2434 175.459 174.567 0.892 1
1 103 . 20 1 1 A 11 11 ALA CA C 2434 50.575 50.498 0.077 1
1 104 . 20 1 1 A 11 11 ALA CB C 2434 23.111 23.498 -0.387 1
1 105 . 20 1 1 A 11 11 ALA N N 2434 124.828 123.482 1.346 1
1 106 . 20 1 1 A 12 12 TYR H H 2435 8.609 8.621 -0.012 1
1 107 . 20 1 1 A 12 12 TYR HA H 2435 4.879 5.097 -0.218 1
1 114 . 20 1 1 A 12 12 TYR C C 2435 173.645 174.651 -1.006 1
1 115 . 20 1 1 A 12 12 TYR CA C 2435 56.268 56.761 -0.493 1
1 116 . 20 1 1 A 12 12 TYR CB C 2435 39.522 42.408 -2.886 1
1 119 . 20 1 1 A 12 12 TYR N N 2435 118.305 119.049 -0.744 1
1 120 . 20 1 1 A 13 13 GLY H H 2436 8.655 8.550 0.105 1
1 121 . 20 1 1 A 13 13 GLY HA2 H 2436 4.943 4.300 0.643 1
1 122 . 20 1 1 A 13 13 GLY HA3 H 2436 4.028 4.343 -0.315 1
1 123 . 20 1 1 A 13 13 GLY C C 2436 175.334 174.919 0.415 1
1 124 . 20 1 1 A 13 13 GLY CA C 2436 44.389 44.375 0.014 1
1 125 . 20 1 1 A 13 13 GLY N N 2436 110.710 110.472 0.238 1
1 126 . 20 1 1 A 14 14 ALA H H 2437 8.939 8.724 0.215 1
1 127 . 20 1 1 A 14 14 ALA HA H 2437 4.276 4.093 0.183 1
1 131 . 20 1 1 A 14 14 ALA C C 2437 180.524 179.155 1.369 1
1 132 . 20 1 1 A 14 14 ALA CA C 2437 55.551 55.071 0.480 1
1 133 . 20 1 1 A 14 14 ALA CB C 2437 18.411 18.376 0.035 1
1 134 . 20 1 1 A 14 14 ALA N N 2437 126.973 123.896 3.077 1
1 135 . 20 1 1 A 15 15 GLY H H 2438 8.933 8.801 0.132 1
1 136 . 20 1 1 A 15 15 GLY HA2 H 2438 4.531 3.965 0.566 1
1 137 . 20 1 1 A 15 15 GLY HA3 H 2438 3.576 4.221 -0.645 1
1 138 . 20 1 1 A 15 15 GLY C C 2438 174.323 175.343 -1.020 1
1 139 . 20 1 1 A 15 15 GLY CA C 2438 46.855 46.871 -0.016 1
1 140 . 20 1 1 A 15 15 GLY N N 2438 104.803 105.653 -0.850 1
1 141 . 20 1 1 A 16 16 LEU H H 2439 7.529 7.657 -0.128 1
1 142 . 20 1 1 A 16 16 LEU HA H 2439 3.768 3.828 -0.060 1
1 152 . 20 1 1 A 16 16 LEU C C 2439 176.388 178.317 -1.929 1
1 153 . 20 1 1 A 16 16 LEU CA C 2439 56.137 57.075 -0.938 1
1 154 . 20 1 1 A 16 16 LEU CB C 2439 41.621 41.248 0.373 1
1 158 . 20 1 1 A 16 16 LEU N N 2439 119.633 121.786 -2.153 1
1 159 . 20 1 1 A 17 17 GLU H H 2440 7.505 8.009 -0.504 1
1 160 . 20 1 1 A 17 17 GLU HA H 2440 4.663 4.438 0.225 1
1 165 . 20 1 1 A 17 17 GLU C C 2440 178.126 177.311 0.815 1
1 166 . 20 1 1 A 17 17 GLU CA C 2440 56.447 56.451 -0.004 1
1 167 . 20 1 1 A 17 17 GLU CB C 2440 31.485 30.797 0.688 1
1 169 . 20 1 1 A 17 17 GLU N N 2440 114.368 116.087 -1.719 1
1 170 . 20 1 1 A 18 18 GLY H H 2441 7.921 7.485 0.436 1
1 171 . 20 1 1 A 18 18 GLY HA2 H 2441 4.889 4.091 0.798 1
1 172 . 20 1 1 A 18 18 GLY HA3 H 2441 3.707 4.102 -0.395 1
1 173 . 20 1 1 A 18 18 GLY C C 2441 170.965 172.418 -1.453 1
1 174 . 20 1 1 A 18 18 GLY CA C 2441 45.549 44.078 1.471 1
1 175 . 20 1 1 A 18 18 GLY N N 2441 109.165 106.967 2.198 1
1 176 . 20 1 1 A 19 19 GLY H H 2442 7.540 8.246 -0.706 1
1 177 . 20 1 1 A 19 19 GLY HA2 H 2442 4.086 4.216 -0.130 1
1 178 . 20 1 1 A 19 19 GLY HA3 H 2442 4.086 4.245 -0.159 1
1 179 . 20 1 1 A 19 19 GLY C C 2442 171.051 171.517 -0.466 1
1 180 . 20 1 1 A 19 19 GLY CA C 2442 44.937 45.905 -0.968 1
1 181 . 20 1 1 A 19 19 GLY N N 2442 105.460 107.620 -2.160 1
1 182 . 20 1 1 A 20 20 VAL H H 2443 8.899 8.327 0.572 1
1 183 . 20 1 1 A 20 20 VAL HA H 2443 5.062 4.576 0.486 1
1 191 . 20 1 1 A 20 20 VAL C C 2443 176.623 175.679 0.944 1
1 192 . 20 1 1 A 20 20 VAL CA C 2443 60.197 62.357 -2.160 1
1 193 . 20 1 1 A 20 20 VAL CB C 2443 35.107 32.192 2.915 1
1 196 . 20 1 1 A 20 20 VAL N N 2443 122.753 121.607 1.146 1
1 197 . 20 1 1 A 21 21 THR H H 2444 8.630 8.433 0.197 1
1 198 . 20 1 1 A 21 21 THR HA H 2444 3.773 4.182 -0.409 1
1 203 . 20 1 1 A 21 21 THR C C 2444 175.646 174.935 0.711 1
1 204 . 20 1 1 A 21 21 THR CA C 2444 62.732 62.556 0.176 1
1 205 . 20 1 1 A 21 21 THR CB C 2444 68.925 68.684 0.241 1
1 207 . 20 1 1 A 21 21 THR N N 2444 118.179 119.250 -1.071 1
1 208 . 20 1 1 A 22 22 GLY H H 2445 8.736 8.920 -0.184 1
1 209 . 20 1 1 A 22 22 GLY HA2 H 2445 3.412 3.970 -0.558 1
1 210 . 20 1 1 A 22 22 GLY HA3 H 2445 4.061 3.971 0.090 1
1 211 . 20 1 1 A 22 22 GLY C C 2445 172.973 173.311 -0.338 1
1 212 . 20 1 1 A 22 22 GLY CA C 2445 45.577 45.294 0.283 1
1 213 . 20 1 1 A 22 22 GLY N N 2445 107.888 113.533 -5.645 1
1 214 . 20 1 1 A 23 23 ASN H H 2446 7.877 7.537 0.340 1
1 215 . 20 1 1 A 23 23 ASN HA H 2446 5.253 5.061 0.192 1
1 220 . 20 1 1 A 23 23 ASN CA C 2446 49.740 50.353 -0.613 1
1 221 . 20 1 1 A 23 23 ASN CB C 2446 40.198 39.926 0.272 1
1 222 . 20 1 1 A 23 23 ASN N N 2446 120.684 120.692 -0.008 1
1 224 . 20 1 1 A 24 24 PRO HA H 2447 4.525 4.679 -0.154 1
1 231 . 20 1 1 A 24 24 PRO CA C 2447 62.766 62.224 0.542 1
1 232 . 20 1 1 A 24 24 PRO CB C 2447 31.732 32.445 -0.713 1
1 235 . 20 1 1 A 25 25 ALA H H 2448 9.178 8.216 0.962 1
1 236 . 20 1 1 A 25 25 ALA HA H 2448 4.614 4.922 -0.308 1
1 240 . 20 1 1 A 25 25 ALA C C 2448 175.503 175.558 -0.055 1
1 241 . 20 1 1 A 25 25 ALA CA C 2448 50.526 50.548 -0.022 1
1 242 . 20 1 1 A 25 25 ALA CB C 2448 20.458 22.634 -2.176 1
1 243 . 20 1 1 A 25 25 ALA N N 2448 132.079 122.418 9.661 1
1 244 . 20 1 1 A 26 26 GLU H H 2449 8.813 8.934 -0.121 1
1 245 . 20 1 1 A 26 26 GLU HA H 2449 5.830 5.302 0.528 1
1 250 . 20 1 1 A 26 26 GLU C C 2449 176.272 174.849 1.423 1
1 251 . 20 1 1 A 26 26 GLU CA C 2449 54.376 54.451 -0.075 1
1 252 . 20 1 1 A 26 26 GLU CB C 2449 35.463 34.063 1.400 1
1 254 . 20 1 1 A 26 26 GLU N N 2449 120.079 118.758 1.321 1
1 255 . 20 1 1 A 27 27 PHE H H 2450 8.782 8.839 -0.057 1
1 256 . 20 1 1 A 27 27 PHE HA H 2450 5.021 5.171 -0.150 1
1 264 . 20 1 1 A 27 27 PHE C C 2450 171.205 171.965 -0.760 1
1 265 . 20 1 1 A 27 27 PHE CA C 2450 56.852 56.333 0.519 1
1 266 . 20 1 1 A 27 27 PHE CB C 2450 41.080 41.310 -0.230 1
1 270 . 20 1 1 A 27 27 PHE N N 2450 118.670 116.740 1.930 1
1 271 . 20 1 1 A 28 28 VAL H H 2451 8.961 9.245 -0.284 1
1 272 . 20 1 1 A 28 28 VAL HA H 2451 4.761 5.048 -0.287 1
1 280 . 20 1 1 A 28 28 VAL C C 2451 174.673 173.796 0.877 1
1 281 . 20 1 1 A 28 28 VAL CA C 2451 60.619 59.448 1.171 1
1 282 . 20 1 1 A 28 28 VAL CB C 2451 35.484 34.516 0.968 1
1 285 . 20 1 1 A 28 28 VAL N N 2451 121.552 120.108 1.444 1
1 286 . 20 1 1 A 29 29 VAL H H 2452 9.294 9.433 -0.139 1
1 287 . 20 1 1 A 29 29 VAL HA H 2452 4.363 4.477 -0.114 1
1 295 . 20 1 1 A 29 29 VAL C C 2452 174.218 174.760 -0.542 1
1 296 . 20 1 1 A 29 29 VAL CA C 2452 61.526 62.065 -0.539 1
1 297 . 20 1 1 A 29 29 VAL CB C 2452 32.666 31.337 1.329 1
1 300 . 20 1 1 A 29 29 VAL N N 2452 125.585 128.310 -2.725 1
1 301 . 20 1 1 A 30 30 ASN H H 2453 9.465 9.095 0.370 1
1 302 . 20 1 1 A 30 30 ASN HA H 2453 5.096 5.142 -0.046 1
1 307 . 20 1 1 A 30 30 ASN C C 2453 176.216 176.365 -0.149 1
1 308 . 20 1 1 A 30 30 ASN CA C 2453 52.011 52.570 -0.559 1
1 309 . 20 1 1 A 30 30 ASN CB C 2453 39.057 38.782 0.275 1
1 310 . 20 1 1 A 30 30 ASN N N 2453 127.724 127.062 0.662 1
1 312 . 20 1 1 A 31 31 THR H H 2454 8.915 8.578 0.337 1
1 313 . 20 1 1 A 31 31 THR HA H 2454 4.342 4.416 -0.074 1
1 318 . 20 1 1 A 31 31 THR C C 2454 176.816 176.551 0.265 1
1 319 . 20 1 1 A 31 31 THR CA C 2454 61.117 62.531 -1.414 1
1 320 . 20 1 1 A 31 31 THR CB C 2454 68.209 69.411 -1.202 1
1 322 . 20 1 1 A 31 31 THR N N 2454 117.783 117.239 0.544 1
1 323 . 20 1 1 A 32 32 SER H H 2455 8.454 7.931 0.523 1
1 324 . 20 1 1 A 32 32 SER HA H 2455 4.155 4.244 -0.089 1
1 327 . 20 1 1 A 32 32 SER C C 2455 175.458 176.135 -0.677 1
1 328 . 20 1 1 A 32 32 SER CA C 2455 62.148 62.376 -0.228 1
1 329 . 20 1 1 A 32 32 SER CB C 2455 63.476 63.035 0.441 1
1 330 . 20 1 1 A 32 32 SER N N 2455 121.781 119.080 2.701 1
1 331 . 20 1 1 A 33 33 ASN H H 2456 8.845 8.306 0.539 1
1 332 . 20 1 1 A 33 33 ASN HA H 2456 5.064 4.602 0.462 1
1 337 . 20 1 1 A 33 33 ASN C C 2456 174.674 176.119 -1.445 1
1 338 . 20 1 1 A 33 33 ASN CA C 2456 53.067 55.112 -2.045 1
1 339 . 20 1 1 A 33 33 ASN CB C 2456 39.632 38.897 0.735 1
1 340 . 20 1 1 A 33 33 ASN N N 2456 120.176 119.738 0.438 1
1 342 . 20 1 1 A 34 34 ALA H H 2457 7.714 8.103 -0.389 1
1 343 . 20 1 1 A 34 34 ALA HA H 2457 4.482 4.537 -0.055 1
1 347 . 20 1 1 A 34 34 ALA C C 2457 177.582 177.816 -0.234 1
1 348 . 20 1 1 A 34 34 ALA CA C 2457 52.521 53.086 -0.565 1
1 349 . 20 1 1 A 34 34 ALA CB C 2457 22.252 21.332 0.920 1
1 350 . 20 1 1 A 34 34 ALA N N 2457 123.065 119.447 3.618 1
1 351 . 20 1 1 A 35 35 GLY H H 2458 8.195 7.674 0.521 1
1 352 . 20 1 1 A 35 35 GLY HA2 H 2458 4.246 4.127 0.119 1
1 353 . 20 1 1 A 35 35 GLY HA3 H 2458 3.902 4.140 -0.238 1
1 354 . 20 1 1 A 35 35 GLY C C 2458 173.360 172.994 0.366 1
1 355 . 20 1 1 A 35 35 GLY CA C 2458 44.486 43.803 0.683 1
1 356 . 20 1 1 A 35 35 GLY N N 2458 108.472 103.764 4.708 1
1 357 . 20 1 1 A 36 36 ALA H H 2459 8.430 8.145 0.285 1
1 358 . 20 1 1 A 36 36 ALA HA H 2459 4.472 4.860 -0.388 1
1 362 . 20 1 1 A 36 36 ALA C C 2459 176.968 177.561 -0.593 1
1 363 . 20 1 1 A 36 36 ALA CA C 2459 52.695 51.704 0.991 1
1 364 . 20 1 1 A 36 36 ALA CB C 2459 19.360 19.928 -0.568 1
1 365 . 20 1 1 A 36 36 ALA N N 2459 126.012 123.591 2.421 1
1 366 . 20 1 1 A 37 37 GLY H H 2460 7.781 8.312 -0.531 1
1 367 . 20 1 1 A 37 37 GLY HA2 H 2460 3.856 3.871 -0.015 1
1 368 . 20 1 1 A 37 37 GLY HA3 H 2460 3.164 4.037 -0.873 1
1 369 . 20 1 1 A 37 37 GLY C C 2460 170.730 171.782 -1.052 1
1 370 . 20 1 1 A 37 37 GLY CA C 2460 44.747 45.790 -1.043 1
1 371 . 20 1 1 A 37 37 GLY N N 2460 109.493 107.683 1.810 1
1 372 . 20 1 1 A 38 38 ALA H H 2461 8.055 7.989 0.066 1
1 373 . 20 1 1 A 38 38 ALA HA H 2461 4.389 4.680 -0.291 1
1 377 . 20 1 1 A 38 38 ALA C C 2461 176.609 176.288 0.321 1
1 378 . 20 1 1 A 38 38 ALA CA C 2461 51.419 51.620 -0.201 1
1 379 . 20 1 1 A 38 38 ALA CB C 2461 19.665 19.640 0.025 1
1 380 . 20 1 1 A 38 38 ALA N N 2461 121.997 122.394 -0.397 1
1 381 . 20 1 1 A 39 39 LEU H H 2462 8.597 8.430 0.167 1
1 382 . 20 1 1 A 39 39 LEU HA H 2462 5.022 5.137 -0.115 1
1 392 . 20 1 1 A 39 39 LEU C C 2462 175.883 175.239 0.644 1
1 393 . 20 1 1 A 39 39 LEU CA C 2462 53.907 53.177 0.730 1
1 394 . 20 1 1 A 39 39 LEU CB C 2462 44.576 45.160 -0.584 1
1 398 . 20 1 1 A 39 39 LEU N N 2462 126.664 123.826 2.838 1
1 399 . 20 1 1 A 40 40 SER H H 2463 8.898 9.004 -0.106 1
1 400 . 20 1 1 A 40 40 SER HA H 2463 4.732 4.709 0.023 1
1 403 . 20 1 1 A 40 40 SER C C 2463 172.984 172.937 0.047 1
1 404 . 20 1 1 A 40 40 SER CA C 2463 56.730 57.023 -0.293 1
1 405 . 20 1 1 A 40 40 SER CB C 2463 64.648 64.317 0.331 1
1 406 . 20 1 1 A 40 40 SER N N 2463 122.932 121.927 1.005 1
1 407 . 20 1 1 A 41 41 VAL H H 2464 8.538 7.416 1.122 1
1 408 . 20 1 1 A 41 41 VAL HA H 2464 5.131 4.122 1.009 1
1 416 . 20 1 1 A 41 41 VAL C C 2464 174.812 174.774 0.038 1
1 417 . 20 1 1 A 41 41 VAL CA C 2464 60.784 63.001 -2.217 1
1 418 . 20 1 1 A 41 41 VAL CB C 2464 34.262 32.283 1.979 1
1 420 . 20 1 1 A 41 41 VAL N N 2464 129.161 122.873 6.288 1
1 421 . 20 1 1 A 42 42 THR H H 2465 8.807 8.881 -0.074 1
1 422 . 20 1 1 A 42 42 THR HA H 2465 4.573 5.102 -0.529 1
1 427 . 20 1 1 A 42 42 THR CA C 2465 60.408 61.348 -0.940 1
1 428 . 20 1 1 A 42 42 THR CB C 2465 71.764 72.226 -0.462 1
1 430 . 20 1 1 A 42 42 THR N N 2465 120.898 124.364 -3.466 1
1 431 . 20 1 1 A 43 43 ILE H H 2466 8.648 8.915 -0.267 1
1 432 . 20 1 1 A 43 43 ILE HA H 2466 4.854 5.016 -0.162 1
1 442 . 20 1 1 A 43 43 ILE C C 2466 174.073 174.131 -0.058 1
1 443 . 20 1 1 A 43 43 ILE CA C 2466 61.184 59.906 1.278 1
1 444 . 20 1 1 A 43 43 ILE CB C 2466 39.516 40.756 -1.240 1
1 448 . 20 1 1 A 43 43 ILE N N 2466 124.810 125.675 -0.865 1
1 449 . 20 1 1 A 44 44 ASP H H 2467 8.821 9.117 -0.296 1
1 450 . 20 1 1 A 44 44 ASP HA H 2467 5.217 5.562 -0.345 1
1 453 . 20 1 1 A 44 44 ASP C C 2467 175.002 175.261 -0.259 1
1 454 . 20 1 1 A 44 44 ASP CA C 2467 52.998 52.341 0.657 1
1 455 . 20 1 1 A 44 44 ASP CB C 2467 44.728 44.258 0.470 1
1 456 . 20 1 1 A 44 44 ASP N N 2467 129.093 128.192 0.901 1
1 457 . 20 1 1 A 45 45 GLY H H 2468 8.535 8.264 0.271 1
1 458 . 20 1 1 A 45 45 GLY HA2 H 2468 3.954 3.583 0.371 1
1 459 . 20 1 1 A 45 45 GLY HA3 H 2468 3.561 3.913 -0.352 1
1 460 . 20 1 1 A 45 45 GLY CA C 2468 45.659 44.890 0.769 1
1 461 . 20 1 1 A 45 45 GLY N N 2468 112.751 111.729 1.022 1
1 462 . 20 1 1 A 46 46 PRO HA H 2469 4.318 4.298 0.020 1
1 469 . 20 1 1 A 46 46 PRO C C 2469 176.086 176.020 0.066 1
1 470 . 20 1 1 A 46 46 PRO CA C 2469 64.198 63.956 0.242 1
1 471 . 20 1 1 A 46 46 PRO CB C 2469 32.348 31.842 0.506 1
1 474 . 20 1 1 A 47 47 SER H H 2470 7.106 7.384 -0.278 1
1 475 . 20 1 1 A 47 47 SER HA H 2470 4.632 4.603 0.029 1
1 478 . 20 1 1 A 47 47 SER C C 2470 172.969 173.135 -0.166 1
1 479 . 20 1 1 A 47 47 SER CA C 2470 57.106 56.149 0.957 1
1 480 . 20 1 1 A 47 47 SER CB C 2470 66.262 65.502 0.760 1
1 481 . 20 1 1 A 47 47 SER N N 2470 110.556 111.876 -1.320 1
1 482 . 20 1 1 A 48 48 LYS H H 2471 8.534 8.350 0.184 1
1 483 . 20 1 1 A 48 48 LYS HA H 2471 4.486 4.614 -0.128 1
1 492 . 20 1 1 A 48 48 LYS C C 2471 177.231 176.103 1.128 1
1 493 . 20 1 1 A 48 48 LYS CA C 2471 56.620 56.495 0.125 1
1 494 . 20 1 1 A 48 48 LYS CB C 2471 32.379 34.116 -1.737 1
1 498 . 20 1 1 A 48 48 LYS N N 2471 124.055 122.081 1.974 1
1 499 . 20 1 1 A 49 49 VAL H H 2472 8.497 8.705 -0.208 1
1 500 . 20 1 1 A 49 49 VAL HA H 2472 4.552 4.897 -0.345 1
1 508 . 20 1 1 A 49 49 VAL C C 2472 175.292 174.059 1.233 1
1 509 . 20 1 1 A 49 49 VAL CA C 2472 60.142 58.976 1.166 1
1 510 . 20 1 1 A 49 49 VAL CB C 2472 33.464 35.431 -1.967 1
1 513 . 20 1 1 A 49 49 VAL N N 2472 121.233 118.530 2.703 1
1 514 . 20 1 1 A 50 50 LYS H H 2473 8.190 8.798 -0.608 1
1 515 . 20 1 1 A 50 50 LYS HA H 2473 4.522 4.685 -0.163 1
1 518 . 20 1 1 A 50 50 LYS CA C 2473 55.952 55.375 0.577 1
1 519 . 20 1 1 A 50 50 LYS CB C 2473 32.896 33.351 -0.455 1
1 520 . 20 1 1 A 50 50 LYS N N 2473 126.082 123.657 2.425 1
1 521 . 20 1 1 A 51 51 MET H H 2474 8.818 9.142 -0.324 1
1 522 . 20 1 1 A 51 51 MET HA H 2474 5.324 5.360 -0.036 1
1 530 . 20 1 1 A 51 51 MET C C 2474 173.933 174.090 -0.157 1
1 531 . 20 1 1 A 51 51 MET CA C 2474 54.848 54.002 0.846 1
1 532 . 20 1 1 A 51 51 MET CB C 2474 37.043 35.781 1.262 1
1 535 . 20 1 1 A 51 51 MET N N 2474 126.911 127.924 -1.013 1
1 536 . 20 1 1 A 52 52 ASP H H 2475 9.095 9.222 -0.127 1
1 537 . 20 1 1 A 52 52 ASP HA H 2475 4.947 5.438 -0.491 1
1 540 . 20 1 1 A 52 52 ASP C C 2475 173.923 174.175 -0.252 1
1 541 . 20 1 1 A 52 52 ASP CA C 2475 53.487 52.755 0.732 1
1 542 . 20 1 1 A 52 52 ASP CB C 2475 44.765 44.705 0.060 1
1 543 . 20 1 1 A 52 52 ASP N N 2475 125.526 125.667 -0.141 1
1 544 . 20 1 1 A 53 53 CYS H H 2476 8.606 8.830 -0.224 1
1 545 . 20 1 1 A 53 53 CYS HA H 2476 5.145 5.477 -0.332 1
1 548 . 20 1 1 A 53 53 CYS C C 2476 173.330 173.819 -0.489 1
1 549 . 20 1 1 A 53 53 CYS CA C 2476 57.452 57.199 0.253 1
1 550 . 20 1 1 A 53 53 CYS CB C 2476 28.108 31.943 -3.835 1
1 551 . 20 1 1 A 53 53 CYS N N 2476 124.317 122.446 1.871 1
1 552 . 20 1 1 A 54 54 GLN H H 2477 8.978 8.691 0.287 1
1 553 . 20 1 1 A 54 54 GLN HA H 2477 4.884 4.725 0.159 1
1 560 . 20 1 1 A 54 54 GLN C C 2477 174.854 174.332 0.522 1
1 561 . 20 1 1 A 54 54 GLN CA C 2477 53.891 54.891 -1.000 1
1 562 . 20 1 1 A 54 54 GLN CB C 2477 32.837 33.065 -0.228 1
1 564 . 20 1 1 A 54 54 GLN N N 2477 127.074 123.760 3.314 1
1 566 . 20 1 1 A 55 55 GLU H H 2478 9.065 8.754 0.311 1
1 567 . 20 1 1 A 55 55 GLU HA H 2478 4.280 4.655 -0.375 1
1 572 . 20 1 1 A 55 55 GLU C C 2478 175.383 175.822 -0.439 1
1 573 . 20 1 1 A 55 55 GLU CA C 2478 57.516 55.997 1.519 1
1 574 . 20 1 1 A 55 55 GLU CB C 2478 30.346 30.742 -0.396 1
1 576 . 20 1 1 A 55 55 GLU N N 2478 125.186 122.582 2.604 1
1 577 . 20 1 1 A 56 56 CYS H H 2479 8.407 8.522 -0.115 1
1 578 . 20 1 1 A 56 56 CYS HA H 2479 5.056 4.584 0.472 1
1 581 . 20 1 1 A 56 56 CYS CA C 2479 55.858 56.978 -1.120 1
1 582 . 20 1 1 A 56 56 CYS CB C 2479 28.676 30.281 -1.605 1
1 583 . 20 1 1 A 56 56 CYS N N 2479 121.499 116.948 4.551 1
1 584 . 20 1 1 A 57 57 PRO HA H 2480 4.159 4.301 -0.142 1
1 591 . 20 1 1 A 57 57 PRO C C 2480 177.964 177.671 0.293 1
1 592 . 20 1 1 A 57 57 PRO CA C 2480 66.877 64.645 2.232 1
1 593 . 20 1 1 A 57 57 PRO CB C 2480 31.709 32.021 -0.312 1
1 596 . 20 1 1 A 58 58 GLU H H 2481 8.900 8.138 0.762 1
1 597 . 20 1 1 A 58 58 GLU HA H 2481 4.201 4.343 -0.142 1
1 602 . 20 1 1 A 58 58 GLU C C 2481 175.129 176.408 -1.279 1
1 603 . 20 1 1 A 58 58 GLU CA C 2481 57.883 57.073 0.810 1
1 604 . 20 1 1 A 58 58 GLU CB C 2481 29.991 29.974 0.017 1
1 606 . 20 1 1 A 58 58 GLU N N 2481 115.316 117.948 -2.632 1
1 607 . 20 1 1 A 59 59 GLY H H 2482 7.527 7.395 0.132 1
1 608 . 20 1 1 A 59 59 GLY HA2 H 2482 4.935 3.993 0.942 1
1 609 . 20 1 1 A 59 59 GLY HA3 H 2482 3.381 4.091 -0.710 1
1 610 . 20 1 1 A 59 59 GLY CA C 2482 47.809 44.271 3.538 1
1 611 . 20 1 1 A 59 59 GLY N N 2482 110.079 107.853 2.226 1
1 612 . 20 1 1 A 60 60 TYR H H 2483 8.990 8.282 0.708 1
1 613 . 20 1 1 A 60 60 TYR HA H 2483 5.157 4.831 0.326 1
1 618 . 20 1 1 A 60 60 TYR C C 2483 175.096 174.660 0.436 1
1 619 . 20 1 1 A 60 60 TYR CA C 2483 57.375 57.998 -0.623 1
1 620 . 20 1 1 A 60 60 TYR CB C 2483 43.153 39.710 3.443 1
1 622 . 20 1 1 A 60 60 TYR N N 2483 125.900 122.113 3.787 1
1 623 . 20 1 1 A 61 61 ARG H H 2484 9.557 8.827 0.730 1
1 624 . 20 1 1 A 61 61 ARG HA H 2484 4.858 4.882 -0.024 1
1 631 . 20 1 1 A 61 61 ARG CA C 2484 55.016 55.243 -0.227 1
1 632 . 20 1 1 A 61 61 ARG CB C 2484 32.128 31.823 0.305 1
1 635 . 20 1 1 A 61 61 ARG N N 2484 124.847 126.410 -1.563 1
1 636 . 20 1 1 A 62 62 VAL H H 2485 9.046 8.950 0.096 1
1 637 . 20 1 1 A 62 62 VAL HA H 2485 4.675 4.976 -0.301 1
1 645 . 20 1 1 A 62 62 VAL C C 2485 173.837 174.537 -0.700 1
1 646 . 20 1 1 A 62 62 VAL CA C 2485 60.752 59.380 1.372 1
1 647 . 20 1 1 A 62 62 VAL CB C 2485 32.459 35.493 -3.034 1
1 650 . 20 1 1 A 62 62 VAL N N 2485 132.205 119.270 12.935 1
1 651 . 20 1 1 A 63 63 THR H H 2486 8.474 8.445 0.029 1
1 652 . 20 1 1 A 63 63 THR HA H 2486 5.392 5.341 0.051 1
1 657 . 20 1 1 A 63 63 THR C C 2486 173.675 173.538 0.137 1
1 658 . 20 1 1 A 63 63 THR CA C 2486 60.008 61.156 -1.148 1
1 659 . 20 1 1 A 63 63 THR CB C 2486 71.035 71.525 -0.490 1
1 661 . 20 1 1 A 63 63 THR N N 2486 121.216 116.764 4.452 1
1 662 . 20 1 1 A 64 64 TYR H H 2487 9.409 9.074 0.335 1
1 663 . 20 1 1 A 64 64 TYR HA H 2487 5.617 5.689 -0.072 1
1 670 . 20 1 1 A 64 64 TYR C C 2487 172.847 172.746 0.101 1
1 671 . 20 1 1 A 64 64 TYR CA C 2487 55.557 55.629 -0.072 1
1 672 . 20 1 1 A 64 64 TYR CB C 2487 41.968 42.192 -0.224 1
1 675 . 20 1 1 A 64 64 TYR N N 2487 124.061 122.322 1.739 1
1 676 . 20 1 1 A 65 65 THR H H 2488 8.145 8.971 -0.826 1
1 677 . 20 1 1 A 65 65 THR HA H 2488 4.959 4.623 0.336 1
1 682 . 20 1 1 A 65 65 THR CA C 2488 58.532 58.978 -0.446 1
1 683 . 20 1 1 A 65 65 THR CB C 2488 70.141 70.079 0.062 1
1 685 . 20 1 1 A 65 65 THR N N 2488 117.924 117.200 0.724 1
1 686 . 20 1 1 A 66 66 PRO HA H 2489 4.602 4.841 -0.239 1
1 693 . 20 1 1 A 66 66 PRO C C 2489 176.647 176.567 0.080 1
1 694 . 20 1 1 A 66 66 PRO CA C 2489 61.442 62.322 -0.880 1
1 695 . 20 1 1 A 66 66 PRO CB C 2489 32.715 33.128 -0.413 1
1 698 . 20 1 1 A 67 67 MET H H 2490 8.832 8.357 0.475 1
1 699 . 20 1 1 A 67 67 MET HA H 2490 4.880 4.797 0.083 1
1 707 . 20 1 1 A 67 67 MET C C 2490 174.121 175.990 -1.869 1
1 708 . 20 1 1 A 67 67 MET CA C 2490 53.848 54.669 -0.821 1
1 709 . 20 1 1 A 67 67 MET CB C 2490 33.727 34.090 -0.363 1
1 712 . 20 1 1 A 67 67 MET N N 2490 119.212 117.472 1.740 1
1 713 . 20 1 1 A 68 68 ALA H H 2491 7.086 7.504 -0.418 1
1 714 . 20 1 1 A 68 68 ALA HA H 2491 4.851 4.853 -0.002 1
1 718 . 20 1 1 A 68 68 ALA CA C 2491 49.222 49.772 -0.550 1
1 719 . 20 1 1 A 68 68 ALA CB C 2491 20.600 21.943 -1.343 1
1 720 . 20 1 1 A 68 68 ALA N N 2491 120.363 121.016 -0.653 1
1 721 . 20 1 1 A 69 69 PRO HA H 2492 4.263 4.697 -0.434 1
1 728 . 20 1 1 A 69 69 PRO C C 2492 174.370 176.200 -1.830 1
1 729 . 20 1 1 A 69 69 PRO CA C 2492 62.555 63.440 -0.885 1
1 730 . 20 1 1 A 69 69 PRO CB C 2492 32.752 32.721 0.031 1
1 733 . 20 1 1 A 70 70 GLY H H 2493 8.858 8.241 0.617 1
1 734 . 20 1 1 A 70 70 GLY HA2 H 2493 4.544 4.073 0.471 1
1 735 . 20 1 1 A 70 70 GLY HA3 H 2493 3.849 4.117 -0.268 1
1 736 . 20 1 1 A 70 70 GLY C C 2493 172.182 172.268 -0.086 1
1 737 . 20 1 1 A 70 70 GLY CA C 2493 44.356 44.257 0.099 1
1 738 . 20 1 1 A 70 70 GLY N N 2493 106.539 109.452 -2.913 1
1 739 . 20 1 1 A 71 71 SER H H 2494 8.490 8.246 0.244 1
1 740 . 20 1 1 A 71 71 SER HA H 2494 5.280 5.247 0.033 1
1 743 . 20 1 1 A 71 71 SER C C 2494 173.512 173.589 -0.077 1
1 744 . 20 1 1 A 71 71 SER CA C 2494 57.674 58.235 -0.561 1
1 745 . 20 1 1 A 71 71 SER CB C 2494 63.799 64.147 -0.348 1
1 746 . 20 1 1 A 71 71 SER N N 2494 117.964 117.329 0.635 1
1 747 . 20 1 1 A 72 72 TYR H H 2495 9.320 9.565 -0.245 1
1 748 . 20 1 1 A 72 72 TYR HA H 2495 4.960 5.022 -0.062 1
1 755 . 20 1 1 A 72 72 TYR C C 2495 173.979 174.897 -0.918 1
1 756 . 20 1 1 A 72 72 TYR CA C 2495 56.384 57.383 -0.999 1
1 757 . 20 1 1 A 72 72 TYR CB C 2495 40.247 39.289 0.958 1
1 760 . 20 1 1 A 72 72 TYR N N 2495 126.442 126.874 -0.432 1
1 761 . 20 1 1 A 73 73 LEU H H 2496 9.019 9.193 -0.174 1
1 762 . 20 1 1 A 73 73 LEU HA H 2496 5.209 4.880 0.329 1
1 772 . 20 1 1 A 73 73 LEU C C 2496 177.015 174.597 2.418 1
1 773 . 20 1 1 A 73 73 LEU CA C 2496 53.393 54.273 -0.880 1
1 774 . 20 1 1 A 73 73 LEU CB C 2496 43.918 43.053 0.865 1
1 778 . 20 1 1 A 73 73 LEU N N 2496 125.439 126.527 -1.088 1
1 779 . 20 1 1 A 74 74 ILE H H 2497 9.921 9.730 0.191 1
1 780 . 20 1 1 A 74 74 ILE HA H 2497 5.128 4.685 0.443 1
1 790 . 20 1 1 A 74 74 ILE C C 2497 175.730 175.088 0.642 1
1 791 . 20 1 1 A 74 74 ILE CA C 2497 60.930 60.141 0.789 1
1 792 . 20 1 1 A 74 74 ILE CB C 2497 39.488 37.734 1.754 1
1 796 . 20 1 1 A 74 74 ILE N N 2497 132.185 130.183 2.002 1
1 797 . 20 1 1 A 75 75 SER H H 2498 9.284 9.019 0.265 1
1 798 . 20 1 1 A 75 75 SER HA H 2498 5.111 5.023 0.088 1
1 801 . 20 1 1 A 75 75 SER C C 2498 173.449 173.470 -0.021 1
1 802 . 20 1 1 A 75 75 SER CA C 2498 58.260 58.271 -0.011 1
1 803 . 20 1 1 A 75 75 SER CB C 2498 63.956 62.847 1.109 1
1 804 . 20 1 1 A 75 75 SER N N 2498 125.384 124.905 0.479 1
1 805 . 20 1 1 A 76 76 ILE H H 2499 9.861 8.917 0.944 1
1 806 . 20 1 1 A 76 76 ILE HA H 2499 4.814 4.662 0.152 1
1 816 . 20 1 1 A 76 76 ILE CA C 2499 61.034 61.111 -0.077 1
1 817 . 20 1 1 A 76 76 ILE CB C 2499 40.387 36.989 3.398 1
1 821 . 20 1 1 A 76 76 ILE N N 2499 129.414 127.218 2.196 1
1 822 . 20 1 1 A 77 77 LYS H H 2500 8.827 9.034 -0.207 1
1 823 . 20 1 1 A 77 77 LYS HA H 2500 5.254 5.167 0.087 1
1 832 . 20 1 1 A 77 77 LYS C C 2500 175.245 175.595 -0.350 1
1 833 . 20 1 1 A 77 77 LYS CA C 2500 54.388 55.207 -0.819 1
1 834 . 20 1 1 A 77 77 LYS CB C 2500 36.127 34.847 1.280 1
1 838 . 20 1 1 A 77 77 LYS N N 2500 126.922 127.374 -0.452 1
1 839 . 20 1 1 A 78 78 TYR H H 2501 8.408 9.257 -0.849 1
1 840 . 20 1 1 A 78 78 TYR HA H 2501 5.479 5.093 0.386 1
1 847 . 20 1 1 A 78 78 TYR C C 2501 174.792 175.587 -0.795 1
1 848 . 20 1 1 A 78 78 TYR CA C 2501 56.837 57.409 -0.572 1
1 849 . 20 1 1 A 78 78 TYR CB C 2501 44.008 42.342 1.666 1
1 852 . 20 1 1 A 78 78 TYR N N 2501 122.282 124.309 -2.027 1
1 853 . 20 1 1 A 79 79 GLY H H 2502 8.196 8.327 -0.131 1
1 854 . 20 1 1 A 79 79 GLY HA2 H 2502 4.040 3.632 0.408 1
1 855 . 20 1 1 A 79 79 GLY HA3 H 2502 3.465 3.835 -0.370 1
1 856 . 20 1 1 A 79 79 GLY C C 2502 173.932 173.782 0.150 1
1 857 . 20 1 1 A 79 79 GLY CA C 2502 45.741 46.143 -0.402 1
1 858 . 20 1 1 A 79 79 GLY N N 2502 113.451 113.612 -0.161 1
1 859 . 20 1 1 A 80 80 GLY H H 2503 7.589 8.339 -0.750 1
1 860 . 20 1 1 A 80 80 GLY HA2 H 2503 4.490 3.981 0.509 1
1 861 . 20 1 1 A 80 80 GLY HA3 H 2503 3.555 4.084 -0.529 1
1 862 . 20 1 1 A 80 80 GLY CA C 2503 43.540 44.079 -0.539 1
1 863 . 20 1 1 A 80 80 GLY N N 2503 107.293 107.257 0.036 1
1 864 . 20 1 1 A 81 81 PRO HA H 2504 4.320 4.377 -0.057 1
1 871 . 20 1 1 A 81 81 PRO C C 2504 175.311 175.316 -0.005 1
1 872 . 20 1 1 A 81 81 PRO CA C 2504 62.722 63.312 -0.590 1
1 873 . 20 1 1 A 81 81 PRO CB C 2504 29.297 31.216 -1.919 1
1 876 . 20 1 1 A 82 82 TYR H H 2505 7.778 7.295 0.483 1
1 877 . 20 1 1 A 82 82 TYR HA H 2505 4.791 5.019 -0.228 1
1 884 . 20 1 1 A 82 82 TYR C C 2505 175.086 175.765 -0.679 1
1 885 . 20 1 1 A 82 82 TYR CA C 2505 56.111 56.636 -0.525 1
1 886 . 20 1 1 A 82 82 TYR CB C 2505 39.483 40.657 -1.174 1
1 889 . 20 1 1 A 82 82 TYR N N 2505 123.973 121.414 2.559 1
1 890 . 20 1 1 A 83 83 HIS H H 2506 8.625 9.034 -0.409 1
1 891 . 20 1 1 A 83 83 HIS HA H 2506 4.583 4.793 -0.210 1
1 896 . 20 1 1 A 83 83 HIS C C 2506 178.161 175.934 2.227 1
1 897 . 20 1 1 A 83 83 HIS CA C 2506 58.241 57.711 0.530 1
1 898 . 20 1 1 A 83 83 HIS CB C 2506 33.132 30.634 2.498 1
1 901 . 20 1 1 A 83 83 HIS N N 2506 124.092 121.849 2.243 1
1 902 . 20 1 1 A 84 84 ILE H H 2507 8.327 8.657 -0.330 1
1 903 . 20 1 1 A 84 84 ILE HA H 2507 4.553 4.289 0.264 1
1 913 . 20 1 1 A 84 84 ILE C C 2507 176.523 178.261 -1.738 1
1 914 . 20 1 1 A 84 84 ILE CA C 2507 60.791 60.550 0.241 1
1 915 . 20 1 1 A 84 84 ILE CB C 2507 39.162 39.960 -0.798 1
1 919 . 20 1 1 A 84 84 ILE N N 2507 117.355 120.953 -3.598 1
1 920 . 20 1 1 A 85 85 GLY H H 2508 9.130 8.460 0.670 1
1 921 . 20 1 1 A 85 85 GLY HA2 H 2508 3.883 3.853 0.030 1
1 922 . 20 1 1 A 85 85 GLY HA3 H 2508 3.800 3.855 -0.055 1
1 923 . 20 1 1 A 85 85 GLY C C 2508 174.438 174.968 -0.530 1
1 924 . 20 1 1 A 85 85 GLY CA C 2508 47.673 47.165 0.508 1
1 925 . 20 1 1 A 85 85 GLY N N 2508 111.346 110.488 0.858 1
1 926 . 20 1 1 A 86 86 GLY H H 2509 8.236 8.030 0.206 1
1 927 . 20 1 1 A 86 86 GLY HA2 H 2509 3.893 3.799 0.094 1
1 928 . 20 1 1 A 86 86 GLY HA3 H 2509 3.161 3.807 -0.646 1
1 929 . 20 1 1 A 86 86 GLY C C 2509 171.837 173.080 -1.243 1
1 930 . 20 1 1 A 86 86 GLY CA C 2509 44.844 44.900 -0.056 1
1 931 . 20 1 1 A 86 86 GLY N N 2509 115.594 108.675 6.919 1
1 932 . 20 1 1 A 87 87 SER H H 2510 7.385 7.828 -0.443 1
1 933 . 20 1 1 A 87 87 SER HA H 2510 4.217 4.353 -0.136 1
1 936 . 20 1 1 A 87 87 SER CA C 2510 54.783 55.236 -0.453 1
1 937 . 20 1 1 A 87 87 SER CB C 2510 62.683 64.003 -1.320 1
1 938 . 20 1 1 A 87 87 SER N N 2510 112.859 116.572 -3.713 1
1 939 . 20 1 1 A 88 88 PRO HA H 2511 5.532 4.908 0.624 1
1 946 . 20 1 1 A 88 88 PRO C C 2511 175.870 175.363 0.507 1
1 947 . 20 1 1 A 88 88 PRO CA C 2511 62.379 62.297 0.082 1
1 948 . 20 1 1 A 88 88 PRO CB C 2511 33.639 32.358 1.281 1
1 951 . 20 1 1 A 89 89 PHE H H 2512 9.359 8.839 0.520 1
1 952 . 20 1 1 A 89 89 PHE HA H 2512 4.467 4.813 -0.346 1
1 960 . 20 1 1 A 89 89 PHE C C 2512 175.152 174.878 0.274 1
1 961 . 20 1 1 A 89 89 PHE CA C 2512 57.401 57.042 0.359 1
1 962 . 20 1 1 A 89 89 PHE CB C 2512 40.843 40.795 0.048 1
1 966 . 20 1 1 A 89 89 PHE N N 2512 124.789 119.261 5.528 1
1 967 . 20 1 1 A 90 90 LYS H H 2513 8.772 8.743 0.029 1
1 968 . 20 1 1 A 90 90 LYS HA H 2513 4.941 4.658 0.283 1
1 973 . 20 1 1 A 90 90 LYS C C 2513 174.183 175.360 -1.177 1
1 974 . 20 1 1 A 90 90 LYS CA C 2513 55.749 55.599 0.150 1
1 975 . 20 1 1 A 90 90 LYS CB C 2513 32.817 32.655 0.162 1
1 978 . 20 1 1 A 90 90 LYS N N 2513 125.133 122.545 2.588 1
1 979 . 20 1 1 A 91 91 ALA H H 2514 9.158 8.992 0.166 1
1 980 . 20 1 1 A 91 91 ALA HA H 2514 4.510 4.830 -0.320 1
1 984 . 20 1 1 A 91 91 ALA C C 2514 176.561 176.278 0.283 1
1 985 . 20 1 1 A 91 91 ALA CA C 2514 50.528 51.502 -0.974 1
1 986 . 20 1 1 A 91 91 ALA CB C 2514 20.653 20.109 0.544 1
1 987 . 20 1 1 A 91 91 ALA N N 2514 131.989 128.202 3.787 1
1 988 . 20 1 1 A 92 92 LYS H H 2515 8.186 9.048 -0.862 1
1 989 . 20 1 1 A 92 92 LYS HA H 2515 4.926 4.866 0.060 1
1 998 . 20 1 1 A 92 92 LYS C C 2515 175.177 175.377 -0.200 1
1 999 . 20 1 1 A 92 92 LYS CA C 2515 55.725 55.706 0.019 1
1 1000 . 20 1 1 A 92 92 LYS CB C 2515 33.765 33.626 0.139 1
1 1004 . 20 1 1 A 92 92 LYS N N 2515 124.887 123.408 1.479 1
1 1005 . 20 1 1 A 93 93 VAL H H 2516 9.362 9.460 -0.098 1
1 1006 . 20 1 1 A 93 93 VAL HA H 2516 5.161 5.221 -0.060 1
1 1014 . 20 1 1 A 93 93 VAL C C 2516 176.988 175.136 1.852 1
1 1015 . 20 1 1 A 93 93 VAL CA C 2516 60.523 61.179 -0.656 1
1 1016 . 20 1 1 A 93 93 VAL CB C 2516 33.291 34.507 -1.216 1
1 1019 . 20 1 1 A 93 93 VAL N N 2516 129.943 125.390 4.553 1
1 1020 . 20 1 1 A 94 94 THR H H 2517 8.614 8.873 -0.259 1
1 1021 . 20 1 1 A 94 94 THR HA H 2517 4.902 4.872 0.030 1
1 1026 . 20 1 1 A 94 94 THR C C 2517 172.759 173.314 -0.555 1
1 1027 . 20 1 1 A 94 94 THR CA C 2517 60.121 59.862 0.259 1
1 1028 . 20 1 1 A 94 94 THR CB C 2517 71.072 71.581 -0.509 1
1 1030 . 20 1 1 A 94 94 THR N N 2517 122.032 116.185 5.847 1
1 1031 . 20 1 1 A 95 95 GLY H H 2518 8.280 8.425 -0.145 1
1 1032 . 20 1 1 A 95 95 GLY HA2 H 2518 3.852 4.135 -0.283 1
1 1033 . 20 1 1 A 95 95 GLY HA3 H 2518 4.846 4.139 0.707 1
1 1034 . 20 1 1 A 95 95 GLY CA C 2518 43.955 44.369 -0.414 1
1 1035 . 20 1 1 A 95 95 GLY N N 2518 107.949 108.174 -0.225 1
1 1036 . 20 1 1 A 96 96 PRO HA H 2519 4.449 4.652 -0.203 1
1 1043 . 20 1 1 A 96 96 PRO C C 2519 176.892 176.022 0.870 1
1 1044 . 20 1 1 A 96 96 PRO CA C 2519 62.062 62.735 -0.673 1
1 1045 . 20 1 1 A 96 96 PRO CB C 2519 32.286 32.531 -0.245 1
1 1048 . 20 1 1 A 97 97 ARG H H 2520 8.651 8.546 0.105 1
1 1049 . 20 1 1 A 97 97 ARG HA H 2520 4.348 4.601 -0.253 1
1 1056 . 20 1 1 A 97 97 ARG C C 2520 176.236 175.770 0.466 1
1 1057 . 20 1 1 A 97 97 ARG CA C 2520 57.587 55.922 1.665 1
1 1058 . 20 1 1 A 97 97 ARG CB C 2520 30.472 30.744 -0.272 1
1 1061 . 20 1 1 A 97 97 ARG N N 2520 120.781 121.886 -1.105 1
1 1062 . 20 1 1 A 98 98 LEU H H 2521 8.545 8.828 -0.283 1
1 1063 . 20 1 1 A 98 98 LEU HA H 2521 4.577 4.267 0.310 1
1 1073 . 20 1 1 A 98 98 LEU C C 2521 175.880 178.227 -2.347 1
1 1074 . 20 1 1 A 98 98 LEU CA C 2521 55.068 55.637 -0.569 1
1 1075 . 20 1 1 A 98 98 LEU CB C 2521 43.082 42.434 0.648 1
1 1079 . 20 1 1 A 98 98 LEU N N 2521 128.715 127.703 1.012 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 79 0.956 1
2 1 1 1 "RMS(OBS, PRED)" CA 95 0.916 1
3 1 1 1 "RMS(OBS, PRED)" CB 79 1.369 1
4 1 1 1 "RMS(OBS, PRED)" H 85 0.394 1
5 1 1 1 "RMS(OBS, PRED)" HA 111 0.337 1
6 1 1 1 "RMS(OBS, PRED)" N 85 2.909 1
7 1 2 1 "RMS(OBS, PRED)" C 79 0.939 1
8 1 2 1 "RMS(OBS, PRED)" CA 95 0.948 1
9 1 2 1 "RMS(OBS, PRED)" CB 79 1.451 1
10 1 2 1 "RMS(OBS, PRED)" H 85 0.452 1
11 1 2 1 "RMS(OBS, PRED)" HA 111 0.327 1
12 1 2 1 "RMS(OBS, PRED)" N 85 2.988 1
13 1 3 1 "RMS(OBS, PRED)" C 79 0.931 1
14 1 3 1 "RMS(OBS, PRED)" CA 95 0.902 1
15 1 3 1 "RMS(OBS, PRED)" CB 79 1.365 1
16 1 3 1 "RMS(OBS, PRED)" H 85 0.437 1
17 1 3 1 "RMS(OBS, PRED)" HA 111 0.339 1
18 1 3 1 "RMS(OBS, PRED)" N 85 3.008 1
19 1 4 1 "RMS(OBS, PRED)" C 79 0.946 1
20 1 4 1 "RMS(OBS, PRED)" CA 95 1.032 1
21 1 4 1 "RMS(OBS, PRED)" CB 79 1.297 1
22 1 4 1 "RMS(OBS, PRED)" H 85 0.405 1
23 1 4 1 "RMS(OBS, PRED)" HA 111 0.335 1
24 1 4 1 "RMS(OBS, PRED)" N 85 2.888 1
25 1 5 1 "RMS(OBS, PRED)" C 79 0.927 1
26 1 5 1 "RMS(OBS, PRED)" CA 95 0.895 1
27 1 5 1 "RMS(OBS, PRED)" CB 79 1.361 1
28 1 5 1 "RMS(OBS, PRED)" H 85 0.426 1
29 1 5 1 "RMS(OBS, PRED)" HA 111 0.325 1
30 1 5 1 "RMS(OBS, PRED)" N 85 3.082 1
31 1 6 1 "RMS(OBS, PRED)" C 79 0.951 1
32 1 6 1 "RMS(OBS, PRED)" CA 95 0.946 1
33 1 6 1 "RMS(OBS, PRED)" CB 79 1.393 1
34 1 6 1 "RMS(OBS, PRED)" H 85 0.491 1
35 1 6 1 "RMS(OBS, PRED)" HA 111 0.340 1
36 1 6 1 "RMS(OBS, PRED)" N 85 3.319 1
37 1 7 1 "RMS(OBS, PRED)" C 79 0.908 1
38 1 7 1 "RMS(OBS, PRED)" CA 95 1.004 1
39 1 7 1 "RMS(OBS, PRED)" CB 79 1.456 1
40 1 7 1 "RMS(OBS, PRED)" H 85 0.433 1
41 1 7 1 "RMS(OBS, PRED)" HA 111 0.342 1
42 1 7 1 "RMS(OBS, PRED)" N 85 3.141 1
43 1 8 1 "RMS(OBS, PRED)" C 79 0.925 1
44 1 8 1 "RMS(OBS, PRED)" CA 95 0.969 1
45 1 8 1 "RMS(OBS, PRED)" CB 79 1.409 1
46 1 8 1 "RMS(OBS, PRED)" H 85 0.451 1
47 1 8 1 "RMS(OBS, PRED)" HA 111 0.354 1
48 1 8 1 "RMS(OBS, PRED)" N 85 2.799 1
49 1 9 1 "RMS(OBS, PRED)" C 79 1.105 1
50 1 9 1 "RMS(OBS, PRED)" CA 95 0.938 1
51 1 9 1 "RMS(OBS, PRED)" CB 79 1.431 1
52 1 9 1 "RMS(OBS, PRED)" H 85 0.410 1
53 1 9 1 "RMS(OBS, PRED)" HA 111 0.333 1
54 1 9 1 "RMS(OBS, PRED)" N 85 3.365 1
55 1 10 1 "RMS(OBS, PRED)" C 79 0.977 1
56 1 10 1 "RMS(OBS, PRED)" CA 95 0.943 1
57 1 10 1 "RMS(OBS, PRED)" CB 79 1.469 1
58 1 10 1 "RMS(OBS, PRED)" H 85 0.417 1
59 1 10 1 "RMS(OBS, PRED)" HA 111 0.344 1
60 1 10 1 "RMS(OBS, PRED)" N 85 2.732 1
61 1 11 1 "RMS(OBS, PRED)" C 79 1.001 1
62 1 11 1 "RMS(OBS, PRED)" CA 95 0.820 1
63 1 11 1 "RMS(OBS, PRED)" CB 79 1.172 1
64 1 11 1 "RMS(OBS, PRED)" H 85 0.426 1
65 1 11 1 "RMS(OBS, PRED)" HA 111 0.326 1
66 1 11 1 "RMS(OBS, PRED)" N 85 2.867 1
67 1 12 1 "RMS(OBS, PRED)" C 79 1.012 1
68 1 12 1 "RMS(OBS, PRED)" CA 95 0.994 1
69 1 12 1 "RMS(OBS, PRED)" CB 79 1.555 1
70 1 12 1 "RMS(OBS, PRED)" H 85 0.451 1
71 1 12 1 "RMS(OBS, PRED)" HA 111 0.347 1
72 1 12 1 "RMS(OBS, PRED)" N 85 3.615 1
73 1 13 1 "RMS(OBS, PRED)" C 79 1.054 1
74 1 13 1 "RMS(OBS, PRED)" CA 95 0.955 1
75 1 13 1 "RMS(OBS, PRED)" CB 79 1.459 1
76 1 13 1 "RMS(OBS, PRED)" H 85 0.444 1
77 1 13 1 "RMS(OBS, PRED)" HA 111 0.337 1
78 1 13 1 "RMS(OBS, PRED)" N 85 3.080 1
79 1 14 1 "RMS(OBS, PRED)" C 79 0.961 1
80 1 14 1 "RMS(OBS, PRED)" CA 95 0.979 1
81 1 14 1 "RMS(OBS, PRED)" CB 79 1.458 1
82 1 14 1 "RMS(OBS, PRED)" H 85 0.447 1
83 1 14 1 "RMS(OBS, PRED)" HA 111 0.344 1
84 1 14 1 "RMS(OBS, PRED)" N 85 3.252 1
85 1 15 1 "RMS(OBS, PRED)" C 79 0.981 1
86 1 15 1 "RMS(OBS, PRED)" CA 95 0.861 1
87 1 15 1 "RMS(OBS, PRED)" CB 79 1.357 1
88 1 15 1 "RMS(OBS, PRED)" H 85 0.447 1
89 1 15 1 "RMS(OBS, PRED)" HA 111 0.327 1
90 1 15 1 "RMS(OBS, PRED)" N 85 3.100 1
91 1 16 1 "RMS(OBS, PRED)" C 79 0.959 1
92 1 16 1 "RMS(OBS, PRED)" CA 95 0.922 1
93 1 16 1 "RMS(OBS, PRED)" CB 79 1.299 1
94 1 16 1 "RMS(OBS, PRED)" H 85 0.449 1
95 1 16 1 "RMS(OBS, PRED)" HA 111 0.339 1
96 1 16 1 "RMS(OBS, PRED)" N 85 3.075 1
97 1 17 1 "RMS(OBS, PRED)" C 79 1.053 1
98 1 17 1 "RMS(OBS, PRED)" CA 95 0.962 1
99 1 17 1 "RMS(OBS, PRED)" CB 79 1.464 1
100 1 17 1 "RMS(OBS, PRED)" H 85 0.433 1
101 1 17 1 "RMS(OBS, PRED)" HA 111 0.344 1
102 1 17 1 "RMS(OBS, PRED)" N 85 3.127 1
103 1 18 1 "RMS(OBS, PRED)" C 79 0.931 1
104 1 18 1 "RMS(OBS, PRED)" CA 95 0.888 1
105 1 18 1 "RMS(OBS, PRED)" CB 79 1.327 1
106 1 18 1 "RMS(OBS, PRED)" H 85 0.469 1
107 1 18 1 "RMS(OBS, PRED)" HA 111 0.338 1
108 1 18 1 "RMS(OBS, PRED)" N 85 3.242 1
109 1 19 1 "RMS(OBS, PRED)" C 79 1.000 1
110 1 19 1 "RMS(OBS, PRED)" CA 95 0.989 1
111 1 19 1 "RMS(OBS, PRED)" CB 79 1.336 1
112 1 19 1 "RMS(OBS, PRED)" H 85 0.418 1
113 1 19 1 "RMS(OBS, PRED)" HA 111 0.333 1
114 1 19 1 "RMS(OBS, PRED)" N 85 3.283 1
115 1 20 1 "RMS(OBS, PRED)" C 79 0.930 1
116 1 20 1 "RMS(OBS, PRED)" CA 95 0.952 1
117 1 20 1 "RMS(OBS, PRED)" CB 79 1.296 1
118 1 20 1 "RMS(OBS, PRED)" H 85 0.425 1
119 1 20 1 "RMS(OBS, PRED)" HA 111 0.325 1
120 1 20 1 "RMS(OBS, PRED)" N 85 3.128 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 ALA HA H -2 4.374 4.500 -0.126 2
1 8 . 1 1 A 2 2 ALA C C -2 177.865 177.472 0.393 2
1 9 . 1 1 A 2 2 ALA CA C -2 52.670 52.097 0.573 2
1 10 . 1 1 A 2 2 ALA CB C -2 19.508 20.378 -0.870 2
1 32 . 1 1 A 5 5 ASP H H 2428 8.300 8.716 -0.416 2
1 33 . 1 1 A 5 5 ASP HA H 2428 5.082 5.205 -0.123 2
1 36 . 1 1 A 5 5 ASP CA C 2428 51.517 51.056 0.461 2
1 37 . 1 1 A 5 5 ASP CB C 2428 42.244 42.653 -0.409 2
1 38 . 1 1 A 5 5 ASP N N 2428 122.879 121.220 1.659 2
1 39 . 1 1 A 6 6 PRO HA H 2429 4.340 4.409 -0.069 2
1 46 . 1 1 A 6 6 PRO C C 2429 178.266 178.255 0.011 2
1 47 . 1 1 A 6 6 PRO CA C 2429 64.494 64.635 -0.141 2
1 48 . 1 1 A 6 6 PRO CB C 2429 31.841 31.954 -0.113 2
1 51 . 1 1 A 7 7 GLY H H 2430 8.686 8.488 0.198 2
1 52 . 1 1 A 7 7 GLY HA2 H 2430 4.116 3.857 0.259 2
1 53 . 1 1 A 7 7 GLY HA3 H 2430 3.868 3.859 0.009 2
1 54 . 1 1 A 7 7 GLY C C 2430 174.567 175.568 -1.001 2
1 55 . 1 1 A 7 7 GLY CA C 2430 46.038 46.547 -0.509 2
1 56 . 1 1 A 7 7 GLY N N 2430 107.655 106.426 1.229 2
1 57 . 1 1 A 8 8 LEU H H 2431 7.692 7.474 0.218 2
1 58 . 1 1 A 8 8 LEU HA H 2431 4.507 4.381 0.126 2
1 68 . 1 1 A 8 8 LEU C C 2431 176.876 177.483 -0.607 2
1 69 . 1 1 A 8 8 LEU CA C 2431 54.307 56.602 -2.295 2
1 70 . 1 1 A 8 8 LEU CB C 2431 42.879 42.802 0.077 2
1 74 . 1 1 A 8 8 LEU N N 2431 120.022 120.054 -0.032 2
1 75 . 1 1 A 9 9 VAL H H 2432 7.378 7.462 -0.084 2
1 76 . 1 1 A 9 9 VAL HA H 2432 4.154 3.901 0.253 2
1 84 . 1 1 A 9 9 VAL C C 2432 174.703 175.587 -0.884 2
1 85 . 1 1 A 9 9 VAL CA C 2432 62.387 63.210 -0.823 2
1 86 . 1 1 A 9 9 VAL CB C 2432 32.519 31.508 1.012 2
1 89 . 1 1 A 9 9 VAL N N 2432 123.902 119.513 4.389 2
1 90 . 1 1 A 10 10 SER H H 2433 8.201 8.605 -0.404 2
1 91 . 1 1 A 10 10 SER HA H 2433 5.136 5.045 0.091 2
1 94 . 1 1 A 10 10 SER CA C 2433 56.554 56.296 0.258 2
1 95 . 1 1 A 10 10 SER CB C 2433 66.763 65.714 1.049 2
1 96 . 1 1 A 10 10 SER N N 2433 121.921 122.447 -0.526 2
1 97 . 1 1 A 11 11 ALA H H 2434 8.670 8.333 0.337 2
1 98 . 1 1 A 11 11 ALA HA H 2434 5.632 5.271 0.361 2
1 102 . 1 1 A 11 11 ALA C C 2434 175.459 174.868 0.591 2
1 103 . 1 1 A 11 11 ALA CA C 2434 50.575 50.645 -0.070 2
1 104 . 1 1 A 11 11 ALA CB C 2434 23.111 22.751 0.360 2
1 105 . 1 1 A 11 11 ALA N N 2434 124.828 124.016 0.812 2
1 106 . 1 1 A 12 12 TYR H H 2435 8.609 8.760 -0.151 2
1 107 . 1 1 A 12 12 TYR HA H 2435 4.879 5.085 -0.206 2
1 114 . 1 1 A 12 12 TYR C C 2435 173.645 174.633 -0.988 2
1 115 . 1 1 A 12 12 TYR CA C 2435 56.268 56.758 -0.490 2
1 116 . 1 1 A 12 12 TYR CB C 2435 39.522 42.390 -2.868 2
1 119 . 1 1 A 12 12 TYR N N 2435 118.305 119.363 -1.058 2
1 120 . 1 1 A 13 13 GLY H H 2436 8.655 8.540 0.115 2
1 121 . 1 1 A 13 13 GLY HA2 H 2436 4.943 4.285 0.658 2
1 122 . 1 1 A 13 13 GLY HA3 H 2436 4.028 4.330 -0.302 2
1 123 . 1 1 A 13 13 GLY C C 2436 175.334 174.969 0.365 2
1 124 . 1 1 A 13 13 GLY CA C 2436 44.389 44.399 -0.010 2
1 125 . 1 1 A 13 13 GLY N N 2436 110.710 110.384 0.326 2
1 126 . 1 1 A 14 14 ALA H H 2437 8.939 8.743 0.196 2
1 127 . 1 1 A 14 14 ALA HA H 2437 4.276 4.086 0.190 2
1 131 . 1 1 A 14 14 ALA C C 2437 180.524 179.152 1.372 2
1 132 . 1 1 A 14 14 ALA CA C 2437 55.551 55.077 0.474 2
1 133 . 1 1 A 14 14 ALA CB C 2437 18.411 18.415 -0.004 2
1 134 . 1 1 A 14 14 ALA N N 2437 126.973 123.832 3.141 2
1 135 . 1 1 A 15 15 GLY H H 2438 8.933 8.712 0.221 2
1 136 . 1 1 A 15 15 GLY HA2 H 2438 4.531 3.992 0.539 2
1 137 . 1 1 A 15 15 GLY HA3 H 2438 3.576 4.207 -0.631 2
1 138 . 1 1 A 15 15 GLY C C 2438 174.323 175.541 -1.218 2
1 139 . 1 1 A 15 15 GLY CA C 2438 46.855 46.869 -0.014 2
1 140 . 1 1 A 15 15 GLY N N 2438 104.803 105.596 -0.792 2
1 141 . 1 1 A 16 16 LEU H H 2439 7.529 7.596 -0.067 2
1 142 . 1 1 A 16 16 LEU HA H 2439 3.768 3.834 -0.066 2
1 152 . 1 1 A 16 16 LEU C C 2439 176.388 178.636 -2.248 2
1 153 . 1 1 A 16 16 LEU CA C 2439 56.137 57.224 -1.087 2
1 154 . 1 1 A 16 16 LEU CB C 2439 41.621 41.168 0.453 2
1 158 . 1 1 A 16 16 LEU N N 2439 119.633 122.049 -2.416 2
1 159 . 1 1 A 17 17 GLU H H 2440 7.505 7.913 -0.408 2
1 160 . 1 1 A 17 17 GLU HA H 2440 4.663 4.361 0.302 2
1 165 . 1 1 A 17 17 GLU C C 2440 178.126 177.033 1.093 2
1 166 . 1 1 A 17 17 GLU CA C 2440 56.447 56.664 -0.217 2
1 167 . 1 1 A 17 17 GLU CB C 2440 31.485 30.734 0.751 2
1 169 . 1 1 A 17 17 GLU N N 2440 114.368 116.166 -1.798 2
1 170 . 1 1 A 18 18 GLY H H 2441 7.921 7.427 0.494 2
1 171 . 1 1 A 18 18 GLY HA2 H 2441 4.889 4.146 0.743 2
1 172 . 1 1 A 18 18 GLY HA3 H 2441 3.707 4.172 -0.465 2
1 173 . 1 1 A 18 18 GLY C C 2441 170.965 172.118 -1.153 2
1 174 . 1 1 A 18 18 GLY CA C 2441 45.549 44.699 0.850 2
1 175 . 1 1 A 18 18 GLY N N 2441 109.165 106.342 2.823 2
1 176 . 1 1 A 19 19 GLY H H 2442 7.540 8.003 -0.463 2
1 177 . 1 1 A 19 19 GLY HA2 H 2442 4.086 4.206 -0.120 2
1 178 . 1 1 A 19 19 GLY HA3 H 2442 4.086 4.235 -0.149 2
1 179 . 1 1 A 19 19 GLY C C 2442 171.051 171.751 -0.700 2
1 180 . 1 1 A 19 19 GLY CA C 2442 44.937 45.651 -0.714 2
1 181 . 1 1 A 19 19 GLY N N 2442 105.460 108.129 -2.670 2
1 182 . 1 1 A 20 20 VAL H H 2443 8.899 8.306 0.593 2
1 183 . 1 1 A 20 20 VAL HA H 2443 5.062 4.803 0.260 2
1 191 . 1 1 A 20 20 VAL C C 2443 176.623 175.433 1.190 2
1 192 . 1 1 A 20 20 VAL CA C 2443 60.197 61.138 -0.941 2
1 193 . 1 1 A 20 20 VAL CB C 2443 35.107 33.935 1.172 2
1 196 . 1 1 A 20 20 VAL N N 2443 122.753 120.809 1.944 2
1 197 . 1 1 A 21 21 THR H H 2444 8.630 8.562 0.068 2
1 198 . 1 1 A 21 21 THR HA H 2444 3.773 4.206 -0.433 2
1 203 . 1 1 A 21 21 THR C C 2444 175.646 174.929 0.717 2
1 204 . 1 1 A 21 21 THR CA C 2444 62.732 62.904 -0.172 2
1 205 . 1 1 A 21 21 THR CB C 2444 68.925 68.663 0.262 2
1 207 . 1 1 A 21 21 THR N N 2444 118.179 119.265 -1.086 2
1 208 . 1 1 A 22 22 GLY H H 2445 8.736 8.887 -0.151 2
1 209 . 1 1 A 22 22 GLY HA2 H 2445 3.412 3.981 -0.569 2
1 210 . 1 1 A 22 22 GLY HA3 H 2445 4.061 3.983 0.078 2
1 211 . 1 1 A 22 22 GLY C C 2445 172.973 173.560 -0.587 2
1 212 . 1 1 A 22 22 GLY CA C 2445 45.577 45.273 0.303 2
1 213 . 1 1 A 22 22 GLY N N 2445 107.888 113.790 -5.902 2
1 214 . 1 1 A 23 23 ASN H H 2446 7.877 7.713 0.164 2
1 215 . 1 1 A 23 23 ASN HA H 2446 5.253 5.077 0.176 2
1 220 . 1 1 A 23 23 ASN CA C 2446 49.740 50.157 -0.417 2
1 221 . 1 1 A 23 23 ASN CB C 2446 40.198 39.405 0.793 2
1 222 . 1 1 A 23 23 ASN N N 2446 120.684 119.846 0.838 2
1 224 . 1 1 A 24 24 PRO HA H 2447 4.525 4.652 -0.127 2
1 231 . 1 1 A 24 24 PRO CA C 2447 62.766 62.347 0.419 2
1 232 . 1 1 A 24 24 PRO CB C 2447 31.732 32.200 -0.468 2
1 235 . 1 1 A 25 25 ALA H H 2448 9.178 8.229 0.949 2
1 236 . 1 1 A 25 25 ALA HA H 2448 4.614 4.862 -0.248 2
1 240 . 1 1 A 25 25 ALA C C 2448 175.503 175.709 -0.206 2
1 241 . 1 1 A 25 25 ALA CA C 2448 50.526 50.513 0.013 2
1 242 . 1 1 A 25 25 ALA CB C 2448 20.458 21.736 -1.278 2
1 243 . 1 1 A 25 25 ALA N N 2448 132.079 123.502 8.577 2
1 244 . 1 1 A 26 26 GLU H H 2449 8.813 8.988 -0.175 2
1 245 . 1 1 A 26 26 GLU HA H 2449 5.830 5.306 0.524 2
1 250 . 1 1 A 26 26 GLU C C 2449 176.272 174.823 1.449 2
1 251 . 1 1 A 26 26 GLU CA C 2449 54.376 54.874 -0.498 2
1 252 . 1 1 A 26 26 GLU CB C 2449 35.463 33.664 1.799 2
1 254 . 1 1 A 26 26 GLU N N 2449 120.079 119.879 0.200 2
1 255 . 1 1 A 27 27 PHE H H 2450 8.782 8.790 -0.008 2
1 256 . 1 1 A 27 27 PHE HA H 2450 5.021 5.165 -0.144 2
1 264 . 1 1 A 27 27 PHE C C 2450 171.205 172.093 -0.888 2
1 265 . 1 1 A 27 27 PHE CA C 2450 56.852 56.302 0.550 2
1 266 . 1 1 A 27 27 PHE CB C 2450 41.080 41.277 -0.197 2
1 270 . 1 1 A 27 27 PHE N N 2450 118.670 118.652 0.018 2
1 271 . 1 1 A 28 28 VAL H H 2451 8.961 9.190 -0.229 2
1 272 . 1 1 A 28 28 VAL HA H 2451 4.761 4.790 -0.029 2
1 280 . 1 1 A 28 28 VAL C C 2451 174.673 174.844 -0.171 2
1 281 . 1 1 A 28 28 VAL CA C 2451 60.619 60.436 0.183 2
1 282 . 1 1 A 28 28 VAL CB C 2451 35.484 34.504 0.980 2
1 285 . 1 1 A 28 28 VAL N N 2451 121.552 120.085 1.467 2
1 286 . 1 1 A 29 29 VAL H H 2452 9.294 9.273 0.021 2
1 287 . 1 1 A 29 29 VAL HA H 2452 4.363 4.408 -0.045 2
1 295 . 1 1 A 29 29 VAL C C 2452 174.218 175.017 -0.799 2
1 296 . 1 1 A 29 29 VAL CA C 2452 61.526 62.449 -0.923 2
1 297 . 1 1 A 29 29 VAL CB C 2452 32.666 31.347 1.319 2
1 300 . 1 1 A 29 29 VAL N N 2452 125.585 128.344 -2.759 2
1 301 . 1 1 A 30 30 ASN H H 2453 9.465 9.023 0.442 2
1 302 . 1 1 A 30 30 ASN HA H 2453 5.096 5.134 -0.038 2
1 307 . 1 1 A 30 30 ASN C C 2453 176.216 176.239 -0.023 2
1 308 . 1 1 A 30 30 ASN CA C 2453 52.011 52.646 -0.635 2
1 309 . 1 1 A 30 30 ASN CB C 2453 39.057 38.748 0.309 2
1 310 . 1 1 A 30 30 ASN N N 2453 127.724 127.052 0.671 2
1 312 . 1 1 A 31 31 THR H H 2454 8.915 8.426 0.489 2
1 313 . 1 1 A 31 31 THR HA H 2454 4.342 4.441 -0.099 2
1 318 . 1 1 A 31 31 THR C C 2454 176.816 176.232 0.584 2
1 319 . 1 1 A 31 31 THR CA C 2454 61.117 62.117 -1.000 2
1 320 . 1 1 A 31 31 THR CB C 2454 68.209 69.604 -1.395 2
1 322 . 1 1 A 31 31 THR N N 2454 117.783 116.943 0.840 2
1 323 . 1 1 A 32 32 SER H H 2455 8.454 7.980 0.474 2
1 324 . 1 1 A 32 32 SER HA H 2455 4.155 4.208 -0.053 2
1 327 . 1 1 A 32 32 SER C C 2455 175.458 175.811 -0.353 2
1 328 . 1 1 A 32 32 SER CA C 2455 62.148 62.126 0.022 2
1 329 . 1 1 A 32 32 SER CB C 2455 63.476 63.027 0.449 2
1 330 . 1 1 A 32 32 SER N N 2455 121.781 118.883 2.898 2
1 331 . 1 1 A 33 33 ASN H H 2456 8.845 8.140 0.705 2
1 332 . 1 1 A 33 33 ASN HA H 2456 5.064 4.575 0.489 2
1 337 . 1 1 A 33 33 ASN C C 2456 174.674 176.179 -1.505 2
1 338 . 1 1 A 33 33 ASN CA C 2456 53.067 54.961 -1.894 2
1 339 . 1 1 A 33 33 ASN CB C 2456 39.632 38.811 0.821 2
1 340 . 1 1 A 33 33 ASN N N 2456 120.176 118.606 1.570 2
1 342 . 1 1 A 34 34 ALA H H 2457 7.714 7.917 -0.203 2
1 343 . 1 1 A 34 34 ALA HA H 2457 4.482 4.495 -0.013 2
1 347 . 1 1 A 34 34 ALA C C 2457 177.582 177.990 -0.408 2
1 348 . 1 1 A 34 34 ALA CA C 2457 52.521 52.544 -0.022 2
1 349 . 1 1 A 34 34 ALA CB C 2457 22.252 20.922 1.331 2
1 350 . 1 1 A 34 34 ALA N N 2457 123.065 119.787 3.278 2
1 351 . 1 1 A 35 35 GLY H H 2458 8.195 8.024 0.171 2
1 352 . 1 1 A 35 35 GLY HA2 H 2458 4.246 4.107 0.139 2
1 353 . 1 1 A 35 35 GLY HA3 H 2458 3.902 4.124 -0.222 2
1 354 . 1 1 A 35 35 GLY C C 2458 173.360 173.239 0.121 2
1 355 . 1 1 A 35 35 GLY CA C 2458 44.486 45.045 -0.559 2
1 356 . 1 1 A 35 35 GLY N N 2458 108.472 104.840 3.632 2
1 357 . 1 1 A 36 36 ALA H H 2459 8.430 8.227 0.203 2
1 358 . 1 1 A 36 36 ALA HA H 2459 4.472 5.011 -0.539 2
1 362 . 1 1 A 36 36 ALA C C 2459 176.968 176.667 0.301 2
1 363 . 1 1 A 36 36 ALA CA C 2459 52.695 51.634 1.061 2
1 364 . 1 1 A 36 36 ALA CB C 2459 19.360 21.708 -2.348 2
1 365 . 1 1 A 36 36 ALA N N 2459 126.012 124.538 1.474 2
1 366 . 1 1 A 37 37 GLY H H 2460 7.781 8.494 -0.713 2
1 367 . 1 1 A 37 37 GLY HA2 H 2460 3.856 3.940 -0.084 2
1 368 . 1 1 A 37 37 GLY HA3 H 2460 3.164 4.085 -0.921 2
1 369 . 1 1 A 37 37 GLY C C 2460 170.730 171.826 -1.096 2
1 370 . 1 1 A 37 37 GLY CA C 2460 44.747 45.284 -0.537 2
1 371 . 1 1 A 37 37 GLY N N 2460 109.493 106.469 3.024 2
1 372 . 1 1 A 38 38 ALA H H 2461 8.055 7.959 0.096 2
1 373 . 1 1 A 38 38 ALA HA H 2461 4.389 4.681 -0.292 2
1 377 . 1 1 A 38 38 ALA C C 2461 176.609 176.243 0.366 2
1 378 . 1 1 A 38 38 ALA CA C 2461 51.419 51.548 -0.129 2
1 379 . 1 1 A 38 38 ALA CB C 2461 19.665 19.760 -0.095 2
1 380 . 1 1 A 38 38 ALA N N 2461 121.997 122.638 -0.641 2
1 381 . 1 1 A 39 39 LEU H H 2462 8.597 8.523 0.074 2
1 382 . 1 1 A 39 39 LEU HA H 2462 5.022 5.141 -0.119 2
1 392 . 1 1 A 39 39 LEU C C 2462 175.883 175.026 0.857 2
1 393 . 1 1 A 39 39 LEU CA C 2462 53.907 53.412 0.495 2
1 394 . 1 1 A 39 39 LEU CB C 2462 44.576 45.296 -0.720 2
1 398 . 1 1 A 39 39 LEU N N 2462 126.664 123.954 2.710 2
1 399 . 1 1 A 40 40 SER H H 2463 8.898 9.196 -0.298 2
1 400 . 1 1 A 40 40 SER HA H 2463 4.732 4.903 -0.171 2
1 403 . 1 1 A 40 40 SER C C 2463 172.984 172.957 0.027 2
1 404 . 1 1 A 40 40 SER CA C 2463 56.730 57.115 -0.385 2
1 405 . 1 1 A 40 40 SER CB C 2463 64.648 64.719 -0.071 2
1 406 . 1 1 A 40 40 SER N N 2463 122.932 121.480 1.452 2
1 407 . 1 1 A 41 41 VAL H H 2464 8.538 7.887 0.651 2
1 408 . 1 1 A 41 41 VAL HA H 2464 5.131 4.409 0.722 2
1 416 . 1 1 A 41 41 VAL C C 2464 174.812 174.555 0.257 2
1 417 . 1 1 A 41 41 VAL CA C 2464 60.784 62.244 -1.460 2
1 418 . 1 1 A 41 41 VAL CB C 2464 34.262 32.793 1.469 2
1 420 . 1 1 A 41 41 VAL N N 2464 129.161 122.774 6.387 2
1 421 . 1 1 A 42 42 THR H H 2465 8.807 8.816 -0.009 2
1 422 . 1 1 A 42 42 THR HA H 2465 4.573 5.060 -0.487 2
1 427 . 1 1 A 42 42 THR CA C 2465 60.408 61.328 -0.920 2
1 428 . 1 1 A 42 42 THR CB C 2465 71.764 71.878 -0.114 2
1 430 . 1 1 A 42 42 THR N N 2465 120.898 122.932 -2.034 2
1 431 . 1 1 A 43 43 ILE H H 2466 8.648 8.863 -0.215 2
1 432 . 1 1 A 43 43 ILE HA H 2466 4.854 4.883 -0.029 2
1 442 . 1 1 A 43 43 ILE C C 2466 174.073 174.212 -0.139 2
1 443 . 1 1 A 43 43 ILE CA C 2466 61.184 60.229 0.955 2
1 444 . 1 1 A 43 43 ILE CB C 2466 39.516 40.353 -0.837 2
1 448 . 1 1 A 43 43 ILE N N 2466 124.810 125.799 -0.989 2
1 449 . 1 1 A 44 44 ASP H H 2467 8.821 9.100 -0.279 2
1 450 . 1 1 A 44 44 ASP HA H 2467 5.217 5.493 -0.276 2
1 453 . 1 1 A 44 44 ASP C C 2467 175.002 175.296 -0.294 2
1 454 . 1 1 A 44 44 ASP CA C 2467 52.998 52.554 0.444 2
1 455 . 1 1 A 44 44 ASP CB C 2467 44.728 43.907 0.821 2
1 456 . 1 1 A 44 44 ASP N N 2467 129.093 128.227 0.866 2
1 457 . 1 1 A 45 45 GLY H H 2468 8.535 8.268 0.267 2
1 458 . 1 1 A 45 45 GLY HA2 H 2468 3.954 3.741 0.213 2
1 459 . 1 1 A 45 45 GLY HA3 H 2468 3.561 4.009 -0.448 2
1 460 . 1 1 A 45 45 GLY CA C 2468 45.659 44.951 0.708 2
1 461 . 1 1 A 45 45 GLY N N 2468 112.751 109.745 3.006 2
1 462 . 1 1 A 46 46 PRO HA H 2469 4.318 4.361 -0.043 2
1 469 . 1 1 A 46 46 PRO C C 2469 176.086 176.070 0.016 2
1 470 . 1 1 A 46 46 PRO CA C 2469 64.198 63.902 0.296 2
1 471 . 1 1 A 46 46 PRO CB C 2469 32.348 31.860 0.488 2
1 474 . 1 1 A 47 47 SER H H 2470 7.106 7.551 -0.445 2
1 475 . 1 1 A 47 47 SER HA H 2470 4.632 4.813 -0.181 2
1 478 . 1 1 A 47 47 SER C C 2470 172.969 173.135 -0.166 2
1 479 . 1 1 A 47 47 SER CA C 2470 57.106 57.245 -0.139 2
1 480 . 1 1 A 47 47 SER CB C 2470 66.262 66.733 -0.471 2
1 481 . 1 1 A 47 47 SER N N 2470 110.556 113.033 -2.477 2
1 482 . 1 1 A 48 48 LYS H H 2471 8.534 8.329 0.205 2
1 483 . 1 1 A 48 48 LYS HA H 2471 4.486 4.546 -0.060 2
1 492 . 1 1 A 48 48 LYS C C 2471 177.231 176.410 0.821 2
1 493 . 1 1 A 48 48 LYS CA C 2471 56.620 56.466 0.154 2
1 494 . 1 1 A 48 48 LYS CB C 2471 32.379 33.289 -0.910 2
1 498 . 1 1 A 48 48 LYS N N 2471 124.055 122.381 1.674 2
1 499 . 1 1 A 49 49 VAL H H 2472 8.497 8.611 -0.114 2
1 500 . 1 1 A 49 49 VAL HA H 2472 4.552 4.687 -0.135 2
1 508 . 1 1 A 49 49 VAL C C 2472 175.292 174.642 0.650 2
1 509 . 1 1 A 49 49 VAL CA C 2472 60.142 59.923 0.219 2
1 510 . 1 1 A 49 49 VAL CB C 2472 33.464 34.695 -1.231 2
1 513 . 1 1 A 49 49 VAL N N 2472 121.233 119.097 2.136 2
1 514 . 1 1 A 50 50 LYS H H 2473 8.190 8.426 -0.236 2
1 515 . 1 1 A 50 50 LYS HA H 2473 4.522 4.576 -0.054 2
1 518 . 1 1 A 50 50 LYS CA C 2473 55.952 55.789 0.163 2
1 519 . 1 1 A 50 50 LYS CB C 2473 32.896 32.381 0.515 2
1 520 . 1 1 A 50 50 LYS N N 2473 126.082 123.500 2.582 2
1 521 . 1 1 A 51 51 MET H H 2474 8.818 8.792 0.026 2
1 522 . 1 1 A 51 51 MET HA H 2474 5.324 5.085 0.239 2
1 530 . 1 1 A 51 51 MET C C 2474 173.933 174.535 -0.602 2
1 531 . 1 1 A 51 51 MET CA C 2474 54.848 54.813 0.035 2
1 532 . 1 1 A 51 51 MET CB C 2474 37.043 34.546 2.497 2
1 535 . 1 1 A 51 51 MET N N 2474 126.911 124.893 2.018 2
1 536 . 1 1 A 52 52 ASP H H 2475 9.095 9.119 -0.024 2
1 537 . 1 1 A 52 52 ASP HA H 2475 4.947 5.314 -0.367 2
1 540 . 1 1 A 52 52 ASP C C 2475 173.923 174.296 -0.373 2
1 541 . 1 1 A 52 52 ASP CA C 2475 53.487 52.891 0.597 2
1 542 . 1 1 A 52 52 ASP CB C 2475 44.765 44.085 0.680 2
1 543 . 1 1 A 52 52 ASP N N 2475 125.526 124.808 0.718 2
1 544 . 1 1 A 53 53 CYS H H 2476 8.606 8.941 -0.335 2
1 545 . 1 1 A 53 53 CYS HA H 2476 5.145 5.309 -0.164 2
1 548 . 1 1 A 53 53 CYS C C 2476 173.330 173.547 -0.217 2
1 549 . 1 1 A 53 53 CYS CA C 2476 57.452 57.562 -0.110 2
1 550 . 1 1 A 53 53 CYS CB C 2476 28.108 30.503 -2.395 2
1 551 . 1 1 A 53 53 CYS N N 2476 124.317 123.493 0.824 2
1 552 . 1 1 A 54 54 GLN H H 2477 8.978 8.903 0.075 2
1 553 . 1 1 A 54 54 GLN HA H 2477 4.884 4.887 -0.003 2
1 560 . 1 1 A 54 54 GLN C C 2477 174.854 174.271 0.583 2
1 561 . 1 1 A 54 54 GLN CA C 2477 53.891 54.619 -0.728 2
1 562 . 1 1 A 54 54 GLN CB C 2477 32.837 32.753 0.084 2
1 564 . 1 1 A 54 54 GLN N N 2477 127.074 123.941 3.133 2
1 566 . 1 1 A 55 55 GLU H H 2478 9.065 8.719 0.346 2
1 567 . 1 1 A 55 55 GLU HA H 2478 4.280 4.628 -0.348 2
1 572 . 1 1 A 55 55 GLU C C 2478 175.383 175.761 -0.378 2
1 573 . 1 1 A 55 55 GLU CA C 2478 57.516 56.197 1.319 2
1 574 . 1 1 A 55 55 GLU CB C 2478 30.346 30.727 -0.381 2
1 576 . 1 1 A 55 55 GLU N N 2478 125.186 122.621 2.565 2
1 577 . 1 1 A 56 56 CYS H H 2479 8.407 8.458 -0.051 2
1 578 . 1 1 A 56 56 CYS HA H 2479 5.056 4.738 0.318 2
1 581 . 1 1 A 56 56 CYS CA C 2479 55.858 56.837 -0.979 2
1 582 . 1 1 A 56 56 CYS CB C 2479 28.676 30.296 -1.620 2
1 583 . 1 1 A 56 56 CYS N N 2479 121.499 121.537 -0.038 2
1 584 . 1 1 A 57 57 PRO HA H 2480 4.159 4.295 -0.136 2
1 591 . 1 1 A 57 57 PRO C C 2480 177.964 177.697 0.267 2
1 592 . 1 1 A 57 57 PRO CA C 2480 66.877 64.724 2.153 2
1 593 . 1 1 A 57 57 PRO CB C 2480 31.709 31.925 -0.216 2
1 596 . 1 1 A 58 58 GLU H H 2481 8.900 8.173 0.727 2
1 597 . 1 1 A 58 58 GLU HA H 2481 4.201 4.361 -0.160 2
1 602 . 1 1 A 58 58 GLU C C 2481 175.129 176.499 -1.370 2
1 603 . 1 1 A 58 58 GLU CA C 2481 57.883 56.991 0.892 2
1 604 . 1 1 A 58 58 GLU CB C 2481 29.991 30.234 -0.243 2
1 606 . 1 1 A 58 58 GLU N N 2481 115.316 117.788 -2.472 2
1 607 . 1 1 A 59 59 GLY H H 2482 7.527 7.337 0.190 2
1 608 . 1 1 A 59 59 GLY HA2 H 2482 4.935 3.979 0.956 2
1 609 . 1 1 A 59 59 GLY HA3 H 2482 3.381 4.088 -0.707 2
1 610 . 1 1 A 59 59 GLY CA C 2482 47.809 44.403 3.406 2
1 611 . 1 1 A 59 59 GLY N N 2482 110.079 107.652 2.427 2
1 612 . 1 1 A 60 60 TYR H H 2483 8.990 8.338 0.652 2
1 613 . 1 1 A 60 60 TYR HA H 2483 5.157 4.907 0.250 2
1 618 . 1 1 A 60 60 TYR C C 2483 175.096 174.792 0.304 2
1 619 . 1 1 A 60 60 TYR CA C 2483 57.375 57.955 -0.580 2
1 620 . 1 1 A 60 60 TYR CB C 2483 43.153 39.515 3.638 2
1 622 . 1 1 A 60 60 TYR N N 2483 125.900 121.775 4.125 2
1 623 . 1 1 A 61 61 ARG H H 2484 9.557 8.871 0.686 2
1 624 . 1 1 A 61 61 ARG HA H 2484 4.858 4.672 0.186 2
1 631 . 1 1 A 61 61 ARG CA C 2484 55.016 55.689 -0.673 2
1 632 . 1 1 A 61 61 ARG CB C 2484 32.128 31.394 0.734 2
1 635 . 1 1 A 61 61 ARG N N 2484 124.847 126.072 -1.225 2
1 636 . 1 1 A 62 62 VAL H H 2485 9.046 8.871 0.175 2
1 637 . 1 1 A 62 62 VAL HA H 2485 4.675 4.769 -0.094 2
1 645 . 1 1 A 62 62 VAL C C 2485 173.837 174.675 -0.838 2
1 646 . 1 1 A 62 62 VAL CA C 2485 60.752 60.597 0.155 2
1 647 . 1 1 A 62 62 VAL CB C 2485 32.459 33.926 -1.467 2
1 650 . 1 1 A 62 62 VAL N N 2485 132.205 124.926 7.279 2
1 651 . 1 1 A 63 63 THR H H 2486 8.474 8.770 -0.296 2
1 652 . 1 1 A 63 63 THR HA H 2486 5.392 5.320 0.072 2
1 657 . 1 1 A 63 63 THR C C 2486 173.675 173.574 0.101 2
1 658 . 1 1 A 63 63 THR CA C 2486 60.008 61.411 -1.403 2
1 659 . 1 1 A 63 63 THR CB C 2486 71.035 71.217 -0.182 2
1 661 . 1 1 A 63 63 THR N N 2486 121.216 121.956 -0.740 2
1 662 . 1 1 A 64 64 TYR H H 2487 9.409 9.027 0.382 2
1 663 . 1 1 A 64 64 TYR HA H 2487 5.617 5.575 0.042 2
1 670 . 1 1 A 64 64 TYR C C 2487 172.847 172.643 0.204 2
1 671 . 1 1 A 64 64 TYR CA C 2487 55.557 55.785 -0.228 2
1 672 . 1 1 A 64 64 TYR CB C 2487 41.968 41.845 0.123 2
1 675 . 1 1 A 64 64 TYR N N 2487 124.061 122.137 1.924 2
1 676 . 1 1 A 65 65 THR H H 2488 8.145 8.858 -0.713 2
1 677 . 1 1 A 65 65 THR HA H 2488 4.959 4.612 0.347 2
1 682 . 1 1 A 65 65 THR CA C 2488 58.532 58.982 -0.450 2
1 683 . 1 1 A 65 65 THR CB C 2488 70.141 70.317 -0.176 2
1 685 . 1 1 A 65 65 THR N N 2488 117.924 116.826 1.098 2
1 686 . 1 1 A 66 66 PRO HA H 2489 4.602 4.765 -0.163 2
1 693 . 1 1 A 66 66 PRO C C 2489 176.647 176.662 -0.015 2
1 694 . 1 1 A 66 66 PRO CA C 2489 61.442 62.290 -0.848 2
1 695 . 1 1 A 66 66 PRO CB C 2489 32.715 32.755 -0.040 2
1 698 . 1 1 A 67 67 MET H H 2490 8.832 8.325 0.507 2
1 699 . 1 1 A 67 67 MET HA H 2490 4.880 4.726 0.154 2
1 707 . 1 1 A 67 67 MET C C 2490 174.121 175.870 -1.749 2
1 708 . 1 1 A 67 67 MET CA C 2490 53.848 54.936 -1.088 2
1 709 . 1 1 A 67 67 MET CB C 2490 33.727 33.823 -0.096 2
1 712 . 1 1 A 67 67 MET N N 2490 119.212 117.718 1.494 2
1 713 . 1 1 A 68 68 ALA H H 2491 7.086 7.565 -0.479 2
1 714 . 1 1 A 68 68 ALA HA H 2491 4.851 4.840 0.011 2
1 718 . 1 1 A 68 68 ALA CA C 2491 49.222 49.876 -0.654 2
1 719 . 1 1 A 68 68 ALA CB C 2491 20.600 22.037 -1.437 2
1 720 . 1 1 A 68 68 ALA N N 2491 120.363 120.855 -0.492 2
1 721 . 1 1 A 69 69 PRO HA H 2492 4.263 4.665 -0.402 2
1 728 . 1 1 A 69 69 PRO C C 2492 174.370 176.262 -1.892 2
1 729 . 1 1 A 69 69 PRO CA C 2492 62.555 63.246 -0.691 2
1 730 . 1 1 A 69 69 PRO CB C 2492 32.752 32.892 -0.140 2
1 733 . 1 1 A 70 70 GLY H H 2493 8.858 8.303 0.555 2
1 734 . 1 1 A 70 70 GLY HA2 H 2493 4.544 4.073 0.471 2
1 735 . 1 1 A 70 70 GLY HA3 H 2493 3.849 4.120 -0.271 2
1 736 . 1 1 A 70 70 GLY C C 2493 172.182 172.390 -0.208 2
1 737 . 1 1 A 70 70 GLY CA C 2493 44.356 44.334 0.021 2
1 738 . 1 1 A 70 70 GLY N N 2493 106.539 108.723 -2.184 2
1 739 . 1 1 A 71 71 SER H H 2494 8.490 8.282 0.208 2
1 740 . 1 1 A 71 71 SER HA H 2494 5.280 5.276 0.004 2
1 743 . 1 1 A 71 71 SER C C 2494 173.512 173.226 0.286 2
1 744 . 1 1 A 71 71 SER CA C 2494 57.674 57.853 -0.179 2
1 745 . 1 1 A 71 71 SER CB C 2494 63.799 64.707 -0.909 2
1 746 . 1 1 A 71 71 SER N N 2494 117.964 116.593 1.371 2
1 747 . 1 1 A 72 72 TYR H H 2495 9.320 9.513 -0.193 2
1 748 . 1 1 A 72 72 TYR HA H 2495 4.960 5.265 -0.305 2
1 755 . 1 1 A 72 72 TYR C C 2495 173.979 174.908 -0.929 2
1 756 . 1 1 A 72 72 TYR CA C 2495 56.384 57.007 -0.623 2
1 757 . 1 1 A 72 72 TYR CB C 2495 40.247 40.294 -0.047 2
1 760 . 1 1 A 72 72 TYR N N 2495 126.442 125.552 0.891 2
1 761 . 1 1 A 73 73 LEU H H 2496 9.019 9.014 0.005 2
1 762 . 1 1 A 73 73 LEU HA H 2496 5.209 4.967 0.242 2
1 772 . 1 1 A 73 73 LEU C C 2496 177.015 174.940 2.075 2
1 773 . 1 1 A 73 73 LEU CA C 2496 53.393 54.036 -0.643 2
1 774 . 1 1 A 73 73 LEU CB C 2496 43.918 43.412 0.506 2
1 778 . 1 1 A 73 73 LEU N N 2496 125.439 125.628 -0.189 2
1 779 . 1 1 A 74 74 ILE H H 2497 9.921 9.605 0.316 2
1 780 . 1 1 A 74 74 ILE HA H 2497 5.128 4.664 0.464 2
1 790 . 1 1 A 74 74 ILE C C 2497 175.730 174.981 0.749 2
1 791 . 1 1 A 74 74 ILE CA C 2497 60.930 60.412 0.518 2
1 792 . 1 1 A 74 74 ILE CB C 2497 39.488 37.650 1.838 2
1 796 . 1 1 A 74 74 ILE N N 2497 132.185 129.191 2.994 2
1 797 . 1 1 A 75 75 SER H H 2498 9.284 9.099 0.185 2
1 798 . 1 1 A 75 75 SER HA H 2498 5.111 5.048 0.063 2
1 801 . 1 1 A 75 75 SER C C 2498 173.449 173.557 -0.108 2
1 802 . 1 1 A 75 75 SER CA C 2498 58.260 58.134 0.126 2
1 803 . 1 1 A 75 75 SER CB C 2498 63.956 62.957 0.999 2
1 804 . 1 1 A 75 75 SER N N 2498 125.384 124.844 0.540 2
1 805 . 1 1 A 76 76 ILE H H 2499 9.861 8.956 0.905 2
1 806 . 1 1 A 76 76 ILE HA H 2499 4.814 4.679 0.135 2
1 816 . 1 1 A 76 76 ILE CA C 2499 61.034 61.015 0.019 2
1 817 . 1 1 A 76 76 ILE CB C 2499 40.387 37.978 2.409 2
1 821 . 1 1 A 76 76 ILE N N 2499 129.414 127.187 2.227 2
1 822 . 1 1 A 77 77 LYS H H 2500 8.827 8.949 -0.122 2
1 823 . 1 1 A 77 77 LYS HA H 2500 5.254 5.246 0.008 2
1 832 . 1 1 A 77 77 LYS C C 2500 175.245 175.154 0.091 2
1 833 . 1 1 A 77 77 LYS CA C 2500 54.388 54.828 -0.440 2
1 834 . 1 1 A 77 77 LYS CB C 2500 36.127 35.284 0.843 2
1 838 . 1 1 A 77 77 LYS N N 2500 126.922 127.156 -0.234 2
1 839 . 1 1 A 78 78 TYR H H 2501 8.408 8.950 -0.542 2
1 840 . 1 1 A 78 78 TYR HA H 2501 5.479 5.048 0.431 2
1 847 . 1 1 A 78 78 TYR C C 2501 174.792 175.604 -0.812 2
1 848 . 1 1 A 78 78 TYR CA C 2501 56.837 57.294 -0.457 2
1 849 . 1 1 A 78 78 TYR CB C 2501 44.008 42.083 1.925 2
1 852 . 1 1 A 78 78 TYR N N 2501 122.282 124.467 -2.185 2
1 853 . 1 1 A 79 79 GLY H H 2502 8.196 8.544 -0.348 2
1 854 . 1 1 A 79 79 GLY HA2 H 2502 4.040 3.661 0.379 2
1 855 . 1 1 A 79 79 GLY HA3 H 2502 3.465 3.822 -0.357 2
1 856 . 1 1 A 79 79 GLY C C 2502 173.932 173.614 0.318 2
1 857 . 1 1 A 79 79 GLY CA C 2502 45.741 45.920 -0.179 2
1 858 . 1 1 A 79 79 GLY N N 2502 113.451 114.021 -0.570 2
1 859 . 1 1 A 80 80 GLY H H 2503 7.589 8.126 -0.537 2
1 860 . 1 1 A 80 80 GLY HA2 H 2503 4.490 4.032 0.458 2
1 861 . 1 1 A 80 80 GLY HA3 H 2503 3.555 4.119 -0.564 2
1 862 . 1 1 A 80 80 GLY CA C 2503 43.540 44.261 -0.721 2
1 863 . 1 1 A 80 80 GLY N N 2503 107.293 107.435 -0.142 2
1 864 . 1 1 A 81 81 PRO HA H 2504 4.320 4.356 -0.036 2
1 871 . 1 1 A 81 81 PRO C C 2504 175.311 175.309 0.002 2
1 872 . 1 1 A 81 81 PRO CA C 2504 62.722 63.407 -0.685 2
1 873 . 1 1 A 81 81 PRO CB C 2504 29.297 31.565 -2.268 2
1 876 . 1 1 A 82 82 TYR H H 2505 7.778 7.359 0.419 2
1 877 . 1 1 A 82 82 TYR HA H 2505 4.791 4.971 -0.180 2
1 884 . 1 1 A 82 82 TYR C C 2505 175.086 175.833 -0.747 2
1 885 . 1 1 A 82 82 TYR CA C 2505 56.111 56.791 -0.680 2
1 886 . 1 1 A 82 82 TYR CB C 2505 39.483 40.880 -1.397 2
1 889 . 1 1 A 82 82 TYR N N 2505 123.973 120.918 3.055 2
1 890 . 1 1 A 83 83 HIS H H 2506 8.625 9.021 -0.396 2
1 891 . 1 1 A 83 83 HIS HA H 2506 4.583 4.912 -0.329 2
1 896 . 1 1 A 83 83 HIS C C 2506 178.161 175.960 2.201 2
1 897 . 1 1 A 83 83 HIS CA C 2506 58.241 57.251 0.990 2
1 898 . 1 1 A 83 83 HIS CB C 2506 33.132 30.560 2.572 2
1 901 . 1 1 A 83 83 HIS N N 2506 124.092 121.480 2.612 2
1 902 . 1 1 A 84 84 ILE H H 2507 8.327 8.597 -0.270 2
1 903 . 1 1 A 84 84 ILE HA H 2507 4.553 4.357 0.196 2
1 913 . 1 1 A 84 84 ILE C C 2507 176.523 176.398 0.125 2
1 914 . 1 1 A 84 84 ILE CA C 2507 60.791 60.144 0.647 2
1 915 . 1 1 A 84 84 ILE CB C 2507 39.162 39.679 -0.517 2
1 919 . 1 1 A 84 84 ILE N N 2507 117.355 119.661 -2.306 2
1 920 . 1 1 A 85 85 GLY H H 2508 9.130 8.546 0.584 2
1 921 . 1 1 A 85 85 GLY HA2 H 2508 3.883 3.773 0.110 2
1 922 . 1 1 A 85 85 GLY HA3 H 2508 3.800 3.791 0.009 2
1 923 . 1 1 A 85 85 GLY C C 2508 174.438 175.323 -0.885 2
1 924 . 1 1 A 85 85 GLY CA C 2508 47.673 46.858 0.815 2
1 925 . 1 1 A 85 85 GLY N N 2508 111.346 110.352 0.995 2
1 926 . 1 1 A 86 86 GLY H H 2509 8.236 8.410 -0.174 2
1 927 . 1 1 A 86 86 GLY HA2 H 2509 3.893 3.845 0.048 2
1 928 . 1 1 A 86 86 GLY HA3 H 2509 3.161 3.893 -0.732 2
1 929 . 1 1 A 86 86 GLY C C 2509 171.837 173.331 -1.494 2
1 930 . 1 1 A 86 86 GLY CA C 2509 44.844 45.203 -0.359 2
1 931 . 1 1 A 86 86 GLY N N 2509 115.594 116.737 -1.143 2
1 932 . 1 1 A 87 87 SER H H 2510 7.385 7.808 -0.423 2
1 933 . 1 1 A 87 87 SER HA H 2510 4.217 4.134 0.083 2
1 936 . 1 1 A 87 87 SER CA C 2510 54.783 55.416 -0.633 2
1 937 . 1 1 A 87 87 SER CB C 2510 62.683 63.974 -1.291 2
1 938 . 1 1 A 87 87 SER N N 2510 112.859 116.647 -3.788 2
1 939 . 1 1 A 88 88 PRO HA H 2511 5.532 4.787 0.745 2
1 946 . 1 1 A 88 88 PRO C C 2511 175.870 175.348 0.522 2
1 947 . 1 1 A 88 88 PRO CA C 2511 62.379 62.265 0.114 2
1 948 . 1 1 A 88 88 PRO CB C 2511 33.639 32.311 1.328 2
1 951 . 1 1 A 89 89 PHE H H 2512 9.359 8.617 0.742 2
1 952 . 1 1 A 89 89 PHE HA H 2512 4.467 4.829 -0.362 2
1 960 . 1 1 A 89 89 PHE C C 2512 175.152 175.441 -0.289 2
1 961 . 1 1 A 89 89 PHE CA C 2512 57.401 57.194 0.207 2
1 962 . 1 1 A 89 89 PHE CB C 2512 40.843 40.973 -0.130 2
1 966 . 1 1 A 89 89 PHE N N 2512 124.789 119.783 5.006 2
1 967 . 1 1 A 90 90 LYS H H 2513 8.772 8.681 0.091 2
1 968 . 1 1 A 90 90 LYS HA H 2513 4.941 4.612 0.329 2
1 973 . 1 1 A 90 90 LYS C C 2513 174.183 175.721 -1.538 2
1 974 . 1 1 A 90 90 LYS CA C 2513 55.749 55.976 -0.227 2
1 975 . 1 1 A 90 90 LYS CB C 2513 32.817 32.508 0.309 2
1 978 . 1 1 A 90 90 LYS N N 2513 125.133 121.905 3.228 2
1 979 . 1 1 A 91 91 ALA H H 2514 9.158 8.427 0.731 2
1 980 . 1 1 A 91 91 ALA HA H 2514 4.510 4.612 -0.102 2
1 984 . 1 1 A 91 91 ALA C C 2514 176.561 176.861 -0.300 2
1 985 . 1 1 A 91 91 ALA CA C 2514 50.528 52.031 -1.503 2
1 986 . 1 1 A 91 91 ALA CB C 2514 20.653 19.570 1.083 2
1 987 . 1 1 A 91 91 ALA N N 2514 131.989 125.994 5.995 2
1 988 . 1 1 A 92 92 LYS H H 2515 8.186 8.858 -0.672 2
1 989 . 1 1 A 92 92 LYS HA H 2515 4.926 4.859 0.067 2
1 998 . 1 1 A 92 92 LYS C C 2515 175.177 175.785 -0.608 2
1 999 . 1 1 A 92 92 LYS CA C 2515 55.725 55.711 0.014 2
1 1000 . 1 1 A 92 92 LYS CB C 2515 33.765 33.581 0.184 2
1 1004 . 1 1 A 92 92 LYS N N 2515 124.887 123.757 1.130 2
1 1005 . 1 1 A 93 93 VAL H H 2516 9.362 9.255 0.107 2
1 1006 . 1 1 A 93 93 VAL HA H 2516 5.161 5.138 0.023 2
1 1014 . 1 1 A 93 93 VAL C C 2516 176.988 175.224 1.764 2
1 1015 . 1 1 A 93 93 VAL CA C 2516 60.523 60.928 -0.405 2
1 1016 . 1 1 A 93 93 VAL CB C 2516 33.291 34.706 -1.415 2
1 1019 . 1 1 A 93 93 VAL N N 2516 129.943 122.918 7.025 2
1 1020 . 1 1 A 94 94 THR H H 2517 8.614 8.663 -0.049 2
1 1021 . 1 1 A 94 94 THR HA H 2517 4.902 4.891 0.011 2
1 1026 . 1 1 A 94 94 THR C C 2517 172.759 173.267 -0.508 2
1 1027 . 1 1 A 94 94 THR CA C 2517 60.121 59.849 0.272 2
1 1028 . 1 1 A 94 94 THR CB C 2517 71.072 71.473 -0.401 2
1 1030 . 1 1 A 94 94 THR N N 2517 122.032 115.453 6.579 2
1 1031 . 1 1 A 95 95 GLY H H 2518 8.280 8.452 -0.172 2
1 1032 . 1 1 A 95 95 GLY HA2 H 2518 3.852 4.137 -0.285 2
1 1033 . 1 1 A 95 95 GLY HA3 H 2518 4.846 4.141 0.705 2
1 1034 . 1 1 A 95 95 GLY CA C 2518 43.955 44.378 -0.423 2
1 1035 . 1 1 A 95 95 GLY N N 2518 107.949 107.916 0.033 2
1 1036 . 1 1 A 96 96 PRO HA H 2519 4.449 4.657 -0.208 2
1 1043 . 1 1 A 96 96 PRO C C 2519 176.892 176.381 0.511 2
1 1044 . 1 1 A 96 96 PRO CA C 2519 62.062 62.716 -0.654 2
1 1045 . 1 1 A 96 96 PRO CB C 2519 32.286 32.413 -0.127 2
1 1048 . 1 1 A 97 97 ARG H H 2520 8.651 8.590 0.061 2
1 1049 . 1 1 A 97 97 ARG HA H 2520 4.348 4.463 -0.115 2
1 1056 . 1 1 A 97 97 ARG C C 2520 176.236 176.297 -0.061 2
1 1057 . 1 1 A 97 97 ARG CA C 2520 57.587 56.547 1.040 2
1 1058 . 1 1 A 97 97 ARG CB C 2520 30.472 31.010 -0.538 2
1 1061 . 1 1 A 97 97 ARG N N 2520 120.781 122.012 -1.231 2
1 1062 . 1 1 A 98 98 LEU H H 2521 8.545 8.755 -0.210 2
1 1063 . 1 1 A 98 98 LEU HA H 2521 4.577 4.260 0.317 2
1 1073 . 1 1 A 98 98 LEU C C 2521 175.880 177.434 -1.554 2
1 1074 . 1 1 A 98 98 LEU CA C 2521 55.068 56.255 -1.187 2
1 1075 . 1 1 A 98 98 LEU CB C 2521 43.082 41.776 1.306 2
1 1079 . 1 1 A 98 98 LEU N N 2521 128.715 126.206 2.509 2
stop_
save_