data_18990 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18990 _Entry.PDB_ID 2M48 save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 18990 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_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.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 343 343 GLU N N 343 121.045 121.045 124.241 -3.196 18990 2 1 1 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.655 -0.490 18990 3 1 1 . 1 1 343 343 GLU C C 343 176.529 176.529 174.908 1.621 18990 4 1 1 . 1 1 343 343 GLU CA C 343 57.162 57.162 56.431 0.731 18990 5 1 1 . 1 1 343 343 GLU CB C 343 30.204 30.204 30.051 0.153 18990 6 1 1 . 1 1 343 343 GLU H H 343 8.293 8.293 8.591 -0.298 18990 7 1 1 . 1 1 344 344 TYR N N 344 121.000 121.000 121.607 -0.607 18990 8 1 1 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.675 -0.137 18990 9 1 1 . 1 1 344 344 TYR C C 344 175.897 175.897 174.375 1.522 18990 10 1 1 . 1 1 344 344 TYR CA C 344 58.179 58.179 58.141 0.038 18990 11 1 1 . 1 1 344 344 TYR CB C 344 38.600 38.600 40.293 -1.693 18990 12 1 1 . 1 1 344 344 TYR H H 344 8.040 8.040 8.198 -0.158 18990 13 1 1 . 1 1 345 345 VAL N N 345 121.900 121.900 127.899 -5.999 18990 14 1 1 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.266 -0.327 18990 15 1 1 . 1 1 345 345 VAL C C 345 176.143 176.143 174.769 1.374 18990 16 1 1 . 1 1 345 345 VAL CA C 345 62.867 62.867 62.200 0.667 18990 17 1 1 . 1 1 345 345 VAL CB C 345 32.799 32.799 31.828 0.971 18990 18 1 1 . 1 1 345 345 VAL H H 345 7.856 7.856 8.090 -0.234 18990 19 1 1 . 1 1 346 346 LEU N N 346 124.950 124.950 126.430 -1.480 18990 20 1 1 . 1 1 346 346 LEU HA H 346 4.243 4.243 5.012 -0.769 18990 21 1 1 . 1 1 346 346 LEU C C 346 177.747 177.747 175.158 2.589 18990 22 1 1 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.033 1.467 18990 23 1 1 . 1 1 346 346 LEU CB C 346 42.252 42.252 43.995 -1.743 18990 24 1 1 . 1 1 346 346 LEU H H 346 8.127 8.127 8.355 -0.228 18990 25 1 1 . 1 1 347 347 GLN N N 347 121.452 121.452 118.470 2.982 18990 26 1 1 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.594 -0.308 18990 27 1 1 . 1 1 347 347 GLN C C 347 175.833 175.833 174.084 1.749 18990 28 1 1 . 1 1 347 347 GLN CA C 347 55.988 55.988 54.773 1.215 18990 29 1 1 . 1 1 347 347 GLN CB C 347 29.375 29.375 30.916 -1.540 18990 30 1 1 . 1 1 347 347 GLN H H 347 8.270 8.270 8.399 -0.129 18990 31 1 1 . 1 1 348 348 ALA N N 348 124.466 124.466 125.139 -0.673 18990 32 1 1 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.655 -0.334 18990 33 1 1 . 1 1 348 348 ALA C C 348 177.929 177.929 177.387 0.542 18990 34 1 1 . 1 1 348 348 ALA CA C 348 52.703 52.703 51.671 1.032 18990 35 1 1 . 1 1 348 348 ALA CB C 348 19.002 19.002 20.135 -1.133 18990 36 1 1 . 1 1 348 348 ALA H H 348 8.227 8.227 8.583 -0.356 18990 37 1 1 . 1 1 349 349 GLY N N 349 108.193 108.193 106.814 1.379 18990 38 1 1 . 1 1 349 349 GLY C C 349 174.269 174.269 174.001 0.268 18990 39 1 1 . 1 1 349 349 GLY CA C 349 45.227 45.227 45.137 0.090 18990 40 1 1 . 1 1 349 349 GLY H H 349 8.298 8.298 8.269 0.029 18990 41 1 1 . 1 1 350 350 GLY N N 350 108.073 108.073 109.962 -1.889 18990 42 1 1 . 1 1 350 350 GLY C C 350 172.979 172.979 172.817 0.162 18990 43 1 1 . 1 1 350 350 GLY CA C 350 44.935 44.935 44.335 0.600 18990 44 1 1 . 1 1 350 350 GLY H H 350 8.156 8.156 8.442 -0.286 18990 45 1 1 . 1 1 351 351 VAL N N 351 119.058 119.058 118.075 0.983 18990 46 1 1 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.485 -0.069 18990 47 1 1 . 1 1 351 351 VAL C C 351 173.412 173.412 173.599 -0.187 18990 48 1 1 . 1 1 351 351 VAL CA C 351 60.663 60.663 60.813 -0.150 18990 49 1 1 . 1 1 351 351 VAL CB C 351 34.866 34.866 35.292 -0.426 18990 50 1 1 . 1 1 351 351 VAL H H 351 8.541 8.541 8.630 -0.089 18990 51 1 1 . 1 1 352 352 LEU N N 352 125.800 125.800 121.950 3.850 18990 52 1 1 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.637 0.128 18990 53 1 1 . 1 1 352 352 LEU C C 352 176.218 176.218 175.694 0.524 18990 54 1 1 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.596 -0.255 18990 55 1 1 . 1 1 352 352 LEU CB C 352 42.706 42.706 45.066 -2.360 18990 56 1 1 . 1 1 352 352 LEU H H 352 8.151 8.151 8.469 -0.318 18990 57 1 1 . 1 1 353 353 CYS N N 353 126.825 126.825 123.552 3.273 18990 58 1 1 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.313 -0.206 18990 59 1 1 . 1 1 353 353 CYS C C 353 176.655 176.655 174.303 2.352 18990 60 1 1 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.081 0.650 18990 61 1 1 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.730 4.135 18990 62 1 1 . 1 1 353 353 CYS H H 353 8.794 8.794 8.533 0.261 18990 63 1 1 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.387 0.033 18990 64 1 1 . 1 1 354 354 PRO C C 354 177.512 177.512 175.746 1.766 18990 65 1 1 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.261 -0.269 18990 66 1 1 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.385 1.182 18990 67 1 1 . 1 1 355 355 GLN N N 355 126.800 126.800 120.285 6.515 18990 68 1 1 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.549 -0.274 18990 69 1 1 . 1 1 355 355 GLN C C 355 175.516 175.516 175.263 0.253 18990 70 1 1 . 1 1 355 355 GLN CA C 355 54.793 54.793 53.154 1.639 18990 71 1 1 . 1 1 355 355 GLN CB C 355 28.547 28.547 30.186 -1.639 18990 72 1 1 . 1 1 355 355 GLN H H 355 9.033 9.033 7.472 1.561 18990 73 1 1 . 1 1 357 357 GLY C C 357 173.229 173.229 174.212 -0.983 18990 74 1 1 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.422 0.832 18990 75 1 1 . 1 1 358 358 CYS N N 358 123.500 123.500 119.222 4.278 18990 76 1 1 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.585 -0.052 18990 77 1 1 . 1 1 358 358 CYS C C 358 176.157 176.157 174.060 2.097 18990 78 1 1 . 1 1 358 358 CYS CA C 358 60.268 60.268 57.999 2.269 18990 79 1 1 . 1 1 358 358 CYS CB C 358 29.375 29.375 29.368 0.007 18990 80 1 1 . 1 1 358 358 CYS H H 358 7.720 7.720 7.663 0.057 18990 81 1 1 . 1 1 359 359 GLY N N 359 104.400 104.400 109.076 -4.676 18990 82 1 1 . 1 1 359 359 GLY C C 359 174.080 174.080 175.258 -1.178 18990 83 1 1 . 1 1 359 359 GLY CA C 359 46.064 46.064 45.213 0.851 18990 84 1 1 . 1 1 359 359 GLY H H 359 7.756 7.756 8.509 -0.753 18990 85 1 1 . 1 1 360 360 MET N N 360 121.300 121.300 119.007 2.293 18990 86 1 1 . 1 1 360 360 MET HA H 360 4.343 4.343 4.202 0.141 18990 87 1 1 . 1 1 360 360 MET C C 360 175.641 175.641 176.932 -1.291 18990 88 1 1 . 1 1 360 360 MET CA C 360 55.923 55.923 57.370 -1.447 18990 89 1 1 . 1 1 360 360 MET CB C 360 33.091 33.091 33.241 -0.150 18990 90 1 1 . 1 1 360 360 MET H H 360 8.229 8.229 7.883 0.346 18990 91 1 1 . 1 1 361 361 GLY N N 361 109.000 109.000 105.053 3.947 18990 92 1 1 . 1 1 361 361 GLY C C 361 173.774 173.774 173.118 0.656 18990 93 1 1 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.347 1.491 18990 94 1 1 . 1 1 361 361 GLY H H 361 8.347 8.347 7.827 0.520 18990 95 1 1 . 1 1 362 362 LEU N N 362 126.725 126.725 124.963 1.762 18990 96 1 1 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.845 -0.170 18990 97 1 1 . 1 1 362 362 LEU C C 362 175.865 175.865 175.441 0.424 18990 98 1 1 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.289 0.900 18990 99 1 1 . 1 1 362 362 LEU CB C 362 44.050 44.050 43.870 0.180 18990 100 1 1 . 1 1 362 362 LEU H H 362 8.935 8.935 8.758 0.177 18990 101 1 1 . 1 1 363 363 LEU N N 363 123.742 123.742 126.337 -2.595 18990 102 1 1 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.648 0.029 18990 103 1 1 . 1 1 363 363 LEU C C 363 176.162 176.162 175.144 1.018 18990 104 1 1 . 1 1 363 363 LEU CA C 363 54.342 54.342 53.746 0.596 18990 105 1 1 . 1 1 363 363 LEU CB C 363 42.210 42.210 43.006 -0.796 18990 106 1 1 . 1 1 363 363 LEU H H 363 8.481 8.481 8.699 -0.218 18990 107 1 1 . 1 1 364 364 VAL N N 364 120.980 120.980 127.674 -6.694 18990 108 1 1 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.107 0.290 18990 109 1 1 . 1 1 364 364 VAL C C 364 175.592 175.592 175.128 0.464 18990 110 1 1 . 1 1 364 364 VAL CA C 364 60.460 60.460 61.494 -1.034 18990 111 1 1 . 1 1 364 364 VAL CB C 364 34.125 34.125 33.312 0.813 18990 112 1 1 . 1 1 364 364 VAL H H 364 8.155 8.155 8.440 -0.285 18990 113 1 1 . 1 1 365 365 GLU N N 365 126.950 126.950 127.459 -0.509 18990 114 1 1 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.557 0.053 18990 115 1 1 . 1 1 365 365 GLU C C 365 175.427 175.427 176.592 -1.165 18990 116 1 1 . 1 1 365 365 GLU CA C 365 54.551 54.551 53.620 0.931 18990 117 1 1 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.540 0.240 18990 118 1 1 . 1 1 365 365 GLU H H 365 8.900 8.900 8.539 0.361 18990 119 1 1 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.317 -0.055 18990 120 1 1 . 1 1 366 366 PRO C C 366 177.013 177.013 176.881 0.132 18990 121 1 1 . 1 1 366 366 PRO CA C 366 64.463 64.463 65.030 -0.567 18990 122 1 1 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.927 0.121 18990 123 1 1 . 1 1 367 367 ASP N N 367 115.459 115.459 117.203 -1.744 18990 124 1 1 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.742 -0.247 18990 125 1 1 . 1 1 367 367 ASP C C 367 175.123 175.123 174.524 0.599 18990 126 1 1 . 1 1 367 367 ASP CA C 367 54.503 54.503 52.845 1.658 18990 127 1 1 . 1 1 367 367 ASP CB C 367 40.123 40.123 40.620 -0.497 18990 128 1 1 . 1 1 367 367 ASP H H 367 8.439 8.439 8.621 -0.182 18990 129 1 1 . 1 1 368 368 CYS N N 368 118.700 118.700 119.443 -0.743 18990 130 1 1 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.739 -0.169 18990 131 1 1 . 1 1 368 368 CYS C C 368 173.806 173.806 173.864 -0.058 18990 132 1 1 . 1 1 368 368 CYS CA C 368 58.581 58.581 57.520 1.061 18990 133 1 1 . 1 1 368 368 CYS CB C 368 28.450 28.450 29.660 -1.210 18990 134 1 1 . 1 1 368 368 CYS H H 368 7.515 7.515 7.758 -0.243 18990 135 1 1 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.574 -0.309 18990 136 1 1 . 1 1 369 369 ARG C C 369 174.908 174.908 174.760 0.148 18990 137 1 1 . 1 1 369 369 ARG CA C 369 57.669 57.669 54.410 3.259 18990 138 1 1 . 1 1 369 369 ARG CB C 369 32.274 32.274 29.500 2.774 18990 139 1 1 . 1 1 370 370 LYS N N 370 121.022 121.022 121.411 -0.389 18990 140 1 1 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.380 -0.210 18990 141 1 1 . 1 1 370 370 LYS C C 370 174.868 174.868 174.305 0.563 18990 142 1 1 . 1 1 370 370 LYS CA C 370 56.554 56.554 56.136 0.418 18990 143 1 1 . 1 1 370 370 LYS CB C 370 33.140 33.140 34.090 -0.950 18990 144 1 1 . 1 1 370 370 LYS H H 370 7.740 7.740 7.376 0.364 18990 145 1 1 . 1 1 371 371 VAL N N 371 128.362 128.362 127.242 1.120 18990 146 1 1 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.194 -0.061 18990 147 1 1 . 1 1 371 371 VAL C C 371 173.402 173.402 173.921 -0.519 18990 148 1 1 . 1 1 371 371 VAL CA C 371 60.777 60.777 60.903 -0.126 18990 149 1 1 . 1 1 371 371 VAL CB C 371 33.000 33.000 32.633 0.367 18990 150 1 1 . 1 1 371 371 VAL H H 371 8.647 8.647 8.642 0.005 18990 151 1 1 . 1 1 372 372 THR N N 372 119.667 119.667 122.314 -2.647 18990 152 1 1 . 1 1 372 372 THR HA H 372 5.032 5.032 4.787 0.245 18990 153 1 1 . 1 1 372 372 THR C C 372 174.339 174.339 173.734 0.605 18990 154 1 1 . 1 1 372 372 THR CA C 372 60.881 60.881 61.114 -0.233 18990 155 1 1 . 1 1 372 372 THR CB C 372 70.471 70.471 71.675 -1.204 18990 156 1 1 . 1 1 372 372 THR H H 372 8.087 8.087 8.253 -0.166 18990 157 1 1 . 1 1 373 373 CYS N N 373 132.554 132.554 126.176 6.378 18990 158 1 1 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.496 0.306 18990 159 1 1 . 1 1 373 373 CYS C C 373 176.791 176.791 176.394 0.397 18990 160 1 1 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.148 -0.644 18990 161 1 1 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.459 3.852 18990 162 1 1 . 1 1 373 373 CYS H H 373 9.322 9.322 9.339 -0.017 18990 163 1 1 . 1 1 374 374 GLN N N 374 125.890 125.890 123.054 2.836 18990 164 1 1 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.148 -0.148 18990 165 1 1 . 1 1 374 374 GLN C C 374 176.827 176.827 176.886 -0.059 18990 166 1 1 . 1 1 374 374 GLN CA C 374 58.300 58.300 58.193 0.107 18990 167 1 1 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.547 1.117 18990 168 1 1 . 1 1 374 374 GLN H H 374 7.856 7.856 8.215 -0.359 18990 169 1 1 . 1 1 375 375 ASN N N 375 115.342 115.342 115.974 -0.632 18990 170 1 1 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.737 0.150 18990 171 1 1 . 1 1 375 375 ASN C C 375 174.049 174.049 174.629 -0.580 18990 172 1 1 . 1 1 375 375 ASN CA C 375 53.047 53.047 53.321 -0.274 18990 173 1 1 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.267 -0.350 18990 174 1 1 . 1 1 375 375 ASN H H 375 8.913 8.913 8.221 0.692 18990 175 1 1 . 1 1 376 376 GLY N N 376 109.098 109.098 107.129 1.969 18990 176 1 1 . 1 1 376 376 GLY C C 376 174.110 174.110 173.086 1.024 18990 177 1 1 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.371 1.015 18990 178 1 1 . 1 1 376 376 GLY H H 376 7.162 7.162 7.784 -0.622 18990 179 1 1 . 1 1 377 377 CYS N N 377 132.546 132.546 122.152 10.394 18990 180 1 1 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.730 0.034 18990 181 1 1 . 1 1 377 377 CYS C C 377 177.355 177.355 175.976 1.379 18990 182 1 1 . 1 1 377 377 CYS CA C 377 59.988 59.988 56.607 3.381 18990 183 1 1 . 1 1 377 377 CYS CB C 377 32.365 32.365 25.226 7.139 18990 184 1 1 . 1 1 377 377 CYS H H 377 9.800 9.800 8.379 1.421 18990 185 1 1 . 1 1 378 378 GLY N N 378 113.851 113.851 112.160 1.691 18990 186 1 1 . 1 1 378 378 GLY C C 378 173.404 173.404 173.086 0.318 18990 187 1 1 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.563 0.300 18990 188 1 1 . 1 1 378 378 GLY H H 378 8.820 8.820 8.382 0.438 18990 189 1 1 . 1 1 379 379 TYR N N 379 125.532 125.532 121.016 4.516 18990 190 1 1 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.785 -0.307 18990 191 1 1 . 1 1 379 379 TYR C C 379 173.661 173.661 173.948 -0.287 18990 192 1 1 . 1 1 379 379 TYR CA C 379 59.180 59.180 56.014 3.166 18990 193 1 1 . 1 1 379 379 TYR CB C 379 40.108 40.108 40.785 -0.677 18990 194 1 1 . 1 1 379 379 TYR H H 379 9.054 9.054 7.601 1.453 18990 195 1 1 . 1 1 380 380 VAL N N 380 124.461 124.461 123.442 1.019 18990 196 1 1 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.891 -0.073 18990 197 1 1 . 1 1 380 380 VAL C C 380 175.876 175.876 176.111 -0.235 18990 198 1 1 . 1 1 380 380 VAL CA C 380 60.797 60.797 62.073 -1.276 18990 199 1 1 . 1 1 380 380 VAL CB C 380 32.610 32.610 31.919 0.691 18990 200 1 1 . 1 1 380 380 VAL H H 380 7.238 7.238 8.489 -1.251 18990 201 1 1 . 1 1 381 381 PHE N N 381 124.588 124.588 124.374 0.214 18990 202 1 1 . 1 1 381 381 PHE HA H 381 5.273 5.273 5.222 0.051 18990 203 1 1 . 1 1 381 381 PHE C C 381 173.242 173.242 174.056 -0.814 18990 204 1 1 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.503 -0.293 18990 205 1 1 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.824 1.266 18990 206 1 1 . 1 1 381 381 PHE H H 381 9.424 9.424 7.865 1.559 18990 207 1 1 . 1 1 382 382 CYS N N 382 120.221 120.221 120.947 -0.726 18990 208 1 1 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.745 0.157 18990 209 1 1 . 1 1 382 382 CYS C C 382 177.165 177.165 175.743 1.422 18990 210 1 1 . 1 1 382 382 CYS CA C 382 57.691 57.691 57.653 0.038 18990 211 1 1 . 1 1 382 382 CYS CB C 382 32.475 32.475 30.592 1.883 18990 212 1 1 . 1 1 382 382 CYS H H 382 8.673 8.673 8.552 0.121 18990 213 1 1 . 1 1 383 383 ARG N N 383 129.347 129.347 121.139 8.208 18990 214 1 1 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.259 -0.238 18990 215 1 1 . 1 1 383 383 ARG C C 383 175.012 175.012 176.050 -1.038 18990 216 1 1 . 1 1 383 383 ARG CA C 383 58.686 58.686 57.825 0.861 18990 217 1 1 . 1 1 383 383 ARG CB C 383 30.900 30.900 29.835 1.065 18990 218 1 1 . 1 1 383 383 ARG H H 383 9.534 9.534 8.694 0.840 18990 219 1 1 . 1 1 384 384 ASN N N 384 117.772 117.772 116.767 1.005 18990 220 1 1 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.870 -0.162 18990 221 1 1 . 1 1 384 384 ASN C C 384 175.656 175.656 174.269 1.387 18990 222 1 1 . 1 1 384 384 ASN CA C 384 55.778 55.778 53.494 2.284 18990 223 1 1 . 1 1 384 384 ASN CB C 384 39.475 39.475 41.020 -1.545 18990 224 1 1 . 1 1 384 384 ASN H H 384 8.840 8.840 7.932 0.908 18990 225 1 1 . 1 1 385 385 CYS N N 385 115.876 115.876 112.761 3.115 18990 226 1 1 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.909 0.119 18990 227 1 1 . 1 1 385 385 CYS C C 385 175.703 175.703 173.829 1.874 18990 228 1 1 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.634 1.478 18990 229 1 1 . 1 1 385 385 CYS CB C 385 32.359 32.359 30.925 1.434 18990 230 1 1 . 1 1 385 385 CYS H H 385 7.868 7.868 7.766 0.102 18990 231 1 1 . 1 1 386 386 LEU N N 386 120.082 120.082 120.375 -0.293 18990 232 1 1 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.760 -0.447 18990 233 1 1 . 1 1 386 386 LEU C C 386 175.722 175.722 177.338 -1.616 18990 234 1 1 . 1 1 386 386 LEU CA C 386 57.009 57.009 55.013 1.996 18990 235 1 1 . 1 1 386 386 LEU CB C 386 38.412 38.412 41.808 -3.396 18990 236 1 1 . 1 1 386 386 LEU H H 386 8.514 8.514 8.523 -0.009 18990 237 1 1 . 1 1 387 387 GLN N N 387 117.579 117.579 119.112 -1.533 18990 238 1 1 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.275 0.501 18990 239 1 1 . 1 1 387 387 GLN C C 387 175.299 175.299 177.130 -1.831 18990 240 1 1 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.797 -1.780 18990 241 1 1 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.268 2.039 18990 242 1 1 . 1 1 387 387 GLN H H 387 8.248 8.248 8.193 0.055 18990 243 1 1 . 1 1 388 388 GLY N N 388 106.107 106.107 106.765 -0.658 18990 244 1 1 . 1 1 388 388 GLY C C 388 173.693 173.693 174.179 -0.486 18990 245 1 1 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.373 0.807 18990 246 1 1 . 1 1 388 388 GLY H H 388 8.695 8.695 8.276 0.419 18990 247 1 1 . 1 1 389 389 TYR N N 389 122.514 122.514 117.011 5.503 18990 248 1 1 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.197 -0.539 18990 249 1 1 . 1 1 389 389 TYR C C 389 172.860 172.860 173.825 -0.965 18990 250 1 1 . 1 1 389 389 TYR CA C 389 62.987 62.987 59.154 3.833 18990 251 1 1 . 1 1 389 389 TYR CB C 389 38.052 38.052 38.562 -0.510 18990 252 1 1 . 1 1 389 389 TYR H H 389 7.923 7.923 8.130 -0.207 18990 253 1 1 . 1 1 390 390 HIS N N 390 120.080 120.080 122.992 -2.912 18990 254 1 1 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.652 0.056 18990 255 1 1 . 1 1 390 390 HIS C C 390 173.235 173.235 172.544 0.691 18990 256 1 1 . 1 1 390 390 HIS CA C 390 51.431 51.431 54.291 -2.860 18990 257 1 1 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.384 0.516 18990 258 1 1 . 1 1 390 390 HIS H H 390 5.291 5.291 7.391 -2.100 18990 259 1 1 . 1 1 391 391 ILE N N 391 117.810 117.810 120.335 -2.525 18990 260 1 1 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.085 0.031 18990 261 1 1 . 1 1 391 391 ILE C C 391 178.208 178.208 175.779 2.429 18990 262 1 1 . 1 1 391 391 ILE CA C 391 60.877 60.877 60.568 0.309 18990 263 1 1 . 1 1 391 391 ILE CB C 391 39.034 39.034 38.093 0.941 18990 264 1 1 . 1 1 391 391 ILE H H 391 8.418 8.418 8.295 0.123 18990 265 1 1 . 1 1 392 392 GLY N N 392 112.387 112.387 115.173 -2.786 18990 266 1 1 . 1 1 392 392 GLY C C 392 173.565 173.565 173.777 -0.212 18990 267 1 1 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.342 0.916 18990 268 1 1 . 1 1 392 392 GLY H H 392 8.654 8.654 8.247 0.407 18990 269 1 1 . 1 1 393 393 GLU N N 393 119.098 119.098 120.440 -1.342 18990 270 1 1 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.642 -0.353 18990 271 1 1 . 1 1 393 393 GLU C C 393 176.899 176.899 176.245 0.654 18990 272 1 1 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.971 0.462 18990 273 1 1 . 1 1 393 393 GLU CB C 393 30.470 30.470 30.652 -0.182 18990 274 1 1 . 1 1 393 393 GLU H H 393 8.391 8.391 8.541 -0.150 18990 275 1 1 . 1 1 394 394 CYS N N 394 122.845 122.845 116.394 6.451 18990 276 1 1 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.851 -1.085 18990 277 1 1 . 1 1 394 394 CYS C C 394 175.461 175.461 173.001 2.460 18990 278 1 1 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.523 1.312 18990 279 1 1 . 1 1 394 394 CYS CB C 394 30.761 30.761 29.569 1.192 18990 280 1 1 . 1 1 394 394 CYS H H 394 8.474 8.474 8.508 -0.034 18990 281 1 1 . 1 1 395 395 LEU N N 395 124.403 124.403 122.966 1.437 18990 282 1 1 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.934 -0.430 18990 283 1 1 . 1 1 395 395 LEU C C 395 175.259 175.259 174.587 0.672 18990 284 1 1 . 1 1 395 395 LEU CA C 395 52.835 52.835 52.487 0.348 18990 285 1 1 . 1 1 395 395 LEU CB C 395 41.436 41.436 45.230 -3.794 18990 286 1 1 . 1 1 395 395 LEU H H 395 8.418 8.418 8.443 -0.025 18990 287 1 1 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.629 -0.259 18990 288 1 1 . 1 1 396 396 PRO C C 396 177.006 177.006 176.978 0.028 18990 289 1 1 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.980 0.116 18990 290 1 1 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.225 -0.153 18990 291 1 1 . 1 1 397 397 GLU N N 397 121.574 121.574 118.949 2.625 18990 292 1 1 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.024 0.201 18990 293 1 1 . 1 1 397 397 GLU C C 397 177.202 177.202 176.115 1.087 18990 294 1 1 . 1 1 397 397 GLU CA C 397 57.034 57.034 57.149 -0.115 18990 295 1 1 . 1 1 397 397 GLU CB C 397 30.263 30.263 28.542 1.721 18990 296 1 1 . 1 1 397 397 GLU H H 397 8.568 8.568 8.844 -0.276 18990 297 1 1 . 1 1 398 398 GLY N N 398 110.495 110.495 105.886 4.609 18990 298 1 1 . 1 1 398 398 GLY C C 398 174.579 174.579 175.152 -0.573 18990 299 1 1 . 1 1 398 398 GLY CA C 398 45.462 45.462 44.679 0.783 18990 300 1 1 . 1 1 398 398 GLY H H 398 8.515 8.515 7.590 0.925 18990 301 1 1 . 1 1 399 399 THR N N 399 113.234 113.234 114.438 -1.204 18990 302 1 1 . 1 1 399 399 THR HA H 399 4.398 4.398 4.140 0.258 18990 303 1 1 . 1 1 399 399 THR C C 399 175.333 175.333 175.876 -0.543 18990 304 1 1 . 1 1 399 399 THR CA C 399 62.233 62.233 62.568 -0.335 18990 305 1 1 . 1 1 399 399 THR CB C 399 69.833 69.833 68.882 0.951 18990 306 1 1 . 1 1 399 399 THR H H 399 8.090 8.090 8.323 -0.233 18990 307 1 1 . 1 1 400 400 GLY N N 400 111.479 111.479 110.151 1.328 18990 308 1 1 . 1 1 400 400 GLY C C 400 174.048 174.048 173.613 0.435 18990 309 1 1 . 1 1 400 400 GLY CA C 400 45.439 45.439 44.751 0.688 18990 310 1 1 . 1 1 400 400 GLY H H 400 8.524 8.524 8.277 0.247 18990 311 1 1 . 1 1 401 401 ALA N N 401 123.919 123.919 121.687 2.232 18990 312 1 1 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.710 -0.459 18990 313 1 1 . 1 1 401 401 ALA C C 401 177.942 177.942 176.059 1.883 18990 314 1 1 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.579 1.151 18990 315 1 1 . 1 1 401 401 ALA CB C 401 19.142 19.142 19.802 -0.660 18990 316 1 1 . 1 1 401 401 ALA H H 401 8.179 8.179 7.662 0.517 18990 317 1 1 . 1 1 402 402 SER N N 402 114.904 114.904 118.071 -3.167 18990 318 1 1 . 1 1 402 402 SER HA H 402 4.448 4.448 4.327 0.121 18990 319 1 1 . 1 1 402 402 SER C C 402 174.426 174.426 174.621 -0.195 18990 320 1 1 . 1 1 402 402 SER CA C 402 58.289 58.289 58.883 -0.593 18990 321 1 1 . 1 1 402 402 SER CB C 402 63.772 63.772 63.620 0.152 18990 322 1 1 . 1 1 402 402 SER H H 402 8.305 8.305 8.804 -0.499 18990 323 1 1 . 1 1 403 403 ALA N N 403 125.965 125.965 122.127 3.838 18990 324 1 1 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.600 -0.201 18990 325 1 1 . 1 1 403 403 ALA C C 403 177.984 177.984 175.937 2.047 18990 326 1 1 . 1 1 403 403 ALA CA C 403 52.655 52.655 51.910 0.745 18990 327 1 1 . 1 1 403 403 ALA CB C 403 19.138 19.138 20.151 -1.013 18990 328 1 1 . 1 1 403 403 ALA H H 403 8.345 8.345 7.650 0.695 18990 329 1 1 . 1 1 404 404 THR N N 404 112.790 112.790 113.524 -0.734 18990 330 1 1 . 1 1 404 404 THR C C 404 174.420 174.420 173.870 0.550 18990 331 1 1 . 1 1 404 404 THR CA C 404 61.988 61.988 62.139 -0.151 18990 332 1 1 . 1 1 404 404 THR CB C 404 69.688 69.688 70.119 -0.431 18990 333 1 1 . 1 1 404 404 THR H H 404 8.118 8.118 8.218 -0.100 18990 334 1 1 . 1 1 405 405 ASN N N 405 121.050 121.050 120.045 1.005 18990 335 1 1 . 1 1 405 405 ASN H H 405 8.396 8.396 8.461 -0.065 18990 336 1 1 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.824 -0.246 18990 337 1 1 . 1 1 407 407 CYS C C 407 174.489 174.489 173.542 0.947 18990 338 1 1 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.754 -0.041 18990 339 1 1 . 1 1 407 407 CYS CB C 407 28.102 28.102 28.910 -0.808 18990 340 1 1 . 1 1 408 408 GLU N N 408 123.021 123.021 124.394 -1.373 18990 341 1 1 . 1 1 408 408 GLU C C 408 175.954 175.954 174.822 1.132 18990 342 1 1 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.790 0.012 18990 343 1 1 . 1 1 408 408 GLU CB C 408 30.328 30.328 30.432 -0.104 18990 344 1 1 . 1 1 408 408 GLU H H 408 8.415 8.415 8.541 -0.126 18990 345 1 1 . 1 1 409 409 TYR N N 409 121.015 121.015 125.095 -4.080 18990 346 1 1 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.637 0.017 18990 347 1 1 . 1 1 409 409 TYR C C 409 175.613 175.613 174.059 1.554 18990 348 1 1 . 1 1 409 409 TYR CA C 409 57.669 57.669 58.219 -0.550 18990 349 1 1 . 1 1 409 409 TYR CB C 409 38.825 38.825 39.675 -0.850 18990 350 1 1 . 1 1 409 409 TYR H H 409 8.135 8.135 8.386 -0.251 18990 351 1 1 . 1 1 410 410 THR N N 410 116.975 116.975 120.755 -3.780 18990 352 1 1 . 1 1 410 410 THR HA H 410 4.306 4.306 4.648 -0.342 18990 353 1 1 . 1 1 410 410 THR C C 410 173.846 173.846 173.169 0.677 18990 354 1 1 . 1 1 410 410 THR CA C 410 61.730 61.730 61.076 0.654 18990 355 1 1 . 1 1 410 410 THR CB C 410 69.914 69.914 69.944 -0.029 18990 356 1 1 . 1 1 410 410 THR H H 410 8.060 8.060 7.897 0.163 18990 357 1 1 . 1 1 411 411 VAL N N 411 122.900 122.900 119.045 3.855 18990 358 1 1 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.371 -0.318 18990 359 1 1 . 1 1 411 411 VAL C C 411 175.275 175.275 175.068 0.207 18990 360 1 1 . 1 1 411 411 VAL CA C 411 61.853 61.853 60.976 0.877 18990 361 1 1 . 1 1 411 411 VAL CB C 411 32.976 32.976 33.701 -0.725 18990 362 1 1 . 1 1 411 411 VAL H H 411 8.089 8.089 8.143 -0.054 18990 363 1 1 . 1 1 412 412 ASP N N 412 125.924 125.924 124.116 1.808 18990 364 1 1 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.963 -0.113 18990 365 1 1 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.631 -1.053 18990 366 1 1 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.842 -0.304 18990 367 1 1 . 1 1 412 412 ASP H H 412 8.397 8.397 8.224 0.173 18990 368 1 1 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.732 -0.346 18990 369 1 1 . 1 1 413 413 PRO C C 413 177.352 177.352 176.304 1.048 18990 370 1 1 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.638 1.272 18990 371 1 1 . 1 1 413 413 PRO CB C 413 32.268 32.268 33.846 -1.578 18990 372 1 1 . 1 1 414 414 ASN N N 414 117.035 117.035 117.380 -0.345 18990 373 1 1 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.751 -0.074 18990 374 1 1 . 1 1 414 414 ASN C C 414 175.532 175.532 175.232 0.300 18990 375 1 1 . 1 1 414 414 ASN CA C 414 53.824 53.824 53.241 0.583 18990 376 1 1 . 1 1 414 414 ASN CB C 414 38.728 38.728 39.327 -0.599 18990 377 1 1 . 1 1 414 414 ASN H H 414 8.496 8.496 8.588 -0.092 18990 378 1 1 . 1 1 415 415 ARG N N 415 121.000 121.000 120.685 0.315 18990 379 1 1 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.112 0.132 18990 380 1 1 . 1 1 415 415 ARG C C 415 176.243 176.243 174.368 1.875 18990 381 1 1 . 1 1 415 415 ARG CA C 415 56.404 56.404 56.074 0.330 18990 382 1 1 . 1 1 415 415 ARG CB C 415 30.637 30.637 28.969 1.668 18990 383 1 1 . 1 1 415 415 ARG H H 415 7.804 7.804 8.470 -0.666 18990 384 1 1 . 1 1 416 416 ALA N N 416 124.880 124.880 122.210 2.670 18990 385 1 1 . 1 1 416 416 ALA C C 416 177.831 177.831 176.201 1.630 18990 386 1 1 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.957 1.000 18990 387 1 1 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.011 -0.952 18990 388 1 1 . 1 1 416 416 ALA H H 416 8.189 8.189 7.987 0.202 18990 389 1 1 . 1 1 417 417 ALA N N 417 122.614 122.614 126.168 -3.554 18990 390 1 1 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.567 -0.320 18990 391 1 1 . 1 1 417 417 ALA C C 417 178.024 178.024 176.166 1.858 18990 392 1 1 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.831 0.958 18990 393 1 1 . 1 1 417 417 ALA CB C 417 19.042 19.042 20.624 -1.582 18990 394 1 1 . 1 1 417 417 ALA H H 417 8.169 8.169 8.427 -0.258 18990 395 1 1 . 1 1 418 418 GLU N N 418 119.500 119.500 119.308 0.192 18990 396 1 1 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.681 -0.492 18990 397 1 1 . 1 1 418 418 GLU C C 418 176.266 176.266 175.114 1.152 18990 398 1 1 . 1 1 418 418 GLU CA C 418 56.576 56.576 56.039 0.536 18990 399 1 1 . 1 1 418 418 GLU CB C 418 30.307 30.307 31.322 -1.014 18990 400 1 1 . 1 1 418 418 GLU H H 418 8.184 8.184 8.542 -0.358 18990 401 1 1 . 1 1 419 419 ALA N N 419 124.643 124.643 123.661 0.982 18990 402 1 1 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.699 -0.449 18990 403 1 1 . 1 1 419 419 ALA C C 419 177.488 177.488 176.393 1.095 18990 404 1 1 . 1 1 419 419 ALA CA C 419 52.509 52.509 52.050 0.459 18990 405 1 1 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.161 -1.000 18990 406 1 1 . 1 1 419 419 ALA H H 419 8.135 8.135 8.340 -0.205 18990 407 1 1 . 1 1 420 420 ARG N N 420 120.003 120.003 122.503 -2.500 18990 408 1 1 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.818 -0.525 18990 409 1 1 . 1 1 420 420 ARG C C 420 176.297 176.297 174.453 1.844 18990 410 1 1 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.455 0.478 18990 411 1 1 . 1 1 420 420 ARG CB C 420 30.850 30.850 32.046 -1.196 18990 412 1 1 . 1 1 420 420 ARG H H 420 8.135 8.135 8.723 -0.588 18990 413 1 1 . 1 1 421 421 TRP N N 421 122.280 122.280 122.493 -0.213 18990 414 1 1 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.777 -0.114 18990 415 1 1 . 1 1 421 421 TRP C C 421 175.856 175.856 174.133 1.723 18990 416 1 1 . 1 1 421 421 TRP CA C 421 57.404 57.404 57.125 0.279 18990 417 1 1 . 1 1 421 421 TRP CB C 421 29.437 29.437 31.614 -2.177 18990 418 1 1 . 1 1 421 421 TRP H H 421 8.159 8.159 8.458 -0.299 18990 419 1 1 . 1 1 422 422 ASP N N 422 121.980 121.980 126.274 -4.294 18990 420 1 1 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.541 -0.046 18990 421 1 1 . 1 1 422 422 ASP C C 422 176.184 176.184 174.869 1.315 18990 422 1 1 . 1 1 422 422 ASP CA C 422 53.899 53.899 53.106 0.793 18990 423 1 1 . 1 1 422 422 ASP CB C 422 40.948 40.948 42.515 -1.567 18990 424 1 1 . 1 1 422 422 ASP H H 422 8.135 8.135 7.619 0.516 18990 425 1 1 . 1 1 423 423 GLU N N 423 121.990 121.990 123.126 -1.136 18990 426 1 1 . 1 1 423 423 GLU HA H 423 4.090 4.090 3.990 0.100 18990 427 1 1 . 1 1 423 423 GLU C C 423 176.720 176.720 175.571 1.149 18990 428 1 1 . 1 1 423 423 GLU CA C 423 57.169 57.169 58.129 -0.960 18990 429 1 1 . 1 1 423 423 GLU CB C 423 30.156 30.156 30.254 -0.098 18990 430 1 1 . 1 1 423 423 GLU H H 423 8.153 8.153 8.629 -0.476 18990 431 1 1 . 1 1 424 424 ALA N N 424 123.900 123.900 120.435 3.465 18990 432 1 1 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.271 0.009 18990 433 1 1 . 1 1 424 424 ALA C C 424 178.095 178.095 175.448 2.647 18990 434 1 1 . 1 1 424 424 ALA CA C 424 53.017 53.017 51.505 1.512 18990 435 1 1 . 1 1 424 424 ALA CB C 424 19.086 19.086 19.867 -0.781 18990 436 1 1 . 1 1 424 424 ALA H H 424 8.243 8.243 7.824 0.419 18990 437 1 1 . 1 1 425 425 SER N N 425 113.881 113.881 115.571 -1.690 18990 438 1 1 . 1 1 425 425 SER HA H 425 4.387 4.387 4.572 -0.185 18990 439 1 1 . 1 1 425 425 SER C C 425 174.338 174.338 173.111 1.227 18990 440 1 1 . 1 1 425 425 SER CA C 425 58.546 58.546 58.228 0.318 18990 441 1 1 . 1 1 425 425 SER CB C 425 63.784 63.784 64.347 -0.563 18990 442 1 1 . 1 1 425 425 SER H H 425 8.063 8.063 8.321 -0.258 18990 443 1 1 . 1 1 426 426 ASN N N 426 121.032 121.032 122.135 -1.103 18990 444 1 1 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.541 0.165 18990 445 1 1 . 1 1 426 426 ASN C C 426 175.046 175.046 173.441 1.605 18990 446 1 1 . 1 1 426 426 ASN CA C 426 53.445 53.445 53.514 -0.069 18990 447 1 1 . 1 1 426 426 ASN CB C 426 38.847 38.847 38.773 0.075 18990 448 1 1 . 1 1 426 426 ASN H H 426 8.391 8.391 8.382 0.009 18990 449 1 1 . 1 1 427 427 VAL N N 427 119.463 119.463 125.056 -5.593 18990 450 1 1 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.254 -0.061 18990 451 1 1 . 1 1 427 427 VAL C C 427 176.213 176.213 175.417 0.796 18990 452 1 1 . 1 1 427 427 VAL CA C 427 62.449 62.449 62.393 0.056 18990 453 1 1 . 1 1 427 427 VAL CB C 427 32.865 32.865 33.339 -0.474 18990 454 1 1 . 1 1 427 427 VAL H H 427 7.954 7.954 8.114 -0.160 18990 455 1 1 . 1 1 428 428 THR N N 428 118.226 118.226 123.000 -4.774 18990 456 1 1 . 1 1 428 428 THR HA H 428 4.353 4.353 4.559 -0.206 18990 457 1 1 . 1 1 428 428 THR C C 428 174.361 174.361 174.184 0.177 18990 458 1 1 . 1 1 428 428 THR CA C 428 62.065 62.065 62.149 -0.084 18990 459 1 1 . 1 1 428 428 THR CB C 428 69.729 69.729 69.385 0.344 18990 460 1 1 . 1 1 428 428 THR H H 428 8.225 8.225 8.332 -0.107 18990 461 1 1 . 1 1 429 429 ILE N N 429 123.910 123.910 125.099 -1.189 18990 462 1 1 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.388 -0.200 18990 463 1 1 . 1 1 429 429 ILE C C 429 175.774 175.774 175.558 0.216 18990 464 1 1 . 1 1 429 429 ILE CA C 429 60.819 60.819 60.979 -0.160 18990 465 1 1 . 1 1 429 429 ILE CB C 429 38.719 38.719 39.336 -0.617 18990 466 1 1 . 1 1 429 429 ILE H H 429 8.148 8.148 8.498 -0.350 18990 467 1 1 . 1 1 430 430 LYS N N 430 126.453 126.453 126.234 0.219 18990 468 1 1 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.662 -0.228 18990 469 1 1 . 1 1 430 430 LYS C C 430 176.241 176.241 175.275 0.966 18990 470 1 1 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.432 0.505 18990 471 1 1 . 1 1 430 430 LYS CB C 430 33.164 33.164 34.354 -1.190 18990 472 1 1 . 1 1 430 430 LYS H H 430 8.406 8.406 8.510 -0.104 18990 473 1 1 . 1 1 431 431 VAL N N 431 122.496 122.496 122.091 0.405 18990 474 1 1 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.386 -0.106 18990 475 1 1 . 1 1 431 431 VAL CA C 431 62.303 62.303 61.884 0.419 18990 476 1 1 . 1 1 431 431 VAL CB C 431 33.132 33.132 32.999 0.133 18990 477 1 1 . 1 1 431 431 VAL H H 431 8.312 8.312 8.393 -0.081 18990 478 1 1 . 1 1 432 432 SER HA H 432 4.486 4.486 4.686 -0.200 18990 479 1 1 . 1 1 432 432 SER C C 432 173.834 173.834 174.324 -0.490 18990 480 1 1 . 1 1 432 432 SER CA C 432 58.650 58.650 57.800 0.850 18990 481 1 1 . 1 1 432 432 SER CB C 432 64.152 64.152 64.013 0.139 18990 482 1 1 . 1 1 433 433 THR N N 433 114.706 114.706 113.190 1.516 18990 483 1 1 . 1 1 433 433 THR HA H 433 5.446 5.446 5.017 0.429 18990 484 1 1 . 1 1 433 433 THR C C 433 173.979 173.979 174.149 -0.170 18990 485 1 1 . 1 1 433 433 THR CA C 433 60.412 60.412 60.616 -0.204 18990 486 1 1 . 1 1 433 433 THR CB C 433 71.896 71.896 70.850 1.046 18990 487 1 1 . 1 1 433 433 THR H H 433 7.833 7.833 7.536 0.297 18990 488 1 1 . 1 1 434 434 LYS N N 434 122.492 122.492 122.667 -0.175 18990 489 1 1 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.982 -0.273 18990 490 1 1 . 1 1 434 434 LYS C C 434 173.589 173.589 174.633 -1.044 18990 491 1 1 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.806 1.569 18990 492 1 1 . 1 1 434 434 LYS CB C 434 36.925 36.925 33.989 2.937 18990 493 1 1 . 1 1 434 434 LYS H H 434 8.937 8.937 8.862 0.075 18990 494 1 1 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.498 -0.231 18990 495 1 1 . 1 1 435 435 PRO C C 435 175.238 175.238 176.509 -1.271 18990 496 1 1 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.579 -1.656 18990 497 1 1 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.728 -0.642 18990 498 1 1 . 1 1 436 436 CYS N N 436 125.422 125.422 124.832 0.590 18990 499 1 1 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.364 -0.934 18990 500 1 1 . 1 1 436 436 CYS C C 436 176.770 176.770 175.213 1.557 18990 501 1 1 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.969 0.047 18990 502 1 1 . 1 1 436 436 CYS CB C 436 31.698 31.698 27.931 3.767 18990 503 1 1 . 1 1 436 436 CYS H H 436 7.768 7.768 8.452 -0.684 18990 504 1 1 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.064 -0.206 18990 505 1 1 . 1 1 437 437 PRO C C 437 173.608 173.608 176.506 -2.898 18990 506 1 1 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.456 -0.242 18990 507 1 1 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.269 1.180 18990 508 1 1 . 1 1 438 438 LYS N N 438 118.600 118.600 118.725 -0.125 18990 509 1 1 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.089 -0.119 18990 510 1 1 . 1 1 438 438 LYS C C 438 176.887 176.887 177.418 -0.531 18990 511 1 1 . 1 1 438 438 LYS CA C 438 57.687 57.687 56.868 0.819 18990 512 1 1 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.544 -0.420 18990 513 1 1 . 1 1 438 438 LYS H H 438 8.390 8.390 7.795 0.595 18990 514 1 1 . 1 1 439 439 CYS N N 439 118.950 118.950 115.513 3.437 18990 515 1 1 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.603 0.143 18990 516 1 1 . 1 1 439 439 CYS C C 439 176.650 176.650 175.032 1.618 18990 517 1 1 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.946 1.402 18990 518 1 1 . 1 1 439 439 CYS CB C 439 31.196 31.196 29.075 2.121 18990 519 1 1 . 1 1 439 439 CYS H H 439 8.357 8.357 7.782 0.575 18990 520 1 1 . 1 1 440 440 ARG N N 440 117.200 117.200 117.051 0.149 18990 521 1 1 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.183 -0.215 18990 522 1 1 . 1 1 440 440 ARG C C 440 175.253 175.253 175.765 -0.512 18990 523 1 1 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.860 0.040 18990 524 1 1 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.150 -1.109 18990 525 1 1 . 1 1 440 440 ARG H H 440 8.065 8.065 7.786 0.279 18990 526 1 1 . 1 1 441 441 THR N N 441 122.400 122.400 113.258 9.142 18990 527 1 1 . 1 1 441 441 THR HA H 441 4.371 4.371 4.625 -0.254 18990 528 1 1 . 1 1 441 441 THR C C 441 173.702 173.702 173.052 0.650 18990 529 1 1 . 1 1 441 441 THR CA C 441 63.194 63.194 59.715 3.479 18990 530 1 1 . 1 1 441 441 THR CB C 441 68.933 68.933 69.053 -0.120 18990 531 1 1 . 1 1 441 441 THR H H 441 8.643 8.643 7.463 1.180 18990 532 1 1 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.599 -0.452 18990 533 1 1 . 1 1 442 442 PRO C C 442 176.215 176.215 176.042 0.173 18990 534 1 1 . 1 1 442 442 PRO CA C 442 64.197 64.197 63.316 0.881 18990 535 1 1 . 1 1 442 442 PRO CB C 442 32.044 32.044 30.868 1.176 18990 536 1 1 . 1 1 443 443 THR N N 443 122.932 122.932 122.498 0.434 18990 537 1 1 . 1 1 443 443 THR HA H 443 4.665 4.665 4.591 0.074 18990 538 1 1 . 1 1 443 443 THR C C 443 172.133 172.133 173.971 -1.838 18990 539 1 1 . 1 1 443 443 THR CA C 443 62.566 62.566 62.444 0.122 18990 540 1 1 . 1 1 443 443 THR CB C 443 71.562 71.562 70.606 0.956 18990 541 1 1 . 1 1 443 443 THR H H 443 9.116 9.116 8.977 0.139 18990 542 1 1 . 1 1 444 444 GLU N N 444 126.390 126.390 127.819 -1.429 18990 543 1 1 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.556 0.386 18990 544 1 1 . 1 1 444 444 GLU C C 444 175.292 175.292 176.038 -0.746 18990 545 1 1 . 1 1 444 444 GLU CA C 444 55.049 55.049 54.993 0.056 18990 546 1 1 . 1 1 444 444 GLU CB C 444 31.861 31.861 31.567 0.294 18990 547 1 1 . 1 1 444 444 GLU H H 444 8.720 8.720 8.783 -0.063 18990 548 1 1 . 1 1 445 445 ARG N N 445 123.505 123.505 123.829 -0.324 18990 549 1 1 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.300 -0.589 18990 550 1 1 . 1 1 445 445 ARG C C 445 175.289 175.289 175.536 -0.247 18990 551 1 1 . 1 1 445 445 ARG CA C 445 55.856 55.856 54.280 1.576 18990 552 1 1 . 1 1 445 445 ARG CB C 445 30.675 30.675 30.841 -0.166 18990 553 1 1 . 1 1 445 445 ARG H H 445 8.157 8.157 8.597 -0.440 18990 554 1 1 . 1 1 446 446 ASP N N 446 126.800 126.800 121.074 5.726 18990 555 1 1 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.685 -0.044 18990 556 1 1 . 1 1 446 446 ASP C C 446 176.020 176.020 175.903 0.117 18990 557 1 1 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.663 -0.711 18990 558 1 1 . 1 1 446 446 ASP CB C 446 41.400 41.400 42.693 -1.293 18990 559 1 1 . 1 1 446 446 ASP H H 446 8.476 8.476 8.267 0.209 18990 560 1 1 . 1 1 447 447 GLY N N 447 111.262 111.262 111.008 0.254 18990 561 1 1 . 1 1 447 447 GLY C C 447 174.073 174.073 175.070 -0.997 18990 562 1 1 . 1 1 447 447 GLY CA C 447 45.832 45.832 45.841 -0.009 18990 563 1 1 . 1 1 447 447 GLY H H 447 8.056 8.056 8.679 -0.623 18990 564 1 1 . 1 1 448 448 GLY N N 448 108.655 108.655 113.705 -5.050 18990 565 1 1 . 1 1 448 448 GLY C C 448 174.020 174.020 173.764 0.256 18990 566 1 1 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.627 0.640 18990 567 1 1 . 1 1 448 448 GLY H H 448 8.380 8.380 8.359 0.021 18990 568 1 1 . 1 1 449 449 CYS N N 449 120.628 120.628 118.797 1.831 18990 569 1 1 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.819 -0.822 18990 570 1 1 . 1 1 449 449 CYS C C 449 174.855 174.855 173.642 1.213 18990 571 1 1 . 1 1 449 449 CYS CA C 449 59.291 59.291 56.745 2.546 18990 572 1 1 . 1 1 449 449 CYS CB C 449 28.000 28.000 29.842 -1.842 18990 573 1 1 . 1 1 449 449 CYS H H 449 7.832 7.832 7.421 0.411 18990 574 1 1 . 1 1 450 450 MET N N 450 123.947 123.947 118.724 5.223 18990 575 1 1 . 1 1 450 450 MET HA H 450 4.551 4.551 4.245 0.306 18990 576 1 1 . 1 1 450 450 MET C C 450 174.658 174.658 174.585 0.073 18990 577 1 1 . 1 1 450 450 MET CA C 450 54.970 54.970 55.392 -0.421 18990 578 1 1 . 1 1 450 450 MET CB C 450 34.100 34.100 31.965 2.135 18990 579 1 1 . 1 1 450 450 MET H H 450 8.916 8.916 8.300 0.616 18990 580 1 1 . 1 1 451 451 HIS N N 451 120.490 120.490 116.297 4.193 18990 581 1 1 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.276 -0.597 18990 582 1 1 . 1 1 451 451 HIS C C 451 172.443 172.443 173.098 -0.655 18990 583 1 1 . 1 1 451 451 HIS CA C 451 53.812 53.812 53.629 0.183 18990 584 1 1 . 1 1 451 451 HIS CB C 451 28.900 28.900 31.293 -2.393 18990 585 1 1 . 1 1 451 451 HIS H H 451 7.557 7.557 6.923 0.634 18990 586 1 1 . 1 1 452 452 MET N N 452 128.800 128.800 119.944 8.856 18990 587 1 1 . 1 1 452 452 MET HA H 452 4.320 4.320 4.719 -0.399 18990 588 1 1 . 1 1 452 452 MET C C 452 175.479 175.479 173.701 1.778 18990 589 1 1 . 1 1 452 452 MET CA C 452 52.589 52.589 54.508 -1.919 18990 590 1 1 . 1 1 452 452 MET CB C 452 28.074 28.074 35.088 -7.014 18990 591 1 1 . 1 1 452 452 MET H H 452 9.087 9.087 7.692 1.395 18990 592 1 1 . 1 1 453 453 VAL N N 453 122.200 122.200 118.337 3.863 18990 593 1 1 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.490 0.304 18990 594 1 1 . 1 1 453 453 VAL C C 453 175.476 175.476 174.773 0.703 18990 595 1 1 . 1 1 453 453 VAL CA C 453 61.380 61.380 60.008 1.372 18990 596 1 1 . 1 1 453 453 VAL CB C 453 33.089 33.089 34.099 -1.010 18990 597 1 1 . 1 1 453 453 VAL H H 453 8.016 8.016 7.909 0.107 18990 598 1 1 . 1 1 454 454 CYS N N 454 130.353 130.353 126.284 4.069 18990 599 1 1 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.803 -0.208 18990 600 1 1 . 1 1 454 454 CYS C C 454 177.833 177.833 174.574 3.259 18990 601 1 1 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.381 3.190 18990 602 1 1 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.248 5.797 18990 603 1 1 . 1 1 454 454 CYS H H 454 8.989 8.989 8.764 0.225 18990 604 1 1 . 1 1 455 455 THR N N 455 119.000 119.000 122.356 -3.356 18990 605 1 1 . 1 1 455 455 THR HA H 455 4.393 4.393 4.406 -0.013 18990 606 1 1 . 1 1 455 455 THR C C 455 175.264 175.264 174.364 0.900 18990 607 1 1 . 1 1 455 455 THR CA C 455 61.644 61.644 61.802 -0.158 18990 608 1 1 . 1 1 455 455 THR CB C 455 69.400 69.400 68.110 1.290 18990 609 1 1 . 1 1 455 455 THR H H 455 8.533 8.533 8.223 0.310 18990 610 1 1 . 1 1 456 456 ARG N N 456 128.900 128.900 127.108 1.792 18990 611 1 1 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.489 -0.264 18990 612 1 1 . 1 1 456 456 ARG C C 456 177.782 177.782 176.986 0.796 18990 613 1 1 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.986 1.964 18990 614 1 1 . 1 1 456 456 ARG CB C 456 30.050 30.050 32.993 -2.943 18990 615 1 1 . 1 1 456 456 ARG H H 456 9.036 9.036 7.965 1.071 18990 616 1 1 . 1 1 457 457 ALA N N 457 133.152 133.152 126.728 6.424 18990 617 1 1 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.250 -0.104 18990 618 1 1 . 1 1 457 457 ALA C C 457 178.757 178.757 176.999 1.758 18990 619 1 1 . 1 1 457 457 ALA CA C 457 53.929 53.929 54.221 -0.292 18990 620 1 1 . 1 1 457 457 ALA CB C 457 17.710 17.710 18.764 -1.054 18990 621 1 1 . 1 1 457 457 ALA H H 457 9.042 9.042 8.623 0.419 18990 622 1 1 . 1 1 458 458 GLY N N 458 111.200 111.200 104.799 6.401 18990 623 1 1 . 1 1 458 458 GLY C C 458 173.558 173.558 173.667 -0.109 18990 624 1 1 . 1 1 458 458 GLY CA C 458 45.436 45.436 43.727 1.710 18990 625 1 1 . 1 1 458 458 GLY H H 458 8.830 8.830 7.959 0.871 18990 626 1 1 . 1 1 459 459 CYS N N 459 123.040 123.040 120.476 2.564 18990 627 1 1 . 1 1 459 459 CYS HA H 459 4.622 4.622 5.030 -0.408 18990 628 1 1 . 1 1 459 459 CYS C C 459 176.591 176.591 174.526 2.065 18990 629 1 1 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.082 1.417 18990 630 1 1 . 1 1 459 459 CYS CB C 459 30.174 30.174 28.969 1.205 18990 631 1 1 . 1 1 459 459 CYS H H 459 8.042 8.042 7.949 0.093 18990 632 1 1 . 1 1 460 460 GLY N N 460 104.500 104.500 111.703 -7.203 18990 633 1 1 . 1 1 460 460 GLY C C 460 173.716 173.716 173.671 0.045 18990 634 1 1 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.468 0.540 18990 635 1 1 . 1 1 460 460 GLY H H 460 7.705 7.705 8.345 -0.640 18990 636 1 1 . 1 1 461 461 PHE N N 461 124.949 124.949 120.924 4.025 18990 637 1 1 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.738 -0.158 18990 638 1 1 . 1 1 461 461 PHE C C 461 174.447 174.447 174.182 0.265 18990 639 1 1 . 1 1 461 461 PHE CA C 461 59.946 59.946 56.467 3.479 18990 640 1 1 . 1 1 461 461 PHE CB C 461 41.300 41.300 41.084 0.216 18990 641 1 1 . 1 1 461 461 PHE H H 461 8.947 8.947 7.711 1.236 18990 642 1 1 . 1 1 462 462 GLU N N 462 125.272 125.272 128.274 -3.002 18990 643 1 1 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.582 1.139 18990 644 1 1 . 1 1 462 462 GLU C C 462 176.067 176.067 175.088 0.979 18990 645 1 1 . 1 1 462 462 GLU CA C 462 54.624 54.624 56.271 -1.647 18990 646 1 1 . 1 1 462 462 GLU CB C 462 31.255 31.255 30.504 0.751 18990 647 1 1 . 1 1 462 462 GLU H H 462 7.799 7.799 8.542 -0.743 18990 648 1 1 . 1 1 463 463 TRP N N 463 121.524 121.524 119.983 1.541 18990 649 1 1 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.304 0.202 18990 650 1 1 . 1 1 463 463 TRP C C 463 172.844 172.844 174.572 -1.728 18990 651 1 1 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.692 -0.921 18990 652 1 1 . 1 1 463 463 TRP CB C 463 31.736 31.736 30.817 0.919 18990 653 1 1 . 1 1 463 463 TRP H H 463 9.300 9.300 8.021 1.279 18990 654 1 1 . 1 1 464 464 CYS N N 464 120.868 120.868 121.142 -0.274 18990 655 1 1 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.724 0.692 18990 656 1 1 . 1 1 464 464 CYS C C 464 177.213 177.213 175.979 1.234 18990 657 1 1 . 1 1 464 464 CYS CA C 464 57.776 57.776 59.545 -1.769 18990 658 1 1 . 1 1 464 464 CYS CB C 464 32.930 32.930 29.207 3.723 18990 659 1 1 . 1 1 464 464 CYS H H 464 8.752 8.752 8.990 -0.238 18990 660 1 1 . 1 1 465 465 TRP N N 465 131.209 131.209 127.624 3.585 18990 661 1 1 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.279 0.148 18990 662 1 1 . 1 1 465 465 TRP C C 465 176.051 176.051 175.914 0.137 18990 663 1 1 . 1 1 465 465 TRP CA C 465 60.763 60.763 60.118 0.645 18990 664 1 1 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.541 1.585 18990 665 1 1 . 1 1 465 465 TRP H H 465 9.809 9.809 8.390 1.419 18990 666 1 1 . 1 1 466 466 VAL N N 466 118.233 118.233 116.055 2.178 18990 667 1 1 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.403 0.221 18990 668 1 1 . 1 1 466 466 VAL C C 466 178.943 178.943 176.190 2.753 18990 669 1 1 . 1 1 466 466 VAL CA C 466 65.602 65.602 64.447 1.155 18990 670 1 1 . 1 1 466 466 VAL CB C 466 33.172 33.172 31.914 1.258 18990 671 1 1 . 1 1 466 466 VAL H H 466 8.627 8.627 7.882 0.745 18990 672 1 1 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.775 -1.344 18990 673 1 1 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.284 0.715 18990 674 1 1 . 1 1 467 467 CYS CB C 467 31.870 31.870 26.786 5.084 18990 675 1 1 . 1 1 467 467 CYS H H 467 7.820 7.820 7.750 0.070 18990 676 1 1 . 1 1 468 468 GLN HA H 468 4.036 4.036 5.233 -1.197 18990 677 1 1 . 1 1 468 468 GLN CA C 468 58.051 58.051 56.391 1.660 18990 678 1 1 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.555 -2.079 18990 679 1 1 . 1 1 469 469 THR HA H 469 4.685 4.685 4.756 -0.071 18990 680 1 1 . 1 1 469 469 THR C C 469 173.351 173.351 173.219 0.132 18990 681 1 1 . 1 1 469 469 THR CA C 469 59.176 59.176 59.814 -0.638 18990 682 1 1 . 1 1 469 469 THR CB C 469 71.775 71.775 71.263 0.512 18990 683 1 1 . 1 1 470 470 GLU N N 470 120.940 120.940 120.171 0.769 18990 684 1 1 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.664 -0.371 18990 685 1 1 . 1 1 470 470 GLU C C 470 175.539 175.539 176.448 -0.909 18990 686 1 1 . 1 1 470 470 GLU CA C 470 57.015 57.015 55.543 1.472 18990 687 1 1 . 1 1 470 470 GLU CB C 470 29.965 29.965 30.728 -0.763 18990 688 1 1 . 1 1 470 470 GLU H H 470 8.912 8.912 8.699 0.213 18990 689 1 1 . 1 1 471 471 TRP N N 471 126.998 126.998 129.453 -2.455 18990 690 1 1 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.474 -0.181 18990 691 1 1 . 1 1 471 471 TRP C C 471 175.408 175.408 175.854 -0.446 18990 692 1 1 . 1 1 471 471 TRP CA C 471 58.220 58.220 58.742 -0.522 18990 693 1 1 . 1 1 471 471 TRP CB C 471 29.500 29.500 28.858 0.642 18990 694 1 1 . 1 1 471 471 TRP H H 471 8.350 8.350 8.646 -0.296 18990 695 1 1 . 1 1 472 472 THR N N 472 117.480 117.480 119.443 -1.963 18990 696 1 1 . 1 1 472 472 THR HA H 472 4.444 4.444 4.485 -0.041 18990 697 1 1 . 1 1 472 472 THR CA C 472 58.930 58.930 59.947 -1.017 18990 698 1 1 . 1 1 472 472 THR H H 472 8.069 8.069 7.586 0.483 18990 699 1 1 . 1 1 473 473 ARG HA H 473 3.773 3.773 4.131 -0.358 18990 700 1 1 . 1 1 473 473 ARG C C 473 178.053 178.053 177.881 0.172 18990 701 1 1 . 1 1 473 473 ARG CA C 473 58.088 58.088 57.730 0.358 18990 702 1 1 . 1 1 473 473 ARG CB C 473 29.426 29.426 29.818 -0.392 18990 703 1 1 . 1 1 474 474 ASP N N 474 119.900 119.900 120.179 -0.279 18990 704 1 1 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.516 -0.301 18990 705 1 1 . 1 1 474 474 ASP C C 474 178.197 178.197 176.505 1.692 18990 706 1 1 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.295 0.507 18990 707 1 1 . 1 1 474 474 ASP CB C 474 40.182 40.182 41.144 -0.962 18990 708 1 1 . 1 1 474 474 ASP H H 474 7.718 7.718 8.296 -0.578 18990 709 1 1 . 1 1 475 475 CYS N N 475 121.000 121.000 118.987 2.013 18990 710 1 1 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.664 -1.297 18990 711 1 1 . 1 1 475 475 CYS CA C 475 64.533 64.533 57.966 6.567 18990 712 1 1 . 1 1 475 475 CYS CB C 475 29.092 29.092 25.662 3.430 18990 713 1 1 . 1 1 475 475 CYS H H 475 6.953 6.953 8.197 -1.244 18990 714 1 1 . 1 1 476 476 MET HA H 476 4.021 4.021 4.163 -0.142 18990 715 1 1 . 1 1 476 476 MET CA C 476 58.010 58.010 56.006 2.004 18990 716 1 1 . 1 1 476 476 MET CB C 476 32.550 32.550 32.764 -0.214 18990 717 1 1 . 1 1 477 477 GLY N N 477 111.938 111.938 105.231 6.707 18990 718 1 1 . 1 1 477 477 GLY C C 477 174.406 174.406 174.930 -0.524 18990 719 1 1 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.888 0.728 18990 720 1 1 . 1 1 477 477 GLY H H 477 9.155 9.155 7.973 1.182 18990 721 1 1 . 1 1 478 478 ALA N N 478 121.900 121.900 124.662 -2.762 18990 722 1 1 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.197 0.094 18990 723 1 1 . 1 1 478 478 ALA C C 478 178.196 178.196 177.670 0.526 18990 724 1 1 . 1 1 478 478 ALA CA C 478 53.440 53.440 54.477 -1.037 18990 725 1 1 . 1 1 478 478 ALA CB C 478 20.390 20.390 18.850 1.540 18990 726 1 1 . 1 1 478 478 ALA H H 478 7.347 7.347 8.554 -1.207 18990 727 1 1 . 1 1 479 479 HIS N N 479 115.200 115.200 111.749 3.451 18990 728 1 1 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.693 0.210 18990 729 1 1 . 1 1 479 479 HIS C C 479 173.325 173.325 174.809 -1.484 18990 730 1 1 . 1 1 479 479 HIS CA C 479 54.526 54.526 53.787 0.739 18990 731 1 1 . 1 1 479 479 HIS CB C 479 27.600 27.600 29.139 -1.539 18990 732 1 1 . 1 1 479 479 HIS H H 479 8.297 8.297 7.836 0.461 18990 733 1 1 . 1 1 480 480 TRP N N 480 121.780 121.780 125.653 -3.873 18990 734 1 1 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.759 -0.464 18990 735 1 1 . 1 1 480 480 TRP C C 480 175.568 175.568 174.698 0.870 18990 736 1 1 . 1 1 480 480 TRP CA C 480 58.358 58.358 57.482 0.876 18990 737 1 1 . 1 1 480 480 TRP CB C 480 29.550 29.550 27.939 1.611 18990 738 1 1 . 1 1 480 480 TRP H H 480 8.081 8.081 7.866 0.215 18990 739 1 1 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.971 -0.126 18990 740 1 1 . 1 1 481 481 PHE C C 481 175.126 175.126 174.441 0.685 18990 741 1 1 . 1 1 481 481 PHE CA C 481 56.471 56.471 56.851 -0.380 18990 742 1 1 . 1 1 481 481 PHE CB C 481 41.006 41.006 40.381 0.625 18990 743 1 2 . 1 1 343 343 GLU N N 343 121.045 121.045 122.080 -1.035 18990 744 1 2 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.596 -0.431 18990 745 1 2 . 1 1 343 343 GLU C C 343 176.529 176.529 176.318 0.211 18990 746 1 2 . 1 1 343 343 GLU CA C 343 57.162 57.162 56.134 1.028 18990 747 1 2 . 1 1 343 343 GLU CB C 343 30.204 30.204 30.364 -0.160 18990 748 1 2 . 1 1 343 343 GLU H H 343 8.293 8.293 8.498 -0.205 18990 749 1 2 . 1 1 344 344 TYR N N 344 121.000 121.000 120.459 0.541 18990 750 1 2 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.637 -0.099 18990 751 1 2 . 1 1 344 344 TYR C C 344 175.897 175.897 175.470 0.427 18990 752 1 2 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.415 0.764 18990 753 1 2 . 1 1 344 344 TYR CB C 344 38.600 38.600 39.055 -0.455 18990 754 1 2 . 1 1 344 344 TYR H H 344 8.040 8.040 8.471 -0.431 18990 755 1 2 . 1 1 345 345 VAL N N 345 121.900 121.900 124.137 -2.237 18990 756 1 2 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.472 -0.533 18990 757 1 2 . 1 1 345 345 VAL C C 345 176.143 176.143 174.032 2.111 18990 758 1 2 . 1 1 345 345 VAL CA C 345 62.867 62.867 61.209 1.658 18990 759 1 2 . 1 1 345 345 VAL CB C 345 32.799 32.799 34.227 -1.427 18990 760 1 2 . 1 1 345 345 VAL H H 345 7.856 7.856 8.899 -1.043 18990 761 1 2 . 1 1 346 346 LEU N N 346 124.950 124.950 126.853 -1.903 18990 762 1 2 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.844 -0.601 18990 763 1 2 . 1 1 346 346 LEU C C 346 177.747 177.747 174.803 2.944 18990 764 1 2 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.471 1.029 18990 765 1 2 . 1 1 346 346 LEU CB C 346 42.252 42.252 43.547 -1.296 18990 766 1 2 . 1 1 346 346 LEU H H 346 8.127 8.127 8.436 -0.309 18990 767 1 2 . 1 1 347 347 GLN N N 347 121.452 121.452 121.866 -0.414 18990 768 1 2 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.631 -0.345 18990 769 1 2 . 1 1 347 347 GLN C C 347 175.833 175.833 174.963 0.870 18990 770 1 2 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.776 0.211 18990 771 1 2 . 1 1 347 347 GLN CB C 347 29.375 29.375 29.294 0.081 18990 772 1 2 . 1 1 347 347 GLN H H 347 8.270 8.270 8.641 -0.371 18990 773 1 2 . 1 1 348 348 ALA N N 348 124.466 124.466 129.664 -5.198 18990 774 1 2 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.758 -0.437 18990 775 1 2 . 1 1 348 348 ALA C C 348 177.929 177.929 177.346 0.583 18990 776 1 2 . 1 1 348 348 ALA CA C 348 52.703 52.703 52.056 0.647 18990 777 1 2 . 1 1 348 348 ALA CB C 348 19.002 19.002 18.948 0.054 18990 778 1 2 . 1 1 348 348 ALA H H 348 8.227 8.227 8.662 -0.435 18990 779 1 2 . 1 1 349 349 GLY N N 349 108.193 108.193 108.943 -0.750 18990 780 1 2 . 1 1 349 349 GLY C C 349 174.269 174.269 174.519 -0.250 18990 781 1 2 . 1 1 349 349 GLY CA C 349 45.227 45.227 44.814 0.413 18990 782 1 2 . 1 1 349 349 GLY H H 349 8.298 8.298 8.764 -0.466 18990 783 1 2 . 1 1 350 350 GLY N N 350 108.073 108.073 106.251 1.822 18990 784 1 2 . 1 1 350 350 GLY C C 350 172.979 172.979 172.342 0.637 18990 785 1 2 . 1 1 350 350 GLY CA C 350 44.935 44.935 44.943 -0.008 18990 786 1 2 . 1 1 350 350 GLY H H 350 8.156 8.156 7.343 0.813 18990 787 1 2 . 1 1 351 351 VAL N N 351 119.058 119.058 118.016 1.042 18990 788 1 2 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.629 -0.213 18990 789 1 2 . 1 1 351 351 VAL C C 351 173.412 173.412 173.516 -0.104 18990 790 1 2 . 1 1 351 351 VAL CA C 351 60.663 60.663 60.239 0.424 18990 791 1 2 . 1 1 351 351 VAL CB C 351 34.866 34.866 34.950 -0.084 18990 792 1 2 . 1 1 351 351 VAL H H 351 8.541 8.541 8.865 -0.324 18990 793 1 2 . 1 1 352 352 LEU N N 352 125.800 125.800 121.525 4.275 18990 794 1 2 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.648 0.117 18990 795 1 2 . 1 1 352 352 LEU C C 352 176.218 176.218 174.880 1.338 18990 796 1 2 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.122 0.219 18990 797 1 2 . 1 1 352 352 LEU CB C 352 42.706 42.706 45.516 -2.810 18990 798 1 2 . 1 1 352 352 LEU H H 352 8.151 8.151 8.388 -0.237 18990 799 1 2 . 1 1 353 353 CYS N N 353 126.825 126.825 122.745 4.080 18990 800 1 2 . 1 1 353 353 CYS HA H 353 4.107 4.107 3.759 0.348 18990 801 1 2 . 1 1 353 353 CYS C C 353 176.655 176.655 174.229 2.426 18990 802 1 2 . 1 1 353 353 CYS CA C 353 57.731 57.731 56.818 0.913 18990 803 1 2 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.987 3.878 18990 804 1 2 . 1 1 353 353 CYS H H 353 8.794 8.794 8.532 0.262 18990 805 1 2 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.169 0.251 18990 806 1 2 . 1 1 354 354 PRO C C 354 177.512 177.512 176.116 1.396 18990 807 1 2 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.466 -0.474 18990 808 1 2 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.643 0.924 18990 809 1 2 . 1 1 355 355 GLN N N 355 126.800 126.800 120.014 6.786 18990 810 1 2 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.331 -0.056 18990 811 1 2 . 1 1 355 355 GLN C C 355 175.516 175.516 175.222 0.294 18990 812 1 2 . 1 1 355 355 GLN CA C 355 54.793 54.793 53.782 1.010 18990 813 1 2 . 1 1 355 355 GLN CB C 355 28.547 28.547 29.309 -0.762 18990 814 1 2 . 1 1 355 355 GLN H H 355 9.033 9.033 7.418 1.615 18990 815 1 2 . 1 1 357 357 GLY C C 357 173.229 173.229 174.618 -1.389 18990 816 1 2 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.931 0.323 18990 817 1 2 . 1 1 358 358 CYS N N 358 123.500 123.500 119.694 3.806 18990 818 1 2 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.701 -0.168 18990 819 1 2 . 1 1 358 358 CYS C C 358 176.157 176.157 176.298 -0.141 18990 820 1 2 . 1 1 358 358 CYS CA C 358 60.268 60.268 59.739 0.529 18990 821 1 2 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.601 0.774 18990 822 1 2 . 1 1 358 358 CYS H H 358 7.720 7.720 7.726 -0.006 18990 823 1 2 . 1 1 359 359 GLY N N 359 104.400 104.400 109.310 -4.910 18990 824 1 2 . 1 1 359 359 GLY C C 359 174.080 174.080 175.005 -0.925 18990 825 1 2 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.438 -0.374 18990 826 1 2 . 1 1 359 359 GLY H H 359 7.756 7.756 8.189 -0.433 18990 827 1 2 . 1 1 360 360 MET N N 360 121.300 121.300 120.588 0.712 18990 828 1 2 . 1 1 360 360 MET HA H 360 4.343 4.343 4.213 0.130 18990 829 1 2 . 1 1 360 360 MET C C 360 175.641 175.641 177.125 -1.484 18990 830 1 2 . 1 1 360 360 MET CA C 360 55.923 55.923 57.421 -1.498 18990 831 1 2 . 1 1 360 360 MET CB C 360 33.091 33.091 33.977 -0.886 18990 832 1 2 . 1 1 360 360 MET H H 360 8.229 8.229 7.533 0.696 18990 833 1 2 . 1 1 361 361 GLY N N 361 109.000 109.000 105.453 3.547 18990 834 1 2 . 1 1 361 361 GLY C C 361 173.774 173.774 172.814 0.960 18990 835 1 2 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.539 1.299 18990 836 1 2 . 1 1 361 361 GLY H H 361 8.347 8.347 8.044 0.303 18990 837 1 2 . 1 1 362 362 LEU N N 362 126.725 126.725 125.255 1.470 18990 838 1 2 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.847 -0.172 18990 839 1 2 . 1 1 362 362 LEU C C 362 175.865 175.865 175.718 0.147 18990 840 1 2 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.021 1.169 18990 841 1 2 . 1 1 362 362 LEU CB C 362 44.050 44.050 45.443 -1.393 18990 842 1 2 . 1 1 362 362 LEU H H 362 8.935 8.935 8.778 0.157 18990 843 1 2 . 1 1 363 363 LEU N N 363 123.742 123.742 125.528 -1.786 18990 844 1 2 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.669 0.008 18990 845 1 2 . 1 1 363 363 LEU C C 363 176.162 176.162 175.718 0.444 18990 846 1 2 . 1 1 363 363 LEU CA C 363 54.342 54.342 53.999 0.343 18990 847 1 2 . 1 1 363 363 LEU CB C 363 42.210 42.210 43.276 -1.066 18990 848 1 2 . 1 1 363 363 LEU H H 363 8.481 8.481 8.740 -0.259 18990 849 1 2 . 1 1 364 364 VAL N N 364 120.980 120.980 128.165 -7.185 18990 850 1 2 . 1 1 364 364 VAL HA H 364 4.397 4.397 3.956 0.441 18990 851 1 2 . 1 1 364 364 VAL C C 364 175.592 175.592 175.378 0.214 18990 852 1 2 . 1 1 364 364 VAL CA C 364 60.460 60.460 62.087 -1.627 18990 853 1 2 . 1 1 364 364 VAL CB C 364 34.125 34.125 31.592 2.533 18990 854 1 2 . 1 1 364 364 VAL H H 364 8.155 8.155 8.586 -0.431 18990 855 1 2 . 1 1 365 365 GLU N N 365 126.950 126.950 128.447 -1.497 18990 856 1 2 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.375 0.235 18990 857 1 2 . 1 1 365 365 GLU C C 365 175.427 175.427 176.446 -1.019 18990 858 1 2 . 1 1 365 365 GLU CA C 365 54.551 54.551 54.720 -0.169 18990 859 1 2 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.640 0.140 18990 860 1 2 . 1 1 365 365 GLU H H 365 8.900 8.900 8.002 0.898 18990 861 1 2 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.229 0.033 18990 862 1 2 . 1 1 366 366 PRO C C 366 177.013 177.013 176.199 0.814 18990 863 1 2 . 1 1 366 366 PRO CA C 366 64.463 64.463 64.768 -0.305 18990 864 1 2 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.869 0.179 18990 865 1 2 . 1 1 367 367 ASP N N 367 115.459 115.459 116.058 -0.599 18990 866 1 2 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.684 -0.189 18990 867 1 2 . 1 1 367 367 ASP C C 367 175.123 175.123 175.279 -0.156 18990 868 1 2 . 1 1 367 367 ASP CA C 367 54.503 54.503 53.087 1.415 18990 869 1 2 . 1 1 367 367 ASP CB C 367 40.123 40.123 40.343 -0.220 18990 870 1 2 . 1 1 367 367 ASP H H 367 8.439 8.439 8.150 0.289 18990 871 1 2 . 1 1 368 368 CYS N N 368 118.700 118.700 122.674 -3.974 18990 872 1 2 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.304 0.266 18990 873 1 2 . 1 1 368 368 CYS C C 368 173.806 173.806 175.113 -1.307 18990 874 1 2 . 1 1 368 368 CYS CA C 368 58.581 58.581 59.308 -0.727 18990 875 1 2 . 1 1 368 368 CYS CB C 368 28.450 28.450 27.877 0.573 18990 876 1 2 . 1 1 368 368 CYS H H 368 7.515 7.515 8.365 -0.850 18990 877 1 2 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.156 0.109 18990 878 1 2 . 1 1 369 369 ARG C C 369 174.908 174.908 175.631 -0.723 18990 879 1 2 . 1 1 369 369 ARG CA C 369 57.669 57.669 58.247 -0.578 18990 880 1 2 . 1 1 369 369 ARG CB C 369 32.274 32.274 30.892 1.383 18990 881 1 2 . 1 1 370 370 LYS N N 370 121.022 121.022 118.348 2.674 18990 882 1 2 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.701 -0.531 18990 883 1 2 . 1 1 370 370 LYS C C 370 174.868 174.868 174.868 0.000 18990 884 1 2 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.023 1.531 18990 885 1 2 . 1 1 370 370 LYS CB C 370 33.140 33.140 33.461 -0.321 18990 886 1 2 . 1 1 370 370 LYS H H 370 7.740 7.740 7.990 -0.250 18990 887 1 2 . 1 1 371 371 VAL N N 371 128.362 128.362 127.440 0.922 18990 888 1 2 . 1 1 371 371 VAL HA H 371 4.133 4.133 3.969 0.164 18990 889 1 2 . 1 1 371 371 VAL C C 371 173.402 173.402 174.627 -1.225 18990 890 1 2 . 1 1 371 371 VAL CA C 371 60.777 60.777 61.740 -0.963 18990 891 1 2 . 1 1 371 371 VAL CB C 371 33.000 33.000 31.962 1.038 18990 892 1 2 . 1 1 371 371 VAL H H 371 8.647 8.647 8.467 0.180 18990 893 1 2 . 1 1 372 372 THR N N 372 119.667 119.667 122.015 -2.348 18990 894 1 2 . 1 1 372 372 THR HA H 372 5.032 5.032 4.859 0.173 18990 895 1 2 . 1 1 372 372 THR C C 372 174.339 174.339 173.907 0.432 18990 896 1 2 . 1 1 372 372 THR CA C 372 60.881 60.881 60.941 -0.060 18990 897 1 2 . 1 1 372 372 THR CB C 372 70.471 70.471 71.822 -1.351 18990 898 1 2 . 1 1 372 372 THR H H 372 8.087 8.087 8.129 -0.042 18990 899 1 2 . 1 1 373 373 CYS N N 373 132.554 132.554 125.613 6.941 18990 900 1 2 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.549 0.253 18990 901 1 2 . 1 1 373 373 CYS C C 373 176.791 176.791 176.372 0.419 18990 902 1 2 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.313 -0.809 18990 903 1 2 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.562 3.749 18990 904 1 2 . 1 1 373 373 CYS H H 373 9.322 9.322 9.534 -0.212 18990 905 1 2 . 1 1 374 374 GLN N N 374 125.890 125.890 123.459 2.431 18990 906 1 2 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.179 -0.179 18990 907 1 2 . 1 1 374 374 GLN C C 374 176.827 176.827 176.505 0.322 18990 908 1 2 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.994 0.306 18990 909 1 2 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.591 1.073 18990 910 1 2 . 1 1 374 374 GLN H H 374 7.856 7.856 8.713 -0.857 18990 911 1 2 . 1 1 375 375 ASN N N 375 115.342 115.342 113.704 1.638 18990 912 1 2 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.818 0.069 18990 913 1 2 . 1 1 375 375 ASN C C 375 174.049 174.049 175.403 -1.354 18990 914 1 2 . 1 1 375 375 ASN CA C 375 53.047 53.047 52.750 0.297 18990 915 1 2 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.245 -0.329 18990 916 1 2 . 1 1 375 375 ASN H H 375 8.913 8.913 8.361 0.552 18990 917 1 2 . 1 1 376 376 GLY N N 376 109.098 109.098 109.871 -0.773 18990 918 1 2 . 1 1 376 376 GLY C C 376 174.110 174.110 172.655 1.455 18990 919 1 2 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.639 0.747 18990 920 1 2 . 1 1 376 376 GLY H H 376 7.162 7.162 8.017 -0.855 18990 921 1 2 . 1 1 377 377 CYS N N 377 132.546 132.546 121.982 10.564 18990 922 1 2 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.799 -0.035 18990 923 1 2 . 1 1 377 377 CYS C C 377 177.355 177.355 175.992 1.363 18990 924 1 2 . 1 1 377 377 CYS CA C 377 59.988 59.988 56.760 3.228 18990 925 1 2 . 1 1 377 377 CYS CB C 377 32.365 32.365 25.738 6.627 18990 926 1 2 . 1 1 377 377 CYS H H 377 9.800 9.800 8.349 1.451 18990 927 1 2 . 1 1 378 378 GLY N N 378 113.851 113.851 112.058 1.793 18990 928 1 2 . 1 1 378 378 GLY C C 378 173.404 173.404 173.012 0.392 18990 929 1 2 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.789 0.074 18990 930 1 2 . 1 1 378 378 GLY H H 378 8.820 8.820 8.595 0.225 18990 931 1 2 . 1 1 379 379 TYR N N 379 125.532 125.532 126.740 -1.208 18990 932 1 2 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.700 -0.222 18990 933 1 2 . 1 1 379 379 TYR C C 379 173.661 173.661 174.035 -0.374 18990 934 1 2 . 1 1 379 379 TYR CA C 379 59.180 59.180 56.860 2.320 18990 935 1 2 . 1 1 379 379 TYR CB C 379 40.108 40.108 42.256 -2.148 18990 936 1 2 . 1 1 379 379 TYR H H 379 9.054 9.054 8.088 0.966 18990 937 1 2 . 1 1 380 380 VAL N N 380 124.461 124.461 127.537 -3.076 18990 938 1 2 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.575 0.243 18990 939 1 2 . 1 1 380 380 VAL C C 380 175.876 175.876 174.165 1.711 18990 940 1 2 . 1 1 380 380 VAL CA C 380 60.797 60.797 60.930 -0.133 18990 941 1 2 . 1 1 380 380 VAL CB C 380 32.610 32.610 32.894 -0.284 18990 942 1 2 . 1 1 380 380 VAL H H 380 7.238 7.238 7.791 -0.553 18990 943 1 2 . 1 1 381 381 PHE N N 381 124.588 124.588 124.965 -0.377 18990 944 1 2 . 1 1 381 381 PHE HA H 381 5.273 5.273 4.875 0.398 18990 945 1 2 . 1 1 381 381 PHE C C 381 173.242 173.242 173.312 -0.070 18990 946 1 2 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.380 -0.170 18990 947 1 2 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.145 1.945 18990 948 1 2 . 1 1 381 381 PHE H H 381 9.424 9.424 7.373 2.051 18990 949 1 2 . 1 1 382 382 CYS N N 382 120.221 120.221 119.879 0.342 18990 950 1 2 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.184 0.718 18990 951 1 2 . 1 1 382 382 CYS C C 382 177.165 177.165 175.749 1.416 18990 952 1 2 . 1 1 382 382 CYS CA C 382 57.691 57.691 58.431 -0.739 18990 953 1 2 . 1 1 382 382 CYS CB C 382 32.475 32.475 30.015 2.461 18990 954 1 2 . 1 1 382 382 CYS H H 382 8.673 8.673 8.661 0.012 18990 955 1 2 . 1 1 383 383 ARG N N 383 129.347 129.347 120.729 8.618 18990 956 1 2 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.173 -0.152 18990 957 1 2 . 1 1 383 383 ARG C C 383 175.012 175.012 175.781 -0.769 18990 958 1 2 . 1 1 383 383 ARG CA C 383 58.686 58.686 57.440 1.246 18990 959 1 2 . 1 1 383 383 ARG CB C 383 30.900 30.900 29.846 1.054 18990 960 1 2 . 1 1 383 383 ARG H H 383 9.534 9.534 8.387 1.147 18990 961 1 2 . 1 1 384 384 ASN N N 384 117.772 117.772 116.745 1.027 18990 962 1 2 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.802 -0.094 18990 963 1 2 . 1 1 384 384 ASN C C 384 175.656 175.656 174.546 1.110 18990 964 1 2 . 1 1 384 384 ASN CA C 384 55.778 55.778 53.941 1.837 18990 965 1 2 . 1 1 384 384 ASN CB C 384 39.475 39.475 40.922 -1.448 18990 966 1 2 . 1 1 384 384 ASN H H 384 8.840 8.840 7.814 1.026 18990 967 1 2 . 1 1 385 385 CYS N N 385 115.876 115.876 113.515 2.361 18990 968 1 2 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.861 0.167 18990 969 1 2 . 1 1 385 385 CYS C C 385 175.703 175.703 173.351 2.352 18990 970 1 2 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.429 1.683 18990 971 1 2 . 1 1 385 385 CYS CB C 385 32.359 32.359 29.551 2.808 18990 972 1 2 . 1 1 385 385 CYS H H 385 7.868 7.868 7.725 0.143 18990 973 1 2 . 1 1 386 386 LEU N N 386 120.082 120.082 118.881 1.201 18990 974 1 2 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.826 -0.513 18990 975 1 2 . 1 1 386 386 LEU C C 386 175.722 175.722 177.307 -1.585 18990 976 1 2 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.335 2.674 18990 977 1 2 . 1 1 386 386 LEU CB C 386 38.412 38.412 41.267 -2.855 18990 978 1 2 . 1 1 386 386 LEU H H 386 8.514 8.514 8.617 -0.103 18990 979 1 2 . 1 1 387 387 GLN N N 387 117.579 117.579 120.792 -3.213 18990 980 1 2 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.472 0.304 18990 981 1 2 . 1 1 387 387 GLN C C 387 175.299 175.299 176.989 -1.690 18990 982 1 2 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.229 -1.212 18990 983 1 2 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.408 1.899 18990 984 1 2 . 1 1 387 387 GLN H H 387 8.248 8.248 7.593 0.655 18990 985 1 2 . 1 1 388 388 GLY N N 388 106.107 106.107 107.980 -1.873 18990 986 1 2 . 1 1 388 388 GLY C C 388 173.693 173.693 173.956 -0.263 18990 987 1 2 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.451 0.729 18990 988 1 2 . 1 1 388 388 GLY H H 388 8.695 8.695 8.404 0.291 18990 989 1 2 . 1 1 389 389 TYR N N 389 122.514 122.514 117.253 5.261 18990 990 1 2 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.191 -0.533 18990 991 1 2 . 1 1 389 389 TYR C C 389 172.860 172.860 174.046 -1.186 18990 992 1 2 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.584 4.403 18990 993 1 2 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.492 0.560 18990 994 1 2 . 1 1 389 389 TYR H H 389 7.923 7.923 8.172 -0.249 18990 995 1 2 . 1 1 390 390 HIS N N 390 120.080 120.080 125.461 -5.381 18990 996 1 2 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.840 -0.132 18990 997 1 2 . 1 1 390 390 HIS C C 390 173.235 173.235 173.266 -0.031 18990 998 1 2 . 1 1 390 390 HIS CA C 390 51.431 51.431 54.541 -3.110 18990 999 1 2 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.276 0.624 18990 1000 1 2 . 1 1 390 390 HIS H H 390 5.291 5.291 8.333 -3.042 18990 1001 1 2 . 1 1 391 391 ILE N N 391 117.810 117.810 120.015 -2.205 18990 1002 1 2 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.223 -0.107 18990 1003 1 2 . 1 1 391 391 ILE C C 391 178.208 178.208 176.110 2.098 18990 1004 1 2 . 1 1 391 391 ILE CA C 391 60.877 60.877 60.506 0.371 18990 1005 1 2 . 1 1 391 391 ILE CB C 391 39.034 39.034 39.874 -0.840 18990 1006 1 2 . 1 1 391 391 ILE H H 391 8.418 8.418 8.404 0.014 18990 1007 1 2 . 1 1 392 392 GLY N N 392 112.387 112.387 114.261 -1.874 18990 1008 1 2 . 1 1 392 392 GLY C C 392 173.565 173.565 173.242 0.323 18990 1009 1 2 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.607 0.651 18990 1010 1 2 . 1 1 392 392 GLY H H 392 8.654 8.654 8.471 0.183 18990 1011 1 2 . 1 1 393 393 GLU N N 393 119.098 119.098 119.944 -0.846 18990 1012 1 2 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.652 -0.363 18990 1013 1 2 . 1 1 393 393 GLU C C 393 176.899 176.899 175.963 0.936 18990 1014 1 2 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.456 0.977 18990 1015 1 2 . 1 1 393 393 GLU CB C 393 30.470 30.470 31.093 -0.623 18990 1016 1 2 . 1 1 393 393 GLU H H 393 8.391 8.391 8.367 0.024 18990 1017 1 2 . 1 1 394 394 CYS N N 394 122.845 122.845 119.127 3.718 18990 1018 1 2 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.874 -1.108 18990 1019 1 2 . 1 1 394 394 CYS C C 394 175.461 175.461 174.507 0.954 18990 1020 1 2 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.309 1.526 18990 1021 1 2 . 1 1 394 394 CYS CB C 394 30.761 30.761 28.296 2.465 18990 1022 1 2 . 1 1 394 394 CYS H H 394 8.474 8.474 8.610 -0.136 18990 1023 1 2 . 1 1 395 395 LEU N N 395 124.403 124.403 121.886 2.517 18990 1024 1 2 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.873 -0.369 18990 1025 1 2 . 1 1 395 395 LEU C C 395 175.259 175.259 174.803 0.456 18990 1026 1 2 . 1 1 395 395 LEU CA C 395 52.835 52.835 52.522 0.313 18990 1027 1 2 . 1 1 395 395 LEU CB C 395 41.436 41.436 42.292 -0.856 18990 1028 1 2 . 1 1 395 395 LEU H H 395 8.418 8.418 8.261 0.157 18990 1029 1 2 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.741 -0.371 18990 1030 1 2 . 1 1 396 396 PRO C C 396 177.006 177.006 176.619 0.387 18990 1031 1 2 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.342 0.754 18990 1032 1 2 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.980 -0.909 18990 1033 1 2 . 1 1 397 397 GLU N N 397 121.574 121.574 120.127 1.447 18990 1034 1 2 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.353 -0.128 18990 1035 1 2 . 1 1 397 397 GLU C C 397 177.202 177.202 177.651 -0.449 18990 1036 1 2 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.391 0.643 18990 1037 1 2 . 1 1 397 397 GLU CB C 397 30.263 30.263 30.187 0.076 18990 1038 1 2 . 1 1 397 397 GLU H H 397 8.568 8.568 8.861 -0.293 18990 1039 1 2 . 1 1 398 398 GLY N N 398 110.495 110.495 110.322 0.173 18990 1040 1 2 . 1 1 398 398 GLY C C 398 174.579 174.579 173.856 0.723 18990 1041 1 2 . 1 1 398 398 GLY CA C 398 45.462 45.462 44.716 0.746 18990 1042 1 2 . 1 1 398 398 GLY H H 398 8.515 8.515 8.234 0.281 18990 1043 1 2 . 1 1 399 399 THR N N 399 113.234 113.234 115.171 -1.937 18990 1044 1 2 . 1 1 399 399 THR HA H 399 4.398 4.398 4.699 -0.301 18990 1045 1 2 . 1 1 399 399 THR C C 399 175.333 175.333 174.842 0.491 18990 1046 1 2 . 1 1 399 399 THR CA C 399 62.233 62.233 61.414 0.819 18990 1047 1 2 . 1 1 399 399 THR CB C 399 69.833 69.833 71.408 -1.575 18990 1048 1 2 . 1 1 399 399 THR H H 399 8.090 8.090 8.233 -0.143 18990 1049 1 2 . 1 1 400 400 GLY N N 400 111.479 111.479 109.211 2.268 18990 1050 1 2 . 1 1 400 400 GLY C C 400 174.048 174.048 173.766 0.282 18990 1051 1 2 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.217 0.222 18990 1052 1 2 . 1 1 400 400 GLY H H 400 8.524 8.524 8.263 0.261 18990 1053 1 2 . 1 1 401 401 ALA N N 401 123.919 123.919 123.227 0.692 18990 1054 1 2 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.180 0.071 18990 1055 1 2 . 1 1 401 401 ALA C C 401 177.942 177.942 176.622 1.320 18990 1056 1 2 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.980 0.750 18990 1057 1 2 . 1 1 401 401 ALA CB C 401 19.142 19.142 18.357 0.785 18990 1058 1 2 . 1 1 401 401 ALA H H 401 8.179 8.179 7.964 0.215 18990 1059 1 2 . 1 1 402 402 SER N N 402 114.904 114.904 115.980 -1.076 18990 1060 1 2 . 1 1 402 402 SER HA H 402 4.448 4.448 4.556 -0.108 18990 1061 1 2 . 1 1 402 402 SER C C 402 174.426 174.426 174.715 -0.289 18990 1062 1 2 . 1 1 402 402 SER CA C 402 58.289 58.289 58.149 0.140 18990 1063 1 2 . 1 1 402 402 SER CB C 402 63.772 63.772 64.053 -0.281 18990 1064 1 2 . 1 1 402 402 SER H H 402 8.305 8.305 8.268 0.037 18990 1065 1 2 . 1 1 403 403 ALA N N 403 125.965 125.965 125.876 0.089 18990 1066 1 2 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.608 -0.209 18990 1067 1 2 . 1 1 403 403 ALA C C 403 177.984 177.984 175.973 2.011 18990 1068 1 2 . 1 1 403 403 ALA CA C 403 52.655 52.655 51.652 1.003 18990 1069 1 2 . 1 1 403 403 ALA CB C 403 19.138 19.138 20.470 -1.332 18990 1070 1 2 . 1 1 403 403 ALA H H 403 8.345 8.345 8.210 0.135 18990 1071 1 2 . 1 1 404 404 THR N N 404 112.790 112.790 114.861 -2.071 18990 1072 1 2 . 1 1 404 404 THR C C 404 174.420 174.420 173.835 0.585 18990 1073 1 2 . 1 1 404 404 THR CA C 404 61.988 61.988 61.424 0.564 18990 1074 1 2 . 1 1 404 404 THR CB C 404 69.688 69.688 69.706 -0.018 18990 1075 1 2 . 1 1 404 404 THR H H 404 8.118 8.118 8.250 -0.132 18990 1076 1 2 . 1 1 405 405 ASN N N 405 121.050 121.050 122.731 -1.681 18990 1077 1 2 . 1 1 405 405 ASN H H 405 8.396 8.396 8.575 -0.179 18990 1078 1 2 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.787 -0.209 18990 1079 1 2 . 1 1 407 407 CYS C C 407 174.489 174.489 173.908 0.581 18990 1080 1 2 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.684 0.029 18990 1081 1 2 . 1 1 407 407 CYS CB C 407 28.102 28.102 28.865 -0.763 18990 1082 1 2 . 1 1 408 408 GLU N N 408 123.021 123.021 123.707 -0.686 18990 1083 1 2 . 1 1 408 408 GLU C C 408 175.954 175.954 174.905 1.049 18990 1084 1 2 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.143 0.659 18990 1085 1 2 . 1 1 408 408 GLU CB C 408 30.328 30.328 30.190 0.138 18990 1086 1 2 . 1 1 408 408 GLU H H 408 8.415 8.415 8.423 -0.008 18990 1087 1 2 . 1 1 409 409 TYR N N 409 121.015 121.015 119.370 1.645 18990 1088 1 2 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.825 -0.171 18990 1089 1 2 . 1 1 409 409 TYR C C 409 175.613 175.613 174.804 0.809 18990 1090 1 2 . 1 1 409 409 TYR CA C 409 57.669 57.669 58.022 -0.353 18990 1091 1 2 . 1 1 409 409 TYR CB C 409 38.825 38.825 40.465 -1.640 18990 1092 1 2 . 1 1 409 409 TYR H H 409 8.135 8.135 8.429 -0.294 18990 1093 1 2 . 1 1 410 410 THR N N 410 116.975 116.975 120.836 -3.861 18990 1094 1 2 . 1 1 410 410 THR HA H 410 4.306 4.306 4.334 -0.028 18990 1095 1 2 . 1 1 410 410 THR C C 410 173.846 173.846 173.300 0.546 18990 1096 1 2 . 1 1 410 410 THR CA C 410 61.730 61.730 60.636 1.094 18990 1097 1 2 . 1 1 410 410 THR CB C 410 69.914 69.914 69.563 0.351 18990 1098 1 2 . 1 1 410 410 THR H H 410 8.060 8.060 7.893 0.167 18990 1099 1 2 . 1 1 411 411 VAL N N 411 122.900 122.900 119.872 3.028 18990 1100 1 2 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.255 -0.202 18990 1101 1 2 . 1 1 411 411 VAL C C 411 175.275 175.275 175.053 0.222 18990 1102 1 2 . 1 1 411 411 VAL CA C 411 61.853 61.853 60.843 1.010 18990 1103 1 2 . 1 1 411 411 VAL CB C 411 32.976 32.976 33.491 -0.515 18990 1104 1 2 . 1 1 411 411 VAL H H 411 8.089 8.089 8.031 0.058 18990 1105 1 2 . 1 1 412 412 ASP N N 412 125.924 125.924 125.332 0.592 18990 1106 1 2 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.944 -0.094 18990 1107 1 2 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.100 -0.522 18990 1108 1 2 . 1 1 412 412 ASP CB C 412 41.538 41.538 42.221 -0.683 18990 1109 1 2 . 1 1 412 412 ASP H H 412 8.397 8.397 8.225 0.172 18990 1110 1 2 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.516 -0.130 18990 1111 1 2 . 1 1 413 413 PRO C C 413 177.352 177.352 176.105 1.247 18990 1112 1 2 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.647 1.263 18990 1113 1 2 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.433 -0.165 18990 1114 1 2 . 1 1 414 414 ASN N N 414 117.035 117.035 118.394 -1.359 18990 1115 1 2 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.610 0.067 18990 1116 1 2 . 1 1 414 414 ASN C C 414 175.532 175.532 175.374 0.158 18990 1117 1 2 . 1 1 414 414 ASN CA C 414 53.824 53.824 54.626 -0.801 18990 1118 1 2 . 1 1 414 414 ASN CB C 414 38.728 38.728 38.619 0.109 18990 1119 1 2 . 1 1 414 414 ASN H H 414 8.496 8.496 8.523 -0.027 18990 1120 1 2 . 1 1 415 415 ARG N N 415 121.000 121.000 118.391 2.609 18990 1121 1 2 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.515 -0.271 18990 1122 1 2 . 1 1 415 415 ARG C C 415 176.243 176.243 174.168 2.075 18990 1123 1 2 . 1 1 415 415 ARG CA C 415 56.404 56.404 55.463 0.941 18990 1124 1 2 . 1 1 415 415 ARG CB C 415 30.637 30.637 30.802 -0.165 18990 1125 1 2 . 1 1 415 415 ARG H H 415 7.804 7.804 7.833 -0.029 18990 1126 1 2 . 1 1 416 416 ALA N N 416 124.880 124.880 122.554 2.326 18990 1127 1 2 . 1 1 416 416 ALA C C 416 177.831 177.831 175.960 1.871 18990 1128 1 2 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.140 1.817 18990 1129 1 2 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.508 -1.449 18990 1130 1 2 . 1 1 416 416 ALA H H 416 8.189 8.189 8.284 -0.095 18990 1131 1 2 . 1 1 417 417 ALA N N 417 122.614 122.614 123.232 -0.618 18990 1132 1 2 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.584 -0.337 18990 1133 1 2 . 1 1 417 417 ALA C C 417 178.024 178.024 176.762 1.262 18990 1134 1 2 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.704 1.085 18990 1135 1 2 . 1 1 417 417 ALA CB C 417 19.042 19.042 20.085 -1.043 18990 1136 1 2 . 1 1 417 417 ALA H H 417 8.169 8.169 8.260 -0.091 18990 1137 1 2 . 1 1 418 418 GLU N N 418 119.500 119.500 124.339 -4.839 18990 1138 1 2 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.276 -0.087 18990 1139 1 2 . 1 1 418 418 GLU C C 418 176.266 176.266 176.101 0.165 18990 1140 1 2 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.830 0.746 18990 1141 1 2 . 1 1 418 418 GLU CB C 418 30.307 30.307 30.067 0.240 18990 1142 1 2 . 1 1 418 418 GLU H H 418 8.184 8.184 8.780 -0.596 18990 1143 1 2 . 1 1 419 419 ALA N N 419 124.643 124.643 124.632 0.011 18990 1144 1 2 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.556 -0.306 18990 1145 1 2 . 1 1 419 419 ALA C C 419 177.488 177.488 176.787 0.701 18990 1146 1 2 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.532 0.977 18990 1147 1 2 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.145 -0.984 18990 1148 1 2 . 1 1 419 419 ALA H H 419 8.135 8.135 8.352 -0.217 18990 1149 1 2 . 1 1 420 420 ARG N N 420 120.003 120.003 120.125 -0.122 18990 1150 1 2 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.395 -0.102 18990 1151 1 2 . 1 1 420 420 ARG C C 420 176.297 176.297 174.290 2.007 18990 1152 1 2 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.011 0.922 18990 1153 1 2 . 1 1 420 420 ARG CB C 420 30.850 30.850 30.978 -0.128 18990 1154 1 2 . 1 1 420 420 ARG H H 420 8.135 8.135 7.910 0.225 18990 1155 1 2 . 1 1 421 421 TRP N N 421 122.280 122.280 120.620 1.660 18990 1156 1 2 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.890 -0.227 18990 1157 1 2 . 1 1 421 421 TRP C C 421 175.856 175.856 174.893 0.963 18990 1158 1 2 . 1 1 421 421 TRP CA C 421 57.404 57.404 56.318 1.086 18990 1159 1 2 . 1 1 421 421 TRP CB C 421 29.437 29.437 31.216 -1.779 18990 1160 1 2 . 1 1 421 421 TRP H H 421 8.159 8.159 8.155 0.004 18990 1161 1 2 . 1 1 422 422 ASP N N 422 121.980 121.980 122.727 -0.747 18990 1162 1 2 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.662 -0.167 18990 1163 1 2 . 1 1 422 422 ASP C C 422 176.184 176.184 176.202 -0.018 18990 1164 1 2 . 1 1 422 422 ASP CA C 422 53.899 53.899 54.947 -1.048 18990 1165 1 2 . 1 1 422 422 ASP CB C 422 40.948 40.948 41.450 -0.501 18990 1166 1 2 . 1 1 422 422 ASP H H 422 8.135 8.135 8.721 -0.586 18990 1167 1 2 . 1 1 423 423 GLU N N 423 121.990 121.990 123.046 -1.056 18990 1168 1 2 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.328 -0.238 18990 1169 1 2 . 1 1 423 423 GLU C C 423 176.720 176.720 176.525 0.195 18990 1170 1 2 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.575 0.594 18990 1171 1 2 . 1 1 423 423 GLU CB C 423 30.156 30.156 29.799 0.357 18990 1172 1 2 . 1 1 423 423 GLU H H 423 8.153 8.153 8.928 -0.775 18990 1173 1 2 . 1 1 424 424 ALA N N 424 123.900 123.900 123.145 0.755 18990 1174 1 2 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.566 -0.286 18990 1175 1 2 . 1 1 424 424 ALA C C 424 178.095 178.095 176.898 1.197 18990 1176 1 2 . 1 1 424 424 ALA CA C 424 53.017 53.017 51.979 1.038 18990 1177 1 2 . 1 1 424 424 ALA CB C 424 19.086 19.086 19.528 -0.442 18990 1178 1 2 . 1 1 424 424 ALA H H 424 8.243 8.243 7.782 0.461 18990 1179 1 2 . 1 1 425 425 SER N N 425 113.881 113.881 114.976 -1.095 18990 1180 1 2 . 1 1 425 425 SER HA H 425 4.387 4.387 4.560 -0.173 18990 1181 1 2 . 1 1 425 425 SER C C 425 174.338 174.338 173.193 1.145 18990 1182 1 2 . 1 1 425 425 SER CA C 425 58.546 58.546 57.525 1.021 18990 1183 1 2 . 1 1 425 425 SER CB C 425 63.784 63.784 64.379 -0.595 18990 1184 1 2 . 1 1 425 425 SER H H 425 8.063 8.063 8.369 -0.306 18990 1185 1 2 . 1 1 426 426 ASN N N 426 121.032 121.032 123.221 -2.189 18990 1186 1 2 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.687 0.019 18990 1187 1 2 . 1 1 426 426 ASN C C 426 175.046 175.046 174.494 0.552 18990 1188 1 2 . 1 1 426 426 ASN CA C 426 53.445 53.445 53.372 0.073 18990 1189 1 2 . 1 1 426 426 ASN CB C 426 38.847 38.847 38.758 0.089 18990 1190 1 2 . 1 1 426 426 ASN H H 426 8.391 8.391 8.394 -0.003 18990 1191 1 2 . 1 1 427 427 VAL N N 427 119.463 119.463 124.013 -4.550 18990 1192 1 2 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.238 -0.045 18990 1193 1 2 . 1 1 427 427 VAL C C 427 176.213 176.213 175.625 0.588 18990 1194 1 2 . 1 1 427 427 VAL CA C 427 62.449 62.449 61.686 0.763 18990 1195 1 2 . 1 1 427 427 VAL CB C 427 32.865 32.865 33.699 -0.834 18990 1196 1 2 . 1 1 427 427 VAL H H 427 7.954 7.954 8.326 -0.372 18990 1197 1 2 . 1 1 428 428 THR N N 428 118.226 118.226 123.516 -5.290 18990 1198 1 2 . 1 1 428 428 THR HA H 428 4.353 4.353 4.375 -0.022 18990 1199 1 2 . 1 1 428 428 THR C C 428 174.361 174.361 174.221 0.140 18990 1200 1 2 . 1 1 428 428 THR CA C 428 62.065 62.065 62.953 -0.888 18990 1201 1 2 . 1 1 428 428 THR CB C 428 69.729 69.729 68.566 1.163 18990 1202 1 2 . 1 1 428 428 THR H H 428 8.225 8.225 8.360 -0.135 18990 1203 1 2 . 1 1 429 429 ILE N N 429 123.910 123.910 122.574 1.336 18990 1204 1 2 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.384 -0.196 18990 1205 1 2 . 1 1 429 429 ILE C C 429 175.774 175.774 174.535 1.239 18990 1206 1 2 . 1 1 429 429 ILE CA C 429 60.819 60.819 59.259 1.560 18990 1207 1 2 . 1 1 429 429 ILE CB C 429 38.719 38.719 39.694 -0.975 18990 1208 1 2 . 1 1 429 429 ILE H H 429 8.148 8.148 8.277 -0.129 18990 1209 1 2 . 1 1 430 430 LYS N N 430 126.453 126.453 121.966 4.487 18990 1210 1 2 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.602 -0.168 18990 1211 1 2 . 1 1 430 430 LYS C C 430 176.241 176.241 175.477 0.764 18990 1212 1 2 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.322 0.615 18990 1213 1 2 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.797 -0.633 18990 1214 1 2 . 1 1 430 430 LYS H H 430 8.406 8.406 8.423 -0.017 18990 1215 1 2 . 1 1 431 431 VAL N N 431 122.496 122.496 123.932 -1.436 18990 1216 1 2 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.173 0.107 18990 1217 1 2 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.434 -0.131 18990 1218 1 2 . 1 1 431 431 VAL CB C 431 33.132 33.132 31.889 1.243 18990 1219 1 2 . 1 1 431 431 VAL H H 431 8.312 8.312 8.490 -0.178 18990 1220 1 2 . 1 1 432 432 SER HA H 432 4.486 4.486 4.538 -0.052 18990 1221 1 2 . 1 1 432 432 SER C C 432 173.834 173.834 174.419 -0.585 18990 1222 1 2 . 1 1 432 432 SER CA C 432 58.650 58.650 59.039 -0.389 18990 1223 1 2 . 1 1 432 432 SER CB C 432 64.152 64.152 64.328 -0.176 18990 1224 1 2 . 1 1 433 433 THR N N 433 114.706 114.706 112.384 2.322 18990 1225 1 2 . 1 1 433 433 THR HA H 433 5.446 5.446 4.338 1.107 18990 1226 1 2 . 1 1 433 433 THR C C 433 173.979 173.979 174.266 -0.287 18990 1227 1 2 . 1 1 433 433 THR CA C 433 60.412 60.412 61.713 -1.301 18990 1228 1 2 . 1 1 433 433 THR CB C 433 71.896 71.896 69.918 1.978 18990 1229 1 2 . 1 1 433 433 THR H H 433 7.833 7.833 7.472 0.361 18990 1230 1 2 . 1 1 434 434 LYS N N 434 122.492 122.492 122.040 0.452 18990 1231 1 2 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.975 -0.266 18990 1232 1 2 . 1 1 434 434 LYS C C 434 173.589 173.589 174.854 -1.265 18990 1233 1 2 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.667 1.708 18990 1234 1 2 . 1 1 434 434 LYS CB C 434 36.925 36.925 32.935 3.990 18990 1235 1 2 . 1 1 434 434 LYS H H 434 8.937 8.937 9.036 -0.099 18990 1236 1 2 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.760 -0.493 18990 1237 1 2 . 1 1 435 435 PRO C C 435 175.238 175.238 176.489 -1.251 18990 1238 1 2 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.247 -1.324 18990 1239 1 2 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.776 -0.690 18990 1240 1 2 . 1 1 436 436 CYS N N 436 125.422 125.422 124.845 0.577 18990 1241 1 2 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.673 -1.243 18990 1242 1 2 . 1 1 436 436 CYS C C 436 176.770 176.770 176.174 0.596 18990 1243 1 2 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.355 0.661 18990 1244 1 2 . 1 1 436 436 CYS CB C 436 31.698 31.698 28.112 3.586 18990 1245 1 2 . 1 1 436 436 CYS H H 436 7.768 7.768 8.419 -0.651 18990 1246 1 2 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.165 -0.307 18990 1247 1 2 . 1 1 437 437 PRO C C 437 173.608 173.608 176.530 -2.922 18990 1248 1 2 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.349 -0.136 18990 1249 1 2 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.540 0.910 18990 1250 1 2 . 1 1 438 438 LYS N N 438 118.600 118.600 116.635 1.965 18990 1251 1 2 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.437 -0.467 18990 1252 1 2 . 1 1 438 438 LYS C C 438 176.887 176.887 178.353 -1.466 18990 1253 1 2 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.857 -0.170 18990 1254 1 2 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.604 -0.480 18990 1255 1 2 . 1 1 438 438 LYS H H 438 8.390 8.390 7.710 0.680 18990 1256 1 2 . 1 1 439 439 CYS N N 439 118.950 118.950 114.449 4.501 18990 1257 1 2 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.591 0.155 18990 1258 1 2 . 1 1 439 439 CYS C C 439 176.650 176.650 175.041 1.609 18990 1259 1 2 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.573 1.775 18990 1260 1 2 . 1 1 439 439 CYS CB C 439 31.196 31.196 27.598 3.598 18990 1261 1 2 . 1 1 439 439 CYS H H 439 8.357 8.357 7.955 0.402 18990 1262 1 2 . 1 1 440 440 ARG N N 440 117.200 117.200 117.518 -0.318 18990 1263 1 2 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.177 -0.209 18990 1264 1 2 . 1 1 440 440 ARG C C 440 175.253 175.253 175.778 -0.525 18990 1265 1 2 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.723 0.177 18990 1266 1 2 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.182 -1.141 18990 1267 1 2 . 1 1 440 440 ARG H H 440 8.065 8.065 8.314 -0.249 18990 1268 1 2 . 1 1 441 441 THR N N 441 122.400 122.400 111.211 11.189 18990 1269 1 2 . 1 1 441 441 THR HA H 441 4.371 4.371 4.729 -0.358 18990 1270 1 2 . 1 1 441 441 THR C C 441 173.702 173.702 173.306 0.396 18990 1271 1 2 . 1 1 441 441 THR CA C 441 63.194 63.194 58.632 4.562 18990 1272 1 2 . 1 1 441 441 THR CB C 441 68.933 68.933 69.816 -0.883 18990 1273 1 2 . 1 1 441 441 THR H H 441 8.643 8.643 7.636 1.007 18990 1274 1 2 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.646 -0.499 18990 1275 1 2 . 1 1 442 442 PRO C C 442 176.215 176.215 176.067 0.148 18990 1276 1 2 . 1 1 442 442 PRO CA C 442 64.197 64.197 63.084 1.113 18990 1277 1 2 . 1 1 442 442 PRO CB C 442 32.044 32.044 31.320 0.724 18990 1278 1 2 . 1 1 443 443 THR N N 443 122.932 122.932 121.395 1.537 18990 1279 1 2 . 1 1 443 443 THR HA H 443 4.665 4.665 4.694 -0.029 18990 1280 1 2 . 1 1 443 443 THR C C 443 172.133 172.133 173.317 -1.184 18990 1281 1 2 . 1 1 443 443 THR CA C 443 62.566 62.566 62.155 0.411 18990 1282 1 2 . 1 1 443 443 THR CB C 443 71.562 71.562 72.167 -0.605 18990 1283 1 2 . 1 1 443 443 THR H H 443 9.116 9.116 9.081 0.035 18990 1284 1 2 . 1 1 444 444 GLU N N 444 126.390 126.390 126.708 -0.318 18990 1285 1 2 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.749 0.193 18990 1286 1 2 . 1 1 444 444 GLU C C 444 175.292 175.292 175.373 -0.081 18990 1287 1 2 . 1 1 444 444 GLU CA C 444 55.049 55.049 55.291 -0.242 18990 1288 1 2 . 1 1 444 444 GLU CB C 444 31.861 31.861 32.773 -0.912 18990 1289 1 2 . 1 1 444 444 GLU H H 444 8.720 8.720 8.738 -0.018 18990 1290 1 2 . 1 1 445 445 ARG N N 445 123.505 123.505 126.208 -2.703 18990 1291 1 2 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.417 -0.706 18990 1292 1 2 . 1 1 445 445 ARG C C 445 175.289 175.289 175.136 0.153 18990 1293 1 2 . 1 1 445 445 ARG CA C 445 55.856 55.856 54.817 1.039 18990 1294 1 2 . 1 1 445 445 ARG CB C 445 30.675 30.675 30.349 0.326 18990 1295 1 2 . 1 1 445 445 ARG H H 445 8.157 8.157 8.766 -0.609 18990 1296 1 2 . 1 1 446 446 ASP N N 446 126.800 126.800 125.713 1.087 18990 1297 1 2 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.531 0.110 18990 1298 1 2 . 1 1 446 446 ASP C C 446 176.020 176.020 176.222 -0.202 18990 1299 1 2 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.889 -0.938 18990 1300 1 2 . 1 1 446 446 ASP CB C 446 41.400 41.400 39.990 1.410 18990 1301 1 2 . 1 1 446 446 ASP H H 446 8.476 8.476 8.667 -0.191 18990 1302 1 2 . 1 1 447 447 GLY N N 447 111.262 111.262 110.840 0.422 18990 1303 1 2 . 1 1 447 447 GLY C C 447 174.073 174.073 173.464 0.609 18990 1304 1 2 . 1 1 447 447 GLY CA C 447 45.832 45.832 44.227 1.605 18990 1305 1 2 . 1 1 447 447 GLY H H 447 8.056 8.056 8.126 -0.070 18990 1306 1 2 . 1 1 448 448 GLY N N 448 108.655 108.655 109.048 -0.393 18990 1307 1 2 . 1 1 448 448 GLY C C 448 174.020 174.020 173.562 0.458 18990 1308 1 2 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.386 0.881 18990 1309 1 2 . 1 1 448 448 GLY H H 448 8.380 8.380 8.036 0.344 18990 1310 1 2 . 1 1 449 449 CYS N N 449 120.628 120.628 118.975 1.653 18990 1311 1 2 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.369 -0.372 18990 1312 1 2 . 1 1 449 449 CYS C C 449 174.855 174.855 175.985 -1.130 18990 1313 1 2 . 1 1 449 449 CYS CA C 449 59.291 59.291 57.215 2.076 18990 1314 1 2 . 1 1 449 449 CYS CB C 449 28.000 28.000 29.230 -1.230 18990 1315 1 2 . 1 1 449 449 CYS H H 449 7.832 7.832 8.316 -0.484 18990 1316 1 2 . 1 1 450 450 MET N N 450 123.947 123.947 121.742 2.205 18990 1317 1 2 . 1 1 450 450 MET HA H 450 4.551 4.551 4.148 0.403 18990 1318 1 2 . 1 1 450 450 MET C C 450 174.658 174.658 173.941 0.717 18990 1319 1 2 . 1 1 450 450 MET CA C 450 54.970 54.970 54.110 0.860 18990 1320 1 2 . 1 1 450 450 MET CB C 450 34.100 34.100 29.938 4.162 18990 1321 1 2 . 1 1 450 450 MET H H 450 8.916 8.916 8.775 0.141 18990 1322 1 2 . 1 1 451 451 HIS N N 451 120.490 120.490 116.032 4.458 18990 1323 1 2 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.106 -0.427 18990 1324 1 2 . 1 1 451 451 HIS C C 451 172.443 172.443 173.663 -1.220 18990 1325 1 2 . 1 1 451 451 HIS CA C 451 53.812 53.812 53.345 0.467 18990 1326 1 2 . 1 1 451 451 HIS CB C 451 28.900 28.900 31.895 -2.995 18990 1327 1 2 . 1 1 451 451 HIS H H 451 7.557 7.557 7.508 0.049 18990 1328 1 2 . 1 1 452 452 MET N N 452 128.800 128.800 122.938 5.862 18990 1329 1 2 . 1 1 452 452 MET HA H 452 4.320 4.320 4.430 -0.110 18990 1330 1 2 . 1 1 452 452 MET C C 452 175.479 175.479 173.956 1.523 18990 1331 1 2 . 1 1 452 452 MET CA C 452 52.589 52.589 53.575 -0.986 18990 1332 1 2 . 1 1 452 452 MET CB C 452 28.074 28.074 31.847 -3.773 18990 1333 1 2 . 1 1 452 452 MET H H 452 9.087 9.087 8.585 0.502 18990 1334 1 2 . 1 1 453 453 VAL N N 453 122.200 122.200 122.891 -0.691 18990 1335 1 2 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.104 0.690 18990 1336 1 2 . 1 1 453 453 VAL C C 453 175.476 175.476 175.099 0.377 18990 1337 1 2 . 1 1 453 453 VAL CA C 453 61.380 61.380 61.571 -0.191 18990 1338 1 2 . 1 1 453 453 VAL CB C 453 33.089 33.089 32.300 0.789 18990 1339 1 2 . 1 1 453 453 VAL H H 453 8.016 8.016 8.328 -0.312 18990 1340 1 2 . 1 1 454 454 CYS N N 454 130.353 130.353 129.386 0.967 18990 1341 1 2 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.628 -0.033 18990 1342 1 2 . 1 1 454 454 CYS C C 454 177.833 177.833 174.851 2.982 18990 1343 1 2 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.555 3.016 18990 1344 1 2 . 1 1 454 454 CYS CB C 454 32.045 32.045 25.890 6.155 18990 1345 1 2 . 1 1 454 454 CYS H H 454 8.989 8.989 9.030 -0.041 18990 1346 1 2 . 1 1 455 455 THR N N 455 119.000 119.000 123.364 -4.364 18990 1347 1 2 . 1 1 455 455 THR HA H 455 4.393 4.393 4.343 0.050 18990 1348 1 2 . 1 1 455 455 THR C C 455 175.264 175.264 173.894 1.370 18990 1349 1 2 . 1 1 455 455 THR CA C 455 61.644 61.644 62.099 -0.455 18990 1350 1 2 . 1 1 455 455 THR CB C 455 69.400 69.400 68.080 1.320 18990 1351 1 2 . 1 1 455 455 THR H H 455 8.533 8.533 8.343 0.190 18990 1352 1 2 . 1 1 456 456 ARG N N 456 128.900 128.900 126.995 1.905 18990 1353 1 2 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.591 -0.366 18990 1354 1 2 . 1 1 456 456 ARG C C 456 177.782 177.782 175.137 2.645 18990 1355 1 2 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.724 2.226 18990 1356 1 2 . 1 1 456 456 ARG CB C 456 30.050 30.050 34.004 -3.954 18990 1357 1 2 . 1 1 456 456 ARG H H 456 9.036 9.036 7.810 1.226 18990 1358 1 2 . 1 1 457 457 ALA N N 457 133.152 133.152 127.583 5.569 18990 1359 1 2 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.295 -0.149 18990 1360 1 2 . 1 1 457 457 ALA C C 457 178.757 178.757 177.712 1.045 18990 1361 1 2 . 1 1 457 457 ALA CA C 457 53.929 53.929 53.031 0.898 18990 1362 1 2 . 1 1 457 457 ALA CB C 457 17.710 17.710 18.037 -0.327 18990 1363 1 2 . 1 1 457 457 ALA H H 457 9.042 9.042 8.819 0.223 18990 1364 1 2 . 1 1 458 458 GLY N N 458 111.200 111.200 111.118 0.082 18990 1365 1 2 . 1 1 458 458 GLY C C 458 173.558 173.558 174.301 -0.743 18990 1366 1 2 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.734 0.702 18990 1367 1 2 . 1 1 458 458 GLY H H 458 8.830 8.830 8.600 0.230 18990 1368 1 2 . 1 1 459 459 CYS N N 459 123.040 123.040 120.455 2.585 18990 1369 1 2 . 1 1 459 459 CYS HA H 459 4.622 4.622 5.048 -0.426 18990 1370 1 2 . 1 1 459 459 CYS C C 459 176.591 176.591 175.205 1.386 18990 1371 1 2 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.008 1.491 18990 1372 1 2 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.068 1.106 18990 1373 1 2 . 1 1 459 459 CYS H H 459 8.042 8.042 8.194 -0.152 18990 1374 1 2 . 1 1 460 460 GLY N N 460 104.500 104.500 110.680 -6.180 18990 1375 1 2 . 1 1 460 460 GLY C C 460 173.716 173.716 173.853 -0.137 18990 1376 1 2 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.481 0.527 18990 1377 1 2 . 1 1 460 460 GLY H H 460 7.705 7.705 8.266 -0.561 18990 1378 1 2 . 1 1 461 461 PHE N N 461 124.949 124.949 122.155 2.794 18990 1379 1 2 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.698 -0.118 18990 1380 1 2 . 1 1 461 461 PHE C C 461 174.447 174.447 173.650 0.797 18990 1381 1 2 . 1 1 461 461 PHE CA C 461 59.946 59.946 56.621 3.325 18990 1382 1 2 . 1 1 461 461 PHE CB C 461 41.300 41.300 41.511 -0.211 18990 1383 1 2 . 1 1 461 461 PHE H H 461 8.947 8.947 7.584 1.363 18990 1384 1 2 . 1 1 462 462 GLU N N 462 125.272 125.272 126.702 -1.430 18990 1385 1 2 . 1 1 462 462 GLU HA H 462 5.721 5.721 5.221 0.500 18990 1386 1 2 . 1 1 462 462 GLU C C 462 176.067 176.067 175.089 0.978 18990 1387 1 2 . 1 1 462 462 GLU CA C 462 54.624 54.624 54.073 0.551 18990 1388 1 2 . 1 1 462 462 GLU CB C 462 31.255 31.255 32.164 -0.909 18990 1389 1 2 . 1 1 462 462 GLU H H 462 7.799 7.799 7.838 -0.039 18990 1390 1 2 . 1 1 463 463 TRP N N 463 121.524 121.524 119.451 2.073 18990 1391 1 2 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.426 0.080 18990 1392 1 2 . 1 1 463 463 TRP C C 463 172.844 172.844 175.110 -2.266 18990 1393 1 2 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.138 -0.367 18990 1394 1 2 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.405 0.331 18990 1395 1 2 . 1 1 463 463 TRP H H 463 9.300 9.300 8.744 0.556 18990 1396 1 2 . 1 1 464 464 CYS N N 464 120.868 120.868 119.150 1.718 18990 1397 1 2 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.912 0.504 18990 1398 1 2 . 1 1 464 464 CYS C C 464 177.213 177.213 176.711 0.502 18990 1399 1 2 . 1 1 464 464 CYS CA C 464 57.776 57.776 60.358 -2.582 18990 1400 1 2 . 1 1 464 464 CYS CB C 464 32.930 32.930 28.090 4.840 18990 1401 1 2 . 1 1 464 464 CYS H H 464 8.752 8.752 8.681 0.071 18990 1402 1 2 . 1 1 465 465 TRP N N 465 131.209 131.209 127.175 4.034 18990 1403 1 2 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.292 0.135 18990 1404 1 2 . 1 1 465 465 TRP C C 465 176.051 176.051 176.105 -0.054 18990 1405 1 2 . 1 1 465 465 TRP CA C 465 60.763 60.763 60.037 0.726 18990 1406 1 2 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.740 1.386 18990 1407 1 2 . 1 1 465 465 TRP H H 465 9.809 9.809 8.085 1.724 18990 1408 1 2 . 1 1 466 466 VAL N N 466 118.233 118.233 115.382 2.851 18990 1409 1 2 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.678 -0.054 18990 1410 1 2 . 1 1 466 466 VAL C C 466 178.943 178.943 176.187 2.756 18990 1411 1 2 . 1 1 466 466 VAL CA C 466 65.602 65.602 64.000 1.602 18990 1412 1 2 . 1 1 466 466 VAL CB C 466 33.172 33.172 31.214 1.958 18990 1413 1 2 . 1 1 466 466 VAL H H 466 8.627 8.627 8.062 0.565 18990 1414 1 2 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.822 -1.391 18990 1415 1 2 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.607 0.392 18990 1416 1 2 . 1 1 467 467 CYS CB C 467 31.870 31.870 29.408 2.462 18990 1417 1 2 . 1 1 467 467 CYS H H 467 7.820 7.820 7.643 0.177 18990 1418 1 2 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.676 -0.640 18990 1419 1 2 . 1 1 468 468 GLN CA C 468 58.051 58.051 56.046 2.005 18990 1420 1 2 . 1 1 468 468 GLN CB C 468 26.476 26.476 29.404 -2.928 18990 1421 1 2 . 1 1 469 469 THR HA H 469 4.685 4.685 4.755 -0.070 18990 1422 1 2 . 1 1 469 469 THR C C 469 173.351 173.351 173.352 -0.001 18990 1423 1 2 . 1 1 469 469 THR CA C 469 59.176 59.176 60.304 -1.128 18990 1424 1 2 . 1 1 469 469 THR CB C 469 71.775 71.775 71.595 0.180 18990 1425 1 2 . 1 1 470 470 GLU N N 470 120.940 120.940 121.857 -0.917 18990 1426 1 2 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.780 -0.487 18990 1427 1 2 . 1 1 470 470 GLU C C 470 175.539 175.539 177.124 -1.585 18990 1428 1 2 . 1 1 470 470 GLU CA C 470 57.015 57.015 55.435 1.580 18990 1429 1 2 . 1 1 470 470 GLU CB C 470 29.965 29.965 31.099 -1.135 18990 1430 1 2 . 1 1 470 470 GLU H H 470 8.912 8.912 8.767 0.145 18990 1431 1 2 . 1 1 471 471 TRP N N 471 126.998 126.998 124.872 2.126 18990 1432 1 2 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.406 -0.113 18990 1433 1 2 . 1 1 471 471 TRP C C 471 175.408 175.408 175.123 0.285 18990 1434 1 2 . 1 1 471 471 TRP CA C 471 58.220 58.220 56.834 1.387 18990 1435 1 2 . 1 1 471 471 TRP CB C 471 29.500 29.500 27.889 1.611 18990 1436 1 2 . 1 1 471 471 TRP H H 471 8.350 8.350 8.530 -0.180 18990 1437 1 2 . 1 1 472 472 THR N N 472 117.480 117.480 115.283 2.197 18990 1438 1 2 . 1 1 472 472 THR HA H 472 4.444 4.444 4.502 -0.058 18990 1439 1 2 . 1 1 472 472 THR CA C 472 58.930 58.930 59.733 -0.803 18990 1440 1 2 . 1 1 472 472 THR H H 472 8.069 8.069 7.673 0.396 18990 1441 1 2 . 1 1 473 473 ARG HA H 473 3.773 3.773 4.085 -0.312 18990 1442 1 2 . 1 1 473 473 ARG C C 473 178.053 178.053 177.158 0.895 18990 1443 1 2 . 1 1 473 473 ARG CA C 473 58.088 58.088 58.264 -0.176 18990 1444 1 2 . 1 1 473 473 ARG CB C 473 29.426 29.426 30.136 -0.710 18990 1445 1 2 . 1 1 474 474 ASP N N 474 119.900 119.900 119.703 0.197 18990 1446 1 2 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.602 -0.387 18990 1447 1 2 . 1 1 474 474 ASP C C 474 178.197 178.197 177.171 1.026 18990 1448 1 2 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.493 0.309 18990 1449 1 2 . 1 1 474 474 ASP CB C 474 40.182 40.182 41.003 -0.821 18990 1450 1 2 . 1 1 474 474 ASP H H 474 7.718 7.718 8.041 -0.323 18990 1451 1 2 . 1 1 475 475 CYS N N 475 121.000 121.000 118.638 2.362 18990 1452 1 2 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.555 -1.188 18990 1453 1 2 . 1 1 475 475 CYS CA C 475 64.533 64.533 59.444 5.089 18990 1454 1 2 . 1 1 475 475 CYS CB C 475 29.092 29.092 25.830 3.262 18990 1455 1 2 . 1 1 475 475 CYS H H 475 6.953 6.953 7.746 -0.793 18990 1456 1 2 . 1 1 476 476 MET HA H 476 4.021 4.021 3.995 0.026 18990 1457 1 2 . 1 1 476 476 MET CA C 476 58.010 58.010 58.495 -0.485 18990 1458 1 2 . 1 1 476 476 MET CB C 476 32.550 32.550 32.953 -0.403 18990 1459 1 2 . 1 1 477 477 GLY N N 477 111.938 111.938 102.087 9.851 18990 1460 1 2 . 1 1 477 477 GLY C C 477 174.406 174.406 174.991 -0.585 18990 1461 1 2 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.486 1.129 18990 1462 1 2 . 1 1 477 477 GLY H H 477 9.155 9.155 8.053 1.102 18990 1463 1 2 . 1 1 478 478 ALA N N 478 121.900 121.900 126.242 -4.342 18990 1464 1 2 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.129 0.162 18990 1465 1 2 . 1 1 478 478 ALA C C 478 178.196 178.196 177.614 0.582 18990 1466 1 2 . 1 1 478 478 ALA CA C 478 53.440 53.440 54.755 -1.315 18990 1467 1 2 . 1 1 478 478 ALA CB C 478 20.390 20.390 18.784 1.606 18990 1468 1 2 . 1 1 478 478 ALA H H 478 7.347 7.347 7.578 -0.231 18990 1469 1 2 . 1 1 479 479 HIS N N 479 115.200 115.200 110.252 4.948 18990 1470 1 2 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.783 0.120 18990 1471 1 2 . 1 1 479 479 HIS C C 479 173.325 173.325 175.583 -2.258 18990 1472 1 2 . 1 1 479 479 HIS CA C 479 54.526 54.526 55.120 -0.594 18990 1473 1 2 . 1 1 479 479 HIS CB C 479 27.600 27.600 30.281 -2.681 18990 1474 1 2 . 1 1 479 479 HIS H H 479 8.297 8.297 7.979 0.318 18990 1475 1 2 . 1 1 480 480 TRP N N 480 121.780 121.780 120.365 1.415 18990 1476 1 2 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.423 -0.128 18990 1477 1 2 . 1 1 480 480 TRP C C 480 175.568 175.568 175.497 0.071 18990 1478 1 2 . 1 1 480 480 TRP CA C 480 58.358 58.358 58.178 0.180 18990 1479 1 2 . 1 1 480 480 TRP CB C 480 29.550 29.550 30.058 -0.508 18990 1480 1 2 . 1 1 480 480 TRP H H 480 8.081 8.081 7.798 0.283 18990 1481 1 2 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.772 0.073 18990 1482 1 2 . 1 1 481 481 PHE C C 481 175.126 175.126 174.910 0.216 18990 1483 1 2 . 1 1 481 481 PHE CA C 481 56.471 56.471 57.834 -1.363 18990 1484 1 2 . 1 1 481 481 PHE CB C 481 41.006 41.006 39.527 1.479 18990 1485 1 3 . 1 1 343 343 GLU N N 343 121.045 121.045 121.595 -0.550 18990 1486 1 3 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.462 -0.297 18990 1487 1 3 . 1 1 343 343 GLU C C 343 176.529 176.529 174.806 1.723 18990 1488 1 3 . 1 1 343 343 GLU CA C 343 57.162 57.162 56.018 1.144 18990 1489 1 3 . 1 1 343 343 GLU CB C 343 30.204 30.204 30.141 0.063 18990 1490 1 3 . 1 1 343 343 GLU H H 343 8.293 8.293 8.144 0.149 18990 1491 1 3 . 1 1 344 344 TYR N N 344 121.000 121.000 123.920 -2.920 18990 1492 1 3 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.605 -0.067 18990 1493 1 3 . 1 1 344 344 TYR C C 344 175.897 175.897 175.819 0.078 18990 1494 1 3 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.980 0.199 18990 1495 1 3 . 1 1 344 344 TYR CB C 344 38.600 38.600 38.304 0.296 18990 1496 1 3 . 1 1 344 344 TYR H H 344 8.040 8.040 8.728 -0.688 18990 1497 1 3 . 1 1 345 345 VAL N N 345 121.900 121.900 126.827 -4.927 18990 1498 1 3 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.368 -0.429 18990 1499 1 3 . 1 1 345 345 VAL C C 345 176.143 176.143 174.969 1.174 18990 1500 1 3 . 1 1 345 345 VAL CA C 345 62.867 62.867 62.443 0.424 18990 1501 1 3 . 1 1 345 345 VAL CB C 345 32.799 32.799 31.455 1.344 18990 1502 1 3 . 1 1 345 345 VAL H H 345 7.856 7.856 8.620 -0.764 18990 1503 1 3 . 1 1 346 346 LEU N N 346 124.950 124.950 126.995 -2.045 18990 1504 1 3 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.959 -0.716 18990 1505 1 3 . 1 1 346 346 LEU C C 346 177.747 177.747 175.397 2.350 18990 1506 1 3 . 1 1 346 346 LEU CA C 346 55.500 55.500 53.364 2.136 18990 1507 1 3 . 1 1 346 346 LEU CB C 346 42.252 42.252 43.302 -1.050 18990 1508 1 3 . 1 1 346 346 LEU H H 346 8.127 8.127 8.202 -0.075 18990 1509 1 3 . 1 1 347 347 GLN N N 347 121.452 121.452 117.498 3.954 18990 1510 1 3 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.666 -0.380 18990 1511 1 3 . 1 1 347 347 GLN C C 347 175.833 175.833 174.607 1.226 18990 1512 1 3 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.455 0.533 18990 1513 1 3 . 1 1 347 347 GLN CB C 347 29.375 29.375 30.639 -1.264 18990 1514 1 3 . 1 1 347 347 GLN H H 347 8.270 8.270 8.383 -0.113 18990 1515 1 3 . 1 1 348 348 ALA N N 348 124.466 124.466 124.206 0.260 18990 1516 1 3 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.619 -0.298 18990 1517 1 3 . 1 1 348 348 ALA C C 348 177.929 177.929 177.317 0.612 18990 1518 1 3 . 1 1 348 348 ALA CA C 348 52.703 52.703 51.671 1.032 18990 1519 1 3 . 1 1 348 348 ALA CB C 348 19.002 19.002 19.180 -0.178 18990 1520 1 3 . 1 1 348 348 ALA H H 348 8.227 8.227 8.527 -0.300 18990 1521 1 3 . 1 1 349 349 GLY N N 349 108.193 108.193 108.804 -0.611 18990 1522 1 3 . 1 1 349 349 GLY C C 349 174.269 174.269 173.468 0.801 18990 1523 1 3 . 1 1 349 349 GLY CA C 349 45.227 45.227 45.362 -0.135 18990 1524 1 3 . 1 1 349 349 GLY H H 349 8.298 8.298 8.508 -0.210 18990 1525 1 3 . 1 1 350 350 GLY N N 350 108.073 108.073 110.505 -2.432 18990 1526 1 3 . 1 1 350 350 GLY C C 350 172.979 172.979 172.623 0.356 18990 1527 1 3 . 1 1 350 350 GLY CA C 350 44.935 44.935 45.177 -0.242 18990 1528 1 3 . 1 1 350 350 GLY H H 350 8.156 8.156 7.775 0.381 18990 1529 1 3 . 1 1 351 351 VAL N N 351 119.058 119.058 118.348 0.710 18990 1530 1 3 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.767 -0.351 18990 1531 1 3 . 1 1 351 351 VAL C C 351 173.412 173.412 174.221 -0.809 18990 1532 1 3 . 1 1 351 351 VAL CA C 351 60.663 60.663 59.554 1.109 18990 1533 1 3 . 1 1 351 351 VAL CB C 351 34.866 34.866 35.374 -0.508 18990 1534 1 3 . 1 1 351 351 VAL H H 351 8.541 8.541 8.995 -0.454 18990 1535 1 3 . 1 1 352 352 LEU N N 352 125.800 125.800 121.650 4.150 18990 1536 1 3 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.684 0.081 18990 1537 1 3 . 1 1 352 352 LEU C C 352 176.218 176.218 175.301 0.917 18990 1538 1 3 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.570 -0.229 18990 1539 1 3 . 1 1 352 352 LEU CB C 352 42.706 42.706 45.219 -2.514 18990 1540 1 3 . 1 1 352 352 LEU H H 352 8.151 8.151 8.337 -0.186 18990 1541 1 3 . 1 1 353 353 CYS N N 353 126.825 126.825 123.245 3.580 18990 1542 1 3 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.152 -0.045 18990 1543 1 3 . 1 1 353 353 CYS C C 353 176.655 176.655 175.231 1.424 18990 1544 1 3 . 1 1 353 353 CYS CA C 353 57.731 57.731 56.759 0.972 18990 1545 1 3 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.104 4.761 18990 1546 1 3 . 1 1 353 353 CYS H H 353 8.794 8.794 8.653 0.141 18990 1547 1 3 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.104 0.316 18990 1548 1 3 . 1 1 354 354 PRO C C 354 177.512 177.512 175.676 1.836 18990 1549 1 3 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.848 -0.856 18990 1550 1 3 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.143 1.423 18990 1551 1 3 . 1 1 355 355 GLN N N 355 126.800 126.800 117.167 9.633 18990 1552 1 3 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.704 -0.429 18990 1553 1 3 . 1 1 355 355 GLN C C 355 175.516 175.516 174.322 1.194 18990 1554 1 3 . 1 1 355 355 GLN CA C 355 54.793 54.793 52.154 2.639 18990 1555 1 3 . 1 1 355 355 GLN CB C 355 28.547 28.547 29.698 -1.151 18990 1556 1 3 . 1 1 355 355 GLN H H 355 9.033 9.033 7.400 1.633 18990 1557 1 3 . 1 1 357 357 GLY C C 357 173.229 173.229 174.886 -1.657 18990 1558 1 3 . 1 1 357 357 GLY CA C 357 45.254 45.254 45.164 0.090 18990 1559 1 3 . 1 1 358 358 CYS N N 358 123.500 123.500 120.475 3.025 18990 1560 1 3 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.372 0.161 18990 1561 1 3 . 1 1 358 358 CYS C C 358 176.157 176.157 176.280 -0.123 18990 1562 1 3 . 1 1 358 358 CYS CA C 358 60.268 60.268 60.142 0.126 18990 1563 1 3 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.547 0.828 18990 1564 1 3 . 1 1 358 358 CYS H H 358 7.720 7.720 7.391 0.329 18990 1565 1 3 . 1 1 359 359 GLY N N 359 104.400 104.400 109.801 -5.401 18990 1566 1 3 . 1 1 359 359 GLY C C 359 174.080 174.080 175.035 -0.955 18990 1567 1 3 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.067 -0.003 18990 1568 1 3 . 1 1 359 359 GLY H H 359 7.756 7.756 8.156 -0.400 18990 1569 1 3 . 1 1 360 360 MET N N 360 121.300 121.300 120.561 0.739 18990 1570 1 3 . 1 1 360 360 MET HA H 360 4.343 4.343 4.379 -0.036 18990 1571 1 3 . 1 1 360 360 MET C C 360 175.641 175.641 176.725 -1.084 18990 1572 1 3 . 1 1 360 360 MET CA C 360 55.923 55.923 56.132 -0.209 18990 1573 1 3 . 1 1 360 360 MET CB C 360 33.091 33.091 33.688 -0.597 18990 1574 1 3 . 1 1 360 360 MET H H 360 8.229 8.229 7.638 0.591 18990 1575 1 3 . 1 1 361 361 GLY N N 361 109.000 109.000 107.936 1.064 18990 1576 1 3 . 1 1 361 361 GLY C C 361 173.774 173.774 173.207 0.567 18990 1577 1 3 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.539 1.299 18990 1578 1 3 . 1 1 361 361 GLY H H 361 8.347 8.347 8.073 0.274 18990 1579 1 3 . 1 1 362 362 LEU N N 362 126.725 126.725 126.586 0.139 18990 1580 1 3 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.732 -0.057 18990 1581 1 3 . 1 1 362 362 LEU C C 362 175.865 175.865 175.779 0.086 18990 1582 1 3 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.155 1.035 18990 1583 1 3 . 1 1 362 362 LEU CB C 362 44.050 44.050 42.300 1.750 18990 1584 1 3 . 1 1 362 362 LEU H H 362 8.935 8.935 8.843 0.092 18990 1585 1 3 . 1 1 363 363 LEU N N 363 123.742 123.742 127.064 -3.322 18990 1586 1 3 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.600 0.077 18990 1587 1 3 . 1 1 363 363 LEU C C 363 176.162 176.162 175.295 0.867 18990 1588 1 3 . 1 1 363 363 LEU CA C 363 54.342 54.342 53.946 0.396 18990 1589 1 3 . 1 1 363 363 LEU CB C 363 42.210 42.210 42.951 -0.741 18990 1590 1 3 . 1 1 363 363 LEU H H 363 8.481 8.481 8.676 -0.195 18990 1591 1 3 . 1 1 364 364 VAL N N 364 120.980 120.980 128.123 -7.143 18990 1592 1 3 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.040 0.357 18990 1593 1 3 . 1 1 364 364 VAL C C 364 175.592 175.592 175.060 0.532 18990 1594 1 3 . 1 1 364 364 VAL CA C 364 60.460 60.460 61.365 -0.905 18990 1595 1 3 . 1 1 364 364 VAL CB C 364 34.125 34.125 31.826 2.299 18990 1596 1 3 . 1 1 364 364 VAL H H 364 8.155 8.155 8.434 -0.279 18990 1597 1 3 . 1 1 365 365 GLU N N 365 126.950 126.950 128.370 -1.420 18990 1598 1 3 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.658 -0.048 18990 1599 1 3 . 1 1 365 365 GLU C C 365 175.427 175.427 175.907 -0.480 18990 1600 1 3 . 1 1 365 365 GLU CA C 365 54.551 54.551 53.653 0.898 18990 1601 1 3 . 1 1 365 365 GLU CB C 365 29.780 29.780 28.696 1.084 18990 1602 1 3 . 1 1 365 365 GLU H H 365 8.900 8.900 7.836 1.064 18990 1603 1 3 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.304 -0.042 18990 1604 1 3 . 1 1 366 366 PRO C C 366 177.013 177.013 176.488 0.525 18990 1605 1 3 . 1 1 366 366 PRO CA C 366 64.463 64.463 64.420 0.043 18990 1606 1 3 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.790 0.258 18990 1607 1 3 . 1 1 367 367 ASP N N 367 115.459 115.459 116.434 -0.975 18990 1608 1 3 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.701 -0.206 18990 1609 1 3 . 1 1 367 367 ASP C C 367 175.123 175.123 175.849 -0.726 18990 1610 1 3 . 1 1 367 367 ASP CA C 367 54.503 54.503 53.664 0.839 18990 1611 1 3 . 1 1 367 367 ASP CB C 367 40.123 40.123 40.882 -0.759 18990 1612 1 3 . 1 1 367 367 ASP H H 367 8.439 8.439 8.282 0.157 18990 1613 1 3 . 1 1 368 368 CYS N N 368 118.700 118.700 122.408 -3.708 18990 1614 1 3 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.235 0.335 18990 1615 1 3 . 1 1 368 368 CYS C C 368 173.806 173.806 175.154 -1.348 18990 1616 1 3 . 1 1 368 368 CYS CA C 368 58.581 58.581 60.332 -1.751 18990 1617 1 3 . 1 1 368 368 CYS CB C 368 28.450 28.450 27.929 0.521 18990 1618 1 3 . 1 1 368 368 CYS H H 368 7.515 7.515 7.850 -0.335 18990 1619 1 3 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.249 0.016 18990 1620 1 3 . 1 1 369 369 ARG C C 369 174.908 174.908 175.869 -0.961 18990 1621 1 3 . 1 1 369 369 ARG CA C 369 57.669 57.669 57.179 0.490 18990 1622 1 3 . 1 1 369 369 ARG CB C 369 32.274 32.274 30.266 2.008 18990 1623 1 3 . 1 1 370 370 LYS N N 370 121.022 121.022 118.637 2.385 18990 1624 1 3 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.827 -0.657 18990 1625 1 3 . 1 1 370 370 LYS C C 370 174.868 174.868 174.789 0.079 18990 1626 1 3 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.371 1.183 18990 1627 1 3 . 1 1 370 370 LYS CB C 370 33.140 33.140 35.250 -2.110 18990 1628 1 3 . 1 1 370 370 LYS H H 370 7.740 7.740 7.540 0.200 18990 1629 1 3 . 1 1 371 371 VAL N N 371 128.362 128.362 123.755 4.607 18990 1630 1 3 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.093 0.040 18990 1631 1 3 . 1 1 371 371 VAL C C 371 173.402 173.402 174.282 -0.880 18990 1632 1 3 . 1 1 371 371 VAL CA C 371 60.777 60.777 61.164 -0.387 18990 1633 1 3 . 1 1 371 371 VAL CB C 371 33.000 33.000 32.432 0.568 18990 1634 1 3 . 1 1 371 371 VAL H H 371 8.647 8.647 8.385 0.262 18990 1635 1 3 . 1 1 372 372 THR N N 372 119.667 119.667 123.150 -3.483 18990 1636 1 3 . 1 1 372 372 THR HA H 372 5.032 5.032 4.918 0.114 18990 1637 1 3 . 1 1 372 372 THR C C 372 174.339 174.339 174.380 -0.041 18990 1638 1 3 . 1 1 372 372 THR CA C 372 60.881 60.881 61.569 -0.688 18990 1639 1 3 . 1 1 372 372 THR CB C 372 70.471 70.471 71.533 -1.062 18990 1640 1 3 . 1 1 372 372 THR H H 372 8.087 8.087 8.084 0.003 18990 1641 1 3 . 1 1 373 373 CYS N N 373 132.554 132.554 127.590 4.964 18990 1642 1 3 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.647 0.155 18990 1643 1 3 . 1 1 373 373 CYS C C 373 176.791 176.791 176.161 0.630 18990 1644 1 3 . 1 1 373 373 CYS CA C 373 58.504 58.504 58.038 0.466 18990 1645 1 3 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.644 3.667 18990 1646 1 3 . 1 1 373 373 CYS H H 373 9.322 9.322 9.148 0.174 18990 1647 1 3 . 1 1 374 374 GLN N N 374 125.890 125.890 122.180 3.710 18990 1648 1 3 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.124 -0.124 18990 1649 1 3 . 1 1 374 374 GLN C C 374 176.827 176.827 176.604 0.223 18990 1650 1 3 . 1 1 374 374 GLN CA C 374 58.300 58.300 58.044 0.256 18990 1651 1 3 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.225 1.439 18990 1652 1 3 . 1 1 374 374 GLN H H 374 7.856 7.856 8.365 -0.509 18990 1653 1 3 . 1 1 375 375 ASN N N 375 115.342 115.342 116.925 -1.583 18990 1654 1 3 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.772 0.115 18990 1655 1 3 . 1 1 375 375 ASN C C 375 174.049 174.049 175.203 -1.154 18990 1656 1 3 . 1 1 375 375 ASN CA C 375 53.047 53.047 53.052 -0.005 18990 1657 1 3 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.138 -0.222 18990 1658 1 3 . 1 1 375 375 ASN H H 375 8.913 8.913 8.190 0.723 18990 1659 1 3 . 1 1 376 376 GLY N N 376 109.098 109.098 106.624 2.474 18990 1660 1 3 . 1 1 376 376 GLY C C 376 174.110 174.110 174.069 0.041 18990 1661 1 3 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.592 0.795 18990 1662 1 3 . 1 1 376 376 GLY H H 376 7.162 7.162 8.234 -1.072 18990 1663 1 3 . 1 1 377 377 CYS N N 377 132.546 132.546 119.543 13.003 18990 1664 1 3 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.939 -0.175 18990 1665 1 3 . 1 1 377 377 CYS C C 377 177.355 177.355 174.065 3.290 18990 1666 1 3 . 1 1 377 377 CYS CA C 377 59.988 59.988 57.426 2.562 18990 1667 1 3 . 1 1 377 377 CYS CB C 377 32.365 32.365 29.588 2.777 18990 1668 1 3 . 1 1 377 377 CYS H H 377 9.800 9.800 8.103 1.697 18990 1669 1 3 . 1 1 378 378 GLY N N 378 113.851 113.851 107.487 6.364 18990 1670 1 3 . 1 1 378 378 GLY C C 378 173.404 173.404 172.718 0.686 18990 1671 1 3 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.686 0.177 18990 1672 1 3 . 1 1 378 378 GLY H H 378 8.820 8.820 8.305 0.515 18990 1673 1 3 . 1 1 379 379 TYR N N 379 125.532 125.532 123.688 1.844 18990 1674 1 3 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.813 -0.335 18990 1675 1 3 . 1 1 379 379 TYR C C 379 173.661 173.661 173.592 0.069 18990 1676 1 3 . 1 1 379 379 TYR CA C 379 59.180 59.180 57.682 1.498 18990 1677 1 3 . 1 1 379 379 TYR CB C 379 40.108 40.108 41.678 -1.570 18990 1678 1 3 . 1 1 379 379 TYR H H 379 9.054 9.054 8.192 0.862 18990 1679 1 3 . 1 1 380 380 VAL N N 380 124.461 124.461 121.404 3.057 18990 1680 1 3 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.844 -0.026 18990 1681 1 3 . 1 1 380 380 VAL C C 380 175.876 175.876 174.157 1.719 18990 1682 1 3 . 1 1 380 380 VAL CA C 380 60.797 60.797 60.006 0.791 18990 1683 1 3 . 1 1 380 380 VAL CB C 380 32.610 32.610 32.881 -0.271 18990 1684 1 3 . 1 1 380 380 VAL H H 380 7.238 7.238 7.744 -0.506 18990 1685 1 3 . 1 1 381 381 PHE N N 381 124.588 124.588 122.913 1.675 18990 1686 1 3 . 1 1 381 381 PHE HA H 381 5.273 5.273 4.958 0.315 18990 1687 1 3 . 1 1 381 381 PHE C C 381 173.242 173.242 174.143 -0.901 18990 1688 1 3 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.106 0.104 18990 1689 1 3 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.391 1.699 18990 1690 1 3 . 1 1 381 381 PHE H H 381 9.424 9.424 7.398 2.026 18990 1691 1 3 . 1 1 382 382 CYS N N 382 120.221 120.221 120.775 -0.554 18990 1692 1 3 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.475 0.427 18990 1693 1 3 . 1 1 382 382 CYS C C 382 177.165 177.165 175.866 1.299 18990 1694 1 3 . 1 1 382 382 CYS CA C 382 57.691 57.691 58.389 -0.698 18990 1695 1 3 . 1 1 382 382 CYS CB C 382 32.475 32.475 29.776 2.699 18990 1696 1 3 . 1 1 382 382 CYS H H 382 8.673 8.673 8.715 -0.042 18990 1697 1 3 . 1 1 383 383 ARG N N 383 129.347 129.347 122.595 6.752 18990 1698 1 3 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.177 -0.156 18990 1699 1 3 . 1 1 383 383 ARG C C 383 175.012 175.012 175.995 -0.983 18990 1700 1 3 . 1 1 383 383 ARG CA C 383 58.686 58.686 57.802 0.884 18990 1701 1 3 . 1 1 383 383 ARG CB C 383 30.900 30.900 29.835 1.065 18990 1702 1 3 . 1 1 383 383 ARG H H 383 9.534 9.534 8.597 0.937 18990 1703 1 3 . 1 1 384 384 ASN N N 384 117.772 117.772 117.894 -0.122 18990 1704 1 3 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.689 0.019 18990 1705 1 3 . 1 1 384 384 ASN C C 384 175.656 175.656 174.834 0.822 18990 1706 1 3 . 1 1 384 384 ASN CA C 384 55.778 55.778 54.273 1.505 18990 1707 1 3 . 1 1 384 384 ASN CB C 384 39.475 39.475 39.541 -0.066 18990 1708 1 3 . 1 1 384 384 ASN H H 384 8.840 8.840 8.108 0.732 18990 1709 1 3 . 1 1 385 385 CYS N N 385 115.876 115.876 114.380 1.496 18990 1710 1 3 . 1 1 385 385 CYS HA H 385 5.028 5.028 5.015 0.013 18990 1711 1 3 . 1 1 385 385 CYS C C 385 175.703 175.703 173.634 2.069 18990 1712 1 3 . 1 1 385 385 CYS CA C 385 58.112 58.112 57.123 0.989 18990 1713 1 3 . 1 1 385 385 CYS CB C 385 32.359 32.359 30.474 1.885 18990 1714 1 3 . 1 1 385 385 CYS H H 385 7.868 7.868 7.709 0.159 18990 1715 1 3 . 1 1 386 386 LEU N N 386 120.082 120.082 119.116 0.966 18990 1716 1 3 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.763 -0.450 18990 1717 1 3 . 1 1 386 386 LEU C C 386 175.722 175.722 177.000 -1.278 18990 1718 1 3 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.337 2.672 18990 1719 1 3 . 1 1 386 386 LEU CB C 386 38.412 38.412 41.009 -2.597 18990 1720 1 3 . 1 1 386 386 LEU H H 386 8.514 8.514 8.343 0.171 18990 1721 1 3 . 1 1 387 387 GLN N N 387 117.579 117.579 119.617 -2.038 18990 1722 1 3 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.383 0.393 18990 1723 1 3 . 1 1 387 387 GLN C C 387 175.299 175.299 176.725 -1.426 18990 1724 1 3 . 1 1 387 387 GLN CA C 387 54.017 54.017 56.262 -2.245 18990 1725 1 3 . 1 1 387 387 GLN CB C 387 30.307 30.307 29.012 1.295 18990 1726 1 3 . 1 1 387 387 GLN H H 387 8.248 8.248 7.668 0.580 18990 1727 1 3 . 1 1 388 388 GLY N N 388 106.107 106.107 108.037 -1.930 18990 1728 1 3 . 1 1 388 388 GLY C C 388 173.693 173.693 173.699 -0.006 18990 1729 1 3 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.239 0.942 18990 1730 1 3 . 1 1 388 388 GLY H H 388 8.695 8.695 8.252 0.443 18990 1731 1 3 . 1 1 389 389 TYR N N 389 122.514 122.514 116.934 5.580 18990 1732 1 3 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.202 -0.544 18990 1733 1 3 . 1 1 389 389 TYR C C 389 172.860 172.860 174.148 -1.288 18990 1734 1 3 . 1 1 389 389 TYR CA C 389 62.987 62.987 57.836 5.152 18990 1735 1 3 . 1 1 389 389 TYR CB C 389 38.052 38.052 36.907 1.145 18990 1736 1 3 . 1 1 389 389 TYR H H 389 7.923 7.923 8.286 -0.363 18990 1737 1 3 . 1 1 390 390 HIS N N 390 120.080 120.080 124.406 -4.326 18990 1738 1 3 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.792 -0.084 18990 1739 1 3 . 1 1 390 390 HIS C C 390 173.235 173.235 173.826 -0.591 18990 1740 1 3 . 1 1 390 390 HIS CA C 390 51.431 51.431 53.893 -2.462 18990 1741 1 3 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.606 0.294 18990 1742 1 3 . 1 1 390 390 HIS H H 390 5.291 5.291 7.786 -2.495 18990 1743 1 3 . 1 1 391 391 ILE N N 391 117.810 117.810 117.352 0.458 18990 1744 1 3 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.203 -0.087 18990 1745 1 3 . 1 1 391 391 ILE C C 391 178.208 178.208 176.620 1.588 18990 1746 1 3 . 1 1 391 391 ILE CA C 391 60.877 60.877 60.990 -0.113 18990 1747 1 3 . 1 1 391 391 ILE CB C 391 39.034 39.034 38.165 0.869 18990 1748 1 3 . 1 1 391 391 ILE H H 391 8.418 8.418 8.397 0.021 18990 1749 1 3 . 1 1 392 392 GLY N N 392 112.387 112.387 112.857 -0.470 18990 1750 1 3 . 1 1 392 392 GLY C C 392 173.565 173.565 173.784 -0.219 18990 1751 1 3 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.738 0.520 18990 1752 1 3 . 1 1 392 392 GLY H H 392 8.654 8.654 8.479 0.175 18990 1753 1 3 . 1 1 393 393 GLU N N 393 119.098 119.098 119.831 -0.733 18990 1754 1 3 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.727 -0.438 18990 1755 1 3 . 1 1 393 393 GLU C C 393 176.899 176.899 175.761 1.138 18990 1756 1 3 . 1 1 393 393 GLU CA C 393 56.433 56.433 54.702 1.731 18990 1757 1 3 . 1 1 393 393 GLU CB C 393 30.470 30.470 32.441 -1.971 18990 1758 1 3 . 1 1 393 393 GLU H H 393 8.391 8.391 8.304 0.087 18990 1759 1 3 . 1 1 394 394 CYS N N 394 122.845 122.845 120.488 2.357 18990 1760 1 3 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.739 -0.973 18990 1761 1 3 . 1 1 394 394 CYS C C 394 175.461 175.461 174.819 0.642 18990 1762 1 3 . 1 1 394 394 CYS CA C 394 59.835 59.835 59.393 0.442 18990 1763 1 3 . 1 1 394 394 CYS CB C 394 30.761 30.761 26.462 4.298 18990 1764 1 3 . 1 1 394 394 CYS H H 394 8.474 8.474 8.702 -0.228 18990 1765 1 3 . 1 1 395 395 LEU N N 395 124.403 124.403 122.267 2.136 18990 1766 1 3 . 1 1 395 395 LEU HA H 395 4.504 4.504 5.086 -0.582 18990 1767 1 3 . 1 1 395 395 LEU C C 395 175.259 175.259 174.447 0.812 18990 1768 1 3 . 1 1 395 395 LEU CA C 395 52.835 52.835 52.677 0.158 18990 1769 1 3 . 1 1 395 395 LEU CB C 395 41.436 41.436 41.966 -0.530 18990 1770 1 3 . 1 1 395 395 LEU H H 395 8.418 8.418 8.157 0.261 18990 1771 1 3 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.693 -0.323 18990 1772 1 3 . 1 1 396 396 PRO C C 396 177.006 177.006 175.935 1.071 18990 1773 1 3 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.565 0.531 18990 1774 1 3 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.915 -0.843 18990 1775 1 3 . 1 1 397 397 GLU N N 397 121.574 121.574 118.914 2.660 18990 1776 1 3 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.540 -0.315 18990 1777 1 3 . 1 1 397 397 GLU C C 397 177.202 177.202 175.404 1.798 18990 1778 1 3 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.471 0.563 18990 1779 1 3 . 1 1 397 397 GLU CB C 397 30.263 30.263 30.529 -0.266 18990 1780 1 3 . 1 1 397 397 GLU H H 397 8.568 8.568 8.560 0.008 18990 1781 1 3 . 1 1 398 398 GLY N N 398 110.495 110.495 113.369 -2.874 18990 1782 1 3 . 1 1 398 398 GLY C C 398 174.579 174.579 173.314 1.265 18990 1783 1 3 . 1 1 398 398 GLY CA C 398 45.462 45.462 45.026 0.436 18990 1784 1 3 . 1 1 398 398 GLY H H 398 8.515 8.515 8.476 0.039 18990 1785 1 3 . 1 1 399 399 THR N N 399 113.234 113.234 114.469 -1.235 18990 1786 1 3 . 1 1 399 399 THR HA H 399 4.398 4.398 5.213 -0.815 18990 1787 1 3 . 1 1 399 399 THR C C 399 175.333 175.333 174.451 0.882 18990 1788 1 3 . 1 1 399 399 THR CA C 399 62.233 62.233 60.861 1.372 18990 1789 1 3 . 1 1 399 399 THR CB C 399 69.833 69.833 71.775 -1.942 18990 1790 1 3 . 1 1 399 399 THR H H 399 8.090 8.090 9.453 -1.363 18990 1791 1 3 . 1 1 400 400 GLY N N 400 111.479 111.479 108.154 3.325 18990 1792 1 3 . 1 1 400 400 GLY C C 400 174.048 174.048 172.708 1.340 18990 1793 1 3 . 1 1 400 400 GLY CA C 400 45.439 45.439 44.770 0.669 18990 1794 1 3 . 1 1 400 400 GLY H H 400 8.524 8.524 9.066 -0.542 18990 1795 1 3 . 1 1 401 401 ALA N N 401 123.919 123.919 125.046 -1.127 18990 1796 1 3 . 1 1 401 401 ALA HA H 401 4.251 4.251 5.253 -1.002 18990 1797 1 3 . 1 1 401 401 ALA C C 401 177.942 177.942 176.688 1.254 18990 1798 1 3 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.711 1.019 18990 1799 1 3 . 1 1 401 401 ALA CB C 401 19.142 19.142 21.490 -2.348 18990 1800 1 3 . 1 1 401 401 ALA H H 401 8.179 8.179 9.147 -0.968 18990 1801 1 3 . 1 1 402 402 SER N N 402 114.904 114.904 116.170 -1.266 18990 1802 1 3 . 1 1 402 402 SER HA H 402 4.448 4.448 5.128 -0.680 18990 1803 1 3 . 1 1 402 402 SER C C 402 174.426 174.426 173.233 1.193 18990 1804 1 3 . 1 1 402 402 SER CA C 402 58.289 58.289 58.112 0.177 18990 1805 1 3 . 1 1 402 402 SER CB C 402 63.772 63.772 64.612 -0.840 18990 1806 1 3 . 1 1 402 402 SER H H 402 8.305 8.305 9.176 -0.871 18990 1807 1 3 . 1 1 403 403 ALA N N 403 125.965 125.965 127.030 -1.065 18990 1808 1 3 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.669 -0.270 18990 1809 1 3 . 1 1 403 403 ALA C C 403 177.984 177.984 175.628 2.356 18990 1810 1 3 . 1 1 403 403 ALA CA C 403 52.655 52.655 51.609 1.046 18990 1811 1 3 . 1 1 403 403 ALA CB C 403 19.138 19.138 20.517 -1.379 18990 1812 1 3 . 1 1 403 403 ALA H H 403 8.345 8.345 8.186 0.159 18990 1813 1 3 . 1 1 404 404 THR N N 404 112.790 112.790 115.620 -2.830 18990 1814 1 3 . 1 1 404 404 THR C C 404 174.420 174.420 173.408 1.012 18990 1815 1 3 . 1 1 404 404 THR CA C 404 61.988 61.988 62.313 -0.325 18990 1816 1 3 . 1 1 404 404 THR CB C 404 69.688 69.688 69.782 -0.094 18990 1817 1 3 . 1 1 404 404 THR H H 404 8.118 8.118 8.181 -0.063 18990 1818 1 3 . 1 1 405 405 ASN N N 405 121.050 121.050 123.347 -2.297 18990 1819 1 3 . 1 1 405 405 ASN H H 405 8.396 8.396 8.580 -0.184 18990 1820 1 3 . 1 1 407 407 CYS HA H 407 4.578 4.578 5.021 -0.443 18990 1821 1 3 . 1 1 407 407 CYS C C 407 174.489 174.489 173.895 0.594 18990 1822 1 3 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.065 0.648 18990 1823 1 3 . 1 1 407 407 CYS CB C 407 28.102 28.102 30.797 -2.695 18990 1824 1 3 . 1 1 408 408 GLU N N 408 123.021 123.021 121.286 1.735 18990 1825 1 3 . 1 1 408 408 GLU C C 408 175.954 175.954 174.543 1.411 18990 1826 1 3 . 1 1 408 408 GLU CA C 408 56.802 56.802 55.748 1.054 18990 1827 1 3 . 1 1 408 408 GLU CB C 408 30.328 30.328 31.821 -1.493 18990 1828 1 3 . 1 1 408 408 GLU H H 408 8.415 8.415 9.070 -0.655 18990 1829 1 3 . 1 1 409 409 TYR N N 409 121.015 121.015 118.051 2.964 18990 1830 1 3 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.860 -0.206 18990 1831 1 3 . 1 1 409 409 TYR C C 409 175.613 175.613 173.752 1.861 18990 1832 1 3 . 1 1 409 409 TYR CA C 409 57.669 57.669 56.984 0.685 18990 1833 1 3 . 1 1 409 409 TYR CB C 409 38.825 38.825 40.009 -1.184 18990 1834 1 3 . 1 1 409 409 TYR H H 409 8.135 8.135 8.004 0.131 18990 1835 1 3 . 1 1 410 410 THR N N 410 116.975 116.975 115.464 1.511 18990 1836 1 3 . 1 1 410 410 THR HA H 410 4.306 4.306 4.606 -0.300 18990 1837 1 3 . 1 1 410 410 THR C C 410 173.846 173.846 174.043 -0.197 18990 1838 1 3 . 1 1 410 410 THR CA C 410 61.730 61.730 61.337 0.393 18990 1839 1 3 . 1 1 410 410 THR CB C 410 69.914 69.914 70.205 -0.291 18990 1840 1 3 . 1 1 410 410 THR H H 410 8.060 8.060 8.223 -0.163 18990 1841 1 3 . 1 1 411 411 VAL N N 411 122.900 122.900 122.320 0.580 18990 1842 1 3 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.280 -0.227 18990 1843 1 3 . 1 1 411 411 VAL C C 411 175.275 175.275 175.329 -0.054 18990 1844 1 3 . 1 1 411 411 VAL CA C 411 61.853 61.853 61.773 0.080 18990 1845 1 3 . 1 1 411 411 VAL CB C 411 32.976 32.976 33.175 -0.199 18990 1846 1 3 . 1 1 411 411 VAL H H 411 8.089 8.089 8.379 -0.290 18990 1847 1 3 . 1 1 412 412 ASP N N 412 125.924 125.924 128.575 -2.651 18990 1848 1 3 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.865 -0.015 18990 1849 1 3 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.208 -0.630 18990 1850 1 3 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.556 -0.018 18990 1851 1 3 . 1 1 412 412 ASP H H 412 8.397 8.397 8.513 -0.116 18990 1852 1 3 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.509 -0.123 18990 1853 1 3 . 1 1 413 413 PRO C C 413 177.352 177.352 176.057 1.295 18990 1854 1 3 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.620 1.290 18990 1855 1 3 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.454 -0.186 18990 1856 1 3 . 1 1 414 414 ASN N N 414 117.035 117.035 121.499 -4.464 18990 1857 1 3 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.907 -0.230 18990 1858 1 3 . 1 1 414 414 ASN C C 414 175.532 175.532 174.607 0.925 18990 1859 1 3 . 1 1 414 414 ASN CA C 414 53.824 53.824 53.154 0.670 18990 1860 1 3 . 1 1 414 414 ASN CB C 414 38.728 38.728 40.580 -1.852 18990 1861 1 3 . 1 1 414 414 ASN H H 414 8.496 8.496 8.644 -0.148 18990 1862 1 3 . 1 1 415 415 ARG N N 415 121.000 121.000 122.996 -1.996 18990 1863 1 3 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.417 -0.173 18990 1864 1 3 . 1 1 415 415 ARG C C 415 176.243 176.243 174.288 1.955 18990 1865 1 3 . 1 1 415 415 ARG CA C 415 56.404 56.404 56.414 -0.010 18990 1866 1 3 . 1 1 415 415 ARG CB C 415 30.637 30.637 30.715 -0.078 18990 1867 1 3 . 1 1 415 415 ARG H H 415 7.804 7.804 8.527 -0.723 18990 1868 1 3 . 1 1 416 416 ALA N N 416 124.880 124.880 128.037 -3.157 18990 1869 1 3 . 1 1 416 416 ALA C C 416 177.831 177.831 175.948 1.883 18990 1870 1 3 . 1 1 416 416 ALA CA C 416 52.957 52.957 52.208 0.750 18990 1871 1 3 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.652 -1.593 18990 1872 1 3 . 1 1 416 416 ALA H H 416 8.189 8.189 8.457 -0.268 18990 1873 1 3 . 1 1 417 417 ALA N N 417 122.614 122.614 125.472 -2.858 18990 1874 1 3 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.543 -0.296 18990 1875 1 3 . 1 1 417 417 ALA C C 417 178.024 178.024 176.834 1.190 18990 1876 1 3 . 1 1 417 417 ALA CA C 417 52.789 52.789 52.198 0.591 18990 1877 1 3 . 1 1 417 417 ALA CB C 417 19.042 19.042 19.512 -0.470 18990 1878 1 3 . 1 1 417 417 ALA H H 417 8.169 8.169 8.254 -0.085 18990 1879 1 3 . 1 1 418 418 GLU N N 418 119.500 119.500 121.333 -1.833 18990 1880 1 3 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.793 -0.604 18990 1881 1 3 . 1 1 418 418 GLU C C 418 176.266 176.266 175.952 0.314 18990 1882 1 3 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.910 0.666 18990 1883 1 3 . 1 1 418 418 GLU CB C 418 30.307 30.307 31.340 -1.033 18990 1884 1 3 . 1 1 418 418 GLU H H 418 8.184 8.184 8.659 -0.475 18990 1885 1 3 . 1 1 419 419 ALA N N 419 124.643 124.643 124.318 0.325 18990 1886 1 3 . 1 1 419 419 ALA HA H 419 4.250 4.250 5.039 -0.789 18990 1887 1 3 . 1 1 419 419 ALA C C 419 177.488 177.488 176.031 1.457 18990 1888 1 3 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.718 0.791 18990 1889 1 3 . 1 1 419 419 ALA CB C 419 19.161 19.161 21.694 -2.533 18990 1890 1 3 . 1 1 419 419 ALA H H 419 8.135 8.135 8.446 -0.311 18990 1891 1 3 . 1 1 420 420 ARG N N 420 120.003 120.003 122.289 -2.286 18990 1892 1 3 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.330 -0.037 18990 1893 1 3 . 1 1 420 420 ARG C C 420 176.297 176.297 174.283 2.014 18990 1894 1 3 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.849 0.084 18990 1895 1 3 . 1 1 420 420 ARG CB C 420 30.850 30.850 31.722 -0.872 18990 1896 1 3 . 1 1 420 420 ARG H H 420 8.135 8.135 8.852 -0.717 18990 1897 1 3 . 1 1 421 421 TRP N N 421 122.280 122.280 123.363 -1.083 18990 1898 1 3 . 1 1 421 421 TRP HA H 421 4.663 4.663 5.017 -0.354 18990 1899 1 3 . 1 1 421 421 TRP C C 421 175.856 175.856 175.048 0.808 18990 1900 1 3 . 1 1 421 421 TRP CA C 421 57.404 57.404 57.011 0.393 18990 1901 1 3 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.474 -1.037 18990 1902 1 3 . 1 1 421 421 TRP H H 421 8.159 8.159 7.863 0.296 18990 1903 1 3 . 1 1 422 422 ASP N N 422 121.980 121.980 120.635 1.345 18990 1904 1 3 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.586 -0.091 18990 1905 1 3 . 1 1 422 422 ASP C C 422 176.184 176.184 176.105 0.079 18990 1906 1 3 . 1 1 422 422 ASP CA C 422 53.899 53.899 54.035 -0.136 18990 1907 1 3 . 1 1 422 422 ASP CB C 422 40.948 40.948 42.364 -1.417 18990 1908 1 3 . 1 1 422 422 ASP H H 422 8.135 8.135 8.160 -0.025 18990 1909 1 3 . 1 1 423 423 GLU N N 423 121.990 121.990 124.103 -2.113 18990 1910 1 3 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.390 -0.300 18990 1911 1 3 . 1 1 423 423 GLU C C 423 176.720 176.720 176.695 0.025 18990 1912 1 3 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.692 0.477 18990 1913 1 3 . 1 1 423 423 GLU CB C 423 30.156 30.156 29.954 0.202 18990 1914 1 3 . 1 1 423 423 GLU H H 423 8.153 8.153 8.845 -0.692 18990 1915 1 3 . 1 1 424 424 ALA N N 424 123.900 123.900 122.812 1.088 18990 1916 1 3 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.041 0.239 18990 1917 1 3 . 1 1 424 424 ALA C C 424 178.095 178.095 176.230 1.865 18990 1918 1 3 . 1 1 424 424 ALA CA C 424 53.017 53.017 52.273 0.744 18990 1919 1 3 . 1 1 424 424 ALA CB C 424 19.086 19.086 17.559 1.527 18990 1920 1 3 . 1 1 424 424 ALA H H 424 8.243 8.243 8.260 -0.017 18990 1921 1 3 . 1 1 425 425 SER N N 425 113.881 113.881 115.153 -1.272 18990 1922 1 3 . 1 1 425 425 SER HA H 425 4.387 4.387 4.290 0.097 18990 1923 1 3 . 1 1 425 425 SER C C 425 174.338 174.338 174.373 -0.035 18990 1924 1 3 . 1 1 425 425 SER CA C 425 58.546 58.546 58.983 -0.437 18990 1925 1 3 . 1 1 425 425 SER CB C 425 63.784 63.784 63.424 0.360 18990 1926 1 3 . 1 1 425 425 SER H H 425 8.063 8.063 8.175 -0.112 18990 1927 1 3 . 1 1 426 426 ASN N N 426 121.032 121.032 122.158 -1.126 18990 1928 1 3 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.914 -0.208 18990 1929 1 3 . 1 1 426 426 ASN C C 426 175.046 175.046 173.337 1.709 18990 1930 1 3 . 1 1 426 426 ASN CA C 426 53.445 53.445 52.672 0.773 18990 1931 1 3 . 1 1 426 426 ASN CB C 426 38.847 38.847 39.676 -0.829 18990 1932 1 3 . 1 1 426 426 ASN H H 426 8.391 8.391 8.406 -0.015 18990 1933 1 3 . 1 1 427 427 VAL N N 427 119.463 119.463 117.479 1.984 18990 1934 1 3 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.670 -0.477 18990 1935 1 3 . 1 1 427 427 VAL C C 427 176.213 176.213 174.608 1.605 18990 1936 1 3 . 1 1 427 427 VAL CA C 427 62.449 62.449 61.328 1.121 18990 1937 1 3 . 1 1 427 427 VAL CB C 427 32.865 32.865 34.305 -1.440 18990 1938 1 3 . 1 1 427 427 VAL H H 427 7.954 7.954 8.396 -0.442 18990 1939 1 3 . 1 1 428 428 THR N N 428 118.226 118.226 116.484 1.742 18990 1940 1 3 . 1 1 428 428 THR HA H 428 4.353 4.353 4.792 -0.439 18990 1941 1 3 . 1 1 428 428 THR C C 428 174.361 174.361 173.467 0.894 18990 1942 1 3 . 1 1 428 428 THR CA C 428 62.065 62.065 61.790 0.275 18990 1943 1 3 . 1 1 428 428 THR CB C 428 69.729 69.729 69.414 0.315 18990 1944 1 3 . 1 1 428 428 THR H H 428 8.225 8.225 8.155 0.070 18990 1945 1 3 . 1 1 429 429 ILE N N 429 123.910 123.910 121.658 2.252 18990 1946 1 3 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.766 -0.578 18990 1947 1 3 . 1 1 429 429 ILE C C 429 175.774 175.774 174.784 0.990 18990 1948 1 3 . 1 1 429 429 ILE CA C 429 60.819 60.819 59.876 0.943 18990 1949 1 3 . 1 1 429 429 ILE CB C 429 38.719 38.719 40.084 -1.365 18990 1950 1 3 . 1 1 429 429 ILE H H 429 8.148 8.148 8.286 -0.138 18990 1951 1 3 . 1 1 430 430 LYS N N 430 126.453 126.453 121.156 5.297 18990 1952 1 3 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.502 -0.068 18990 1953 1 3 . 1 1 430 430 LYS C C 430 176.241 176.241 175.028 1.213 18990 1954 1 3 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.193 0.744 18990 1955 1 3 . 1 1 430 430 LYS CB C 430 33.164 33.164 35.224 -2.059 18990 1956 1 3 . 1 1 430 430 LYS H H 430 8.406 8.406 8.235 0.171 18990 1957 1 3 . 1 1 431 431 VAL N N 431 122.496 122.496 124.259 -1.763 18990 1958 1 3 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.082 0.198 18990 1959 1 3 . 1 1 431 431 VAL CA C 431 62.303 62.303 63.129 -0.826 18990 1960 1 3 . 1 1 431 431 VAL CB C 431 33.132 33.132 32.178 0.954 18990 1961 1 3 . 1 1 431 431 VAL H H 431 8.312 8.312 8.506 -0.194 18990 1962 1 3 . 1 1 432 432 SER HA H 432 4.486 4.486 4.603 -0.117 18990 1963 1 3 . 1 1 432 432 SER C C 432 173.834 173.834 174.270 -0.436 18990 1964 1 3 . 1 1 432 432 SER CA C 432 58.650 58.650 58.301 0.349 18990 1965 1 3 . 1 1 432 432 SER CB C 432 64.152 64.152 63.505 0.647 18990 1966 1 3 . 1 1 433 433 THR N N 433 114.706 114.706 112.731 1.975 18990 1967 1 3 . 1 1 433 433 THR HA H 433 5.446 5.446 4.641 0.805 18990 1968 1 3 . 1 1 433 433 THR C C 433 173.979 173.979 173.445 0.534 18990 1969 1 3 . 1 1 433 433 THR CA C 433 60.412 60.412 60.071 0.341 18990 1970 1 3 . 1 1 433 433 THR CB C 433 71.896 71.896 70.854 1.042 18990 1971 1 3 . 1 1 433 433 THR H H 433 7.833 7.833 7.352 0.481 18990 1972 1 3 . 1 1 434 434 LYS N N 434 122.492 122.492 121.402 1.090 18990 1973 1 3 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.790 -0.081 18990 1974 1 3 . 1 1 434 434 LYS C C 434 173.589 173.589 174.496 -0.907 18990 1975 1 3 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.437 1.938 18990 1976 1 3 . 1 1 434 434 LYS CB C 434 36.925 36.925 34.401 2.524 18990 1977 1 3 . 1 1 434 434 LYS H H 434 8.937 8.937 8.608 0.329 18990 1978 1 3 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.482 -0.215 18990 1979 1 3 . 1 1 435 435 PRO C C 435 175.238 175.238 176.528 -1.290 18990 1980 1 3 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.229 -1.306 18990 1981 1 3 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.384 -0.298 18990 1982 1 3 . 1 1 436 436 CYS N N 436 125.422 125.422 124.981 0.441 18990 1983 1 3 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.125 -0.695 18990 1984 1 3 . 1 1 436 436 CYS C C 436 176.770 176.770 175.368 1.402 18990 1985 1 3 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.991 0.025 18990 1986 1 3 . 1 1 436 436 CYS CB C 436 31.698 31.698 27.936 3.762 18990 1987 1 3 . 1 1 436 436 CYS H H 436 7.768 7.768 8.459 -0.691 18990 1988 1 3 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.211 -0.353 18990 1989 1 3 . 1 1 437 437 PRO C C 437 173.608 173.608 176.085 -2.477 18990 1990 1 3 . 1 1 437 437 PRO CA C 437 64.213 64.213 63.810 0.403 18990 1991 1 3 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.340 1.109 18990 1992 1 3 . 1 1 438 438 LYS N N 438 118.600 118.600 117.854 0.746 18990 1993 1 3 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.182 -0.212 18990 1994 1 3 . 1 1 438 438 LYS C C 438 176.887 176.887 177.388 -0.501 18990 1995 1 3 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.466 0.221 18990 1996 1 3 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.349 -0.225 18990 1997 1 3 . 1 1 438 438 LYS H H 438 8.390 8.390 7.593 0.797 18990 1998 1 3 . 1 1 439 439 CYS N N 439 118.950 118.950 116.112 2.838 18990 1999 1 3 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.791 -0.045 18990 2000 1 3 . 1 1 439 439 CYS C C 439 176.650 176.650 174.869 1.781 18990 2001 1 3 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.308 2.040 18990 2002 1 3 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.588 2.607 18990 2003 1 3 . 1 1 439 439 CYS H H 439 8.357 8.357 7.656 0.701 18990 2004 1 3 . 1 1 440 440 ARG N N 440 117.200 117.200 117.071 0.129 18990 2005 1 3 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.139 -0.171 18990 2006 1 3 . 1 1 440 440 ARG C C 440 175.253 175.253 175.554 -0.301 18990 2007 1 3 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.839 0.061 18990 2008 1 3 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.397 -1.356 18990 2009 1 3 . 1 1 440 440 ARG H H 440 8.065 8.065 8.215 -0.150 18990 2010 1 3 . 1 1 441 441 THR N N 441 122.400 122.400 112.173 10.227 18990 2011 1 3 . 1 1 441 441 THR HA H 441 4.371 4.371 4.676 -0.305 18990 2012 1 3 . 1 1 441 441 THR C C 441 173.702 173.702 173.296 0.406 18990 2013 1 3 . 1 1 441 441 THR CA C 441 63.194 63.194 58.952 4.242 18990 2014 1 3 . 1 1 441 441 THR CB C 441 68.933 68.933 69.441 -0.508 18990 2015 1 3 . 1 1 441 441 THR H H 441 8.643 8.643 7.567 1.076 18990 2016 1 3 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.411 -0.264 18990 2017 1 3 . 1 1 442 442 PRO C C 442 176.215 176.215 175.833 0.382 18990 2018 1 3 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.923 1.274 18990 2019 1 3 . 1 1 442 442 PRO CB C 442 32.044 32.044 30.602 1.442 18990 2020 1 3 . 1 1 443 443 THR N N 443 122.932 122.932 121.997 0.935 18990 2021 1 3 . 1 1 443 443 THR HA H 443 4.665 4.665 4.496 0.169 18990 2022 1 3 . 1 1 443 443 THR C C 443 172.133 172.133 174.425 -2.292 18990 2023 1 3 . 1 1 443 443 THR CA C 443 62.566 62.566 62.581 -0.015 18990 2024 1 3 . 1 1 443 443 THR CB C 443 71.562 71.562 70.151 1.411 18990 2025 1 3 . 1 1 443 443 THR H H 443 9.116 9.116 8.400 0.716 18990 2026 1 3 . 1 1 444 444 GLU N N 444 126.390 126.390 126.561 -0.171 18990 2027 1 3 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.513 0.429 18990 2028 1 3 . 1 1 444 444 GLU C C 444 175.292 175.292 176.378 -1.086 18990 2029 1 3 . 1 1 444 444 GLU CA C 444 55.049 55.049 56.329 -1.280 18990 2030 1 3 . 1 1 444 444 GLU CB C 444 31.861 31.861 30.814 1.047 18990 2031 1 3 . 1 1 444 444 GLU H H 444 8.720 8.720 8.867 -0.147 18990 2032 1 3 . 1 1 445 445 ARG N N 445 123.505 123.505 125.912 -2.407 18990 2033 1 3 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.552 -0.841 18990 2034 1 3 . 1 1 445 445 ARG C C 445 175.289 175.289 175.450 -0.161 18990 2035 1 3 . 1 1 445 445 ARG CA C 445 55.856 55.856 55.824 0.032 18990 2036 1 3 . 1 1 445 445 ARG CB C 445 30.675 30.675 30.217 0.458 18990 2037 1 3 . 1 1 445 445 ARG H H 445 8.157 8.157 8.615 -0.458 18990 2038 1 3 . 1 1 446 446 ASP N N 446 126.800 126.800 124.675 2.125 18990 2039 1 3 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.849 -0.208 18990 2040 1 3 . 1 1 446 446 ASP C C 446 176.020 176.020 176.852 -0.832 18990 2041 1 3 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.851 -0.899 18990 2042 1 3 . 1 1 446 446 ASP CB C 446 41.400 41.400 42.679 -1.279 18990 2043 1 3 . 1 1 446 446 ASP H H 446 8.476 8.476 8.178 0.298 18990 2044 1 3 . 1 1 447 447 GLY N N 447 111.262 111.262 109.094 2.168 18990 2045 1 3 . 1 1 447 447 GLY C C 447 174.073 174.073 175.082 -1.009 18990 2046 1 3 . 1 1 447 447 GLY CA C 447 45.832 45.832 45.371 0.461 18990 2047 1 3 . 1 1 447 447 GLY H H 447 8.056 8.056 8.730 -0.674 18990 2048 1 3 . 1 1 448 448 GLY N N 448 108.655 108.655 108.772 -0.117 18990 2049 1 3 . 1 1 448 448 GLY C C 448 174.020 174.020 174.127 -0.107 18990 2050 1 3 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.347 0.920 18990 2051 1 3 . 1 1 448 448 GLY H H 448 8.380 8.380 8.108 0.272 18990 2052 1 3 . 1 1 449 449 CYS N N 449 120.628 120.628 116.749 3.879 18990 2053 1 3 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.176 -0.179 18990 2054 1 3 . 1 1 449 449 CYS C C 449 174.855 174.855 175.753 -0.898 18990 2055 1 3 . 1 1 449 449 CYS CA C 449 59.291 59.291 57.560 1.731 18990 2056 1 3 . 1 1 449 449 CYS CB C 449 28.000 28.000 28.537 -0.537 18990 2057 1 3 . 1 1 449 449 CYS H H 449 7.832 7.832 7.483 0.349 18990 2058 1 3 . 1 1 450 450 MET N N 450 123.947 123.947 118.207 5.740 18990 2059 1 3 . 1 1 450 450 MET HA H 450 4.551 4.551 3.771 0.780 18990 2060 1 3 . 1 1 450 450 MET C C 450 174.658 174.658 174.925 -0.267 18990 2061 1 3 . 1 1 450 450 MET CA C 450 54.970 54.970 56.342 -1.372 18990 2062 1 3 . 1 1 450 450 MET CB C 450 34.100 34.100 32.321 1.779 18990 2063 1 3 . 1 1 450 450 MET H H 450 8.916 8.916 8.225 0.691 18990 2064 1 3 . 1 1 451 451 HIS N N 451 120.490 120.490 118.992 1.498 18990 2065 1 3 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.229 -0.550 18990 2066 1 3 . 1 1 451 451 HIS C C 451 172.443 172.443 173.774 -1.331 18990 2067 1 3 . 1 1 451 451 HIS CA C 451 53.812 53.812 55.787 -1.975 18990 2068 1 3 . 1 1 451 451 HIS CB C 451 28.900 28.900 28.947 -0.047 18990 2069 1 3 . 1 1 451 451 HIS H H 451 7.557 7.557 7.732 -0.175 18990 2070 1 3 . 1 1 452 452 MET N N 452 128.800 128.800 120.563 8.237 18990 2071 1 3 . 1 1 452 452 MET HA H 452 4.320 4.320 4.754 -0.434 18990 2072 1 3 . 1 1 452 452 MET C C 452 175.479 175.479 173.162 2.317 18990 2073 1 3 . 1 1 452 452 MET CA C 452 52.589 52.589 54.990 -2.401 18990 2074 1 3 . 1 1 452 452 MET CB C 452 28.074 28.074 35.600 -7.526 18990 2075 1 3 . 1 1 452 452 MET H H 452 9.087 9.087 7.538 1.549 18990 2076 1 3 . 1 1 453 453 VAL N N 453 122.200 122.200 121.788 0.412 18990 2077 1 3 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.081 0.713 18990 2078 1 3 . 1 1 453 453 VAL C C 453 175.476 175.476 174.327 1.149 18990 2079 1 3 . 1 1 453 453 VAL CA C 453 61.380 61.380 59.197 2.183 18990 2080 1 3 . 1 1 453 453 VAL CB C 453 33.089 33.089 34.815 -1.726 18990 2081 1 3 . 1 1 453 453 VAL H H 453 8.016 8.016 7.807 0.209 18990 2082 1 3 . 1 1 454 454 CYS N N 454 130.353 130.353 127.670 2.683 18990 2083 1 3 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.631 -0.036 18990 2084 1 3 . 1 1 454 454 CYS C C 454 177.833 177.833 175.095 2.738 18990 2085 1 3 . 1 1 454 454 CYS CA C 454 61.571 61.571 59.829 1.742 18990 2086 1 3 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.065 5.980 18990 2087 1 3 . 1 1 454 454 CYS H H 454 8.989 8.989 8.801 0.188 18990 2088 1 3 . 1 1 455 455 THR N N 455 119.000 119.000 124.248 -5.248 18990 2089 1 3 . 1 1 455 455 THR HA H 455 4.393 4.393 4.344 0.049 18990 2090 1 3 . 1 1 455 455 THR C C 455 175.264 175.264 173.673 1.591 18990 2091 1 3 . 1 1 455 455 THR CA C 455 61.644 61.644 62.544 -0.900 18990 2092 1 3 . 1 1 455 455 THR CB C 455 69.400 69.400 68.373 1.027 18990 2093 1 3 . 1 1 455 455 THR H H 455 8.533 8.533 8.473 0.060 18990 2094 1 3 . 1 1 456 456 ARG N N 456 128.900 128.900 128.538 0.362 18990 2095 1 3 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.629 -0.404 18990 2096 1 3 . 1 1 456 456 ARG C C 456 177.782 177.782 176.715 1.067 18990 2097 1 3 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.108 2.842 18990 2098 1 3 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.060 -3.010 18990 2099 1 3 . 1 1 456 456 ARG H H 456 9.036 9.036 7.790 1.246 18990 2100 1 3 . 1 1 457 457 ALA N N 457 133.152 133.152 128.445 4.707 18990 2101 1 3 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.103 0.043 18990 2102 1 3 . 1 1 457 457 ALA C C 457 178.757 178.757 177.919 0.838 18990 2103 1 3 . 1 1 457 457 ALA CA C 457 53.929 53.929 54.264 -0.335 18990 2104 1 3 . 1 1 457 457 ALA CB C 457 17.710 17.710 18.575 -0.865 18990 2105 1 3 . 1 1 457 457 ALA H H 457 9.042 9.042 8.731 0.311 18990 2106 1 3 . 1 1 458 458 GLY N N 458 111.200 111.200 104.023 7.177 18990 2107 1 3 . 1 1 458 458 GLY C C 458 173.558 173.558 173.060 0.498 18990 2108 1 3 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.787 0.649 18990 2109 1 3 . 1 1 458 458 GLY H H 458 8.830 8.830 8.136 0.694 18990 2110 1 3 . 1 1 459 459 CYS N N 459 123.040 123.040 119.300 3.740 18990 2111 1 3 . 1 1 459 459 CYS HA H 459 4.622 4.622 5.008 -0.386 18990 2112 1 3 . 1 1 459 459 CYS C C 459 176.591 176.591 174.874 1.717 18990 2113 1 3 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.278 1.221 18990 2114 1 3 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.359 0.815 18990 2115 1 3 . 1 1 459 459 CYS H H 459 8.042 8.042 7.780 0.262 18990 2116 1 3 . 1 1 460 460 GLY N N 460 104.500 104.500 111.685 -7.185 18990 2117 1 3 . 1 1 460 460 GLY C C 460 173.716 173.716 173.921 -0.205 18990 2118 1 3 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.695 0.313 18990 2119 1 3 . 1 1 460 460 GLY H H 460 7.705 7.705 8.272 -0.567 18990 2120 1 3 . 1 1 461 461 PHE N N 461 124.949 124.949 121.377 3.572 18990 2121 1 3 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.699 -0.119 18990 2122 1 3 . 1 1 461 461 PHE C C 461 174.447 174.447 174.213 0.234 18990 2123 1 3 . 1 1 461 461 PHE CA C 461 59.946 59.946 57.370 2.576 18990 2124 1 3 . 1 1 461 461 PHE CB C 461 41.300 41.300 40.818 0.482 18990 2125 1 3 . 1 1 461 461 PHE H H 461 8.947 8.947 7.731 1.216 18990 2126 1 3 . 1 1 462 462 GLU N N 462 125.272 125.272 127.980 -2.708 18990 2127 1 3 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.493 1.228 18990 2128 1 3 . 1 1 462 462 GLU C C 462 176.067 176.067 175.347 0.720 18990 2129 1 3 . 1 1 462 462 GLU CA C 462 54.624 54.624 55.968 -1.344 18990 2130 1 3 . 1 1 462 462 GLU CB C 462 31.255 31.255 30.313 0.942 18990 2131 1 3 . 1 1 462 462 GLU H H 462 7.799 7.799 8.521 -0.722 18990 2132 1 3 . 1 1 463 463 TRP N N 463 121.524 121.524 120.725 0.799 18990 2133 1 3 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.504 0.002 18990 2134 1 3 . 1 1 463 463 TRP C C 463 172.844 172.844 175.151 -2.307 18990 2135 1 3 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.374 -0.603 18990 2136 1 3 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.062 0.674 18990 2137 1 3 . 1 1 463 463 TRP H H 463 9.300 9.300 7.612 1.688 18990 2138 1 3 . 1 1 464 464 CYS N N 464 120.868 120.868 122.459 -1.591 18990 2139 1 3 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.079 1.337 18990 2140 1 3 . 1 1 464 464 CYS C C 464 177.213 177.213 176.109 1.104 18990 2141 1 3 . 1 1 464 464 CYS CA C 464 57.776 57.776 59.496 -1.720 18990 2142 1 3 . 1 1 464 464 CYS CB C 464 32.930 32.930 29.129 3.801 18990 2143 1 3 . 1 1 464 464 CYS H H 464 8.752 8.752 8.895 -0.143 18990 2144 1 3 . 1 1 465 465 TRP N N 465 131.209 131.209 130.173 1.036 18990 2145 1 3 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.369 0.058 18990 2146 1 3 . 1 1 465 465 TRP C C 465 176.051 176.051 175.652 0.399 18990 2147 1 3 . 1 1 465 465 TRP CA C 465 60.763 60.763 59.758 1.005 18990 2148 1 3 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.398 1.728 18990 2149 1 3 . 1 1 465 465 TRP H H 465 9.809 9.809 8.707 1.102 18990 2150 1 3 . 1 1 466 466 VAL N N 466 118.233 118.233 120.574 -2.341 18990 2151 1 3 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.559 0.065 18990 2152 1 3 . 1 1 466 466 VAL C C 466 178.943 178.943 176.376 2.567 18990 2153 1 3 . 1 1 466 466 VAL CA C 466 65.602 65.602 64.383 1.219 18990 2154 1 3 . 1 1 466 466 VAL CB C 466 33.172 33.172 31.998 1.174 18990 2155 1 3 . 1 1 466 466 VAL H H 466 8.627 8.627 7.731 0.896 18990 2156 1 3 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.809 -1.378 18990 2157 1 3 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.384 0.615 18990 2158 1 3 . 1 1 467 467 CYS CB C 467 31.870 31.870 30.175 1.695 18990 2159 1 3 . 1 1 467 467 CYS H H 467 7.820 7.820 7.928 -0.108 18990 2160 1 3 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.377 -0.341 18990 2161 1 3 . 1 1 468 468 GLN CA C 468 58.051 58.051 57.039 1.012 18990 2162 1 3 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.124 -1.648 18990 2163 1 3 . 1 1 469 469 THR HA H 469 4.685 4.685 4.710 -0.025 18990 2164 1 3 . 1 1 469 469 THR C C 469 173.351 173.351 172.854 0.497 18990 2165 1 3 . 1 1 469 469 THR CA C 469 59.176 59.176 61.037 -1.861 18990 2166 1 3 . 1 1 469 469 THR CB C 469 71.775 71.775 71.684 0.091 18990 2167 1 3 . 1 1 470 470 GLU N N 470 120.940 120.940 121.633 -0.693 18990 2168 1 3 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.767 -0.474 18990 2169 1 3 . 1 1 470 470 GLU C C 470 175.539 175.539 177.416 -1.877 18990 2170 1 3 . 1 1 470 470 GLU CA C 470 57.015 57.015 55.015 2.000 18990 2171 1 3 . 1 1 470 470 GLU CB C 470 29.965 29.965 30.908 -0.943 18990 2172 1 3 . 1 1 470 470 GLU H H 470 8.912 8.912 8.663 0.249 18990 2173 1 3 . 1 1 471 471 TRP N N 471 126.998 126.998 122.120 4.878 18990 2174 1 3 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.194 0.099 18990 2175 1 3 . 1 1 471 471 TRP C C 471 175.408 175.408 174.822 0.586 18990 2176 1 3 . 1 1 471 471 TRP CA C 471 58.220 58.220 58.217 0.004 18990 2177 1 3 . 1 1 471 471 TRP CB C 471 29.500 29.500 28.519 0.981 18990 2178 1 3 . 1 1 471 471 TRP H H 471 8.350 8.350 8.312 0.038 18990 2179 1 3 . 1 1 472 472 THR N N 472 117.480 117.480 120.164 -2.684 18990 2180 1 3 . 1 1 472 472 THR HA H 472 4.444 4.444 4.461 -0.017 18990 2181 1 3 . 1 1 472 472 THR CA C 472 58.930 58.930 59.789 -0.859 18990 2182 1 3 . 1 1 472 472 THR H H 472 8.069 8.069 7.186 0.883 18990 2183 1 3 . 1 1 473 473 ARG HA H 473 3.773 3.773 3.891 -0.118 18990 2184 1 3 . 1 1 473 473 ARG C C 473 178.053 178.053 177.953 0.100 18990 2185 1 3 . 1 1 473 473 ARG CA C 473 58.088 58.088 59.791 -1.703 18990 2186 1 3 . 1 1 473 473 ARG CB C 473 29.426 29.426 29.859 -0.433 18990 2187 1 3 . 1 1 474 474 ASP N N 474 119.900 119.900 118.171 1.729 18990 2188 1 3 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.424 -0.209 18990 2189 1 3 . 1 1 474 474 ASP C C 474 178.197 178.197 176.628 1.569 18990 2190 1 3 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.552 0.250 18990 2191 1 3 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.025 0.157 18990 2192 1 3 . 1 1 474 474 ASP H H 474 7.718 7.718 8.655 -0.937 18990 2193 1 3 . 1 1 475 475 CYS N N 475 121.000 121.000 117.650 3.350 18990 2194 1 3 . 1 1 475 475 CYS HA H 475 3.367 3.367 3.994 -0.627 18990 2195 1 3 . 1 1 475 475 CYS CA C 475 64.533 64.533 60.422 4.111 18990 2196 1 3 . 1 1 475 475 CYS CB C 475 29.092 29.092 27.433 1.659 18990 2197 1 3 . 1 1 475 475 CYS H H 475 6.953 6.953 7.512 -0.559 18990 2198 1 3 . 1 1 476 476 MET HA H 476 4.021 4.021 3.957 0.064 18990 2199 1 3 . 1 1 476 476 MET CA C 476 58.010 58.010 57.689 0.321 18990 2200 1 3 . 1 1 476 476 MET CB C 476 32.550 32.550 32.225 0.325 18990 2201 1 3 . 1 1 477 477 GLY N N 477 111.938 111.938 103.513 8.425 18990 2202 1 3 . 1 1 477 477 GLY C C 477 174.406 174.406 174.017 0.389 18990 2203 1 3 . 1 1 477 477 GLY CA C 477 45.616 45.616 45.284 0.332 18990 2204 1 3 . 1 1 477 477 GLY H H 477 9.155 9.155 8.200 0.955 18990 2205 1 3 . 1 1 478 478 ALA N N 478 121.900 121.900 124.672 -2.772 18990 2206 1 3 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.538 -0.247 18990 2207 1 3 . 1 1 478 478 ALA C C 478 178.196 178.196 177.373 0.823 18990 2208 1 3 . 1 1 478 478 ALA CA C 478 53.440 53.440 52.956 0.484 18990 2209 1 3 . 1 1 478 478 ALA CB C 478 20.390 20.390 20.041 0.349 18990 2210 1 3 . 1 1 478 478 ALA H H 478 7.347 7.347 7.801 -0.454 18990 2211 1 3 . 1 1 479 479 HIS N N 479 115.200 115.200 113.172 2.028 18990 2212 1 3 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.915 -0.012 18990 2213 1 3 . 1 1 479 479 HIS C C 479 173.325 173.325 174.095 -0.770 18990 2214 1 3 . 1 1 479 479 HIS CA C 479 54.526 54.526 55.156 -0.630 18990 2215 1 3 . 1 1 479 479 HIS CB C 479 27.600 27.600 29.693 -2.093 18990 2216 1 3 . 1 1 479 479 HIS H H 479 8.297 8.297 8.090 0.207 18990 2217 1 3 . 1 1 480 480 TRP N N 480 121.780 121.780 121.771 0.009 18990 2218 1 3 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.543 -0.248 18990 2219 1 3 . 1 1 480 480 TRP C C 480 175.568 175.568 174.436 1.132 18990 2220 1 3 . 1 1 480 480 TRP CA C 480 58.358 58.358 58.655 -0.297 18990 2221 1 3 . 1 1 480 480 TRP CB C 480 29.550 29.550 30.687 -1.137 18990 2222 1 3 . 1 1 480 480 TRP H H 480 8.081 8.081 7.509 0.572 18990 2223 1 3 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.560 0.285 18990 2224 1 3 . 1 1 481 481 PHE C C 481 175.126 175.126 174.936 0.190 18990 2225 1 3 . 1 1 481 481 PHE CA C 481 56.471 56.471 58.293 -1.822 18990 2226 1 3 . 1 1 481 481 PHE CB C 481 41.006 41.006 38.510 2.496 18990 2227 1 4 . 1 1 343 343 GLU N N 343 121.045 121.045 120.755 0.290 18990 2228 1 4 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.532 -0.367 18990 2229 1 4 . 1 1 343 343 GLU C C 343 176.529 176.529 174.758 1.771 18990 2230 1 4 . 1 1 343 343 GLU CA C 343 57.162 57.162 55.854 1.308 18990 2231 1 4 . 1 1 343 343 GLU CB C 343 30.204 30.204 30.651 -0.447 18990 2232 1 4 . 1 1 343 343 GLU H H 343 8.293 8.293 8.545 -0.252 18990 2233 1 4 . 1 1 344 344 TYR N N 344 121.000 121.000 120.132 0.868 18990 2234 1 4 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.662 -0.124 18990 2235 1 4 . 1 1 344 344 TYR C C 344 175.897 175.897 175.336 0.561 18990 2236 1 4 . 1 1 344 344 TYR CA C 344 58.179 58.179 58.086 0.093 18990 2237 1 4 . 1 1 344 344 TYR CB C 344 38.600 38.600 39.014 -0.414 18990 2238 1 4 . 1 1 344 344 TYR H H 344 8.040 8.040 8.412 -0.372 18990 2239 1 4 . 1 1 345 345 VAL N N 345 121.900 121.900 117.691 4.209 18990 2240 1 4 . 1 1 345 345 VAL HA H 345 3.939 3.939 3.794 0.145 18990 2241 1 4 . 1 1 345 345 VAL C C 345 176.143 176.143 174.439 1.704 18990 2242 1 4 . 1 1 345 345 VAL CA C 345 62.867 62.867 62.778 0.089 18990 2243 1 4 . 1 1 345 345 VAL CB C 345 32.799 32.799 31.838 0.961 18990 2244 1 4 . 1 1 345 345 VAL H H 345 7.856 7.856 7.795 0.061 18990 2245 1 4 . 1 1 346 346 LEU N N 346 124.950 124.950 119.566 5.384 18990 2246 1 4 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.660 -0.417 18990 2247 1 4 . 1 1 346 346 LEU C C 346 177.747 177.747 176.396 1.351 18990 2248 1 4 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.693 0.807 18990 2249 1 4 . 1 1 346 346 LEU CB C 346 42.252 42.252 42.239 0.013 18990 2250 1 4 . 1 1 346 346 LEU H H 346 8.127 8.127 7.785 0.342 18990 2251 1 4 . 1 1 347 347 GLN N N 347 121.452 121.452 125.218 -3.766 18990 2252 1 4 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.434 -0.148 18990 2253 1 4 . 1 1 347 347 GLN C C 347 175.833 175.833 175.726 0.107 18990 2254 1 4 . 1 1 347 347 GLN CA C 347 55.988 55.988 56.126 -0.138 18990 2255 1 4 . 1 1 347 347 GLN CB C 347 29.375 29.375 29.510 -0.135 18990 2256 1 4 . 1 1 347 347 GLN H H 347 8.270 8.270 8.635 -0.365 18990 2257 1 4 . 1 1 348 348 ALA N N 348 124.466 124.466 123.194 1.272 18990 2258 1 4 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.622 -0.301 18990 2259 1 4 . 1 1 348 348 ALA C C 348 177.929 177.929 176.956 0.973 18990 2260 1 4 . 1 1 348 348 ALA CA C 348 52.703 52.703 51.791 0.912 18990 2261 1 4 . 1 1 348 348 ALA CB C 348 19.002 19.002 19.462 -0.460 18990 2262 1 4 . 1 1 348 348 ALA H H 348 8.227 8.227 8.026 0.201 18990 2263 1 4 . 1 1 349 349 GLY N N 349 108.193 108.193 109.068 -0.875 18990 2264 1 4 . 1 1 349 349 GLY C C 349 174.269 174.269 172.989 1.280 18990 2265 1 4 . 1 1 349 349 GLY CA C 349 45.227 45.227 45.604 -0.377 18990 2266 1 4 . 1 1 349 349 GLY H H 349 8.298 8.298 8.637 -0.339 18990 2267 1 4 . 1 1 350 350 GLY N N 350 108.073 108.073 107.499 0.574 18990 2268 1 4 . 1 1 350 350 GLY C C 350 172.979 172.979 172.389 0.590 18990 2269 1 4 . 1 1 350 350 GLY CA C 350 44.935 44.935 44.593 0.342 18990 2270 1 4 . 1 1 350 350 GLY H H 350 8.156 8.156 7.671 0.485 18990 2271 1 4 . 1 1 351 351 VAL N N 351 119.058 119.058 120.594 -1.536 18990 2272 1 4 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.777 -0.361 18990 2273 1 4 . 1 1 351 351 VAL C C 351 173.412 173.412 174.531 -1.119 18990 2274 1 4 . 1 1 351 351 VAL CA C 351 60.663 60.663 59.389 1.274 18990 2275 1 4 . 1 1 351 351 VAL CB C 351 34.866 34.866 35.663 -0.797 18990 2276 1 4 . 1 1 351 351 VAL H H 351 8.541 8.541 9.073 -0.532 18990 2277 1 4 . 1 1 352 352 LEU N N 352 125.800 125.800 121.054 4.746 18990 2278 1 4 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.750 0.015 18990 2279 1 4 . 1 1 352 352 LEU C C 352 176.218 176.218 175.442 0.776 18990 2280 1 4 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.051 0.290 18990 2281 1 4 . 1 1 352 352 LEU CB C 352 42.706 42.706 44.972 -2.266 18990 2282 1 4 . 1 1 352 352 LEU H H 352 8.151 8.151 8.298 -0.147 18990 2283 1 4 . 1 1 353 353 CYS N N 353 126.825 126.825 123.559 3.266 18990 2284 1 4 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.292 -0.185 18990 2285 1 4 . 1 1 353 353 CYS C C 353 176.655 176.655 174.520 2.135 18990 2286 1 4 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.136 0.595 18990 2287 1 4 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.545 4.320 18990 2288 1 4 . 1 1 353 353 CYS H H 353 8.794 8.794 8.675 0.119 18990 2289 1 4 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.156 0.264 18990 2290 1 4 . 1 1 354 354 PRO C C 354 177.512 177.512 176.320 1.192 18990 2291 1 4 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.434 -0.442 18990 2292 1 4 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.451 1.116 18990 2293 1 4 . 1 1 355 355 GLN N N 355 126.800 126.800 119.524 7.276 18990 2294 1 4 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.403 -0.128 18990 2295 1 4 . 1 1 355 355 GLN C C 355 175.516 175.516 175.434 0.082 18990 2296 1 4 . 1 1 355 355 GLN CA C 355 54.793 54.793 53.831 0.962 18990 2297 1 4 . 1 1 355 355 GLN CB C 355 28.547 28.547 28.380 0.167 18990 2298 1 4 . 1 1 355 355 GLN H H 355 9.033 9.033 7.464 1.569 18990 2299 1 4 . 1 1 357 357 GLY C C 357 173.229 173.229 174.324 -1.095 18990 2300 1 4 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.528 0.726 18990 2301 1 4 . 1 1 358 358 CYS N N 358 123.500 123.500 119.450 4.050 18990 2302 1 4 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.871 -0.338 18990 2303 1 4 . 1 1 358 358 CYS C C 358 176.157 176.157 176.015 0.142 18990 2304 1 4 . 1 1 358 358 CYS CA C 358 60.268 60.268 59.157 1.111 18990 2305 1 4 . 1 1 358 358 CYS CB C 358 29.375 29.375 29.082 0.293 18990 2306 1 4 . 1 1 358 358 CYS H H 358 7.720 7.720 7.586 0.134 18990 2307 1 4 . 1 1 359 359 GLY N N 359 104.400 104.400 110.095 -5.695 18990 2308 1 4 . 1 1 359 359 GLY C C 359 174.080 174.080 175.283 -1.203 18990 2309 1 4 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.365 -0.302 18990 2310 1 4 . 1 1 359 359 GLY H H 359 7.756 7.756 8.189 -0.433 18990 2311 1 4 . 1 1 360 360 MET N N 360 121.300 121.300 119.716 1.584 18990 2312 1 4 . 1 1 360 360 MET HA H 360 4.343 4.343 4.198 0.145 18990 2313 1 4 . 1 1 360 360 MET C C 360 175.641 175.641 177.573 -1.932 18990 2314 1 4 . 1 1 360 360 MET CA C 360 55.923 55.923 57.578 -1.655 18990 2315 1 4 . 1 1 360 360 MET CB C 360 33.091 33.091 33.528 -0.437 18990 2316 1 4 . 1 1 360 360 MET H H 360 8.229 8.229 7.534 0.695 18990 2317 1 4 . 1 1 361 361 GLY N N 361 109.000 109.000 104.689 4.311 18990 2318 1 4 . 1 1 361 361 GLY C C 361 173.774 173.774 173.167 0.607 18990 2319 1 4 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.511 1.327 18990 2320 1 4 . 1 1 361 361 GLY H H 361 8.347 8.347 8.005 0.342 18990 2321 1 4 . 1 1 362 362 LEU N N 362 126.725 126.725 126.447 0.278 18990 2322 1 4 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.801 -0.126 18990 2323 1 4 . 1 1 362 362 LEU C C 362 175.865 175.865 175.748 0.117 18990 2324 1 4 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.005 1.185 18990 2325 1 4 . 1 1 362 362 LEU CB C 362 44.050 44.050 42.140 1.910 18990 2326 1 4 . 1 1 362 362 LEU H H 362 8.935 8.935 8.887 0.048 18990 2327 1 4 . 1 1 363 363 LEU N N 363 123.742 123.742 126.431 -2.689 18990 2328 1 4 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.449 0.228 18990 2329 1 4 . 1 1 363 363 LEU C C 363 176.162 176.162 176.352 -0.190 18990 2330 1 4 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.520 -0.178 18990 2331 1 4 . 1 1 363 363 LEU CB C 363 42.210 42.210 43.469 -1.259 18990 2332 1 4 . 1 1 363 363 LEU H H 363 8.481 8.481 8.757 -0.276 18990 2333 1 4 . 1 1 364 364 VAL N N 364 120.980 120.980 127.497 -6.517 18990 2334 1 4 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.088 0.309 18990 2335 1 4 . 1 1 364 364 VAL C C 364 175.592 175.592 175.337 0.255 18990 2336 1 4 . 1 1 364 364 VAL CA C 364 60.460 60.460 61.590 -1.130 18990 2337 1 4 . 1 1 364 364 VAL CB C 364 34.125 34.125 29.718 4.407 18990 2338 1 4 . 1 1 364 364 VAL H H 364 8.155 8.155 8.541 -0.386 18990 2339 1 4 . 1 1 365 365 GLU N N 365 126.950 126.950 127.689 -0.739 18990 2340 1 4 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.569 0.041 18990 2341 1 4 . 1 1 365 365 GLU C C 365 175.427 175.427 176.208 -0.781 18990 2342 1 4 . 1 1 365 365 GLU CA C 365 54.551 54.551 53.628 0.923 18990 2343 1 4 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.761 0.019 18990 2344 1 4 . 1 1 365 365 GLU H H 365 8.900 8.900 7.668 1.232 18990 2345 1 4 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.346 -0.084 18990 2346 1 4 . 1 1 366 366 PRO C C 366 177.013 177.013 176.848 0.165 18990 2347 1 4 . 1 1 366 366 PRO CA C 366 64.463 64.463 64.715 -0.252 18990 2348 1 4 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.897 0.151 18990 2349 1 4 . 1 1 367 367 ASP N N 367 115.459 115.459 114.984 0.475 18990 2350 1 4 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.607 -0.112 18990 2351 1 4 . 1 1 367 367 ASP C C 367 175.123 175.123 175.331 -0.208 18990 2352 1 4 . 1 1 367 367 ASP CA C 367 54.503 54.503 53.749 0.754 18990 2353 1 4 . 1 1 367 367 ASP CB C 367 40.123 40.123 41.195 -1.072 18990 2354 1 4 . 1 1 367 367 ASP H H 367 8.439 8.439 8.480 -0.041 18990 2355 1 4 . 1 1 368 368 CYS N N 368 118.700 118.700 119.691 -0.991 18990 2356 1 4 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.535 0.035 18990 2357 1 4 . 1 1 368 368 CYS C C 368 173.806 173.806 175.037 -1.231 18990 2358 1 4 . 1 1 368 368 CYS CA C 368 58.581 58.581 58.242 0.339 18990 2359 1 4 . 1 1 368 368 CYS CB C 368 28.450 28.450 28.075 0.375 18990 2360 1 4 . 1 1 368 368 CYS H H 368 7.515 7.515 7.693 -0.178 18990 2361 1 4 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.384 -0.119 18990 2362 1 4 . 1 1 369 369 ARG C C 369 174.908 174.908 175.729 -0.821 18990 2363 1 4 . 1 1 369 369 ARG CA C 369 57.669 57.669 56.169 1.500 18990 2364 1 4 . 1 1 369 369 ARG CB C 369 32.274 32.274 30.009 2.265 18990 2365 1 4 . 1 1 370 370 LYS N N 370 121.022 121.022 119.799 1.223 18990 2366 1 4 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.135 0.035 18990 2367 1 4 . 1 1 370 370 LYS C C 370 174.868 174.868 173.557 1.311 18990 2368 1 4 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.887 0.667 18990 2369 1 4 . 1 1 370 370 LYS CB C 370 33.140 33.140 35.312 -2.172 18990 2370 1 4 . 1 1 370 370 LYS H H 370 7.740 7.740 7.367 0.373 18990 2371 1 4 . 1 1 371 371 VAL N N 371 128.362 128.362 124.985 3.377 18990 2372 1 4 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.269 -0.136 18990 2373 1 4 . 1 1 371 371 VAL C C 371 173.402 173.402 173.684 -0.282 18990 2374 1 4 . 1 1 371 371 VAL CA C 371 60.777 60.777 60.871 -0.094 18990 2375 1 4 . 1 1 371 371 VAL CB C 371 33.000 33.000 33.061 -0.061 18990 2376 1 4 . 1 1 371 371 VAL H H 371 8.647 8.647 8.663 -0.016 18990 2377 1 4 . 1 1 372 372 THR N N 372 119.667 119.667 123.115 -3.448 18990 2378 1 4 . 1 1 372 372 THR HA H 372 5.032 5.032 5.034 -0.002 18990 2379 1 4 . 1 1 372 372 THR C C 372 174.339 174.339 173.828 0.511 18990 2380 1 4 . 1 1 372 372 THR CA C 372 60.881 60.881 61.587 -0.706 18990 2381 1 4 . 1 1 372 372 THR CB C 372 70.471 70.471 71.510 -1.039 18990 2382 1 4 . 1 1 372 372 THR H H 372 8.087 8.087 8.261 -0.174 18990 2383 1 4 . 1 1 373 373 CYS N N 373 132.554 132.554 128.176 4.378 18990 2384 1 4 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.636 0.166 18990 2385 1 4 . 1 1 373 373 CYS C C 373 176.791 176.791 175.846 0.945 18990 2386 1 4 . 1 1 373 373 CYS CA C 373 58.504 58.504 58.281 0.223 18990 2387 1 4 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.867 3.444 18990 2388 1 4 . 1 1 373 373 CYS H H 373 9.322 9.322 8.985 0.337 18990 2389 1 4 . 1 1 374 374 GLN N N 374 125.890 125.890 124.146 1.744 18990 2390 1 4 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.298 -0.298 18990 2391 1 4 . 1 1 374 374 GLN C C 374 176.827 176.827 176.266 0.561 18990 2392 1 4 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.635 0.665 18990 2393 1 4 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.646 1.018 18990 2394 1 4 . 1 1 374 374 GLN H H 374 7.856 7.856 8.499 -0.643 18990 2395 1 4 . 1 1 375 375 ASN N N 375 115.342 115.342 118.081 -2.739 18990 2396 1 4 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.737 0.150 18990 2397 1 4 . 1 1 375 375 ASN C C 375 174.049 174.049 175.316 -1.267 18990 2398 1 4 . 1 1 375 375 ASN CA C 375 53.047 53.047 54.139 -1.092 18990 2399 1 4 . 1 1 375 375 ASN CB C 375 38.916 38.916 38.619 0.297 18990 2400 1 4 . 1 1 375 375 ASN H H 375 8.913 8.913 8.540 0.373 18990 2401 1 4 . 1 1 376 376 GLY N N 376 109.098 109.098 106.878 2.220 18990 2402 1 4 . 1 1 376 376 GLY C C 376 174.110 174.110 174.022 0.088 18990 2403 1 4 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.374 1.012 18990 2404 1 4 . 1 1 376 376 GLY H H 376 7.162 7.162 7.713 -0.551 18990 2405 1 4 . 1 1 377 377 CYS N N 377 132.546 132.546 120.477 12.069 18990 2406 1 4 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.960 -0.196 18990 2407 1 4 . 1 1 377 377 CYS C C 377 177.355 177.355 174.650 2.705 18990 2408 1 4 . 1 1 377 377 CYS CA C 377 59.988 59.988 58.215 1.773 18990 2409 1 4 . 1 1 377 377 CYS CB C 377 32.365 32.365 28.843 3.522 18990 2410 1 4 . 1 1 377 377 CYS H H 377 9.800 9.800 8.102 1.698 18990 2411 1 4 . 1 1 378 378 GLY N N 378 113.851 113.851 107.251 6.600 18990 2412 1 4 . 1 1 378 378 GLY C C 378 173.404 173.404 172.478 0.926 18990 2413 1 4 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.676 0.187 18990 2414 1 4 . 1 1 378 378 GLY H H 378 8.820 8.820 8.288 0.532 18990 2415 1 4 . 1 1 379 379 TYR N N 379 125.532 125.532 123.936 1.596 18990 2416 1 4 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.798 -0.320 18990 2417 1 4 . 1 1 379 379 TYR C C 379 173.661 173.661 173.764 -0.103 18990 2418 1 4 . 1 1 379 379 TYR CA C 379 59.180 59.180 57.629 1.551 18990 2419 1 4 . 1 1 379 379 TYR CB C 379 40.108 40.108 41.573 -1.465 18990 2420 1 4 . 1 1 379 379 TYR H H 379 9.054 9.054 8.227 0.827 18990 2421 1 4 . 1 1 380 380 VAL N N 380 124.461 124.461 123.030 1.431 18990 2422 1 4 . 1 1 380 380 VAL HA H 380 4.818 4.818 5.028 -0.210 18990 2423 1 4 . 1 1 380 380 VAL C C 380 175.876 175.876 174.141 1.735 18990 2424 1 4 . 1 1 380 380 VAL CA C 380 60.797 60.797 60.693 0.104 18990 2425 1 4 . 1 1 380 380 VAL CB C 380 32.610 32.610 32.790 -0.180 18990 2426 1 4 . 1 1 380 380 VAL H H 380 7.238 7.238 7.811 -0.573 18990 2427 1 4 . 1 1 381 381 PHE N N 381 124.588 124.588 121.927 2.661 18990 2428 1 4 . 1 1 381 381 PHE HA H 381 5.273 5.273 5.067 0.206 18990 2429 1 4 . 1 1 381 381 PHE C C 381 173.242 173.242 173.453 -0.211 18990 2430 1 4 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.423 -0.213 18990 2431 1 4 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.052 2.038 18990 2432 1 4 . 1 1 381 381 PHE H H 381 9.424 9.424 8.020 1.404 18990 2433 1 4 . 1 1 382 382 CYS N N 382 120.221 120.221 120.269 -0.048 18990 2434 1 4 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.717 0.185 18990 2435 1 4 . 1 1 382 382 CYS C C 382 177.165 177.165 175.762 1.403 18990 2436 1 4 . 1 1 382 382 CYS CA C 382 57.691 57.691 58.197 -0.506 18990 2437 1 4 . 1 1 382 382 CYS CB C 382 32.475 32.475 29.945 2.530 18990 2438 1 4 . 1 1 382 382 CYS H H 382 8.673 8.673 8.487 0.186 18990 2439 1 4 . 1 1 383 383 ARG N N 383 129.347 129.347 120.753 8.594 18990 2440 1 4 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.384 -0.363 18990 2441 1 4 . 1 1 383 383 ARG C C 383 175.012 175.012 176.041 -1.029 18990 2442 1 4 . 1 1 383 383 ARG CA C 383 58.686 58.686 57.839 0.847 18990 2443 1 4 . 1 1 383 383 ARG CB C 383 30.900 30.900 29.985 0.915 18990 2444 1 4 . 1 1 383 383 ARG H H 383 9.534 9.534 8.675 0.859 18990 2445 1 4 . 1 1 384 384 ASN N N 384 117.772 117.772 117.658 0.114 18990 2446 1 4 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.756 -0.048 18990 2447 1 4 . 1 1 384 384 ASN C C 384 175.656 175.656 174.593 1.063 18990 2448 1 4 . 1 1 384 384 ASN CA C 384 55.778 55.778 54.012 1.766 18990 2449 1 4 . 1 1 384 384 ASN CB C 384 39.475 39.475 39.693 -0.218 18990 2450 1 4 . 1 1 384 384 ASN H H 384 8.840 8.840 8.317 0.523 18990 2451 1 4 . 1 1 385 385 CYS N N 385 115.876 115.876 113.993 1.883 18990 2452 1 4 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.980 0.048 18990 2453 1 4 . 1 1 385 385 CYS C C 385 175.703 175.703 173.778 1.925 18990 2454 1 4 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.950 1.162 18990 2455 1 4 . 1 1 385 385 CYS CB C 385 32.359 32.359 30.371 1.988 18990 2456 1 4 . 1 1 385 385 CYS H H 385 7.868 7.868 7.762 0.106 18990 2457 1 4 . 1 1 386 386 LEU N N 386 120.082 120.082 119.371 0.711 18990 2458 1 4 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.749 -0.436 18990 2459 1 4 . 1 1 386 386 LEU C C 386 175.722 175.722 177.072 -1.350 18990 2460 1 4 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.254 2.755 18990 2461 1 4 . 1 1 386 386 LEU CB C 386 38.412 38.412 41.803 -3.391 18990 2462 1 4 . 1 1 386 386 LEU H H 386 8.514 8.514 8.437 0.078 18990 2463 1 4 . 1 1 387 387 GLN N N 387 117.579 117.579 120.150 -2.571 18990 2464 1 4 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.335 0.441 18990 2465 1 4 . 1 1 387 387 GLN C C 387 175.299 175.299 176.810 -1.511 18990 2466 1 4 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.649 -1.632 18990 2467 1 4 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.492 1.815 18990 2468 1 4 . 1 1 387 387 GLN H H 387 8.248 8.248 7.670 0.578 18990 2469 1 4 . 1 1 388 388 GLY N N 388 106.107 106.107 107.966 -1.859 18990 2470 1 4 . 1 1 388 388 GLY C C 388 173.693 173.693 173.949 -0.256 18990 2471 1 4 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.158 1.022 18990 2472 1 4 . 1 1 388 388 GLY H H 388 8.695 8.695 8.326 0.369 18990 2473 1 4 . 1 1 389 389 TYR N N 389 122.514 122.514 117.168 5.346 18990 2474 1 4 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.192 -0.534 18990 2475 1 4 . 1 1 389 389 TYR C C 389 172.860 172.860 174.087 -1.227 18990 2476 1 4 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.665 4.322 18990 2477 1 4 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.703 0.349 18990 2478 1 4 . 1 1 389 389 TYR H H 389 7.923 7.923 8.310 -0.387 18990 2479 1 4 . 1 1 390 390 HIS N N 390 120.080 120.080 124.619 -4.539 18990 2480 1 4 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.758 -0.050 18990 2481 1 4 . 1 1 390 390 HIS C C 390 173.235 173.235 173.667 -0.432 18990 2482 1 4 . 1 1 390 390 HIS CA C 390 51.431 51.431 54.105 -2.674 18990 2483 1 4 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.747 0.153 18990 2484 1 4 . 1 1 390 390 HIS H H 390 5.291 5.291 7.682 -2.391 18990 2485 1 4 . 1 1 391 391 ILE N N 391 117.810 117.810 116.250 1.560 18990 2486 1 4 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.226 -0.110 18990 2487 1 4 . 1 1 391 391 ILE C C 391 178.208 178.208 175.915 2.293 18990 2488 1 4 . 1 1 391 391 ILE CA C 391 60.877 60.877 60.294 0.584 18990 2489 1 4 . 1 1 391 391 ILE CB C 391 39.034 39.034 39.428 -0.394 18990 2490 1 4 . 1 1 391 391 ILE H H 391 8.418 8.418 8.242 0.176 18990 2491 1 4 . 1 1 392 392 GLY N N 392 112.387 112.387 111.549 0.838 18990 2492 1 4 . 1 1 392 392 GLY C C 392 173.565 173.565 173.919 -0.354 18990 2493 1 4 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.681 0.577 18990 2494 1 4 . 1 1 392 392 GLY H H 392 8.654 8.654 8.410 0.244 18990 2495 1 4 . 1 1 393 393 GLU N N 393 119.098 119.098 121.172 -2.074 18990 2496 1 4 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.670 -0.381 18990 2497 1 4 . 1 1 393 393 GLU C C 393 176.899 176.899 175.776 1.123 18990 2498 1 4 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.113 1.320 18990 2499 1 4 . 1 1 393 393 GLU CB C 393 30.470 30.470 32.018 -1.548 18990 2500 1 4 . 1 1 393 393 GLU H H 393 8.391 8.391 8.437 -0.046 18990 2501 1 4 . 1 1 394 394 CYS N N 394 122.845 122.845 120.478 2.367 18990 2502 1 4 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.681 -0.915 18990 2503 1 4 . 1 1 394 394 CYS C C 394 175.461 175.461 175.422 0.039 18990 2504 1 4 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.828 1.007 18990 2505 1 4 . 1 1 394 394 CYS CB C 394 30.761 30.761 27.622 3.139 18990 2506 1 4 . 1 1 394 394 CYS H H 394 8.474 8.474 8.646 -0.172 18990 2507 1 4 . 1 1 395 395 LEU N N 395 124.403 124.403 124.020 0.383 18990 2508 1 4 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.686 -0.182 18990 2509 1 4 . 1 1 395 395 LEU C C 395 175.259 175.259 175.647 -0.388 18990 2510 1 4 . 1 1 395 395 LEU CA C 395 52.835 52.835 54.370 -1.535 18990 2511 1 4 . 1 1 395 395 LEU CB C 395 41.436 41.436 41.638 -0.202 18990 2512 1 4 . 1 1 395 395 LEU H H 395 8.418 8.418 8.348 0.070 18990 2513 1 4 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.865 -0.495 18990 2514 1 4 . 1 1 396 396 PRO C C 396 177.006 177.006 175.468 1.538 18990 2515 1 4 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.422 0.674 18990 2516 1 4 . 1 1 396 396 PRO CB C 396 32.072 32.072 33.193 -1.121 18990 2517 1 4 . 1 1 397 397 GLU N N 397 121.574 121.574 118.050 3.524 18990 2518 1 4 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.819 -0.594 18990 2519 1 4 . 1 1 397 397 GLU C C 397 177.202 177.202 175.474 1.728 18990 2520 1 4 . 1 1 397 397 GLU CA C 397 57.034 57.034 55.650 1.384 18990 2521 1 4 . 1 1 397 397 GLU CB C 397 30.263 30.263 31.816 -1.553 18990 2522 1 4 . 1 1 397 397 GLU H H 397 8.568 8.568 8.856 -0.288 18990 2523 1 4 . 1 1 398 398 GLY N N 398 110.495 110.495 110.785 -0.290 18990 2524 1 4 . 1 1 398 398 GLY C C 398 174.579 174.579 173.712 0.867 18990 2525 1 4 . 1 1 398 398 GLY CA C 398 45.462 45.462 45.107 0.355 18990 2526 1 4 . 1 1 398 398 GLY H H 398 8.515 8.515 8.827 -0.312 18990 2527 1 4 . 1 1 399 399 THR N N 399 113.234 113.234 111.012 2.222 18990 2528 1 4 . 1 1 399 399 THR HA H 399 4.398 4.398 4.843 -0.445 18990 2529 1 4 . 1 1 399 399 THR C C 399 175.333 175.333 173.829 1.504 18990 2530 1 4 . 1 1 399 399 THR CA C 399 62.233 62.233 62.973 -0.740 18990 2531 1 4 . 1 1 399 399 THR CB C 399 69.833 69.833 69.885 -0.052 18990 2532 1 4 . 1 1 399 399 THR H H 399 8.090 8.090 9.300 -1.210 18990 2533 1 4 . 1 1 400 400 GLY N N 400 111.479 111.479 108.558 2.921 18990 2534 1 4 . 1 1 400 400 GLY C C 400 174.048 174.048 172.392 1.656 18990 2535 1 4 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.249 0.190 18990 2536 1 4 . 1 1 400 400 GLY H H 400 8.524 8.524 8.964 -0.441 18990 2537 1 4 . 1 1 401 401 ALA N N 401 123.919 123.919 122.673 1.246 18990 2538 1 4 . 1 1 401 401 ALA HA H 401 4.251 4.251 5.296 -1.045 18990 2539 1 4 . 1 1 401 401 ALA C C 401 177.942 177.942 176.260 1.682 18990 2540 1 4 . 1 1 401 401 ALA CA C 401 52.730 52.730 52.009 0.721 18990 2541 1 4 . 1 1 401 401 ALA CB C 401 19.142 19.142 21.228 -2.086 18990 2542 1 4 . 1 1 401 401 ALA H H 401 8.179 8.179 9.726 -1.547 18990 2543 1 4 . 1 1 402 402 SER N N 402 114.904 114.904 114.969 -0.065 18990 2544 1 4 . 1 1 402 402 SER HA H 402 4.448 4.448 5.247 -0.799 18990 2545 1 4 . 1 1 402 402 SER C C 402 174.426 174.426 173.876 0.550 18990 2546 1 4 . 1 1 402 402 SER CA C 402 58.289 58.289 58.015 0.274 18990 2547 1 4 . 1 1 402 402 SER CB C 402 63.772 63.772 65.302 -1.530 18990 2548 1 4 . 1 1 402 402 SER H H 402 8.305 8.305 9.341 -1.036 18990 2549 1 4 . 1 1 403 403 ALA N N 403 125.965 125.965 123.902 2.063 18990 2550 1 4 . 1 1 403 403 ALA HA H 403 4.399 4.399 5.262 -0.863 18990 2551 1 4 . 1 1 403 403 ALA C C 403 177.984 177.984 175.959 2.025 18990 2552 1 4 . 1 1 403 403 ALA CA C 403 52.655 52.655 51.408 1.247 18990 2553 1 4 . 1 1 403 403 ALA CB C 403 19.138 19.138 21.079 -1.941 18990 2554 1 4 . 1 1 403 403 ALA H H 403 8.345 8.345 8.894 -0.549 18990 2555 1 4 . 1 1 404 404 THR N N 404 112.790 112.790 113.507 -0.717 18990 2556 1 4 . 1 1 404 404 THR C C 404 174.420 174.420 173.048 1.372 18990 2557 1 4 . 1 1 404 404 THR CA C 404 61.988 61.988 62.175 -0.187 18990 2558 1 4 . 1 1 404 404 THR CB C 404 69.688 69.688 69.733 -0.045 18990 2559 1 4 . 1 1 404 404 THR H H 404 8.118 8.118 8.101 0.017 18990 2560 1 4 . 1 1 405 405 ASN N N 405 121.050 121.050 122.731 -1.681 18990 2561 1 4 . 1 1 405 405 ASN H H 405 8.396 8.396 8.431 -0.035 18990 2562 1 4 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.657 -0.079 18990 2563 1 4 . 1 1 407 407 CYS C C 407 174.489 174.489 173.372 1.117 18990 2564 1 4 . 1 1 407 407 CYS CA C 407 58.713 58.713 59.348 -0.635 18990 2565 1 4 . 1 1 407 407 CYS CB C 407 28.102 28.102 29.199 -1.097 18990 2566 1 4 . 1 1 408 408 GLU N N 408 123.021 123.021 124.094 -1.073 18990 2567 1 4 . 1 1 408 408 GLU C C 408 175.954 175.954 174.662 1.292 18990 2568 1 4 . 1 1 408 408 GLU CA C 408 56.802 56.802 55.788 1.014 18990 2569 1 4 . 1 1 408 408 GLU CB C 408 30.328 30.328 32.090 -1.762 18990 2570 1 4 . 1 1 408 408 GLU H H 408 8.415 8.415 8.805 -0.390 18990 2571 1 4 . 1 1 409 409 TYR N N 409 121.015 121.015 117.834 3.181 18990 2572 1 4 . 1 1 409 409 TYR HA H 409 4.654 4.654 5.243 -0.589 18990 2573 1 4 . 1 1 409 409 TYR C C 409 175.613 175.613 174.310 1.303 18990 2574 1 4 . 1 1 409 409 TYR CA C 409 57.669 57.669 57.002 0.667 18990 2575 1 4 . 1 1 409 409 TYR CB C 409 38.825 38.825 40.808 -1.983 18990 2576 1 4 . 1 1 409 409 TYR H H 409 8.135 8.135 8.694 -0.559 18990 2577 1 4 . 1 1 410 410 THR N N 410 116.975 116.975 115.423 1.552 18990 2578 1 4 . 1 1 410 410 THR HA H 410 4.306 4.306 4.829 -0.523 18990 2579 1 4 . 1 1 410 410 THR C C 410 173.846 173.846 172.699 1.147 18990 2580 1 4 . 1 1 410 410 THR CA C 410 61.730 61.730 61.068 0.662 18990 2581 1 4 . 1 1 410 410 THR CB C 410 69.914 69.914 70.426 -0.512 18990 2582 1 4 . 1 1 410 410 THR H H 410 8.060 8.060 8.837 -0.777 18990 2583 1 4 . 1 1 411 411 VAL N N 411 122.900 122.900 120.794 2.106 18990 2584 1 4 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.688 -0.635 18990 2585 1 4 . 1 1 411 411 VAL C C 411 175.275 175.275 174.157 1.118 18990 2586 1 4 . 1 1 411 411 VAL CA C 411 61.853 61.853 61.598 0.255 18990 2587 1 4 . 1 1 411 411 VAL CB C 411 32.976 32.976 34.165 -1.189 18990 2588 1 4 . 1 1 411 411 VAL H H 411 8.089 8.089 8.815 -0.726 18990 2589 1 4 . 1 1 412 412 ASP N N 412 125.924 125.924 121.348 4.576 18990 2590 1 4 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.929 -0.079 18990 2591 1 4 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.020 -0.442 18990 2592 1 4 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.760 -0.222 18990 2593 1 4 . 1 1 412 412 ASP H H 412 8.397 8.397 8.303 0.094 18990 2594 1 4 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.495 -0.109 18990 2595 1 4 . 1 1 413 413 PRO C C 413 177.352 177.352 175.900 1.452 18990 2596 1 4 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.616 1.294 18990 2597 1 4 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.580 -0.312 18990 2598 1 4 . 1 1 414 414 ASN N N 414 117.035 117.035 120.153 -3.118 18990 2599 1 4 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.714 -0.037 18990 2600 1 4 . 1 1 414 414 ASN C C 414 175.532 175.532 174.898 0.634 18990 2601 1 4 . 1 1 414 414 ASN CA C 414 53.824 53.824 52.375 1.449 18990 2602 1 4 . 1 1 414 414 ASN CB C 414 38.728 38.728 40.661 -1.933 18990 2603 1 4 . 1 1 414 414 ASN H H 414 8.496 8.496 8.576 -0.080 18990 2604 1 4 . 1 1 415 415 ARG N N 415 121.000 121.000 118.029 2.971 18990 2605 1 4 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.778 -0.534 18990 2606 1 4 . 1 1 415 415 ARG C C 415 176.243 176.243 174.247 1.996 18990 2607 1 4 . 1 1 415 415 ARG CA C 415 56.404 56.404 55.518 0.886 18990 2608 1 4 . 1 1 415 415 ARG CB C 415 30.637 30.637 31.712 -1.075 18990 2609 1 4 . 1 1 415 415 ARG H H 415 7.804 7.804 8.471 -0.667 18990 2610 1 4 . 1 1 416 416 ALA N N 416 124.880 124.880 124.563 0.317 18990 2611 1 4 . 1 1 416 416 ALA C C 416 177.831 177.831 175.984 1.847 18990 2612 1 4 . 1 1 416 416 ALA CA C 416 52.957 52.957 52.239 0.718 18990 2613 1 4 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.290 -1.231 18990 2614 1 4 . 1 1 416 416 ALA H H 416 8.189 8.189 8.418 -0.229 18990 2615 1 4 . 1 1 417 417 ALA N N 417 122.614 122.614 127.311 -4.697 18990 2616 1 4 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.566 -0.319 18990 2617 1 4 . 1 1 417 417 ALA C C 417 178.024 178.024 176.690 1.334 18990 2618 1 4 . 1 1 417 417 ALA CA C 417 52.789 52.789 52.212 0.577 18990 2619 1 4 . 1 1 417 417 ALA CB C 417 19.042 19.042 19.552 -0.510 18990 2620 1 4 . 1 1 417 417 ALA H H 417 8.169 8.169 8.161 0.008 18990 2621 1 4 . 1 1 418 418 GLU N N 418 119.500 119.500 121.030 -1.530 18990 2622 1 4 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.478 -0.289 18990 2623 1 4 . 1 1 418 418 GLU C C 418 176.266 176.266 175.628 0.638 18990 2624 1 4 . 1 1 418 418 GLU CA C 418 56.576 56.576 56.323 0.253 18990 2625 1 4 . 1 1 418 418 GLU CB C 418 30.307 30.307 30.868 -0.561 18990 2626 1 4 . 1 1 418 418 GLU H H 418 8.184 8.184 8.475 -0.291 18990 2627 1 4 . 1 1 419 419 ALA N N 419 124.643 124.643 125.454 -0.811 18990 2628 1 4 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.194 0.056 18990 2629 1 4 . 1 1 419 419 ALA C C 419 177.488 177.488 175.669 1.819 18990 2630 1 4 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.573 0.936 18990 2631 1 4 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.145 -0.984 18990 2632 1 4 . 1 1 419 419 ALA H H 419 8.135 8.135 8.068 0.067 18990 2633 1 4 . 1 1 420 420 ARG N N 420 120.003 120.003 123.335 -3.332 18990 2634 1 4 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.650 -0.357 18990 2635 1 4 . 1 1 420 420 ARG C C 420 176.297 176.297 175.047 1.250 18990 2636 1 4 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.123 0.810 18990 2637 1 4 . 1 1 420 420 ARG CB C 420 30.850 30.850 31.749 -0.899 18990 2638 1 4 . 1 1 420 420 ARG H H 420 8.135 8.135 8.035 0.100 18990 2639 1 4 . 1 1 421 421 TRP N N 421 122.280 122.280 123.606 -1.326 18990 2640 1 4 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.827 -0.164 18990 2641 1 4 . 1 1 421 421 TRP C C 421 175.856 175.856 175.469 0.387 18990 2642 1 4 . 1 1 421 421 TRP CA C 421 57.404 57.404 56.362 1.042 18990 2643 1 4 . 1 1 421 421 TRP CB C 421 29.437 29.437 31.198 -1.762 18990 2644 1 4 . 1 1 421 421 TRP H H 421 8.159 8.159 8.559 -0.400 18990 2645 1 4 . 1 1 422 422 ASP N N 422 121.980 121.980 120.098 1.882 18990 2646 1 4 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.745 -0.250 18990 2647 1 4 . 1 1 422 422 ASP C C 422 176.184 176.184 175.511 0.673 18990 2648 1 4 . 1 1 422 422 ASP CA C 422 53.899 53.899 53.964 -0.065 18990 2649 1 4 . 1 1 422 422 ASP CB C 422 40.948 40.948 41.687 -0.739 18990 2650 1 4 . 1 1 422 422 ASP H H 422 8.135 8.135 8.492 -0.357 18990 2651 1 4 . 1 1 423 423 GLU N N 423 121.990 121.990 122.933 -0.943 18990 2652 1 4 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.286 -0.196 18990 2653 1 4 . 1 1 423 423 GLU C C 423 176.720 176.720 175.937 0.783 18990 2654 1 4 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.388 0.781 18990 2655 1 4 . 1 1 423 423 GLU CB C 423 30.156 30.156 30.045 0.111 18990 2656 1 4 . 1 1 423 423 GLU H H 423 8.153 8.153 8.844 -0.691 18990 2657 1 4 . 1 1 424 424 ALA N N 424 123.900 123.900 123.299 0.601 18990 2658 1 4 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.266 0.014 18990 2659 1 4 . 1 1 424 424 ALA C C 424 178.095 178.095 177.246 0.849 18990 2660 1 4 . 1 1 424 424 ALA CA C 424 53.017 53.017 53.062 -0.045 18990 2661 1 4 . 1 1 424 424 ALA CB C 424 19.086 19.086 18.882 0.204 18990 2662 1 4 . 1 1 424 424 ALA H H 424 8.243 8.243 7.977 0.266 18990 2663 1 4 . 1 1 425 425 SER N N 425 113.881 113.881 116.202 -2.321 18990 2664 1 4 . 1 1 425 425 SER HA H 425 4.387 4.387 4.587 -0.200 18990 2665 1 4 . 1 1 425 425 SER C C 425 174.338 174.338 173.280 1.058 18990 2666 1 4 . 1 1 425 425 SER CA C 425 58.546 58.546 57.142 1.404 18990 2667 1 4 . 1 1 425 425 SER CB C 425 63.784 63.784 64.559 -0.775 18990 2668 1 4 . 1 1 425 425 SER H H 425 8.063 8.063 8.406 -0.343 18990 2669 1 4 . 1 1 426 426 ASN N N 426 121.032 121.032 123.970 -2.938 18990 2670 1 4 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.860 -0.154 18990 2671 1 4 . 1 1 426 426 ASN C C 426 175.046 175.046 174.595 0.451 18990 2672 1 4 . 1 1 426 426 ASN CA C 426 53.445 53.445 52.793 0.652 18990 2673 1 4 . 1 1 426 426 ASN CB C 426 38.847 38.847 38.917 -0.070 18990 2674 1 4 . 1 1 426 426 ASN H H 426 8.391 8.391 8.477 -0.086 18990 2675 1 4 . 1 1 427 427 VAL N N 427 119.463 119.463 123.566 -4.103 18990 2676 1 4 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.345 -0.152 18990 2677 1 4 . 1 1 427 427 VAL C C 427 176.213 176.213 175.614 0.599 18990 2678 1 4 . 1 1 427 427 VAL CA C 427 62.449 62.449 61.939 0.510 18990 2679 1 4 . 1 1 427 427 VAL CB C 427 32.865 32.865 31.938 0.927 18990 2680 1 4 . 1 1 427 427 VAL H H 427 7.954 7.954 8.403 -0.449 18990 2681 1 4 . 1 1 428 428 THR N N 428 118.226 118.226 120.480 -2.254 18990 2682 1 4 . 1 1 428 428 THR HA H 428 4.353 4.353 4.487 -0.134 18990 2683 1 4 . 1 1 428 428 THR C C 428 174.361 174.361 174.402 -0.041 18990 2684 1 4 . 1 1 428 428 THR CA C 428 62.065 62.065 61.266 0.799 18990 2685 1 4 . 1 1 428 428 THR CB C 428 69.729 69.729 70.396 -0.667 18990 2686 1 4 . 1 1 428 428 THR H H 428 8.225 8.225 8.206 0.019 18990 2687 1 4 . 1 1 429 429 ILE N N 429 123.910 123.910 124.474 -0.564 18990 2688 1 4 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.208 -0.020 18990 2689 1 4 . 1 1 429 429 ILE C C 429 175.774 175.774 175.293 0.481 18990 2690 1 4 . 1 1 429 429 ILE CA C 429 60.819 60.819 61.263 -0.444 18990 2691 1 4 . 1 1 429 429 ILE CB C 429 38.719 38.719 38.491 0.228 18990 2692 1 4 . 1 1 429 429 ILE H H 429 8.148 8.148 8.328 -0.180 18990 2693 1 4 . 1 1 430 430 LYS N N 430 126.453 126.453 129.083 -2.630 18990 2694 1 4 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.645 -0.211 18990 2695 1 4 . 1 1 430 430 LYS C C 430 176.241 176.241 175.253 0.988 18990 2696 1 4 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.811 0.126 18990 2697 1 4 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.656 -0.492 18990 2698 1 4 . 1 1 430 430 LYS H H 430 8.406 8.406 8.558 -0.152 18990 2699 1 4 . 1 1 431 431 VAL N N 431 122.496 122.496 122.956 -0.460 18990 2700 1 4 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.424 -0.144 18990 2701 1 4 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.219 0.084 18990 2702 1 4 . 1 1 431 431 VAL CB C 431 33.132 33.132 33.984 -0.852 18990 2703 1 4 . 1 1 431 431 VAL H H 431 8.312 8.312 8.569 -0.257 18990 2704 1 4 . 1 1 432 432 SER HA H 432 4.486 4.486 4.756 -0.271 18990 2705 1 4 . 1 1 432 432 SER C C 432 173.834 173.834 173.485 0.349 18990 2706 1 4 . 1 1 432 432 SER CA C 432 58.650 58.650 58.763 -0.113 18990 2707 1 4 . 1 1 432 432 SER CB C 432 64.152 64.152 63.684 0.468 18990 2708 1 4 . 1 1 433 433 THR N N 433 114.706 114.706 113.559 1.147 18990 2709 1 4 . 1 1 433 433 THR HA H 433 5.446 5.446 4.940 0.506 18990 2710 1 4 . 1 1 433 433 THR C C 433 173.979 173.979 174.508 -0.529 18990 2711 1 4 . 1 1 433 433 THR CA C 433 60.412 60.412 60.861 -0.449 18990 2712 1 4 . 1 1 433 433 THR CB C 433 71.896 71.896 69.827 2.069 18990 2713 1 4 . 1 1 433 433 THR H H 433 7.833 7.833 7.586 0.247 18990 2714 1 4 . 1 1 434 434 LYS N N 434 122.492 122.492 124.576 -2.084 18990 2715 1 4 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.990 -0.281 18990 2716 1 4 . 1 1 434 434 LYS C C 434 173.589 173.589 174.645 -1.056 18990 2717 1 4 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.958 1.417 18990 2718 1 4 . 1 1 434 434 LYS CB C 434 36.925 36.925 33.978 2.947 18990 2719 1 4 . 1 1 434 434 LYS H H 434 8.937 8.937 9.128 -0.191 18990 2720 1 4 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.662 -0.395 18990 2721 1 4 . 1 1 435 435 PRO C C 435 175.238 175.238 176.601 -1.363 18990 2722 1 4 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.404 -1.481 18990 2723 1 4 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.733 -0.647 18990 2724 1 4 . 1 1 436 436 CYS N N 436 125.422 125.422 125.150 0.272 18990 2725 1 4 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.267 -0.837 18990 2726 1 4 . 1 1 436 436 CYS C C 436 176.770 176.770 174.855 1.915 18990 2727 1 4 . 1 1 436 436 CYS CA C 436 57.016 57.016 57.206 -0.190 18990 2728 1 4 . 1 1 436 436 CYS CB C 436 31.698 31.698 27.680 4.018 18990 2729 1 4 . 1 1 436 436 CYS H H 436 7.768 7.768 8.656 -0.888 18990 2730 1 4 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.068 -0.210 18990 2731 1 4 . 1 1 437 437 PRO C C 437 173.608 173.608 176.434 -2.826 18990 2732 1 4 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.481 -0.268 18990 2733 1 4 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.471 0.978 18990 2734 1 4 . 1 1 438 438 LYS N N 438 118.600 118.600 118.398 0.202 18990 2735 1 4 . 1 1 438 438 LYS HA H 438 3.970 3.970 3.956 0.014 18990 2736 1 4 . 1 1 438 438 LYS C C 438 176.887 176.887 177.490 -0.603 18990 2737 1 4 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.115 0.572 18990 2738 1 4 . 1 1 438 438 LYS CB C 438 33.124 33.124 32.850 0.274 18990 2739 1 4 . 1 1 438 438 LYS H H 438 8.390 8.390 7.600 0.790 18990 2740 1 4 . 1 1 439 439 CYS N N 439 118.950 118.950 115.332 3.618 18990 2741 1 4 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.785 -0.039 18990 2742 1 4 . 1 1 439 439 CYS C C 439 176.650 176.650 174.892 1.758 18990 2743 1 4 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.392 1.956 18990 2744 1 4 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.981 2.215 18990 2745 1 4 . 1 1 439 439 CYS H H 439 8.357 8.357 7.681 0.676 18990 2746 1 4 . 1 1 440 440 ARG N N 440 117.200 117.200 119.858 -2.658 18990 2747 1 4 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.165 -0.197 18990 2748 1 4 . 1 1 440 440 ARG C C 440 175.253 175.253 175.598 -0.345 18990 2749 1 4 . 1 1 440 440 ARG CA C 440 56.900 56.900 57.100 -0.200 18990 2750 1 4 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.716 -1.675 18990 2751 1 4 . 1 1 440 440 ARG H H 440 8.065 8.065 7.860 0.205 18990 2752 1 4 . 1 1 441 441 THR N N 441 122.400 122.400 111.885 10.515 18990 2753 1 4 . 1 1 441 441 THR HA H 441 4.371 4.371 4.648 -0.277 18990 2754 1 4 . 1 1 441 441 THR C C 441 173.702 173.702 172.762 0.940 18990 2755 1 4 . 1 1 441 441 THR CA C 441 63.194 63.194 59.661 3.533 18990 2756 1 4 . 1 1 441 441 THR CB C 441 68.933 68.933 69.198 -0.265 18990 2757 1 4 . 1 1 441 441 THR H H 441 8.643 8.643 7.456 1.187 18990 2758 1 4 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.724 -0.577 18990 2759 1 4 . 1 1 442 442 PRO C C 442 176.215 176.215 176.133 0.082 18990 2760 1 4 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.708 1.489 18990 2761 1 4 . 1 1 442 442 PRO CB C 442 32.044 32.044 31.225 0.819 18990 2762 1 4 . 1 1 443 443 THR N N 443 122.932 122.932 122.263 0.669 18990 2763 1 4 . 1 1 443 443 THR HA H 443 4.665 4.665 4.610 0.055 18990 2764 1 4 . 1 1 443 443 THR C C 443 172.133 172.133 174.398 -2.265 18990 2765 1 4 . 1 1 443 443 THR CA C 443 62.566 62.566 61.875 0.691 18990 2766 1 4 . 1 1 443 443 THR CB C 443 71.562 71.562 70.309 1.253 18990 2767 1 4 . 1 1 443 443 THR H H 443 9.116 9.116 9.024 0.092 18990 2768 1 4 . 1 1 444 444 GLU N N 444 126.390 126.390 125.569 0.821 18990 2769 1 4 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.546 0.396 18990 2770 1 4 . 1 1 444 444 GLU C C 444 175.292 175.292 176.165 -0.873 18990 2771 1 4 . 1 1 444 444 GLU CA C 444 55.049 55.049 55.977 -0.928 18990 2772 1 4 . 1 1 444 444 GLU CB C 444 31.861 31.861 30.853 1.008 18990 2773 1 4 . 1 1 444 444 GLU H H 444 8.720 8.720 8.796 -0.076 18990 2774 1 4 . 1 1 445 445 ARG N N 445 123.505 123.505 122.308 1.197 18990 2775 1 4 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.382 -0.671 18990 2776 1 4 . 1 1 445 445 ARG C C 445 175.289 175.289 174.625 0.664 18990 2777 1 4 . 1 1 445 445 ARG CA C 445 55.856 55.856 55.035 0.820 18990 2778 1 4 . 1 1 445 445 ARG CB C 445 30.675 30.675 30.393 0.282 18990 2779 1 4 . 1 1 445 445 ARG H H 445 8.157 8.157 8.531 -0.374 18990 2780 1 4 . 1 1 446 446 ASP N N 446 126.800 126.800 126.528 0.272 18990 2781 1 4 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.800 -0.159 18990 2782 1 4 . 1 1 446 446 ASP C C 446 176.020 176.020 176.251 -0.231 18990 2783 1 4 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.858 -0.906 18990 2784 1 4 . 1 1 446 446 ASP CB C 446 41.400 41.400 43.033 -1.633 18990 2785 1 4 . 1 1 446 446 ASP H H 446 8.476 8.476 8.434 0.042 18990 2786 1 4 . 1 1 447 447 GLY N N 447 111.262 111.262 111.302 -0.040 18990 2787 1 4 . 1 1 447 447 GLY C C 447 174.073 174.073 173.965 0.108 18990 2788 1 4 . 1 1 447 447 GLY CA C 447 45.832 45.832 45.421 0.411 18990 2789 1 4 . 1 1 447 447 GLY H H 447 8.056 8.056 8.571 -0.515 18990 2790 1 4 . 1 1 448 448 GLY N N 448 108.655 108.655 108.807 -0.152 18990 2791 1 4 . 1 1 448 448 GLY C C 448 174.020 174.020 174.451 -0.431 18990 2792 1 4 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.525 0.742 18990 2793 1 4 . 1 1 448 448 GLY H H 448 8.380 8.380 8.283 0.097 18990 2794 1 4 . 1 1 449 449 CYS N N 449 120.628 120.628 117.306 3.322 18990 2795 1 4 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.539 -0.542 18990 2796 1 4 . 1 1 449 449 CYS C C 449 174.855 174.855 175.630 -0.775 18990 2797 1 4 . 1 1 449 449 CYS CA C 449 59.291 59.291 57.621 1.670 18990 2798 1 4 . 1 1 449 449 CYS CB C 449 28.000 28.000 29.388 -1.388 18990 2799 1 4 . 1 1 449 449 CYS H H 449 7.832 7.832 7.560 0.272 18990 2800 1 4 . 1 1 450 450 MET N N 450 123.947 123.947 119.127 4.820 18990 2801 1 4 . 1 1 450 450 MET HA H 450 4.551 4.551 4.196 0.355 18990 2802 1 4 . 1 1 450 450 MET C C 450 174.658 174.658 175.615 -0.957 18990 2803 1 4 . 1 1 450 450 MET CA C 450 54.970 54.970 56.107 -1.137 18990 2804 1 4 . 1 1 450 450 MET CB C 450 34.100 34.100 32.360 1.740 18990 2805 1 4 . 1 1 450 450 MET H H 450 8.916 8.916 8.357 0.559 18990 2806 1 4 . 1 1 451 451 HIS N N 451 120.490 120.490 120.585 -0.095 18990 2807 1 4 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.729 -1.050 18990 2808 1 4 . 1 1 451 451 HIS C C 451 172.443 172.443 174.420 -1.977 18990 2809 1 4 . 1 1 451 451 HIS CA C 451 53.812 53.812 54.811 -0.999 18990 2810 1 4 . 1 1 451 451 HIS CB C 451 28.900 28.900 29.311 -0.411 18990 2811 1 4 . 1 1 451 451 HIS H H 451 7.557 7.557 7.857 -0.300 18990 2812 1 4 . 1 1 452 452 MET N N 452 128.800 128.800 125.831 2.969 18990 2813 1 4 . 1 1 452 452 MET HA H 452 4.320 4.320 4.806 -0.485 18990 2814 1 4 . 1 1 452 452 MET C C 452 175.479 175.479 174.041 1.438 18990 2815 1 4 . 1 1 452 452 MET CA C 452 52.589 52.589 54.317 -1.728 18990 2816 1 4 . 1 1 452 452 MET CB C 452 28.074 28.074 33.693 -5.619 18990 2817 1 4 . 1 1 452 452 MET H H 452 9.087 9.087 7.826 1.261 18990 2818 1 4 . 1 1 453 453 VAL N N 453 122.200 122.200 123.989 -1.789 18990 2819 1 4 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.147 0.647 18990 2820 1 4 . 1 1 453 453 VAL C C 453 175.476 175.476 176.023 -0.547 18990 2821 1 4 . 1 1 453 453 VAL CA C 453 61.380 61.380 61.243 0.137 18990 2822 1 4 . 1 1 453 453 VAL CB C 453 33.089 33.089 32.550 0.539 18990 2823 1 4 . 1 1 453 453 VAL H H 453 8.016 8.016 8.171 -0.155 18990 2824 1 4 . 1 1 454 454 CYS N N 454 130.353 130.353 128.901 1.452 18990 2825 1 4 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.545 0.050 18990 2826 1 4 . 1 1 454 454 CYS C C 454 177.833 177.833 174.422 3.411 18990 2827 1 4 . 1 1 454 454 CYS CA C 454 61.571 61.571 59.590 1.981 18990 2828 1 4 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.288 5.757 18990 2829 1 4 . 1 1 454 454 CYS H H 454 8.989 8.989 8.916 0.073 18990 2830 1 4 . 1 1 455 455 THR N N 455 119.000 119.000 123.445 -4.445 18990 2831 1 4 . 1 1 455 455 THR HA H 455 4.393 4.393 4.347 0.046 18990 2832 1 4 . 1 1 455 455 THR C C 455 175.264 175.264 173.733 1.531 18990 2833 1 4 . 1 1 455 455 THR CA C 455 61.644 61.644 62.379 -0.735 18990 2834 1 4 . 1 1 455 455 THR CB C 455 69.400 69.400 68.189 1.211 18990 2835 1 4 . 1 1 455 455 THR H H 455 8.533 8.533 8.424 0.109 18990 2836 1 4 . 1 1 456 456 ARG N N 456 128.900 128.900 128.322 0.578 18990 2837 1 4 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.556 -0.331 18990 2838 1 4 . 1 1 456 456 ARG C C 456 177.782 177.782 174.993 2.789 18990 2839 1 4 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.512 2.438 18990 2840 1 4 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.804 -3.754 18990 2841 1 4 . 1 1 456 456 ARG H H 456 9.036 9.036 7.726 1.310 18990 2842 1 4 . 1 1 457 457 ALA N N 457 133.152 133.152 126.284 6.868 18990 2843 1 4 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.258 -0.112 18990 2844 1 4 . 1 1 457 457 ALA C C 457 178.757 178.757 177.531 1.226 18990 2845 1 4 . 1 1 457 457 ALA CA C 457 53.929 53.929 52.670 1.259 18990 2846 1 4 . 1 1 457 457 ALA CB C 457 17.710 17.710 17.593 0.117 18990 2847 1 4 . 1 1 457 457 ALA H H 457 9.042 9.042 8.713 0.329 18990 2848 1 4 . 1 1 458 458 GLY N N 458 111.200 111.200 111.070 0.130 18990 2849 1 4 . 1 1 458 458 GLY C C 458 173.558 173.558 173.575 -0.017 18990 2850 1 4 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.636 0.800 18990 2851 1 4 . 1 1 458 458 GLY H H 458 8.830 8.830 8.300 0.530 18990 2852 1 4 . 1 1 459 459 CYS N N 459 123.040 123.040 118.787 4.253 18990 2853 1 4 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.855 -0.233 18990 2854 1 4 . 1 1 459 459 CYS C C 459 176.591 176.591 174.442 2.149 18990 2855 1 4 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.363 1.136 18990 2856 1 4 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.270 0.904 18990 2857 1 4 . 1 1 459 459 CYS H H 459 8.042 8.042 8.037 0.005 18990 2858 1 4 . 1 1 460 460 GLY N N 460 104.500 104.500 111.319 -6.819 18990 2859 1 4 . 1 1 460 460 GLY C C 460 173.716 173.716 174.192 -0.476 18990 2860 1 4 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.631 0.377 18990 2861 1 4 . 1 1 460 460 GLY H H 460 7.705 7.705 8.138 -0.433 18990 2862 1 4 . 1 1 461 461 PHE N N 461 124.949 124.949 121.315 3.634 18990 2863 1 4 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.549 0.031 18990 2864 1 4 . 1 1 461 461 PHE C C 461 174.447 174.447 174.622 -0.175 18990 2865 1 4 . 1 1 461 461 PHE CA C 461 59.946 59.946 58.554 1.392 18990 2866 1 4 . 1 1 461 461 PHE CB C 461 41.300 41.300 40.582 0.718 18990 2867 1 4 . 1 1 461 461 PHE H H 461 8.947 8.947 7.624 1.323 18990 2868 1 4 . 1 1 462 462 GLU N N 462 125.272 125.272 126.714 -1.442 18990 2869 1 4 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.701 1.020 18990 2870 1 4 . 1 1 462 462 GLU C C 462 176.067 176.067 175.112 0.955 18990 2871 1 4 . 1 1 462 462 GLU CA C 462 54.624 54.624 55.356 -0.732 18990 2872 1 4 . 1 1 462 462 GLU CB C 462 31.255 31.255 31.868 -0.613 18990 2873 1 4 . 1 1 462 462 GLU H H 462 7.799 7.799 8.245 -0.446 18990 2874 1 4 . 1 1 463 463 TRP N N 463 121.524 121.524 119.152 2.372 18990 2875 1 4 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.135 0.371 18990 2876 1 4 . 1 1 463 463 TRP C C 463 172.844 172.844 175.241 -2.397 18990 2877 1 4 . 1 1 463 463 TRP CA C 463 53.771 53.771 55.628 -1.857 18990 2878 1 4 . 1 1 463 463 TRP CB C 463 31.736 31.736 30.911 0.825 18990 2879 1 4 . 1 1 463 463 TRP H H 463 9.300 9.300 8.127 1.173 18990 2880 1 4 . 1 1 464 464 CYS N N 464 120.868 120.868 120.922 -0.054 18990 2881 1 4 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.896 0.520 18990 2882 1 4 . 1 1 464 464 CYS C C 464 177.213 177.213 176.356 0.857 18990 2883 1 4 . 1 1 464 464 CYS CA C 464 57.776 57.776 60.122 -2.346 18990 2884 1 4 . 1 1 464 464 CYS CB C 464 32.930 32.930 28.045 4.885 18990 2885 1 4 . 1 1 464 464 CYS H H 464 8.752 8.752 8.974 -0.222 18990 2886 1 4 . 1 1 465 465 TRP N N 465 131.209 131.209 126.749 4.460 18990 2887 1 4 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.324 0.103 18990 2888 1 4 . 1 1 465 465 TRP C C 465 176.051 176.051 176.113 -0.062 18990 2889 1 4 . 1 1 465 465 TRP CA C 465 60.763 60.763 60.102 0.661 18990 2890 1 4 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.375 1.751 18990 2891 1 4 . 1 1 465 465 TRP H H 465 9.809 9.809 8.931 0.878 18990 2892 1 4 . 1 1 466 466 VAL N N 466 118.233 118.233 119.573 -1.340 18990 2893 1 4 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.725 -0.101 18990 2894 1 4 . 1 1 466 466 VAL C C 466 178.943 178.943 177.025 1.918 18990 2895 1 4 . 1 1 466 466 VAL CA C 466 65.602 65.602 63.565 2.037 18990 2896 1 4 . 1 1 466 466 VAL CB C 466 33.172 33.172 30.893 2.279 18990 2897 1 4 . 1 1 466 466 VAL H H 466 8.627 8.627 7.812 0.815 18990 2898 1 4 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.705 -1.274 18990 2899 1 4 . 1 1 467 467 CYS CA C 467 56.999 56.999 57.327 -0.328 18990 2900 1 4 . 1 1 467 467 CYS CB C 467 31.870 31.870 28.360 3.510 18990 2901 1 4 . 1 1 467 467 CYS H H 467 7.820 7.820 7.777 0.043 18990 2902 1 4 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.515 -0.479 18990 2903 1 4 . 1 1 468 468 GLN CA C 468 58.051 58.051 56.335 1.716 18990 2904 1 4 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.701 -2.225 18990 2905 1 4 . 1 1 469 469 THR HA H 469 4.685 4.685 4.644 0.041 18990 2906 1 4 . 1 1 469 469 THR C C 469 173.351 173.351 172.655 0.696 18990 2907 1 4 . 1 1 469 469 THR CA C 469 59.176 59.176 60.524 -1.348 18990 2908 1 4 . 1 1 469 469 THR CB C 469 71.775 71.775 69.874 1.901 18990 2909 1 4 . 1 1 470 470 GLU N N 470 120.940 120.940 120.963 -0.023 18990 2910 1 4 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.795 -0.502 18990 2911 1 4 . 1 1 470 470 GLU C C 470 175.539 175.539 176.209 -0.670 18990 2912 1 4 . 1 1 470 470 GLU CA C 470 57.015 57.015 54.956 2.059 18990 2913 1 4 . 1 1 470 470 GLU CB C 470 29.965 29.965 31.835 -1.870 18990 2914 1 4 . 1 1 470 470 GLU H H 470 8.912 8.912 8.478 0.434 18990 2915 1 4 . 1 1 471 471 TRP N N 471 126.998 126.998 121.108 5.890 18990 2916 1 4 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.451 -0.158 18990 2917 1 4 . 1 1 471 471 TRP C C 471 175.408 175.408 175.307 0.101 18990 2918 1 4 . 1 1 471 471 TRP CA C 471 58.220 58.220 56.860 1.360 18990 2919 1 4 . 1 1 471 471 TRP CB C 471 29.500 29.500 28.518 0.982 18990 2920 1 4 . 1 1 471 471 TRP H H 471 8.350 8.350 8.056 0.294 18990 2921 1 4 . 1 1 472 472 THR N N 472 117.480 117.480 117.840 -0.360 18990 2922 1 4 . 1 1 472 472 THR HA H 472 4.444 4.444 4.311 0.133 18990 2923 1 4 . 1 1 472 472 THR CA C 472 58.930 58.930 59.950 -1.020 18990 2924 1 4 . 1 1 472 472 THR H H 472 8.069 8.069 7.458 0.611 18990 2925 1 4 . 1 1 473 473 ARG HA H 473 3.773 3.773 4.134 -0.361 18990 2926 1 4 . 1 1 473 473 ARG C C 473 178.053 178.053 178.000 0.053 18990 2927 1 4 . 1 1 473 473 ARG CA C 473 58.088 58.088 58.390 -0.302 18990 2928 1 4 . 1 1 473 473 ARG CB C 473 29.426 29.426 30.290 -0.863 18990 2929 1 4 . 1 1 474 474 ASP N N 474 119.900 119.900 121.789 -1.889 18990 2930 1 4 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.489 -0.274 18990 2931 1 4 . 1 1 474 474 ASP C C 474 178.197 178.197 176.800 1.397 18990 2932 1 4 . 1 1 474 474 ASP CA C 474 56.802 56.802 57.035 -0.234 18990 2933 1 4 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.950 -0.768 18990 2934 1 4 . 1 1 474 474 ASP H H 474 7.718 7.718 7.828 -0.110 18990 2935 1 4 . 1 1 475 475 CYS N N 475 121.000 121.000 116.503 4.497 18990 2936 1 4 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.726 -1.359 18990 2937 1 4 . 1 1 475 475 CYS CA C 475 64.533 64.533 58.063 6.470 18990 2938 1 4 . 1 1 475 475 CYS CB C 475 29.092 29.092 25.837 3.255 18990 2939 1 4 . 1 1 475 475 CYS H H 475 6.953 6.953 8.385 -1.432 18990 2940 1 4 . 1 1 476 476 MET HA H 476 4.021 4.021 4.085 -0.064 18990 2941 1 4 . 1 1 476 476 MET CA C 476 58.010 58.010 57.641 0.369 18990 2942 1 4 . 1 1 476 476 MET CB C 476 32.550 32.550 32.710 -0.160 18990 2943 1 4 . 1 1 477 477 GLY N N 477 111.938 111.938 104.765 7.173 18990 2944 1 4 . 1 1 477 477 GLY C C 477 174.406 174.406 173.898 0.508 18990 2945 1 4 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.991 0.625 18990 2946 1 4 . 1 1 477 477 GLY H H 477 9.155 9.155 7.776 1.379 18990 2947 1 4 . 1 1 478 478 ALA N N 478 121.900 121.900 124.510 -2.610 18990 2948 1 4 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.266 0.025 18990 2949 1 4 . 1 1 478 478 ALA C C 478 178.196 178.196 177.771 0.425 18990 2950 1 4 . 1 1 478 478 ALA CA C 478 53.440 53.440 54.467 -1.027 18990 2951 1 4 . 1 1 478 478 ALA CB C 478 20.390 20.390 19.284 1.106 18990 2952 1 4 . 1 1 478 478 ALA H H 478 7.347 7.347 8.191 -0.844 18990 2953 1 4 . 1 1 479 479 HIS N N 479 115.200 115.200 111.518 3.682 18990 2954 1 4 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.874 0.029 18990 2955 1 4 . 1 1 479 479 HIS C C 479 173.325 173.325 175.187 -1.862 18990 2956 1 4 . 1 1 479 479 HIS CA C 479 54.526 54.526 54.702 -0.176 18990 2957 1 4 . 1 1 479 479 HIS CB C 479 27.600 27.600 29.815 -2.215 18990 2958 1 4 . 1 1 479 479 HIS H H 479 8.297 8.297 8.006 0.291 18990 2959 1 4 . 1 1 480 480 TRP N N 480 121.780 121.780 123.320 -1.540 18990 2960 1 4 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.348 -0.053 18990 2961 1 4 . 1 1 480 480 TRP C C 480 175.568 175.568 174.488 1.080 18990 2962 1 4 . 1 1 480 480 TRP CA C 480 58.358 58.358 56.942 1.416 18990 2963 1 4 . 1 1 480 480 TRP CB C 480 29.550 29.550 27.085 2.465 18990 2964 1 4 . 1 1 480 480 TRP H H 480 8.081 8.081 7.633 0.448 18990 2965 1 4 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.710 0.135 18990 2966 1 4 . 1 1 481 481 PHE C C 481 175.126 175.126 174.886 0.240 18990 2967 1 4 . 1 1 481 481 PHE CA C 481 56.471 56.471 57.858 -1.387 18990 2968 1 4 . 1 1 481 481 PHE CB C 481 41.006 41.006 40.109 0.897 18990 2969 1 5 . 1 1 343 343 GLU N N 343 121.045 121.045 125.859 -4.814 18990 2970 1 5 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.412 -0.247 18990 2971 1 5 . 1 1 343 343 GLU C C 343 176.529 176.529 174.608 1.921 18990 2972 1 5 . 1 1 343 343 GLU CA C 343 57.162 57.162 56.710 0.452 18990 2973 1 5 . 1 1 343 343 GLU CB C 343 30.204 30.204 30.391 -0.187 18990 2974 1 5 . 1 1 343 343 GLU H H 343 8.293 8.293 8.216 0.077 18990 2975 1 5 . 1 1 344 344 TYR N N 344 121.000 121.000 122.356 -1.356 18990 2976 1 5 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.616 -0.078 18990 2977 1 5 . 1 1 344 344 TYR C C 344 175.897 175.897 175.887 0.010 18990 2978 1 5 . 1 1 344 344 TYR CA C 344 58.179 58.179 58.299 -0.120 18990 2979 1 5 . 1 1 344 344 TYR CB C 344 38.600 38.600 38.455 0.145 18990 2980 1 5 . 1 1 344 344 TYR H H 344 8.040 8.040 8.439 -0.399 18990 2981 1 5 . 1 1 345 345 VAL N N 345 121.900 121.900 126.772 -4.872 18990 2982 1 5 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.373 -0.434 18990 2983 1 5 . 1 1 345 345 VAL C C 345 176.143 176.143 174.927 1.216 18990 2984 1 5 . 1 1 345 345 VAL CA C 345 62.867 62.867 61.676 1.191 18990 2985 1 5 . 1 1 345 345 VAL CB C 345 32.799 32.799 32.697 0.102 18990 2986 1 5 . 1 1 345 345 VAL H H 345 7.856 7.856 8.598 -0.742 18990 2987 1 5 . 1 1 346 346 LEU N N 346 124.950 124.950 129.641 -4.691 18990 2988 1 5 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.641 -0.398 18990 2989 1 5 . 1 1 346 346 LEU C C 346 177.747 177.747 175.956 1.791 18990 2990 1 5 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.232 1.268 18990 2991 1 5 . 1 1 346 346 LEU CB C 346 42.252 42.252 42.041 0.211 18990 2992 1 5 . 1 1 346 346 LEU H H 346 8.127 8.127 8.621 -0.494 18990 2993 1 5 . 1 1 347 347 GLN N N 347 121.452 121.452 124.825 -3.373 18990 2994 1 5 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.460 -0.174 18990 2995 1 5 . 1 1 347 347 GLN C C 347 175.833 175.833 174.849 0.984 18990 2996 1 5 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.552 0.436 18990 2997 1 5 . 1 1 347 347 GLN CB C 347 29.375 29.375 29.302 0.073 18990 2998 1 5 . 1 1 347 347 GLN H H 347 8.270 8.270 8.676 -0.406 18990 2999 1 5 . 1 1 348 348 ALA N N 348 124.466 124.466 127.413 -2.947 18990 3000 1 5 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.819 -0.498 18990 3001 1 5 . 1 1 348 348 ALA C C 348 177.929 177.929 176.292 1.637 18990 3002 1 5 . 1 1 348 348 ALA CA C 348 52.703 52.703 51.341 1.362 18990 3003 1 5 . 1 1 348 348 ALA CB C 348 19.002 19.002 20.559 -1.557 18990 3004 1 5 . 1 1 348 348 ALA H H 348 8.227 8.227 8.651 -0.424 18990 3005 1 5 . 1 1 349 349 GLY N N 349 108.193 108.193 106.694 1.499 18990 3006 1 5 . 1 1 349 349 GLY C C 349 174.269 174.269 173.233 1.036 18990 3007 1 5 . 1 1 349 349 GLY CA C 349 45.227 45.227 44.777 0.450 18990 3008 1 5 . 1 1 349 349 GLY H H 349 8.298 8.298 8.471 -0.173 18990 3009 1 5 . 1 1 350 350 GLY N N 350 108.073 108.073 107.744 0.329 18990 3010 1 5 . 1 1 350 350 GLY C C 350 172.979 172.979 172.435 0.544 18990 3011 1 5 . 1 1 350 350 GLY CA C 350 44.935 44.935 45.173 -0.238 18990 3012 1 5 . 1 1 350 350 GLY H H 350 8.156 8.156 7.984 0.172 18990 3013 1 5 . 1 1 351 351 VAL N N 351 119.058 119.058 117.672 1.386 18990 3014 1 5 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.604 -0.188 18990 3015 1 5 . 1 1 351 351 VAL C C 351 173.412 173.412 173.742 -0.330 18990 3016 1 5 . 1 1 351 351 VAL CA C 351 60.663 60.663 60.523 0.140 18990 3017 1 5 . 1 1 351 351 VAL CB C 351 34.866 34.866 36.452 -1.586 18990 3018 1 5 . 1 1 351 351 VAL H H 351 8.541 8.541 8.802 -0.261 18990 3019 1 5 . 1 1 352 352 LEU N N 352 125.800 125.800 121.562 4.238 18990 3020 1 5 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.698 0.067 18990 3021 1 5 . 1 1 352 352 LEU C C 352 176.218 176.218 175.087 1.131 18990 3022 1 5 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.266 0.075 18990 3023 1 5 . 1 1 352 352 LEU CB C 352 42.706 42.706 45.229 -2.523 18990 3024 1 5 . 1 1 352 352 LEU H H 352 8.151 8.151 8.280 -0.129 18990 3025 1 5 . 1 1 353 353 CYS N N 353 126.825 126.825 123.134 3.691 18990 3026 1 5 . 1 1 353 353 CYS HA H 353 4.107 4.107 3.749 0.358 18990 3027 1 5 . 1 1 353 353 CYS C C 353 176.655 176.655 174.262 2.393 18990 3028 1 5 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.106 0.625 18990 3029 1 5 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.557 4.308 18990 3030 1 5 . 1 1 353 353 CYS H H 353 8.794 8.794 8.644 0.150 18990 3031 1 5 . 1 1 354 354 PRO HA H 354 4.420 4.420 3.958 0.462 18990 3032 1 5 . 1 1 354 354 PRO C C 354 177.512 177.512 175.971 1.541 18990 3033 1 5 . 1 1 354 354 PRO CA C 354 62.992 62.992 62.877 0.115 18990 3034 1 5 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.087 1.480 18990 3035 1 5 . 1 1 355 355 GLN N N 355 126.800 126.800 118.956 7.844 18990 3036 1 5 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.347 -0.072 18990 3037 1 5 . 1 1 355 355 GLN C C 355 175.516 175.516 176.513 -0.997 18990 3038 1 5 . 1 1 355 355 GLN CA C 355 54.793 54.793 54.081 0.712 18990 3039 1 5 . 1 1 355 355 GLN CB C 355 28.547 28.547 29.033 -0.486 18990 3040 1 5 . 1 1 355 355 GLN H H 355 9.033 9.033 6.923 2.110 18990 3041 1 5 . 1 1 357 357 GLY C C 357 173.229 173.229 174.067 -0.838 18990 3042 1 5 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.371 0.883 18990 3043 1 5 . 1 1 358 358 CYS N N 358 123.500 123.500 119.310 4.190 18990 3044 1 5 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.879 -0.346 18990 3045 1 5 . 1 1 358 358 CYS C C 358 176.157 176.157 175.834 0.323 18990 3046 1 5 . 1 1 358 358 CYS CA C 358 60.268 60.268 59.200 1.068 18990 3047 1 5 . 1 1 358 358 CYS CB C 358 29.375 29.375 29.083 0.292 18990 3048 1 5 . 1 1 358 358 CYS H H 358 7.720 7.720 7.924 -0.204 18990 3049 1 5 . 1 1 359 359 GLY N N 359 104.400 104.400 111.018 -6.618 18990 3050 1 5 . 1 1 359 359 GLY C C 359 174.080 174.080 175.317 -1.237 18990 3051 1 5 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.400 -0.336 18990 3052 1 5 . 1 1 359 359 GLY H H 359 7.756 7.756 8.330 -0.574 18990 3053 1 5 . 1 1 360 360 MET N N 360 121.300 121.300 119.311 1.989 18990 3054 1 5 . 1 1 360 360 MET HA H 360 4.343 4.343 4.358 -0.015 18990 3055 1 5 . 1 1 360 360 MET C C 360 175.641 175.641 177.691 -2.050 18990 3056 1 5 . 1 1 360 360 MET CA C 360 55.923 55.923 55.750 0.173 18990 3057 1 5 . 1 1 360 360 MET CB C 360 33.091 33.091 33.112 -0.021 18990 3058 1 5 . 1 1 360 360 MET H H 360 8.229 8.229 7.602 0.627 18990 3059 1 5 . 1 1 361 361 GLY N N 361 109.000 109.000 107.132 1.868 18990 3060 1 5 . 1 1 361 361 GLY C C 361 173.774 173.774 173.178 0.596 18990 3061 1 5 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.307 1.531 18990 3062 1 5 . 1 1 361 361 GLY H H 361 8.347 8.347 7.696 0.651 18990 3063 1 5 . 1 1 362 362 LEU N N 362 126.725 126.725 125.139 1.586 18990 3064 1 5 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.803 -0.128 18990 3065 1 5 . 1 1 362 362 LEU C C 362 175.865 175.865 175.888 -0.023 18990 3066 1 5 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.153 1.037 18990 3067 1 5 . 1 1 362 362 LEU CB C 362 44.050 44.050 43.176 0.874 18990 3068 1 5 . 1 1 362 362 LEU H H 362 8.935 8.935 8.862 0.073 18990 3069 1 5 . 1 1 363 363 LEU N N 363 123.742 123.742 124.399 -0.657 18990 3070 1 5 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.631 0.046 18990 3071 1 5 . 1 1 363 363 LEU C C 363 176.162 176.162 175.701 0.461 18990 3072 1 5 . 1 1 363 363 LEU CA C 363 54.342 54.342 53.291 1.052 18990 3073 1 5 . 1 1 363 363 LEU CB C 363 42.210 42.210 44.492 -2.281 18990 3074 1 5 . 1 1 363 363 LEU H H 363 8.481 8.481 8.625 -0.144 18990 3075 1 5 . 1 1 364 364 VAL N N 364 120.980 120.980 127.485 -6.505 18990 3076 1 5 . 1 1 364 364 VAL HA H 364 4.397 4.397 3.935 0.462 18990 3077 1 5 . 1 1 364 364 VAL C C 364 175.592 175.592 175.538 0.054 18990 3078 1 5 . 1 1 364 364 VAL CA C 364 60.460 60.460 62.429 -1.969 18990 3079 1 5 . 1 1 364 364 VAL CB C 364 34.125 34.125 30.168 3.958 18990 3080 1 5 . 1 1 364 364 VAL H H 364 8.155 8.155 8.237 -0.082 18990 3081 1 5 . 1 1 365 365 GLU N N 365 126.950 126.950 128.472 -1.522 18990 3082 1 5 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.683 -0.073 18990 3083 1 5 . 1 1 365 365 GLU C C 365 175.427 175.427 176.527 -1.100 18990 3084 1 5 . 1 1 365 365 GLU CA C 365 54.551 54.551 53.475 1.075 18990 3085 1 5 . 1 1 365 365 GLU CB C 365 29.780 29.780 30.090 -0.309 18990 3086 1 5 . 1 1 365 365 GLU H H 365 8.900 8.900 7.687 1.213 18990 3087 1 5 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.271 -0.009 18990 3088 1 5 . 1 1 366 366 PRO C C 366 177.013 177.013 176.508 0.505 18990 3089 1 5 . 1 1 366 366 PRO CA C 366 64.463 64.463 64.655 -0.192 18990 3090 1 5 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.812 0.236 18990 3091 1 5 . 1 1 367 367 ASP N N 367 115.459 115.459 115.433 0.026 18990 3092 1 5 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.559 -0.064 18990 3093 1 5 . 1 1 367 367 ASP C C 367 175.123 175.123 175.907 -0.784 18990 3094 1 5 . 1 1 367 367 ASP CA C 367 54.503 54.503 53.085 1.418 18990 3095 1 5 . 1 1 367 367 ASP CB C 367 40.123 40.123 39.870 0.254 18990 3096 1 5 . 1 1 367 367 ASP H H 367 8.439 8.439 8.385 0.054 18990 3097 1 5 . 1 1 368 368 CYS N N 368 118.700 118.700 122.736 -4.036 18990 3098 1 5 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.496 0.074 18990 3099 1 5 . 1 1 368 368 CYS C C 368 173.806 173.806 174.749 -0.943 18990 3100 1 5 . 1 1 368 368 CYS CA C 368 58.581 58.581 57.559 1.022 18990 3101 1 5 . 1 1 368 368 CYS CB C 368 28.450 28.450 26.773 1.677 18990 3102 1 5 . 1 1 368 368 CYS H H 368 7.515 7.515 7.809 -0.294 18990 3103 1 5 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.240 0.025 18990 3104 1 5 . 1 1 369 369 ARG C C 369 174.908 174.908 175.629 -0.721 18990 3105 1 5 . 1 1 369 369 ARG CA C 369 57.669 57.669 57.323 0.346 18990 3106 1 5 . 1 1 369 369 ARG CB C 369 32.274 32.274 30.191 2.083 18990 3107 1 5 . 1 1 370 370 LYS N N 370 121.022 121.022 119.512 1.510 18990 3108 1 5 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.737 -0.567 18990 3109 1 5 . 1 1 370 370 LYS C C 370 174.868 174.868 174.860 0.008 18990 3110 1 5 . 1 1 370 370 LYS CA C 370 56.554 56.554 54.862 1.692 18990 3111 1 5 . 1 1 370 370 LYS CB C 370 33.140 33.140 34.409 -1.269 18990 3112 1 5 . 1 1 370 370 LYS H H 370 7.740 7.740 7.832 -0.092 18990 3113 1 5 . 1 1 371 371 VAL N N 371 128.362 128.362 127.293 1.069 18990 3114 1 5 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.035 0.098 18990 3115 1 5 . 1 1 371 371 VAL C C 371 173.402 173.402 174.760 -1.358 18990 3116 1 5 . 1 1 371 371 VAL CA C 371 60.777 60.777 61.502 -0.725 18990 3117 1 5 . 1 1 371 371 VAL CB C 371 33.000 33.000 32.276 0.724 18990 3118 1 5 . 1 1 371 371 VAL H H 371 8.647 8.647 8.464 0.183 18990 3119 1 5 . 1 1 372 372 THR N N 372 119.667 119.667 124.437 -4.770 18990 3120 1 5 . 1 1 372 372 THR HA H 372 5.032 5.032 4.984 0.048 18990 3121 1 5 . 1 1 372 372 THR C C 372 174.339 174.339 173.573 0.766 18990 3122 1 5 . 1 1 372 372 THR CA C 372 60.881 60.881 61.370 -0.489 18990 3123 1 5 . 1 1 372 372 THR CB C 372 70.471 70.471 71.547 -1.076 18990 3124 1 5 . 1 1 372 372 THR H H 372 8.087 8.087 7.983 0.104 18990 3125 1 5 . 1 1 373 373 CYS N N 373 132.554 132.554 127.805 4.749 18990 3126 1 5 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.523 0.279 18990 3127 1 5 . 1 1 373 373 CYS C C 373 176.791 176.791 175.545 1.246 18990 3128 1 5 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.335 -0.831 18990 3129 1 5 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.951 3.360 18990 3130 1 5 . 1 1 373 373 CYS H H 373 9.322 9.322 9.098 0.224 18990 3131 1 5 . 1 1 374 374 GLN N N 374 125.890 125.890 125.671 0.219 18990 3132 1 5 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.287 -0.287 18990 3133 1 5 . 1 1 374 374 GLN C C 374 176.827 176.827 177.333 -0.506 18990 3134 1 5 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.835 0.465 18990 3135 1 5 . 1 1 374 374 GLN CB C 374 29.664 29.664 29.053 0.611 18990 3136 1 5 . 1 1 374 374 GLN H H 374 7.856 7.856 8.300 -0.444 18990 3137 1 5 . 1 1 375 375 ASN N N 375 115.342 115.342 117.633 -2.291 18990 3138 1 5 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.702 0.185 18990 3139 1 5 . 1 1 375 375 ASN C C 375 174.049 174.049 176.162 -2.113 18990 3140 1 5 . 1 1 375 375 ASN CA C 375 53.047 53.047 54.037 -0.990 18990 3141 1 5 . 1 1 375 375 ASN CB C 375 38.916 38.916 38.801 0.115 18990 3142 1 5 . 1 1 375 375 ASN H H 375 8.913 8.913 8.430 0.483 18990 3143 1 5 . 1 1 376 376 GLY N N 376 109.098 109.098 107.575 1.523 18990 3144 1 5 . 1 1 376 376 GLY C C 376 174.110 174.110 173.953 0.157 18990 3145 1 5 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.305 1.081 18990 3146 1 5 . 1 1 376 376 GLY H H 376 7.162 7.162 8.346 -1.184 18990 3147 1 5 . 1 1 377 377 CYS N N 377 132.546 132.546 116.749 15.797 18990 3148 1 5 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.772 -0.008 18990 3149 1 5 . 1 1 377 377 CYS C C 377 177.355 177.355 174.280 3.075 18990 3150 1 5 . 1 1 377 377 CYS CA C 377 59.988 59.988 57.745 2.243 18990 3151 1 5 . 1 1 377 377 CYS CB C 377 32.365 32.365 29.154 3.211 18990 3152 1 5 . 1 1 377 377 CYS H H 377 9.800 9.800 8.191 1.609 18990 3153 1 5 . 1 1 378 378 GLY N N 378 113.851 113.851 107.823 6.028 18990 3154 1 5 . 1 1 378 378 GLY C C 378 173.404 173.404 172.330 1.074 18990 3155 1 5 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.321 0.542 18990 3156 1 5 . 1 1 378 378 GLY H H 378 8.820 8.820 7.845 0.975 18990 3157 1 5 . 1 1 379 379 TYR N N 379 125.532 125.532 123.801 1.731 18990 3158 1 5 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.797 -0.319 18990 3159 1 5 . 1 1 379 379 TYR C C 379 173.661 173.661 173.910 -0.249 18990 3160 1 5 . 1 1 379 379 TYR CA C 379 59.180 59.180 57.885 1.295 18990 3161 1 5 . 1 1 379 379 TYR CB C 379 40.108 40.108 41.949 -1.841 18990 3162 1 5 . 1 1 379 379 TYR H H 379 9.054 9.054 8.220 0.834 18990 3163 1 5 . 1 1 380 380 VAL N N 380 124.461 124.461 127.271 -2.810 18990 3164 1 5 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.889 -0.071 18990 3165 1 5 . 1 1 380 380 VAL C C 380 175.876 175.876 174.959 0.917 18990 3166 1 5 . 1 1 380 380 VAL CA C 380 60.797 60.797 61.916 -1.119 18990 3167 1 5 . 1 1 380 380 VAL CB C 380 32.610 32.610 32.819 -0.209 18990 3168 1 5 . 1 1 380 380 VAL H H 380 7.238 7.238 8.372 -1.134 18990 3169 1 5 . 1 1 381 381 PHE N N 381 124.588 124.588 123.388 1.200 18990 3170 1 5 . 1 1 381 381 PHE HA H 381 5.273 5.273 5.067 0.206 18990 3171 1 5 . 1 1 381 381 PHE C C 381 173.242 173.242 173.232 0.010 18990 3172 1 5 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.649 -0.439 18990 3173 1 5 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.106 1.984 18990 3174 1 5 . 1 1 381 381 PHE H H 381 9.424 9.424 7.775 1.649 18990 3175 1 5 . 1 1 382 382 CYS N N 382 120.221 120.221 120.056 0.165 18990 3176 1 5 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.576 0.326 18990 3177 1 5 . 1 1 382 382 CYS C C 382 177.165 177.165 175.793 1.372 18990 3178 1 5 . 1 1 382 382 CYS CA C 382 57.691 57.691 57.308 0.383 18990 3179 1 5 . 1 1 382 382 CYS CB C 382 32.475 32.475 30.064 2.411 18990 3180 1 5 . 1 1 382 382 CYS H H 382 8.673 8.673 8.681 -0.008 18990 3181 1 5 . 1 1 383 383 ARG N N 383 129.347 129.347 121.641 7.706 18990 3182 1 5 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.194 -0.173 18990 3183 1 5 . 1 1 383 383 ARG C C 383 175.012 175.012 176.212 -1.200 18990 3184 1 5 . 1 1 383 383 ARG CA C 383 58.686 58.686 57.694 0.992 18990 3185 1 5 . 1 1 383 383 ARG CB C 383 30.900 30.900 30.090 0.810 18990 3186 1 5 . 1 1 383 383 ARG H H 383 9.534 9.534 8.622 0.912 18990 3187 1 5 . 1 1 384 384 ASN N N 384 117.772 117.772 116.513 1.259 18990 3188 1 5 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.804 -0.096 18990 3189 1 5 . 1 1 384 384 ASN C C 384 175.656 175.656 174.744 0.912 18990 3190 1 5 . 1 1 384 384 ASN CA C 384 55.778 55.778 54.194 1.585 18990 3191 1 5 . 1 1 384 384 ASN CB C 384 39.475 39.475 40.968 -1.493 18990 3192 1 5 . 1 1 384 384 ASN H H 384 8.840 8.840 7.894 0.946 18990 3193 1 5 . 1 1 385 385 CYS N N 385 115.876 115.876 114.104 1.772 18990 3194 1 5 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.923 0.105 18990 3195 1 5 . 1 1 385 385 CYS C C 385 175.703 175.703 173.719 1.984 18990 3196 1 5 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.797 1.315 18990 3197 1 5 . 1 1 385 385 CYS CB C 385 32.359 32.359 29.609 2.750 18990 3198 1 5 . 1 1 385 385 CYS H H 385 7.868 7.868 7.968 -0.100 18990 3199 1 5 . 1 1 386 386 LEU N N 386 120.082 120.082 119.256 0.826 18990 3200 1 5 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.706 -0.393 18990 3201 1 5 . 1 1 386 386 LEU C C 386 175.722 175.722 177.033 -1.311 18990 3202 1 5 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.340 2.669 18990 3203 1 5 . 1 1 386 386 LEU CB C 386 38.412 38.412 41.581 -3.170 18990 3204 1 5 . 1 1 386 386 LEU H H 386 8.514 8.514 8.374 0.140 18990 3205 1 5 . 1 1 387 387 GLN N N 387 117.579 117.579 120.452 -2.873 18990 3206 1 5 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.317 0.459 18990 3207 1 5 . 1 1 387 387 GLN C C 387 175.299 175.299 176.827 -1.528 18990 3208 1 5 . 1 1 387 387 GLN CA C 387 54.017 54.017 56.252 -2.235 18990 3209 1 5 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.574 1.733 18990 3210 1 5 . 1 1 387 387 GLN H H 387 8.248 8.248 7.591 0.657 18990 3211 1 5 . 1 1 388 388 GLY N N 388 106.107 106.107 107.923 -1.816 18990 3212 1 5 . 1 1 388 388 GLY C C 388 173.693 173.693 174.139 -0.446 18990 3213 1 5 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.303 0.877 18990 3214 1 5 . 1 1 388 388 GLY H H 388 8.695 8.695 8.463 0.232 18990 3215 1 5 . 1 1 389 389 TYR N N 389 122.514 122.514 117.376 5.138 18990 3216 1 5 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.266 -0.608 18990 3217 1 5 . 1 1 389 389 TYR C C 389 172.860 172.860 174.412 -1.552 18990 3218 1 5 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.283 4.704 18990 3219 1 5 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.196 0.856 18990 3220 1 5 . 1 1 389 389 TYR H H 389 7.923 7.923 8.262 -0.339 18990 3221 1 5 . 1 1 390 390 HIS N N 390 120.080 120.080 122.999 -2.919 18990 3222 1 5 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.627 0.081 18990 3223 1 5 . 1 1 390 390 HIS C C 390 173.235 173.235 173.994 -0.759 18990 3224 1 5 . 1 1 390 390 HIS CA C 390 51.431 51.431 56.065 -4.634 18990 3225 1 5 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.442 0.458 18990 3226 1 5 . 1 1 390 390 HIS H H 390 5.291 5.291 8.875 -3.584 18990 3227 1 5 . 1 1 391 391 ILE N N 391 117.810 117.810 120.077 -2.267 18990 3228 1 5 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.293 -0.177 18990 3229 1 5 . 1 1 391 391 ILE C C 391 178.208 178.208 174.692 3.516 18990 3230 1 5 . 1 1 391 391 ILE CA C 391 60.877 60.877 59.700 1.177 18990 3231 1 5 . 1 1 391 391 ILE CB C 391 39.034 39.034 40.673 -1.639 18990 3232 1 5 . 1 1 391 391 ILE H H 391 8.418 8.418 7.136 1.282 18990 3233 1 5 . 1 1 392 392 GLY N N 392 112.387 112.387 110.513 1.874 18990 3234 1 5 . 1 1 392 392 GLY C C 392 173.565 173.565 173.743 -0.178 18990 3235 1 5 . 1 1 392 392 GLY CA C 392 45.258 45.258 45.166 0.092 18990 3236 1 5 . 1 1 392 392 GLY H H 392 8.654 8.654 8.456 0.198 18990 3237 1 5 . 1 1 393 393 GLU N N 393 119.098 119.098 119.012 0.086 18990 3238 1 5 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.638 -0.349 18990 3239 1 5 . 1 1 393 393 GLU C C 393 176.899 176.899 175.072 1.827 18990 3240 1 5 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.597 0.836 18990 3241 1 5 . 1 1 393 393 GLU CB C 393 30.470 30.470 31.732 -1.262 18990 3242 1 5 . 1 1 393 393 GLU H H 393 8.391 8.391 8.116 0.275 18990 3243 1 5 . 1 1 394 394 CYS N N 394 122.845 122.845 120.992 1.853 18990 3244 1 5 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.851 -1.085 18990 3245 1 5 . 1 1 394 394 CYS C C 394 175.461 175.461 174.113 1.348 18990 3246 1 5 . 1 1 394 394 CYS CA C 394 59.835 59.835 57.481 2.354 18990 3247 1 5 . 1 1 394 394 CYS CB C 394 30.761 30.761 30.219 0.542 18990 3248 1 5 . 1 1 394 394 CYS H H 394 8.474 8.474 8.681 -0.207 18990 3249 1 5 . 1 1 395 395 LEU N N 395 124.403 124.403 123.926 0.477 18990 3250 1 5 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.625 -0.121 18990 3251 1 5 . 1 1 395 395 LEU C C 395 175.259 175.259 176.329 -1.070 18990 3252 1 5 . 1 1 395 395 LEU CA C 395 52.835 52.835 53.909 -1.074 18990 3253 1 5 . 1 1 395 395 LEU CB C 395 41.436 41.436 41.850 -0.414 18990 3254 1 5 . 1 1 395 395 LEU H H 395 8.418 8.418 8.553 -0.135 18990 3255 1 5 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.463 -0.093 18990 3256 1 5 . 1 1 396 396 PRO C C 396 177.006 177.006 176.442 0.564 18990 3257 1 5 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.229 0.867 18990 3258 1 5 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.346 -0.274 18990 3259 1 5 . 1 1 397 397 GLU N N 397 121.574 121.574 119.499 2.075 18990 3260 1 5 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.285 -0.060 18990 3261 1 5 . 1 1 397 397 GLU C C 397 177.202 177.202 176.417 0.785 18990 3262 1 5 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.794 0.240 18990 3263 1 5 . 1 1 397 397 GLU CB C 397 30.263 30.263 28.425 1.838 18990 3264 1 5 . 1 1 397 397 GLU H H 397 8.568 8.568 8.539 0.029 18990 3265 1 5 . 1 1 398 398 GLY N N 398 110.495 110.495 112.916 -2.421 18990 3266 1 5 . 1 1 398 398 GLY C C 398 174.579 174.579 174.882 -0.303 18990 3267 1 5 . 1 1 398 398 GLY CA C 398 45.462 45.462 45.559 -0.097 18990 3268 1 5 . 1 1 398 398 GLY H H 398 8.515 8.515 8.400 0.115 18990 3269 1 5 . 1 1 399 399 THR N N 399 113.234 113.234 117.871 -4.637 18990 3270 1 5 . 1 1 399 399 THR HA H 399 4.398 4.398 4.551 -0.153 18990 3271 1 5 . 1 1 399 399 THR C C 399 175.333 175.333 174.949 0.384 18990 3272 1 5 . 1 1 399 399 THR CA C 399 62.233 62.233 62.580 -0.347 18990 3273 1 5 . 1 1 399 399 THR CB C 399 69.833 69.833 68.143 1.690 18990 3274 1 5 . 1 1 399 399 THR H H 399 8.090 8.090 8.215 -0.125 18990 3275 1 5 . 1 1 400 400 GLY N N 400 111.479 111.479 112.631 -1.152 18990 3276 1 5 . 1 1 400 400 GLY C C 400 174.048 174.048 173.564 0.484 18990 3277 1 5 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.240 0.199 18990 3278 1 5 . 1 1 400 400 GLY H H 400 8.524 8.524 8.280 0.244 18990 3279 1 5 . 1 1 401 401 ALA N N 401 123.919 123.919 123.658 0.261 18990 3280 1 5 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.550 -0.299 18990 3281 1 5 . 1 1 401 401 ALA C C 401 177.942 177.942 177.761 0.181 18990 3282 1 5 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.400 1.330 18990 3283 1 5 . 1 1 401 401 ALA CB C 401 19.142 19.142 19.705 -0.563 18990 3284 1 5 . 1 1 401 401 ALA H H 401 8.179 8.179 7.807 0.372 18990 3285 1 5 . 1 1 402 402 SER N N 402 114.904 114.904 119.020 -4.116 18990 3286 1 5 . 1 1 402 402 SER HA H 402 4.448 4.448 4.492 -0.044 18990 3287 1 5 . 1 1 402 402 SER C C 402 174.426 174.426 174.529 -0.103 18990 3288 1 5 . 1 1 402 402 SER CA C 402 58.289 58.289 58.249 0.040 18990 3289 1 5 . 1 1 402 402 SER CB C 402 63.772 63.772 62.887 0.885 18990 3290 1 5 . 1 1 402 402 SER H H 402 8.305 8.305 8.776 -0.471 18990 3291 1 5 . 1 1 403 403 ALA N N 403 125.965 125.965 129.154 -3.189 18990 3292 1 5 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.342 0.057 18990 3293 1 5 . 1 1 403 403 ALA C C 403 177.984 177.984 177.905 0.079 18990 3294 1 5 . 1 1 403 403 ALA CA C 403 52.655 52.655 53.072 -0.417 18990 3295 1 5 . 1 1 403 403 ALA CB C 403 19.138 19.138 19.505 -0.366 18990 3296 1 5 . 1 1 403 403 ALA H H 403 8.345 8.345 8.429 -0.084 18990 3297 1 5 . 1 1 404 404 THR N N 404 112.790 112.790 115.748 -2.958 18990 3298 1 5 . 1 1 404 404 THR C C 404 174.420 174.420 174.881 -0.461 18990 3299 1 5 . 1 1 404 404 THR CA C 404 61.988 61.988 63.248 -1.260 18990 3300 1 5 . 1 1 404 404 THR CB C 404 69.688 69.688 68.447 1.241 18990 3301 1 5 . 1 1 404 404 THR H H 404 8.118 8.118 7.739 0.379 18990 3302 1 5 . 1 1 405 405 ASN N N 405 121.050 121.050 124.114 -3.064 18990 3303 1 5 . 1 1 405 405 ASN H H 405 8.396 8.396 8.920 -0.524 18990 3304 1 5 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.662 -0.084 18990 3305 1 5 . 1 1 407 407 CYS C C 407 174.489 174.489 173.940 0.549 18990 3306 1 5 . 1 1 407 407 CYS CA C 407 58.713 58.713 56.678 2.035 18990 3307 1 5 . 1 1 407 407 CYS CB C 407 28.102 28.102 30.991 -2.889 18990 3308 1 5 . 1 1 408 408 GLU N N 408 123.021 123.021 121.551 1.470 18990 3309 1 5 . 1 1 408 408 GLU C C 408 175.954 175.954 175.537 0.417 18990 3310 1 5 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.190 0.612 18990 3311 1 5 . 1 1 408 408 GLU CB C 408 30.328 30.328 30.156 0.172 18990 3312 1 5 . 1 1 408 408 GLU H H 408 8.415 8.415 8.402 0.013 18990 3313 1 5 . 1 1 409 409 TYR N N 409 121.015 121.015 118.591 2.424 18990 3314 1 5 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.970 -0.316 18990 3315 1 5 . 1 1 409 409 TYR C C 409 175.613 175.613 175.437 0.176 18990 3316 1 5 . 1 1 409 409 TYR CA C 409 57.669 57.669 57.102 0.567 18990 3317 1 5 . 1 1 409 409 TYR CB C 409 38.825 38.825 39.762 -0.937 18990 3318 1 5 . 1 1 409 409 TYR H H 409 8.135 8.135 8.119 0.016 18990 3319 1 5 . 1 1 410 410 THR N N 410 116.975 116.975 115.634 1.341 18990 3320 1 5 . 1 1 410 410 THR HA H 410 4.306 4.306 4.490 -0.184 18990 3321 1 5 . 1 1 410 410 THR C C 410 173.846 173.846 173.711 0.135 18990 3322 1 5 . 1 1 410 410 THR CA C 410 61.730 61.730 60.581 1.149 18990 3323 1 5 . 1 1 410 410 THR CB C 410 69.914 69.914 69.552 0.362 18990 3324 1 5 . 1 1 410 410 THR H H 410 8.060 8.060 8.302 -0.242 18990 3325 1 5 . 1 1 411 411 VAL N N 411 122.900 122.900 119.650 3.250 18990 3326 1 5 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.626 -0.573 18990 3327 1 5 . 1 1 411 411 VAL C C 411 175.275 175.275 174.513 0.762 18990 3328 1 5 . 1 1 411 411 VAL CA C 411 61.853 61.853 61.526 0.327 18990 3329 1 5 . 1 1 411 411 VAL CB C 411 32.976 32.976 33.466 -0.490 18990 3330 1 5 . 1 1 411 411 VAL H H 411 8.089 8.089 8.598 -0.509 18990 3331 1 5 . 1 1 412 412 ASP N N 412 125.924 125.924 121.590 4.334 18990 3332 1 5 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.862 -0.012 18990 3333 1 5 . 1 1 412 412 ASP CA C 412 51.578 51.578 51.973 -0.395 18990 3334 1 5 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.967 -0.429 18990 3335 1 5 . 1 1 412 412 ASP H H 412 8.397 8.397 8.441 -0.044 18990 3336 1 5 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.398 -0.012 18990 3337 1 5 . 1 1 413 413 PRO C C 413 177.352 177.352 176.013 1.339 18990 3338 1 5 . 1 1 413 413 PRO CA C 413 63.910 63.910 63.264 0.646 18990 3339 1 5 . 1 1 413 413 PRO CB C 413 32.268 32.268 31.878 0.390 18990 3340 1 5 . 1 1 414 414 ASN N N 414 117.035 117.035 124.144 -7.109 18990 3341 1 5 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.602 0.075 18990 3342 1 5 . 1 1 414 414 ASN C C 414 175.532 175.532 175.412 0.120 18990 3343 1 5 . 1 1 414 414 ASN CA C 414 53.824 53.824 52.669 1.155 18990 3344 1 5 . 1 1 414 414 ASN CB C 414 38.728 38.728 39.697 -0.969 18990 3345 1 5 . 1 1 414 414 ASN H H 414 8.496 8.496 8.629 -0.133 18990 3346 1 5 . 1 1 415 415 ARG N N 415 121.000 121.000 119.019 1.981 18990 3347 1 5 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.527 -0.283 18990 3348 1 5 . 1 1 415 415 ARG C C 415 176.243 176.243 175.727 0.516 18990 3349 1 5 . 1 1 415 415 ARG CA C 415 56.404 56.404 55.196 1.208 18990 3350 1 5 . 1 1 415 415 ARG CB C 415 30.637 30.637 30.594 0.043 18990 3351 1 5 . 1 1 415 415 ARG H H 415 7.804 7.804 8.708 -0.904 18990 3352 1 5 . 1 1 416 416 ALA N N 416 124.880 124.880 127.494 -2.614 18990 3353 1 5 . 1 1 416 416 ALA C C 416 177.831 177.831 176.752 1.079 18990 3354 1 5 . 1 1 416 416 ALA CA C 416 52.957 52.957 52.558 0.399 18990 3355 1 5 . 1 1 416 416 ALA CB C 416 19.059 19.059 18.967 0.092 18990 3356 1 5 . 1 1 416 416 ALA H H 416 8.189 8.189 8.709 -0.520 18990 3357 1 5 . 1 1 417 417 ALA N N 417 122.614 122.614 122.182 0.432 18990 3358 1 5 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.166 0.081 18990 3359 1 5 . 1 1 417 417 ALA C C 417 178.024 178.024 176.901 1.123 18990 3360 1 5 . 1 1 417 417 ALA CA C 417 52.789 52.789 52.033 0.756 18990 3361 1 5 . 1 1 417 417 ALA CB C 417 19.042 19.042 18.759 0.283 18990 3362 1 5 . 1 1 417 417 ALA H H 417 8.169 8.169 8.044 0.125 18990 3363 1 5 . 1 1 418 418 GLU N N 418 119.500 119.500 121.067 -1.567 18990 3364 1 5 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.330 -0.141 18990 3365 1 5 . 1 1 418 418 GLU C C 418 176.266 176.266 176.335 -0.069 18990 3366 1 5 . 1 1 418 418 GLU CA C 418 56.576 56.576 56.324 0.252 18990 3367 1 5 . 1 1 418 418 GLU CB C 418 30.307 30.307 30.296 0.011 18990 3368 1 5 . 1 1 418 418 GLU H H 418 8.184 8.184 8.417 -0.233 18990 3369 1 5 . 1 1 419 419 ALA N N 419 124.643 124.643 127.219 -2.576 18990 3370 1 5 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.335 -0.085 18990 3371 1 5 . 1 1 419 419 ALA C C 419 177.488 177.488 175.467 2.021 18990 3372 1 5 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.460 1.049 18990 3373 1 5 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.472 -1.311 18990 3374 1 5 . 1 1 419 419 ALA H H 419 8.135 8.135 8.098 0.037 18990 3375 1 5 . 1 1 420 420 ARG N N 420 120.003 120.003 120.276 -0.273 18990 3376 1 5 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.215 0.078 18990 3377 1 5 . 1 1 420 420 ARG C C 420 176.297 176.297 175.222 1.075 18990 3378 1 5 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.520 0.413 18990 3379 1 5 . 1 1 420 420 ARG CB C 420 30.850 30.850 31.264 -0.413 18990 3380 1 5 . 1 1 420 420 ARG H H 420 8.135 8.135 8.153 -0.018 18990 3381 1 5 . 1 1 421 421 TRP N N 421 122.280 122.280 122.185 0.095 18990 3382 1 5 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.820 -0.157 18990 3383 1 5 . 1 1 421 421 TRP C C 421 175.856 175.856 175.419 0.437 18990 3384 1 5 . 1 1 421 421 TRP CA C 421 57.404 57.404 56.069 1.335 18990 3385 1 5 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.072 -0.635 18990 3386 1 5 . 1 1 421 421 TRP H H 421 8.159 8.159 8.435 -0.277 18990 3387 1 5 . 1 1 422 422 ASP N N 422 121.980 121.980 120.817 1.163 18990 3388 1 5 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.743 -0.248 18990 3389 1 5 . 1 1 422 422 ASP C C 422 176.184 176.184 176.353 -0.169 18990 3390 1 5 . 1 1 422 422 ASP CA C 422 53.899 53.899 54.000 -0.101 18990 3391 1 5 . 1 1 422 422 ASP CB C 422 40.948 40.948 41.240 -0.292 18990 3392 1 5 . 1 1 422 422 ASP H H 422 8.135 8.135 8.086 0.049 18990 3393 1 5 . 1 1 423 423 GLU N N 423 121.990 121.990 123.260 -1.270 18990 3394 1 5 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.295 -0.205 18990 3395 1 5 . 1 1 423 423 GLU C C 423 176.720 176.720 176.154 0.566 18990 3396 1 5 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.432 0.737 18990 3397 1 5 . 1 1 423 423 GLU CB C 423 30.156 30.156 29.369 0.787 18990 3398 1 5 . 1 1 423 423 GLU H H 423 8.153 8.153 8.867 -0.714 18990 3399 1 5 . 1 1 424 424 ALA N N 424 123.900 123.900 123.359 0.541 18990 3400 1 5 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.136 0.144 18990 3401 1 5 . 1 1 424 424 ALA C C 424 178.095 178.095 177.005 1.090 18990 3402 1 5 . 1 1 424 424 ALA CA C 424 53.017 53.017 52.254 0.763 18990 3403 1 5 . 1 1 424 424 ALA CB C 424 19.086 19.086 17.657 1.429 18990 3404 1 5 . 1 1 424 424 ALA H H 424 8.243 8.243 8.255 -0.012 18990 3405 1 5 . 1 1 425 425 SER N N 425 113.881 113.881 114.204 -0.323 18990 3406 1 5 . 1 1 425 425 SER HA H 425 4.387 4.387 4.342 0.045 18990 3407 1 5 . 1 1 425 425 SER C C 425 174.338 174.338 173.990 0.348 18990 3408 1 5 . 1 1 425 425 SER CA C 425 58.546 58.546 57.946 0.600 18990 3409 1 5 . 1 1 425 425 SER CB C 425 63.784 63.784 63.320 0.464 18990 3410 1 5 . 1 1 425 425 SER H H 425 8.063 8.063 8.040 0.023 18990 3411 1 5 . 1 1 426 426 ASN N N 426 121.032 121.032 125.402 -4.370 18990 3412 1 5 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.951 -0.245 18990 3413 1 5 . 1 1 426 426 ASN C C 426 175.046 175.046 174.149 0.897 18990 3414 1 5 . 1 1 426 426 ASN CA C 426 53.445 53.445 52.902 0.543 18990 3415 1 5 . 1 1 426 426 ASN CB C 426 38.847 38.847 39.410 -0.563 18990 3416 1 5 . 1 1 426 426 ASN H H 426 8.391 8.391 8.630 -0.239 18990 3417 1 5 . 1 1 427 427 VAL N N 427 119.463 119.463 123.185 -3.722 18990 3418 1 5 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.553 -0.360 18990 3419 1 5 . 1 1 427 427 VAL C C 427 176.213 176.213 175.219 0.994 18990 3420 1 5 . 1 1 427 427 VAL CA C 427 62.449 62.449 60.446 2.003 18990 3421 1 5 . 1 1 427 427 VAL CB C 427 32.865 32.865 33.895 -1.030 18990 3422 1 5 . 1 1 427 427 VAL H H 427 7.954 7.954 8.351 -0.397 18990 3423 1 5 . 1 1 428 428 THR N N 428 118.226 118.226 117.426 0.800 18990 3424 1 5 . 1 1 428 428 THR HA H 428 4.353 4.353 4.504 -0.151 18990 3425 1 5 . 1 1 428 428 THR C C 428 174.361 174.361 174.834 -0.473 18990 3426 1 5 . 1 1 428 428 THR CA C 428 62.065 62.065 61.354 0.711 18990 3427 1 5 . 1 1 428 428 THR CB C 428 69.729 69.729 69.561 0.168 18990 3428 1 5 . 1 1 428 428 THR H H 428 8.225 8.225 8.198 0.027 18990 3429 1 5 . 1 1 429 429 ILE N N 429 123.910 123.910 127.083 -3.173 18990 3430 1 5 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.097 0.091 18990 3431 1 5 . 1 1 429 429 ILE C C 429 175.774 175.774 175.557 0.217 18990 3432 1 5 . 1 1 429 429 ILE CA C 429 60.819 60.819 61.018 -0.199 18990 3433 1 5 . 1 1 429 429 ILE CB C 429 38.719 38.719 38.448 0.271 18990 3434 1 5 . 1 1 429 429 ILE H H 429 8.148 8.148 8.508 -0.360 18990 3435 1 5 . 1 1 430 430 LYS N N 430 126.453 126.453 128.553 -2.100 18990 3436 1 5 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.498 -0.064 18990 3437 1 5 . 1 1 430 430 LYS C C 430 176.241 176.241 175.773 0.468 18990 3438 1 5 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.658 0.279 18990 3439 1 5 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.966 -0.802 18990 3440 1 5 . 1 1 430 430 LYS H H 430 8.406 8.406 8.469 -0.063 18990 3441 1 5 . 1 1 431 431 VAL N N 431 122.496 122.496 124.999 -2.503 18990 3442 1 5 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.130 0.150 18990 3443 1 5 . 1 1 431 431 VAL CA C 431 62.303 62.303 63.490 -1.187 18990 3444 1 5 . 1 1 431 431 VAL CB C 431 33.132 33.132 32.357 0.775 18990 3445 1 5 . 1 1 431 431 VAL H H 431 8.312 8.312 8.649 -0.337 18990 3446 1 5 . 1 1 432 432 SER HA H 432 4.486 4.486 4.596 -0.110 18990 3447 1 5 . 1 1 432 432 SER C C 432 173.834 173.834 174.367 -0.533 18990 3448 1 5 . 1 1 432 432 SER CA C 432 58.650 58.650 59.085 -0.435 18990 3449 1 5 . 1 1 432 432 SER CB C 432 64.152 64.152 64.037 0.115 18990 3450 1 5 . 1 1 433 433 THR N N 433 114.706 114.706 115.429 -0.723 18990 3451 1 5 . 1 1 433 433 THR HA H 433 5.446 5.446 4.349 1.097 18990 3452 1 5 . 1 1 433 433 THR C C 433 173.979 173.979 174.581 -0.602 18990 3453 1 5 . 1 1 433 433 THR CA C 433 60.412 60.412 61.587 -1.175 18990 3454 1 5 . 1 1 433 433 THR CB C 433 71.896 71.896 69.829 2.067 18990 3455 1 5 . 1 1 433 433 THR H H 433 7.833 7.833 7.686 0.147 18990 3456 1 5 . 1 1 434 434 LYS N N 434 122.492 122.492 121.621 0.871 18990 3457 1 5 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.776 -0.067 18990 3458 1 5 . 1 1 434 434 LYS C C 434 173.589 173.589 174.965 -1.376 18990 3459 1 5 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.927 1.448 18990 3460 1 5 . 1 1 434 434 LYS CB C 434 36.925 36.925 34.168 2.757 18990 3461 1 5 . 1 1 434 434 LYS H H 434 8.937 8.937 8.579 0.358 18990 3462 1 5 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.456 -0.189 18990 3463 1 5 . 1 1 435 435 PRO C C 435 175.238 175.238 176.462 -1.224 18990 3464 1 5 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.446 -1.523 18990 3465 1 5 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.669 -0.583 18990 3466 1 5 . 1 1 436 436 CYS N N 436 125.422 125.422 124.629 0.793 18990 3467 1 5 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.490 -1.060 18990 3468 1 5 . 1 1 436 436 CYS C C 436 176.770 176.770 175.430 1.340 18990 3469 1 5 . 1 1 436 436 CYS CA C 436 57.016 57.016 57.240 -0.224 18990 3470 1 5 . 1 1 436 436 CYS CB C 436 31.698 31.698 28.057 3.641 18990 3471 1 5 . 1 1 436 436 CYS H H 436 7.768 7.768 8.575 -0.807 18990 3472 1 5 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.222 -0.364 18990 3473 1 5 . 1 1 437 437 PRO C C 437 173.608 173.608 176.132 -2.524 18990 3474 1 5 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.254 -0.042 18990 3475 1 5 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.509 0.940 18990 3476 1 5 . 1 1 438 438 LYS N N 438 118.600 118.600 116.670 1.930 18990 3477 1 5 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.212 -0.242 18990 3478 1 5 . 1 1 438 438 LYS C C 438 176.887 176.887 177.403 -0.516 18990 3479 1 5 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.377 0.310 18990 3480 1 5 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.730 -0.606 18990 3481 1 5 . 1 1 438 438 LYS H H 438 8.390 8.390 7.620 0.770 18990 3482 1 5 . 1 1 439 439 CYS N N 439 118.950 118.950 115.956 2.994 18990 3483 1 5 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.821 -0.075 18990 3484 1 5 . 1 1 439 439 CYS C C 439 176.650 176.650 175.444 1.206 18990 3485 1 5 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.608 1.740 18990 3486 1 5 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.266 2.930 18990 3487 1 5 . 1 1 439 439 CYS H H 439 8.357 8.357 7.838 0.519 18990 3488 1 5 . 1 1 440 440 ARG N N 440 117.200 117.200 118.332 -1.132 18990 3489 1 5 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.149 -0.181 18990 3490 1 5 . 1 1 440 440 ARG C C 440 175.253 175.253 175.730 -0.477 18990 3491 1 5 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.944 -0.044 18990 3492 1 5 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.058 -1.017 18990 3493 1 5 . 1 1 440 440 ARG H H 440 8.065 8.065 8.194 -0.129 18990 3494 1 5 . 1 1 441 441 THR N N 441 122.400 122.400 112.514 9.886 18990 3495 1 5 . 1 1 441 441 THR HA H 441 4.371 4.371 4.700 -0.329 18990 3496 1 5 . 1 1 441 441 THR C C 441 173.702 173.702 172.961 0.741 18990 3497 1 5 . 1 1 441 441 THR CA C 441 63.194 63.194 59.154 4.040 18990 3498 1 5 . 1 1 441 441 THR CB C 441 68.933 68.933 69.228 -0.295 18990 3499 1 5 . 1 1 441 441 THR H H 441 8.643 8.643 7.612 1.031 18990 3500 1 5 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.457 -0.310 18990 3501 1 5 . 1 1 442 442 PRO C C 442 176.215 176.215 175.739 0.476 18990 3502 1 5 . 1 1 442 442 PRO CA C 442 64.197 64.197 63.444 0.752 18990 3503 1 5 . 1 1 442 442 PRO CB C 442 32.044 32.044 30.867 1.177 18990 3504 1 5 . 1 1 443 443 THR N N 443 122.932 122.932 122.934 -0.002 18990 3505 1 5 . 1 1 443 443 THR HA H 443 4.665 4.665 4.586 0.079 18990 3506 1 5 . 1 1 443 443 THR C C 443 172.133 172.133 174.528 -2.395 18990 3507 1 5 . 1 1 443 443 THR CA C 443 62.566 62.566 62.110 0.456 18990 3508 1 5 . 1 1 443 443 THR CB C 443 71.562 71.562 70.699 0.863 18990 3509 1 5 . 1 1 443 443 THR H H 443 9.116 9.116 8.446 0.670 18990 3510 1 5 . 1 1 444 444 GLU N N 444 126.390 126.390 125.238 1.152 18990 3511 1 5 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.500 0.442 18990 3512 1 5 . 1 1 444 444 GLU C C 444 175.292 175.292 175.939 -0.647 18990 3513 1 5 . 1 1 444 444 GLU CA C 444 55.049 55.049 55.959 -0.910 18990 3514 1 5 . 1 1 444 444 GLU CB C 444 31.861 31.861 31.143 0.718 18990 3515 1 5 . 1 1 444 444 GLU H H 444 8.720 8.720 8.712 0.008 18990 3516 1 5 . 1 1 445 445 ARG N N 445 123.505 123.505 119.117 4.388 18990 3517 1 5 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.671 -0.960 18990 3518 1 5 . 1 1 445 445 ARG C C 445 175.289 175.289 175.431 -0.142 18990 3519 1 5 . 1 1 445 445 ARG CA C 445 55.856 55.856 54.717 1.139 18990 3520 1 5 . 1 1 445 445 ARG CB C 445 30.675 30.675 33.124 -2.449 18990 3521 1 5 . 1 1 445 445 ARG H H 445 8.157 8.157 8.420 -0.263 18990 3522 1 5 . 1 1 446 446 ASP N N 446 126.800 126.800 121.141 5.659 18990 3523 1 5 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.773 -0.132 18990 3524 1 5 . 1 1 446 446 ASP C C 446 176.020 176.020 176.990 -0.970 18990 3525 1 5 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.558 -0.606 18990 3526 1 5 . 1 1 446 446 ASP CB C 446 41.400 41.400 42.077 -0.677 18990 3527 1 5 . 1 1 446 446 ASP H H 446 8.476 8.476 8.332 0.144 18990 3528 1 5 . 1 1 447 447 GLY N N 447 111.262 111.262 108.857 2.405 18990 3529 1 5 . 1 1 447 447 GLY C C 447 174.073 174.073 175.020 -0.947 18990 3530 1 5 . 1 1 447 447 GLY CA C 447 45.832 45.832 45.957 -0.125 18990 3531 1 5 . 1 1 447 447 GLY H H 447 8.056 8.056 8.590 -0.534 18990 3532 1 5 . 1 1 448 448 GLY N N 448 108.655 108.655 107.134 1.521 18990 3533 1 5 . 1 1 448 448 GLY C C 448 174.020 174.020 172.833 1.187 18990 3534 1 5 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.888 0.379 18990 3535 1 5 . 1 1 448 448 GLY H H 448 8.380 8.380 7.987 0.393 18990 3536 1 5 . 1 1 449 449 CYS N N 449 120.628 120.628 119.236 1.392 18990 3537 1 5 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.557 -0.560 18990 3538 1 5 . 1 1 449 449 CYS C C 449 174.855 174.855 173.812 1.043 18990 3539 1 5 . 1 1 449 449 CYS CA C 449 59.291 59.291 57.188 2.103 18990 3540 1 5 . 1 1 449 449 CYS CB C 449 28.000 28.000 29.583 -1.583 18990 3541 1 5 . 1 1 449 449 CYS H H 449 7.832 7.832 7.698 0.134 18990 3542 1 5 . 1 1 450 450 MET N N 450 123.947 123.947 120.360 3.587 18990 3543 1 5 . 1 1 450 450 MET HA H 450 4.551 4.551 4.182 0.369 18990 3544 1 5 . 1 1 450 450 MET C C 450 174.658 174.658 175.755 -1.097 18990 3545 1 5 . 1 1 450 450 MET CA C 450 54.970 54.970 55.156 -0.185 18990 3546 1 5 . 1 1 450 450 MET CB C 450 34.100 34.100 33.030 1.070 18990 3547 1 5 . 1 1 450 450 MET H H 450 8.916 8.916 8.268 0.648 18990 3548 1 5 . 1 1 451 451 HIS N N 451 120.490 120.490 119.489 1.001 18990 3549 1 5 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.081 -0.402 18990 3550 1 5 . 1 1 451 451 HIS C C 451 172.443 172.443 173.857 -1.414 18990 3551 1 5 . 1 1 451 451 HIS CA C 451 53.812 53.812 55.043 -1.231 18990 3552 1 5 . 1 1 451 451 HIS CB C 451 28.900 28.900 29.761 -0.861 18990 3553 1 5 . 1 1 451 451 HIS H H 451 7.557 7.557 7.780 -0.223 18990 3554 1 5 . 1 1 452 452 MET N N 452 128.800 128.800 126.990 1.810 18990 3555 1 5 . 1 1 452 452 MET HA H 452 4.320 4.320 4.459 -0.139 18990 3556 1 5 . 1 1 452 452 MET C C 452 175.479 175.479 173.999 1.480 18990 3557 1 5 . 1 1 452 452 MET CA C 452 52.589 52.589 53.416 -0.827 18990 3558 1 5 . 1 1 452 452 MET CB C 452 28.074 28.074 32.532 -4.457 18990 3559 1 5 . 1 1 452 452 MET H H 452 9.087 9.087 7.691 1.396 18990 3560 1 5 . 1 1 453 453 VAL N N 453 122.200 122.200 122.351 -0.151 18990 3561 1 5 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.159 0.635 18990 3562 1 5 . 1 1 453 453 VAL C C 453 175.476 175.476 174.953 0.523 18990 3563 1 5 . 1 1 453 453 VAL CA C 453 61.380 61.380 59.966 1.414 18990 3564 1 5 . 1 1 453 453 VAL CB C 453 33.089 33.089 33.891 -0.802 18990 3565 1 5 . 1 1 453 453 VAL H H 453 8.016 8.016 8.320 -0.304 18990 3566 1 5 . 1 1 454 454 CYS N N 454 130.353 130.353 126.446 3.907 18990 3567 1 5 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.670 -0.075 18990 3568 1 5 . 1 1 454 454 CYS C C 454 177.833 177.833 175.067 2.766 18990 3569 1 5 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.682 2.889 18990 3570 1 5 . 1 1 454 454 CYS CB C 454 32.045 32.045 27.810 4.235 18990 3571 1 5 . 1 1 454 454 CYS H H 454 8.989 8.989 8.788 0.201 18990 3572 1 5 . 1 1 455 455 THR N N 455 119.000 119.000 122.293 -3.293 18990 3573 1 5 . 1 1 455 455 THR HA H 455 4.393 4.393 4.424 -0.031 18990 3574 1 5 . 1 1 455 455 THR C C 455 175.264 175.264 173.694 1.570 18990 3575 1 5 . 1 1 455 455 THR CA C 455 61.644 61.644 61.383 0.261 18990 3576 1 5 . 1 1 455 455 THR CB C 455 69.400 69.400 68.316 1.084 18990 3577 1 5 . 1 1 455 455 THR H H 455 8.533 8.533 8.555 -0.022 18990 3578 1 5 . 1 1 456 456 ARG N N 456 128.900 128.900 126.995 1.905 18990 3579 1 5 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.571 -0.346 18990 3580 1 5 . 1 1 456 456 ARG C C 456 177.782 177.782 174.964 2.818 18990 3581 1 5 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.877 2.073 18990 3582 1 5 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.738 -3.688 18990 3583 1 5 . 1 1 456 456 ARG H H 456 9.036 9.036 7.876 1.160 18990 3584 1 5 . 1 1 457 457 ALA N N 457 133.152 133.152 126.914 6.238 18990 3585 1 5 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.250 -0.104 18990 3586 1 5 . 1 1 457 457 ALA C C 457 178.757 178.757 177.720 1.037 18990 3587 1 5 . 1 1 457 457 ALA CA C 457 53.929 53.929 52.969 0.960 18990 3588 1 5 . 1 1 457 457 ALA CB C 457 17.710 17.710 17.855 -0.145 18990 3589 1 5 . 1 1 457 457 ALA H H 457 9.042 9.042 8.783 0.259 18990 3590 1 5 . 1 1 458 458 GLY N N 458 111.200 111.200 111.069 0.131 18990 3591 1 5 . 1 1 458 458 GLY C C 458 173.558 173.558 173.864 -0.306 18990 3592 1 5 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.706 0.730 18990 3593 1 5 . 1 1 458 458 GLY H H 458 8.830 8.830 8.438 0.392 18990 3594 1 5 . 1 1 459 459 CYS N N 459 123.040 123.040 119.457 3.583 18990 3595 1 5 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.979 -0.357 18990 3596 1 5 . 1 1 459 459 CYS C C 459 176.591 176.591 175.533 1.058 18990 3597 1 5 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.168 1.331 18990 3598 1 5 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.227 0.947 18990 3599 1 5 . 1 1 459 459 CYS H H 459 8.042 8.042 8.198 -0.156 18990 3600 1 5 . 1 1 460 460 GLY N N 460 104.500 104.500 110.609 -6.109 18990 3601 1 5 . 1 1 460 460 GLY C C 460 173.716 173.716 173.999 -0.283 18990 3602 1 5 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.559 0.449 18990 3603 1 5 . 1 1 460 460 GLY H H 460 7.705 7.705 8.487 -0.782 18990 3604 1 5 . 1 1 461 461 PHE N N 461 124.949 124.949 122.020 2.929 18990 3605 1 5 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.758 -0.178 18990 3606 1 5 . 1 1 461 461 PHE C C 461 174.447 174.447 173.595 0.852 18990 3607 1 5 . 1 1 461 461 PHE CA C 461 59.946 59.946 56.858 3.088 18990 3608 1 5 . 1 1 461 461 PHE CB C 461 41.300 41.300 41.446 -0.145 18990 3609 1 5 . 1 1 461 461 PHE H H 461 8.947 8.947 7.598 1.349 18990 3610 1 5 . 1 1 462 462 GLU N N 462 125.272 125.272 124.822 0.450 18990 3611 1 5 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.632 1.089 18990 3612 1 5 . 1 1 462 462 GLU C C 462 176.067 176.067 174.251 1.816 18990 3613 1 5 . 1 1 462 462 GLU CA C 462 54.624 54.624 54.414 0.210 18990 3614 1 5 . 1 1 462 462 GLU CB C 462 31.255 31.255 32.772 -1.517 18990 3615 1 5 . 1 1 462 462 GLU H H 462 7.799 7.799 7.643 0.156 18990 3616 1 5 . 1 1 463 463 TRP N N 463 121.524 121.524 116.315 5.209 18990 3617 1 5 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.279 0.227 18990 3618 1 5 . 1 1 463 463 TRP C C 463 172.844 172.844 175.081 -2.237 18990 3619 1 5 . 1 1 463 463 TRP CA C 463 53.771 53.771 55.466 -1.695 18990 3620 1 5 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.666 0.070 18990 3621 1 5 . 1 1 463 463 TRP H H 463 9.300 9.300 8.495 0.805 18990 3622 1 5 . 1 1 464 464 CYS N N 464 120.868 120.868 120.620 0.248 18990 3623 1 5 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.246 1.170 18990 3624 1 5 . 1 1 464 464 CYS C C 464 177.213 177.213 176.197 1.016 18990 3625 1 5 . 1 1 464 464 CYS CA C 464 57.776 57.776 59.638 -1.862 18990 3626 1 5 . 1 1 464 464 CYS CB C 464 32.930 32.930 29.195 3.735 18990 3627 1 5 . 1 1 464 464 CYS H H 464 8.752 8.752 9.265 -0.513 18990 3628 1 5 . 1 1 465 465 TRP N N 465 131.209 131.209 128.290 2.919 18990 3629 1 5 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.550 -0.123 18990 3630 1 5 . 1 1 465 465 TRP C C 465 176.051 176.051 176.133 -0.082 18990 3631 1 5 . 1 1 465 465 TRP CA C 465 60.763 60.763 59.811 0.952 18990 3632 1 5 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.722 1.404 18990 3633 1 5 . 1 1 465 465 TRP H H 465 9.809 9.809 8.391 1.418 18990 3634 1 5 . 1 1 466 466 VAL N N 466 118.233 118.233 116.919 1.314 18990 3635 1 5 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.581 0.043 18990 3636 1 5 . 1 1 466 466 VAL C C 466 178.943 178.943 176.110 2.833 18990 3637 1 5 . 1 1 466 466 VAL CA C 466 65.602 65.602 64.347 1.255 18990 3638 1 5 . 1 1 466 466 VAL CB C 466 33.172 33.172 32.389 0.784 18990 3639 1 5 . 1 1 466 466 VAL H H 466 8.627 8.627 7.735 0.892 18990 3640 1 5 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.806 -1.375 18990 3641 1 5 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.602 0.397 18990 3642 1 5 . 1 1 467 467 CYS CB C 467 31.870 31.870 30.257 1.613 18990 3643 1 5 . 1 1 467 467 CYS H H 467 7.820 7.820 7.649 0.171 18990 3644 1 5 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.378 -0.342 18990 3645 1 5 . 1 1 468 468 GLN CA C 468 58.051 58.051 57.056 0.995 18990 3646 1 5 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.384 -1.908 18990 3647 1 5 . 1 1 469 469 THR HA H 469 4.685 4.685 4.691 -0.006 18990 3648 1 5 . 1 1 469 469 THR C C 469 173.351 173.351 173.332 0.019 18990 3649 1 5 . 1 1 469 469 THR CA C 469 59.176 59.176 60.012 -0.836 18990 3650 1 5 . 1 1 469 469 THR CB C 469 71.775 71.775 70.902 0.873 18990 3651 1 5 . 1 1 470 470 GLU N N 470 120.940 120.940 120.945 -0.005 18990 3652 1 5 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.802 -0.509 18990 3653 1 5 . 1 1 470 470 GLU C C 470 175.539 175.539 175.848 -0.309 18990 3654 1 5 . 1 1 470 470 GLU CA C 470 57.015 57.015 55.424 1.591 18990 3655 1 5 . 1 1 470 470 GLU CB C 470 29.965 29.965 31.413 -1.448 18990 3656 1 5 . 1 1 470 470 GLU H H 470 8.912 8.912 8.543 0.369 18990 3657 1 5 . 1 1 471 471 TRP N N 471 126.998 126.998 124.038 2.960 18990 3658 1 5 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.444 -0.151 18990 3659 1 5 . 1 1 471 471 TRP C C 471 175.408 175.408 175.039 0.369 18990 3660 1 5 . 1 1 471 471 TRP CA C 471 58.220 58.220 58.612 -0.392 18990 3661 1 5 . 1 1 471 471 TRP CB C 471 29.500 29.500 29.545 -0.045 18990 3662 1 5 . 1 1 471 471 TRP H H 471 8.350 8.350 8.295 0.055 18990 3663 1 5 . 1 1 472 472 THR N N 472 117.480 117.480 120.383 -2.903 18990 3664 1 5 . 1 1 472 472 THR HA H 472 4.444 4.444 3.813 0.631 18990 3665 1 5 . 1 1 472 472 THR CA C 472 58.930 58.930 60.153 -1.223 18990 3666 1 5 . 1 1 472 472 THR H H 472 8.069 8.069 6.994 1.075 18990 3667 1 5 . 1 1 473 473 ARG HA H 473 3.773 3.773 3.644 0.129 18990 3668 1 5 . 1 1 473 473 ARG C C 473 178.053 178.053 177.210 0.843 18990 3669 1 5 . 1 1 473 473 ARG CA C 473 58.088 58.088 58.564 -0.476 18990 3670 1 5 . 1 1 473 473 ARG CB C 473 29.426 29.426 30.146 -0.720 18990 3671 1 5 . 1 1 474 474 ASP N N 474 119.900 119.900 119.907 -0.007 18990 3672 1 5 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.331 -0.116 18990 3673 1 5 . 1 1 474 474 ASP C C 474 178.197 178.197 177.469 0.728 18990 3674 1 5 . 1 1 474 474 ASP CA C 474 56.802 56.802 57.199 -0.397 18990 3675 1 5 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.720 -0.538 18990 3676 1 5 . 1 1 474 474 ASP H H 474 7.718 7.718 7.713 0.005 18990 3677 1 5 . 1 1 475 475 CYS N N 475 121.000 121.000 117.415 3.585 18990 3678 1 5 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.533 -1.166 18990 3679 1 5 . 1 1 475 475 CYS CA C 475 64.533 64.533 59.240 5.293 18990 3680 1 5 . 1 1 475 475 CYS CB C 475 29.092 29.092 27.525 1.567 18990 3681 1 5 . 1 1 475 475 CYS H H 475 6.953 6.953 7.521 -0.568 18990 3682 1 5 . 1 1 476 476 MET HA H 476 4.021 4.021 4.030 -0.009 18990 3683 1 5 . 1 1 476 476 MET CA C 476 58.010 58.010 58.764 -0.754 18990 3684 1 5 . 1 1 476 476 MET CB C 476 32.550 32.550 32.580 -0.030 18990 3685 1 5 . 1 1 477 477 GLY N N 477 111.938 111.938 103.574 8.364 18990 3686 1 5 . 1 1 477 477 GLY C C 477 174.406 174.406 173.648 0.758 18990 3687 1 5 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.823 0.793 18990 3688 1 5 . 1 1 477 477 GLY H H 477 9.155 9.155 7.850 1.305 18990 3689 1 5 . 1 1 478 478 ALA N N 478 121.900 121.900 124.889 -2.989 18990 3690 1 5 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.475 -0.184 18990 3691 1 5 . 1 1 478 478 ALA C C 478 178.196 178.196 177.440 0.756 18990 3692 1 5 . 1 1 478 478 ALA CA C 478 53.440 53.440 52.968 0.472 18990 3693 1 5 . 1 1 478 478 ALA CB C 478 20.390 20.390 19.986 0.404 18990 3694 1 5 . 1 1 478 478 ALA H H 478 7.347 7.347 7.982 -0.635 18990 3695 1 5 . 1 1 479 479 HIS N N 479 115.200 115.200 112.091 3.109 18990 3696 1 5 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.900 0.003 18990 3697 1 5 . 1 1 479 479 HIS C C 479 173.325 173.325 174.651 -1.326 18990 3698 1 5 . 1 1 479 479 HIS CA C 479 54.526 54.526 54.941 -0.415 18990 3699 1 5 . 1 1 479 479 HIS CB C 479 27.600 27.600 29.727 -2.127 18990 3700 1 5 . 1 1 479 479 HIS H H 479 8.297 8.297 7.681 0.616 18990 3701 1 5 . 1 1 480 480 TRP N N 480 121.780 121.780 122.473 -0.693 18990 3702 1 5 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.551 -0.256 18990 3703 1 5 . 1 1 480 480 TRP C C 480 175.568 175.568 175.215 0.353 18990 3704 1 5 . 1 1 480 480 TRP CA C 480 58.358 58.358 59.660 -1.302 18990 3705 1 5 . 1 1 480 480 TRP CB C 480 29.550 29.550 30.164 -0.614 18990 3706 1 5 . 1 1 480 480 TRP H H 480 8.081 8.081 7.784 0.297 18990 3707 1 5 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.656 0.189 18990 3708 1 5 . 1 1 481 481 PHE C C 481 175.126 175.126 174.520 0.606 18990 3709 1 5 . 1 1 481 481 PHE CA C 481 56.471 56.471 57.884 -1.413 18990 3710 1 5 . 1 1 481 481 PHE CB C 481 41.006 41.006 39.699 1.307 18990 3711 1 6 . 1 1 343 343 GLU N N 343 121.045 121.045 119.597 1.448 18990 3712 1 6 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.491 -0.326 18990 3713 1 6 . 1 1 343 343 GLU C C 343 176.529 176.529 174.617 1.912 18990 3714 1 6 . 1 1 343 343 GLU CA C 343 57.162 57.162 56.226 0.936 18990 3715 1 6 . 1 1 343 343 GLU CB C 343 30.204 30.204 31.474 -1.270 18990 3716 1 6 . 1 1 343 343 GLU H H 343 8.293 8.293 8.231 0.062 18990 3717 1 6 . 1 1 344 344 TYR N N 344 121.000 121.000 124.769 -3.769 18990 3718 1 6 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.517 0.021 18990 3719 1 6 . 1 1 344 344 TYR C C 344 175.897 175.897 175.130 0.767 18990 3720 1 6 . 1 1 344 344 TYR CA C 344 58.179 58.179 58.200 -0.021 18990 3721 1 6 . 1 1 344 344 TYR CB C 344 38.600 38.600 37.587 1.013 18990 3722 1 6 . 1 1 344 344 TYR H H 344 8.040 8.040 8.825 -0.785 18990 3723 1 6 . 1 1 345 345 VAL N N 345 121.900 121.900 124.201 -2.301 18990 3724 1 6 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.399 -0.460 18990 3725 1 6 . 1 1 345 345 VAL C C 345 176.143 176.143 174.407 1.736 18990 3726 1 6 . 1 1 345 345 VAL CA C 345 62.867 62.867 61.298 1.569 18990 3727 1 6 . 1 1 345 345 VAL CB C 345 32.799 32.799 32.633 0.166 18990 3728 1 6 . 1 1 345 345 VAL H H 345 7.856 7.856 7.869 -0.013 18990 3729 1 6 . 1 1 346 346 LEU N N 346 124.950 124.950 129.575 -4.625 18990 3730 1 6 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.697 -0.454 18990 3731 1 6 . 1 1 346 346 LEU C C 346 177.747 177.747 176.153 1.594 18990 3732 1 6 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.343 1.157 18990 3733 1 6 . 1 1 346 346 LEU CB C 346 42.252 42.252 40.744 1.508 18990 3734 1 6 . 1 1 346 346 LEU H H 346 8.127 8.127 8.660 -0.533 18990 3735 1 6 . 1 1 347 347 GLN N N 347 121.452 121.452 123.430 -1.978 18990 3736 1 6 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.664 -0.378 18990 3737 1 6 . 1 1 347 347 GLN C C 347 175.833 175.833 174.187 1.646 18990 3738 1 6 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.354 0.634 18990 3739 1 6 . 1 1 347 347 GLN CB C 347 29.375 29.375 31.887 -2.512 18990 3740 1 6 . 1 1 347 347 GLN H H 347 8.270 8.270 8.517 -0.247 18990 3741 1 6 . 1 1 348 348 ALA N N 348 124.466 124.466 122.839 1.627 18990 3742 1 6 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.732 -0.411 18990 3743 1 6 . 1 1 348 348 ALA C C 348 177.929 177.929 176.530 1.399 18990 3744 1 6 . 1 1 348 348 ALA CA C 348 52.703 52.703 52.181 0.522 18990 3745 1 6 . 1 1 348 348 ALA CB C 348 19.002 19.002 20.256 -1.254 18990 3746 1 6 . 1 1 348 348 ALA H H 348 8.227 8.227 8.370 -0.143 18990 3747 1 6 . 1 1 349 349 GLY N N 349 108.193 108.193 107.729 0.464 18990 3748 1 6 . 1 1 349 349 GLY C C 349 174.269 174.269 174.714 -0.445 18990 3749 1 6 . 1 1 349 349 GLY CA C 349 45.227 45.227 44.910 0.317 18990 3750 1 6 . 1 1 349 349 GLY H H 349 8.298 8.298 8.737 -0.439 18990 3751 1 6 . 1 1 350 350 GLY N N 350 108.073 108.073 107.108 0.965 18990 3752 1 6 . 1 1 350 350 GLY C C 350 172.979 172.979 172.092 0.887 18990 3753 1 6 . 1 1 350 350 GLY CA C 350 44.935 44.935 45.397 -0.461 18990 3754 1 6 . 1 1 350 350 GLY H H 350 8.156 8.156 7.406 0.750 18990 3755 1 6 . 1 1 351 351 VAL N N 351 119.058 119.058 119.002 0.056 18990 3756 1 6 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.677 -0.261 18990 3757 1 6 . 1 1 351 351 VAL C C 351 173.412 173.412 173.680 -0.268 18990 3758 1 6 . 1 1 351 351 VAL CA C 351 60.663 60.663 59.688 0.975 18990 3759 1 6 . 1 1 351 351 VAL CB C 351 34.866 34.866 35.516 -0.650 18990 3760 1 6 . 1 1 351 351 VAL H H 351 8.541 8.541 8.483 0.058 18990 3761 1 6 . 1 1 352 352 LEU N N 352 125.800 125.800 121.887 3.913 18990 3762 1 6 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.575 0.190 18990 3763 1 6 . 1 1 352 352 LEU C C 352 176.218 176.218 175.254 0.964 18990 3764 1 6 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.371 -0.030 18990 3765 1 6 . 1 1 352 352 LEU CB C 352 42.706 42.706 45.710 -3.004 18990 3766 1 6 . 1 1 352 352 LEU H H 352 8.151 8.151 8.328 -0.177 18990 3767 1 6 . 1 1 353 353 CYS N N 353 126.825 126.825 122.953 3.872 18990 3768 1 6 . 1 1 353 353 CYS HA H 353 4.107 4.107 3.986 0.121 18990 3769 1 6 . 1 1 353 353 CYS C C 353 176.655 176.655 174.337 2.318 18990 3770 1 6 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.475 0.256 18990 3771 1 6 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.215 4.650 18990 3772 1 6 . 1 1 353 353 CYS H H 353 8.794 8.794 8.451 0.343 18990 3773 1 6 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.149 0.271 18990 3774 1 6 . 1 1 354 354 PRO C C 354 177.512 177.512 176.009 1.503 18990 3775 1 6 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.533 -0.541 18990 3776 1 6 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.349 1.218 18990 3777 1 6 . 1 1 355 355 GLN N N 355 126.800 126.800 118.272 8.528 18990 3778 1 6 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.611 -0.336 18990 3779 1 6 . 1 1 355 355 GLN C C 355 175.516 175.516 174.678 0.838 18990 3780 1 6 . 1 1 355 355 GLN CA C 355 54.793 54.793 52.081 2.712 18990 3781 1 6 . 1 1 355 355 GLN CB C 355 28.547 28.547 28.781 -0.234 18990 3782 1 6 . 1 1 355 355 GLN H H 355 9.033 9.033 7.514 1.519 18990 3783 1 6 . 1 1 357 357 GLY C C 357 173.229 173.229 174.084 -0.855 18990 3784 1 6 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.705 0.549 18990 3785 1 6 . 1 1 358 358 CYS N N 358 123.500 123.500 119.467 4.033 18990 3786 1 6 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.501 0.032 18990 3787 1 6 . 1 1 358 358 CYS C C 358 176.157 176.157 175.472 0.685 18990 3788 1 6 . 1 1 358 358 CYS CA C 358 60.268 60.268 59.100 1.168 18990 3789 1 6 . 1 1 358 358 CYS CB C 358 29.375 29.375 29.292 0.083 18990 3790 1 6 . 1 1 358 358 CYS H H 358 7.720 7.720 7.356 0.364 18990 3791 1 6 . 1 1 359 359 GLY N N 359 104.400 104.400 110.439 -6.039 18990 3792 1 6 . 1 1 359 359 GLY C C 359 174.080 174.080 174.904 -0.824 18990 3793 1 6 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.092 -0.028 18990 3794 1 6 . 1 1 359 359 GLY H H 359 7.756 7.756 8.309 -0.553 18990 3795 1 6 . 1 1 360 360 MET N N 360 121.300 121.300 120.412 0.888 18990 3796 1 6 . 1 1 360 360 MET HA H 360 4.343 4.343 4.309 0.034 18990 3797 1 6 . 1 1 360 360 MET C C 360 175.641 175.641 176.717 -1.076 18990 3798 1 6 . 1 1 360 360 MET CA C 360 55.923 55.923 56.960 -1.037 18990 3799 1 6 . 1 1 360 360 MET CB C 360 33.091 33.091 33.900 -0.809 18990 3800 1 6 . 1 1 360 360 MET H H 360 8.229 8.229 7.523 0.706 18990 3801 1 6 . 1 1 361 361 GLY N N 361 109.000 109.000 107.755 1.245 18990 3802 1 6 . 1 1 361 361 GLY C C 361 173.774 173.774 173.098 0.676 18990 3803 1 6 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.486 1.352 18990 3804 1 6 . 1 1 361 361 GLY H H 361 8.347 8.347 7.826 0.521 18990 3805 1 6 . 1 1 362 362 LEU N N 362 126.725 126.725 124.315 2.410 18990 3806 1 6 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.793 -0.118 18990 3807 1 6 . 1 1 362 362 LEU C C 362 175.865 175.865 175.706 0.159 18990 3808 1 6 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.507 0.683 18990 3809 1 6 . 1 1 362 362 LEU CB C 362 44.050 44.050 45.093 -1.042 18990 3810 1 6 . 1 1 362 362 LEU H H 362 8.935 8.935 8.902 0.033 18990 3811 1 6 . 1 1 363 363 LEU N N 363 123.742 123.742 121.326 2.416 18990 3812 1 6 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.608 0.069 18990 3813 1 6 . 1 1 363 363 LEU C C 363 176.162 176.162 175.991 0.171 18990 3814 1 6 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.416 -0.074 18990 3815 1 6 . 1 1 363 363 LEU CB C 363 42.210 42.210 44.318 -2.108 18990 3816 1 6 . 1 1 363 363 LEU H H 363 8.481 8.481 8.561 -0.080 18990 3817 1 6 . 1 1 364 364 VAL N N 364 120.980 120.980 124.139 -3.159 18990 3818 1 6 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.151 0.246 18990 3819 1 6 . 1 1 364 364 VAL C C 364 175.592 175.592 175.227 0.365 18990 3820 1 6 . 1 1 364 364 VAL CA C 364 60.460 60.460 61.136 -0.676 18990 3821 1 6 . 1 1 364 364 VAL CB C 364 34.125 34.125 32.443 1.682 18990 3822 1 6 . 1 1 364 364 VAL H H 364 8.155 8.155 8.267 -0.112 18990 3823 1 6 . 1 1 365 365 GLU N N 365 126.950 126.950 128.042 -1.092 18990 3824 1 6 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.447 0.163 18990 3825 1 6 . 1 1 365 365 GLU C C 365 175.427 175.427 176.208 -0.781 18990 3826 1 6 . 1 1 365 365 GLU CA C 365 54.551 54.551 54.800 -0.249 18990 3827 1 6 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.283 0.497 18990 3828 1 6 . 1 1 365 365 GLU H H 365 8.900 8.900 8.400 0.500 18990 3829 1 6 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.264 -0.002 18990 3830 1 6 . 1 1 366 366 PRO C C 366 177.013 177.013 176.745 0.268 18990 3831 1 6 . 1 1 366 366 PRO CA C 366 64.463 64.463 64.697 -0.234 18990 3832 1 6 . 1 1 366 366 PRO CB C 366 32.048 32.048 32.049 -0.001 18990 3833 1 6 . 1 1 367 367 ASP N N 367 115.459 115.459 115.906 -0.447 18990 3834 1 6 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.695 -0.200 18990 3835 1 6 . 1 1 367 367 ASP C C 367 175.123 175.123 175.244 -0.121 18990 3836 1 6 . 1 1 367 367 ASP CA C 367 54.503 54.503 53.707 0.796 18990 3837 1 6 . 1 1 367 367 ASP CB C 367 40.123 40.123 40.332 -0.209 18990 3838 1 6 . 1 1 367 367 ASP H H 367 8.439 8.439 8.399 0.040 18990 3839 1 6 . 1 1 368 368 CYS N N 368 118.700 118.700 121.364 -2.664 18990 3840 1 6 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.290 0.280 18990 3841 1 6 . 1 1 368 368 CYS C C 368 173.806 173.806 174.744 -0.938 18990 3842 1 6 . 1 1 368 368 CYS CA C 368 58.581 58.581 60.028 -1.447 18990 3843 1 6 . 1 1 368 368 CYS CB C 368 28.450 28.450 27.604 0.846 18990 3844 1 6 . 1 1 368 368 CYS H H 368 7.515 7.515 7.736 -0.221 18990 3845 1 6 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.755 -0.490 18990 3846 1 6 . 1 1 369 369 ARG C C 369 174.908 174.908 175.170 -0.262 18990 3847 1 6 . 1 1 369 369 ARG CA C 369 57.669 57.669 55.963 1.706 18990 3848 1 6 . 1 1 369 369 ARG CB C 369 32.274 32.274 31.473 0.801 18990 3849 1 6 . 1 1 370 370 LYS N N 370 121.022 121.022 120.289 0.733 18990 3850 1 6 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.628 -0.458 18990 3851 1 6 . 1 1 370 370 LYS C C 370 174.868 174.868 174.483 0.385 18990 3852 1 6 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.445 1.109 18990 3853 1 6 . 1 1 370 370 LYS CB C 370 33.140 33.140 33.301 -0.161 18990 3854 1 6 . 1 1 370 370 LYS H H 370 7.740 7.740 7.748 -0.008 18990 3855 1 6 . 1 1 371 371 VAL N N 371 128.362 128.362 124.764 3.598 18990 3856 1 6 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.159 -0.026 18990 3857 1 6 . 1 1 371 371 VAL C C 371 173.402 173.402 174.056 -0.654 18990 3858 1 6 . 1 1 371 371 VAL CA C 371 60.777 60.777 60.571 0.206 18990 3859 1 6 . 1 1 371 371 VAL CB C 371 33.000 33.000 32.686 0.314 18990 3860 1 6 . 1 1 371 371 VAL H H 371 8.647 8.647 8.633 0.014 18990 3861 1 6 . 1 1 372 372 THR N N 372 119.667 119.667 122.060 -2.393 18990 3862 1 6 . 1 1 372 372 THR HA H 372 5.032 5.032 4.993 0.039 18990 3863 1 6 . 1 1 372 372 THR C C 372 174.339 174.339 174.527 -0.188 18990 3864 1 6 . 1 1 372 372 THR CA C 372 60.881 60.881 61.503 -0.622 18990 3865 1 6 . 1 1 372 372 THR CB C 372 70.471 70.471 71.820 -1.349 18990 3866 1 6 . 1 1 372 372 THR H H 372 8.087 8.087 8.221 -0.134 18990 3867 1 6 . 1 1 373 373 CYS N N 373 132.554 132.554 127.851 4.703 18990 3868 1 6 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.881 -0.079 18990 3869 1 6 . 1 1 373 373 CYS C C 373 176.791 176.791 176.164 0.627 18990 3870 1 6 . 1 1 373 373 CYS CA C 373 58.504 58.504 57.386 1.118 18990 3871 1 6 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.713 3.598 18990 3872 1 6 . 1 1 373 373 CYS H H 373 9.322 9.322 9.170 0.152 18990 3873 1 6 . 1 1 374 374 GLN N N 374 125.890 125.890 122.792 3.098 18990 3874 1 6 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.197 -0.197 18990 3875 1 6 . 1 1 374 374 GLN C C 374 176.827 176.827 176.386 0.441 18990 3876 1 6 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.808 0.492 18990 3877 1 6 . 1 1 374 374 GLN CB C 374 29.664 29.664 27.981 1.683 18990 3878 1 6 . 1 1 374 374 GLN H H 374 7.856 7.856 8.562 -0.706 18990 3879 1 6 . 1 1 375 375 ASN N N 375 115.342 115.342 115.514 -0.172 18990 3880 1 6 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.785 0.102 18990 3881 1 6 . 1 1 375 375 ASN C C 375 174.049 174.049 175.632 -1.583 18990 3882 1 6 . 1 1 375 375 ASN CA C 375 53.047 53.047 52.792 0.255 18990 3883 1 6 . 1 1 375 375 ASN CB C 375 38.916 38.916 38.774 0.142 18990 3884 1 6 . 1 1 375 375 ASN H H 375 8.913 8.913 8.287 0.626 18990 3885 1 6 . 1 1 376 376 GLY N N 376 109.098 109.098 107.974 1.124 18990 3886 1 6 . 1 1 376 376 GLY C C 376 174.110 174.110 173.929 0.181 18990 3887 1 6 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.657 0.729 18990 3888 1 6 . 1 1 376 376 GLY H H 376 7.162 7.162 8.384 -1.222 18990 3889 1 6 . 1 1 377 377 CYS N N 377 132.546 132.546 120.018 12.528 18990 3890 1 6 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.947 -0.183 18990 3891 1 6 . 1 1 377 377 CYS C C 377 177.355 177.355 174.039 3.316 18990 3892 1 6 . 1 1 377 377 CYS CA C 377 59.988 59.988 57.641 2.347 18990 3893 1 6 . 1 1 377 377 CYS CB C 377 32.365 32.365 29.480 2.885 18990 3894 1 6 . 1 1 377 377 CYS H H 377 9.800 9.800 8.040 1.760 18990 3895 1 6 . 1 1 378 378 GLY N N 378 113.851 113.851 107.304 6.547 18990 3896 1 6 . 1 1 378 378 GLY C C 378 173.404 173.404 172.663 0.741 18990 3897 1 6 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.702 0.161 18990 3898 1 6 . 1 1 378 378 GLY H H 378 8.820 8.820 8.293 0.527 18990 3899 1 6 . 1 1 379 379 TYR N N 379 125.532 125.532 123.950 1.582 18990 3900 1 6 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.818 -0.340 18990 3901 1 6 . 1 1 379 379 TYR C C 379 173.661 173.661 173.814 -0.153 18990 3902 1 6 . 1 1 379 379 TYR CA C 379 59.180 59.180 57.686 1.494 18990 3903 1 6 . 1 1 379 379 TYR CB C 379 40.108 40.108 41.684 -1.576 18990 3904 1 6 . 1 1 379 379 TYR H H 379 9.054 9.054 8.234 0.820 18990 3905 1 6 . 1 1 380 380 VAL N N 380 124.461 124.461 122.735 1.726 18990 3906 1 6 . 1 1 380 380 VAL HA H 380 4.818 4.818 5.029 -0.211 18990 3907 1 6 . 1 1 380 380 VAL C C 380 175.876 175.876 174.470 1.406 18990 3908 1 6 . 1 1 380 380 VAL CA C 380 60.797 60.797 60.867 -0.070 18990 3909 1 6 . 1 1 380 380 VAL CB C 380 32.610 32.610 32.463 0.147 18990 3910 1 6 . 1 1 380 380 VAL H H 380 7.238 7.238 7.759 -0.521 18990 3911 1 6 . 1 1 381 381 PHE N N 381 124.588 124.588 122.616 1.972 18990 3912 1 6 . 1 1 381 381 PHE HA H 381 5.273 5.273 5.068 0.205 18990 3913 1 6 . 1 1 381 381 PHE C C 381 173.242 173.242 173.602 -0.360 18990 3914 1 6 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.423 -0.213 18990 3915 1 6 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.161 1.929 18990 3916 1 6 . 1 1 381 381 PHE H H 381 9.424 9.424 7.573 1.851 18990 3917 1 6 . 1 1 382 382 CYS N N 382 120.221 120.221 120.134 0.087 18990 3918 1 6 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.101 0.801 18990 3919 1 6 . 1 1 382 382 CYS C C 382 177.165 177.165 175.769 1.396 18990 3920 1 6 . 1 1 382 382 CYS CA C 382 57.691 57.691 58.295 -0.604 18990 3921 1 6 . 1 1 382 382 CYS CB C 382 32.475 32.475 29.762 2.713 18990 3922 1 6 . 1 1 382 382 CYS H H 382 8.673 8.673 8.616 0.057 18990 3923 1 6 . 1 1 383 383 ARG N N 383 129.347 129.347 120.322 9.025 18990 3924 1 6 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.111 -0.090 18990 3925 1 6 . 1 1 383 383 ARG C C 383 175.012 175.012 175.854 -0.842 18990 3926 1 6 . 1 1 383 383 ARG CA C 383 58.686 58.686 57.594 1.092 18990 3927 1 6 . 1 1 383 383 ARG CB C 383 30.900 30.900 29.659 1.241 18990 3928 1 6 . 1 1 383 383 ARG H H 383 9.534 9.534 8.180 1.354 18990 3929 1 6 . 1 1 384 384 ASN N N 384 117.772 117.772 117.773 -0.001 18990 3930 1 6 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.818 -0.110 18990 3931 1 6 . 1 1 384 384 ASN C C 384 175.656 175.656 175.041 0.615 18990 3932 1 6 . 1 1 384 384 ASN CA C 384 55.778 55.778 54.054 1.724 18990 3933 1 6 . 1 1 384 384 ASN CB C 384 39.475 39.475 40.484 -1.010 18990 3934 1 6 . 1 1 384 384 ASN H H 384 8.840 8.840 7.674 1.166 18990 3935 1 6 . 1 1 385 385 CYS N N 385 115.876 115.876 114.612 1.264 18990 3936 1 6 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.827 0.201 18990 3937 1 6 . 1 1 385 385 CYS C C 385 175.703 175.703 173.780 1.923 18990 3938 1 6 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.633 1.479 18990 3939 1 6 . 1 1 385 385 CYS CB C 385 32.359 32.359 29.345 3.014 18990 3940 1 6 . 1 1 385 385 CYS H H 385 7.868 7.868 7.928 -0.060 18990 3941 1 6 . 1 1 386 386 LEU N N 386 120.082 120.082 118.855 1.227 18990 3942 1 6 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.656 -0.343 18990 3943 1 6 . 1 1 386 386 LEU C C 386 175.722 175.722 176.835 -1.113 18990 3944 1 6 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.396 2.613 18990 3945 1 6 . 1 1 386 386 LEU CB C 386 38.412 38.412 42.186 -3.774 18990 3946 1 6 . 1 1 386 386 LEU H H 386 8.514 8.514 8.284 0.230 18990 3947 1 6 . 1 1 387 387 GLN N N 387 117.579 117.579 120.174 -2.595 18990 3948 1 6 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.449 0.327 18990 3949 1 6 . 1 1 387 387 GLN C C 387 175.299 175.299 176.854 -1.555 18990 3950 1 6 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.709 -1.692 18990 3951 1 6 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.587 1.720 18990 3952 1 6 . 1 1 387 387 GLN H H 387 8.248 8.248 7.564 0.684 18990 3953 1 6 . 1 1 388 388 GLY N N 388 106.107 106.107 107.904 -1.797 18990 3954 1 6 . 1 1 388 388 GLY C C 388 173.693 173.693 174.037 -0.344 18990 3955 1 6 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.410 0.770 18990 3956 1 6 . 1 1 388 388 GLY H H 388 8.695 8.695 8.374 0.321 18990 3957 1 6 . 1 1 389 389 TYR N N 389 122.514 122.514 117.373 5.141 18990 3958 1 6 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.154 -0.496 18990 3959 1 6 . 1 1 389 389 TYR C C 389 172.860 172.860 174.126 -1.266 18990 3960 1 6 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.542 4.445 18990 3961 1 6 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.382 0.670 18990 3962 1 6 . 1 1 389 389 TYR H H 389 7.923 7.923 8.201 -0.278 18990 3963 1 6 . 1 1 390 390 HIS N N 390 120.080 120.080 125.283 -5.203 18990 3964 1 6 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.899 -0.191 18990 3965 1 6 . 1 1 390 390 HIS C C 390 173.235 173.235 173.744 -0.509 18990 3966 1 6 . 1 1 390 390 HIS CA C 390 51.431 51.431 53.867 -2.436 18990 3967 1 6 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.834 0.066 18990 3968 1 6 . 1 1 390 390 HIS H H 390 5.291 5.291 8.040 -2.749 18990 3969 1 6 . 1 1 391 391 ILE N N 391 117.810 117.810 122.090 -4.280 18990 3970 1 6 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.238 -0.122 18990 3971 1 6 . 1 1 391 391 ILE C C 391 178.208 178.208 175.752 2.456 18990 3972 1 6 . 1 1 391 391 ILE CA C 391 60.877 60.877 61.943 -1.066 18990 3973 1 6 . 1 1 391 391 ILE CB C 391 39.034 39.034 38.554 0.480 18990 3974 1 6 . 1 1 391 391 ILE H H 391 8.418 8.418 8.324 0.094 18990 3975 1 6 . 1 1 392 392 GLY N N 392 112.387 112.387 113.624 -1.237 18990 3976 1 6 . 1 1 392 392 GLY C C 392 173.565 173.565 173.091 0.474 18990 3977 1 6 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.290 0.968 18990 3978 1 6 . 1 1 392 392 GLY H H 392 8.654 8.654 8.115 0.539 18990 3979 1 6 . 1 1 393 393 GLU N N 393 119.098 119.098 120.974 -1.876 18990 3980 1 6 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.576 -0.287 18990 3981 1 6 . 1 1 393 393 GLU C C 393 176.899 176.899 176.409 0.490 18990 3982 1 6 . 1 1 393 393 GLU CA C 393 56.433 56.433 56.022 0.411 18990 3983 1 6 . 1 1 393 393 GLU CB C 393 30.470 30.470 30.378 0.092 18990 3984 1 6 . 1 1 393 393 GLU H H 393 8.391 8.391 8.418 -0.027 18990 3985 1 6 . 1 1 394 394 CYS N N 394 122.845 122.845 122.087 0.758 18990 3986 1 6 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.679 -0.913 18990 3987 1 6 . 1 1 394 394 CYS C C 394 175.461 175.461 174.680 0.781 18990 3988 1 6 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.887 0.948 18990 3989 1 6 . 1 1 394 394 CYS CB C 394 30.761 30.761 27.815 2.946 18990 3990 1 6 . 1 1 394 394 CYS H H 394 8.474 8.474 8.575 -0.101 18990 3991 1 6 . 1 1 395 395 LEU N N 395 124.403 124.403 121.428 2.975 18990 3992 1 6 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.958 -0.454 18990 3993 1 6 . 1 1 395 395 LEU C C 395 175.259 175.259 174.780 0.479 18990 3994 1 6 . 1 1 395 395 LEU CA C 395 52.835 52.835 52.887 -0.052 18990 3995 1 6 . 1 1 395 395 LEU CB C 395 41.436 41.436 43.319 -1.883 18990 3996 1 6 . 1 1 395 395 LEU H H 395 8.418 8.418 8.148 0.270 18990 3997 1 6 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.671 -0.301 18990 3998 1 6 . 1 1 396 396 PRO C C 396 177.006 177.006 176.424 0.582 18990 3999 1 6 . 1 1 396 396 PRO CA C 396 63.096 63.096 61.978 1.118 18990 4000 1 6 . 1 1 396 396 PRO CB C 396 32.072 32.072 33.394 -1.322 18990 4001 1 6 . 1 1 397 397 GLU N N 397 121.574 121.574 119.522 2.052 18990 4002 1 6 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.147 0.078 18990 4003 1 6 . 1 1 397 397 GLU C C 397 177.202 177.202 176.434 0.768 18990 4004 1 6 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.184 0.850 18990 4005 1 6 . 1 1 397 397 GLU CB C 397 30.263 30.263 28.724 1.539 18990 4006 1 6 . 1 1 397 397 GLU H H 397 8.568 8.568 8.395 0.173 18990 4007 1 6 . 1 1 398 398 GLY N N 398 110.495 110.495 116.179 -5.684 18990 4008 1 6 . 1 1 398 398 GLY C C 398 174.579 174.579 174.025 0.554 18990 4009 1 6 . 1 1 398 398 GLY CA C 398 45.462 45.462 44.630 0.832 18990 4010 1 6 . 1 1 398 398 GLY H H 398 8.515 8.515 7.846 0.669 18990 4011 1 6 . 1 1 399 399 THR N N 399 113.234 113.234 115.581 -2.347 18990 4012 1 6 . 1 1 399 399 THR HA H 399 4.398 4.398 4.408 -0.010 18990 4013 1 6 . 1 1 399 399 THR C C 399 175.333 175.333 174.635 0.698 18990 4014 1 6 . 1 1 399 399 THR CA C 399 62.233 62.233 62.085 0.148 18990 4015 1 6 . 1 1 399 399 THR CB C 399 69.833 69.833 69.642 0.191 18990 4016 1 6 . 1 1 399 399 THR H H 399 8.090 8.090 7.587 0.503 18990 4017 1 6 . 1 1 400 400 GLY N N 400 111.479 111.479 109.618 1.861 18990 4018 1 6 . 1 1 400 400 GLY C C 400 174.048 174.048 172.712 1.336 18990 4019 1 6 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.518 -0.079 18990 4020 1 6 . 1 1 400 400 GLY H H 400 8.524 8.524 8.347 0.177 18990 4021 1 6 . 1 1 401 401 ALA N N 401 123.919 123.919 125.184 -1.265 18990 4022 1 6 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.488 -0.237 18990 4023 1 6 . 1 1 401 401 ALA C C 401 177.942 177.942 176.342 1.600 18990 4024 1 6 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.986 0.744 18990 4025 1 6 . 1 1 401 401 ALA CB C 401 19.142 19.142 19.804 -0.662 18990 4026 1 6 . 1 1 401 401 ALA H H 401 8.179 8.179 8.158 0.021 18990 4027 1 6 . 1 1 402 402 SER N N 402 114.904 114.904 115.171 -0.267 18990 4028 1 6 . 1 1 402 402 SER HA H 402 4.448 4.448 4.339 0.109 18990 4029 1 6 . 1 1 402 402 SER C C 402 174.426 174.426 172.936 1.490 18990 4030 1 6 . 1 1 402 402 SER CA C 402 58.289 58.289 58.636 -0.346 18990 4031 1 6 . 1 1 402 402 SER CB C 402 63.772 63.772 63.250 0.522 18990 4032 1 6 . 1 1 402 402 SER H H 402 8.305 8.305 8.274 0.031 18990 4033 1 6 . 1 1 403 403 ALA N N 403 125.965 125.965 128.145 -2.180 18990 4034 1 6 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.485 -0.086 18990 4035 1 6 . 1 1 403 403 ALA C C 403 177.984 177.984 175.961 2.023 18990 4036 1 6 . 1 1 403 403 ALA CA C 403 52.655 52.655 51.664 0.991 18990 4037 1 6 . 1 1 403 403 ALA CB C 403 19.138 19.138 20.660 -1.522 18990 4038 1 6 . 1 1 403 403 ALA H H 403 8.345 8.345 8.135 0.210 18990 4039 1 6 . 1 1 404 404 THR N N 404 112.790 112.790 114.952 -2.162 18990 4040 1 6 . 1 1 404 404 THR C C 404 174.420 174.420 173.839 0.581 18990 4041 1 6 . 1 1 404 404 THR CA C 404 61.988 61.988 61.814 0.174 18990 4042 1 6 . 1 1 404 404 THR CB C 404 69.688 69.688 69.559 0.129 18990 4043 1 6 . 1 1 404 404 THR H H 404 8.118 8.118 8.173 -0.055 18990 4044 1 6 . 1 1 405 405 ASN N N 405 121.050 121.050 121.312 -0.262 18990 4045 1 6 . 1 1 405 405 ASN H H 405 8.396 8.396 8.617 -0.221 18990 4046 1 6 . 1 1 407 407 CYS HA H 407 4.578 4.578 5.229 -0.651 18990 4047 1 6 . 1 1 407 407 CYS C C 407 174.489 174.489 173.082 1.407 18990 4048 1 6 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.548 0.165 18990 4049 1 6 . 1 1 407 407 CYS CB C 407 28.102 28.102 30.575 -2.473 18990 4050 1 6 . 1 1 408 408 GLU N N 408 123.021 123.021 121.164 1.857 18990 4051 1 6 . 1 1 408 408 GLU C C 408 175.954 175.954 174.576 1.378 18990 4052 1 6 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.026 0.776 18990 4053 1 6 . 1 1 408 408 GLU CB C 408 30.328 30.328 32.195 -1.867 18990 4054 1 6 . 1 1 408 408 GLU H H 408 8.415 8.415 9.113 -0.698 18990 4055 1 6 . 1 1 409 409 TYR N N 409 121.015 121.015 118.604 2.411 18990 4056 1 6 . 1 1 409 409 TYR HA H 409 4.654 4.654 5.345 -0.691 18990 4057 1 6 . 1 1 409 409 TYR C C 409 175.613 175.613 174.089 1.524 18990 4058 1 6 . 1 1 409 409 TYR CA C 409 57.669 57.669 56.959 0.710 18990 4059 1 6 . 1 1 409 409 TYR CB C 409 38.825 38.825 40.952 -2.127 18990 4060 1 6 . 1 1 409 409 TYR H H 409 8.135 8.135 8.790 -0.655 18990 4061 1 6 . 1 1 410 410 THR N N 410 116.975 116.975 116.649 0.326 18990 4062 1 6 . 1 1 410 410 THR HA H 410 4.306 4.306 4.387 -0.081 18990 4063 1 6 . 1 1 410 410 THR C C 410 173.846 173.846 172.865 0.981 18990 4064 1 6 . 1 1 410 410 THR CA C 410 61.730 61.730 61.806 -0.076 18990 4065 1 6 . 1 1 410 410 THR CB C 410 69.914 69.914 70.003 -0.089 18990 4066 1 6 . 1 1 410 410 THR H H 410 8.060 8.060 8.262 -0.202 18990 4067 1 6 . 1 1 411 411 VAL N N 411 122.900 122.900 120.912 1.988 18990 4068 1 6 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.634 -0.581 18990 4069 1 6 . 1 1 411 411 VAL C C 411 175.275 175.275 174.845 0.430 18990 4070 1 6 . 1 1 411 411 VAL CA C 411 61.853 61.853 61.363 0.490 18990 4071 1 6 . 1 1 411 411 VAL CB C 411 32.976 32.976 33.179 -0.203 18990 4072 1 6 . 1 1 411 411 VAL H H 411 8.089 8.089 8.149 -0.060 18990 4073 1 6 . 1 1 412 412 ASP N N 412 125.924 125.924 125.626 0.298 18990 4074 1 6 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.927 -0.077 18990 4075 1 6 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.249 -0.671 18990 4076 1 6 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.545 -0.007 18990 4077 1 6 . 1 1 412 412 ASP H H 412 8.397 8.397 8.588 -0.192 18990 4078 1 6 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.605 -0.219 18990 4079 1 6 . 1 1 413 413 PRO C C 413 177.352 177.352 175.847 1.505 18990 4080 1 6 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.753 1.157 18990 4081 1 6 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.500 -0.232 18990 4082 1 6 . 1 1 414 414 ASN N N 414 117.035 117.035 118.793 -1.758 18990 4083 1 6 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.695 -0.018 18990 4084 1 6 . 1 1 414 414 ASN C C 414 175.532 175.532 175.081 0.451 18990 4085 1 6 . 1 1 414 414 ASN CA C 414 53.824 53.824 52.915 0.909 18990 4086 1 6 . 1 1 414 414 ASN CB C 414 38.728 38.728 39.326 -0.598 18990 4087 1 6 . 1 1 414 414 ASN H H 414 8.496 8.496 8.476 0.020 18990 4088 1 6 . 1 1 415 415 ARG N N 415 121.000 121.000 120.937 0.063 18990 4089 1 6 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.775 -0.531 18990 4090 1 6 . 1 1 415 415 ARG C C 415 176.243 176.243 174.813 1.430 18990 4091 1 6 . 1 1 415 415 ARG CA C 415 56.404 56.404 55.192 1.212 18990 4092 1 6 . 1 1 415 415 ARG CB C 415 30.637 30.637 31.544 -0.907 18990 4093 1 6 . 1 1 415 415 ARG H H 415 7.804 7.804 8.713 -0.909 18990 4094 1 6 . 1 1 416 416 ALA N N 416 124.880 124.880 123.203 1.677 18990 4095 1 6 . 1 1 416 416 ALA C C 416 177.831 177.831 175.820 2.011 18990 4096 1 6 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.816 1.141 18990 4097 1 6 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.227 -1.168 18990 4098 1 6 . 1 1 416 416 ALA H H 416 8.189 8.189 8.308 -0.119 18990 4099 1 6 . 1 1 417 417 ALA N N 417 122.614 122.614 125.890 -3.276 18990 4100 1 6 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.884 -0.637 18990 4101 1 6 . 1 1 417 417 ALA C C 417 178.024 178.024 176.049 1.975 18990 4102 1 6 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.958 0.831 18990 4103 1 6 . 1 1 417 417 ALA CB C 417 19.042 19.042 20.469 -1.427 18990 4104 1 6 . 1 1 417 417 ALA H H 417 8.169 8.169 8.379 -0.210 18990 4105 1 6 . 1 1 418 418 GLU N N 418 119.500 119.500 120.713 -1.213 18990 4106 1 6 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.696 -0.507 18990 4107 1 6 . 1 1 418 418 GLU C C 418 176.266 176.266 174.839 1.427 18990 4108 1 6 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.594 0.981 18990 4109 1 6 . 1 1 418 418 GLU CB C 418 30.307 30.307 30.869 -0.562 18990 4110 1 6 . 1 1 418 418 GLU H H 418 8.184 8.184 8.628 -0.444 18990 4111 1 6 . 1 1 419 419 ALA N N 419 124.643 124.643 123.190 1.453 18990 4112 1 6 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.619 -0.369 18990 4113 1 6 . 1 1 419 419 ALA C C 419 177.488 177.488 175.742 1.746 18990 4114 1 6 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.745 0.763 18990 4115 1 6 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.400 -1.239 18990 4116 1 6 . 1 1 419 419 ALA H H 419 8.135 8.135 8.436 -0.301 18990 4117 1 6 . 1 1 420 420 ARG N N 420 120.003 120.003 120.645 -0.642 18990 4118 1 6 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.855 -0.562 18990 4119 1 6 . 1 1 420 420 ARG C C 420 176.297 176.297 174.860 1.437 18990 4120 1 6 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.571 0.362 18990 4121 1 6 . 1 1 420 420 ARG CB C 420 30.850 30.850 31.672 -0.823 18990 4122 1 6 . 1 1 420 420 ARG H H 420 8.135 8.135 8.528 -0.393 18990 4123 1 6 . 1 1 421 421 TRP N N 421 122.280 122.280 123.073 -0.793 18990 4124 1 6 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.878 -0.215 18990 4125 1 6 . 1 1 421 421 TRP C C 421 175.856 175.856 174.616 1.240 18990 4126 1 6 . 1 1 421 421 TRP CA C 421 57.404 57.404 55.989 1.415 18990 4127 1 6 . 1 1 421 421 TRP CB C 421 29.437 29.437 29.921 -0.484 18990 4128 1 6 . 1 1 421 421 TRP H H 421 8.159 8.159 8.029 0.130 18990 4129 1 6 . 1 1 422 422 ASP N N 422 121.980 121.980 119.416 2.564 18990 4130 1 6 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.668 -0.173 18990 4131 1 6 . 1 1 422 422 ASP C C 422 176.184 176.184 175.682 0.502 18990 4132 1 6 . 1 1 422 422 ASP CA C 422 53.899 53.899 53.843 0.056 18990 4133 1 6 . 1 1 422 422 ASP CB C 422 40.948 40.948 42.501 -1.553 18990 4134 1 6 . 1 1 422 422 ASP H H 422 8.135 8.135 8.545 -0.410 18990 4135 1 6 . 1 1 423 423 GLU N N 423 121.990 121.990 118.473 3.517 18990 4136 1 6 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.650 -0.560 18990 4137 1 6 . 1 1 423 423 GLU C C 423 176.720 176.720 176.246 0.474 18990 4138 1 6 . 1 1 423 423 GLU CA C 423 57.169 57.169 55.889 1.280 18990 4139 1 6 . 1 1 423 423 GLU CB C 423 30.156 30.156 28.881 1.276 18990 4140 1 6 . 1 1 423 423 GLU H H 423 8.153 8.153 8.682 -0.529 18990 4141 1 6 . 1 1 424 424 ALA N N 424 123.900 123.900 124.029 -0.129 18990 4142 1 6 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.314 -0.034 18990 4143 1 6 . 1 1 424 424 ALA C C 424 178.095 178.095 177.176 0.919 18990 4144 1 6 . 1 1 424 424 ALA CA C 424 53.017 53.017 53.329 -0.312 18990 4145 1 6 . 1 1 424 424 ALA CB C 424 19.086 19.086 19.168 -0.082 18990 4146 1 6 . 1 1 424 424 ALA H H 424 8.243 8.243 7.890 0.353 18990 4147 1 6 . 1 1 425 425 SER N N 425 113.881 113.881 116.870 -2.989 18990 4148 1 6 . 1 1 425 425 SER HA H 425 4.387 4.387 4.526 -0.139 18990 4149 1 6 . 1 1 425 425 SER C C 425 174.338 174.338 173.124 1.214 18990 4150 1 6 . 1 1 425 425 SER CA C 425 58.546 58.546 58.400 0.146 18990 4151 1 6 . 1 1 425 425 SER CB C 425 63.784 63.784 64.467 -0.683 18990 4152 1 6 . 1 1 425 425 SER H H 425 8.063 8.063 8.452 -0.389 18990 4153 1 6 . 1 1 426 426 ASN N N 426 121.032 121.032 124.329 -3.297 18990 4154 1 6 . 1 1 426 426 ASN HA H 426 4.706 4.706 5.086 -0.380 18990 4155 1 6 . 1 1 426 426 ASN C C 426 175.046 175.046 173.838 1.208 18990 4156 1 6 . 1 1 426 426 ASN CA C 426 53.445 53.445 53.715 -0.270 18990 4157 1 6 . 1 1 426 426 ASN CB C 426 38.847 38.847 38.954 -0.107 18990 4158 1 6 . 1 1 426 426 ASN H H 426 8.391 8.391 8.546 -0.154 18990 4159 1 6 . 1 1 427 427 VAL N N 427 119.463 119.463 122.125 -2.662 18990 4160 1 6 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.634 -0.441 18990 4161 1 6 . 1 1 427 427 VAL C C 427 176.213 176.213 175.089 1.124 18990 4162 1 6 . 1 1 427 427 VAL CA C 427 62.449 62.449 60.605 1.844 18990 4163 1 6 . 1 1 427 427 VAL CB C 427 32.865 32.865 33.110 -0.245 18990 4164 1 6 . 1 1 427 427 VAL H H 427 7.954 7.954 7.827 0.127 18990 4165 1 6 . 1 1 428 428 THR N N 428 118.226 118.226 116.242 1.984 18990 4166 1 6 . 1 1 428 428 THR HA H 428 4.353 4.353 4.682 -0.329 18990 4167 1 6 . 1 1 428 428 THR C C 428 174.361 174.361 173.755 0.606 18990 4168 1 6 . 1 1 428 428 THR CA C 428 62.065 62.065 62.177 -0.112 18990 4169 1 6 . 1 1 428 428 THR CB C 428 69.729 69.729 69.305 0.424 18990 4170 1 6 . 1 1 428 428 THR H H 428 8.225 8.225 8.167 0.058 18990 4171 1 6 . 1 1 429 429 ILE N N 429 123.910 123.910 122.083 1.827 18990 4172 1 6 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.526 -0.338 18990 4173 1 6 . 1 1 429 429 ILE C C 429 175.774 175.774 175.113 0.661 18990 4174 1 6 . 1 1 429 429 ILE CA C 429 60.819 60.819 60.121 0.698 18990 4175 1 6 . 1 1 429 429 ILE CB C 429 38.719 38.719 39.773 -1.054 18990 4176 1 6 . 1 1 429 429 ILE H H 429 8.148 8.148 8.043 0.105 18990 4177 1 6 . 1 1 430 430 LYS N N 430 126.453 126.453 123.192 3.261 18990 4178 1 6 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.587 -0.153 18990 4179 1 6 . 1 1 430 430 LYS C C 430 176.241 176.241 175.747 0.494 18990 4180 1 6 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.658 0.279 18990 4181 1 6 . 1 1 430 430 LYS CB C 430 33.164 33.164 34.598 -1.434 18990 4182 1 6 . 1 1 430 430 LYS H H 430 8.406 8.406 8.340 0.066 18990 4183 1 6 . 1 1 431 431 VAL N N 431 122.496 122.496 123.045 -0.549 18990 4184 1 6 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.162 0.118 18990 4185 1 6 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.362 -0.059 18990 4186 1 6 . 1 1 431 431 VAL CB C 431 33.132 33.132 31.712 1.420 18990 4187 1 6 . 1 1 431 431 VAL H H 431 8.312 8.312 8.552 -0.240 18990 4188 1 6 . 1 1 432 432 SER HA H 432 4.486 4.486 4.570 -0.084 18990 4189 1 6 . 1 1 432 432 SER C C 432 173.834 173.834 174.167 -0.333 18990 4190 1 6 . 1 1 432 432 SER CA C 432 58.650 58.650 59.016 -0.366 18990 4191 1 6 . 1 1 432 432 SER CB C 432 64.152 64.152 63.869 0.283 18990 4192 1 6 . 1 1 433 433 THR N N 433 114.706 114.706 113.414 1.292 18990 4193 1 6 . 1 1 433 433 THR HA H 433 5.446 5.446 4.561 0.885 18990 4194 1 6 . 1 1 433 433 THR C C 433 173.979 173.979 174.429 -0.450 18990 4195 1 6 . 1 1 433 433 THR CA C 433 60.412 60.412 61.617 -1.205 18990 4196 1 6 . 1 1 433 433 THR CB C 433 71.896 71.896 70.035 1.861 18990 4197 1 6 . 1 1 433 433 THR H H 433 7.833 7.833 7.339 0.494 18990 4198 1 6 . 1 1 434 434 LYS N N 434 122.492 122.492 126.074 -3.582 18990 4199 1 6 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.809 -0.100 18990 4200 1 6 . 1 1 434 434 LYS C C 434 173.589 173.589 174.544 -0.955 18990 4201 1 6 . 1 1 434 434 LYS CA C 434 54.375 54.375 53.314 1.061 18990 4202 1 6 . 1 1 434 434 LYS CB C 434 36.925 36.925 33.669 3.256 18990 4203 1 6 . 1 1 434 434 LYS H H 434 8.937 8.937 8.435 0.502 18990 4204 1 6 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.605 -0.338 18990 4205 1 6 . 1 1 435 435 PRO C C 435 175.238 175.238 176.251 -1.013 18990 4206 1 6 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.063 -1.140 18990 4207 1 6 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.468 -0.382 18990 4208 1 6 . 1 1 436 436 CYS N N 436 125.422 125.422 125.588 -0.166 18990 4209 1 6 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.267 -0.837 18990 4210 1 6 . 1 1 436 436 CYS C C 436 176.770 176.770 175.492 1.278 18990 4211 1 6 . 1 1 436 436 CYS CA C 436 57.016 57.016 57.325 -0.310 18990 4212 1 6 . 1 1 436 436 CYS CB C 436 31.698 31.698 28.180 3.518 18990 4213 1 6 . 1 1 436 436 CYS H H 436 7.768 7.768 8.490 -0.722 18990 4214 1 6 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.218 -0.360 18990 4215 1 6 . 1 1 437 437 PRO C C 437 173.608 173.608 176.690 -3.082 18990 4216 1 6 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.621 -0.408 18990 4217 1 6 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.555 0.894 18990 4218 1 6 . 1 1 438 438 LYS N N 438 118.600 118.600 117.826 0.774 18990 4219 1 6 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.316 -0.346 18990 4220 1 6 . 1 1 438 438 LYS C C 438 176.887 176.887 177.730 -0.843 18990 4221 1 6 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.508 0.179 18990 4222 1 6 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.607 -0.483 18990 4223 1 6 . 1 1 438 438 LYS H H 438 8.390 8.390 7.737 0.653 18990 4224 1 6 . 1 1 439 439 CYS N N 439 118.950 118.950 114.389 4.561 18990 4225 1 6 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.817 -0.071 18990 4226 1 6 . 1 1 439 439 CYS C C 439 176.650 176.650 175.131 1.519 18990 4227 1 6 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.964 1.384 18990 4228 1 6 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.653 2.543 18990 4229 1 6 . 1 1 439 439 CYS H H 439 8.357 8.357 7.999 0.358 18990 4230 1 6 . 1 1 440 440 ARG N N 440 117.200 117.200 117.964 -0.764 18990 4231 1 6 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.155 -0.187 18990 4232 1 6 . 1 1 440 440 ARG C C 440 175.253 175.253 175.700 -0.447 18990 4233 1 6 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.779 0.121 18990 4234 1 6 . 1 1 440 440 ARG CB C 440 26.041 26.041 26.910 -0.869 18990 4235 1 6 . 1 1 440 440 ARG H H 440 8.065 8.065 8.114 -0.049 18990 4236 1 6 . 1 1 441 441 THR N N 441 122.400 122.400 112.625 9.775 18990 4237 1 6 . 1 1 441 441 THR HA H 441 4.371 4.371 4.697 -0.326 18990 4238 1 6 . 1 1 441 441 THR C C 441 173.702 173.702 172.959 0.743 18990 4239 1 6 . 1 1 441 441 THR CA C 441 63.194 63.194 59.152 4.042 18990 4240 1 6 . 1 1 441 441 THR CB C 441 68.933 68.933 69.293 -0.360 18990 4241 1 6 . 1 1 441 441 THR H H 441 8.643 8.643 7.596 1.047 18990 4242 1 6 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.641 -0.494 18990 4243 1 6 . 1 1 442 442 PRO C C 442 176.215 176.215 176.149 0.066 18990 4244 1 6 . 1 1 442 442 PRO CA C 442 64.197 64.197 63.038 1.159 18990 4245 1 6 . 1 1 442 442 PRO CB C 442 32.044 32.044 30.879 1.165 18990 4246 1 6 . 1 1 443 443 THR N N 443 122.932 122.932 122.460 0.472 18990 4247 1 6 . 1 1 443 443 THR HA H 443 4.665 4.665 4.459 0.206 18990 4248 1 6 . 1 1 443 443 THR C C 443 172.133 172.133 173.944 -1.811 18990 4249 1 6 . 1 1 443 443 THR CA C 443 62.566 62.566 63.290 -0.724 18990 4250 1 6 . 1 1 443 443 THR CB C 443 71.562 71.562 70.056 1.506 18990 4251 1 6 . 1 1 443 443 THR H H 443 9.116 9.116 8.863 0.253 18990 4252 1 6 . 1 1 444 444 GLU N N 444 126.390 126.390 127.539 -1.149 18990 4253 1 6 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.637 0.305 18990 4254 1 6 . 1 1 444 444 GLU C C 444 175.292 175.292 175.677 -0.385 18990 4255 1 6 . 1 1 444 444 GLU CA C 444 55.049 55.049 55.705 -0.655 18990 4256 1 6 . 1 1 444 444 GLU CB C 444 31.861 31.861 30.179 1.682 18990 4257 1 6 . 1 1 444 444 GLU H H 444 8.720 8.720 8.874 -0.154 18990 4258 1 6 . 1 1 445 445 ARG N N 445 123.505 123.505 125.049 -1.544 18990 4259 1 6 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.510 -0.799 18990 4260 1 6 . 1 1 445 445 ARG C C 445 175.289 175.289 174.774 0.515 18990 4261 1 6 . 1 1 445 445 ARG CA C 445 55.856 55.856 54.880 0.976 18990 4262 1 6 . 1 1 445 445 ARG CB C 445 30.675 30.675 32.468 -1.793 18990 4263 1 6 . 1 1 445 445 ARG H H 445 8.157 8.157 8.398 -0.241 18990 4264 1 6 . 1 1 446 446 ASP N N 446 126.800 126.800 120.709 6.091 18990 4265 1 6 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.584 0.057 18990 4266 1 6 . 1 1 446 446 ASP C C 446 176.020 176.020 176.899 -0.879 18990 4267 1 6 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.788 -0.836 18990 4268 1 6 . 1 1 446 446 ASP CB C 446 41.400 41.400 42.024 -0.624 18990 4269 1 6 . 1 1 446 446 ASP H H 446 8.476 8.476 8.380 0.096 18990 4270 1 6 . 1 1 447 447 GLY N N 447 111.262 111.262 108.733 2.529 18990 4271 1 6 . 1 1 447 447 GLY C C 447 174.073 174.073 174.455 -0.382 18990 4272 1 6 . 1 1 447 447 GLY CA C 447 45.832 45.832 43.769 2.063 18990 4273 1 6 . 1 1 447 447 GLY H H 447 8.056 8.056 8.352 -0.296 18990 4274 1 6 . 1 1 448 448 GLY N N 448 108.655 108.655 109.324 -0.669 18990 4275 1 6 . 1 1 448 448 GLY C C 448 174.020 174.020 174.170 -0.150 18990 4276 1 6 . 1 1 448 448 GLY CA C 448 45.267 45.267 45.658 -0.391 18990 4277 1 6 . 1 1 448 448 GLY H H 448 8.380 8.380 7.925 0.455 18990 4278 1 6 . 1 1 449 449 CYS N N 449 120.628 120.628 116.493 4.135 18990 4279 1 6 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.864 -0.867 18990 4280 1 6 . 1 1 449 449 CYS C C 449 174.855 174.855 174.809 0.046 18990 4281 1 6 . 1 1 449 449 CYS CA C 449 59.291 59.291 55.653 3.638 18990 4282 1 6 . 1 1 449 449 CYS CB C 449 28.000 28.000 30.681 -2.681 18990 4283 1 6 . 1 1 449 449 CYS H H 449 7.832 7.832 7.303 0.529 18990 4284 1 6 . 1 1 450 450 MET N N 450 123.947 123.947 116.290 7.657 18990 4285 1 6 . 1 1 450 450 MET HA H 450 4.551 4.551 4.605 -0.054 18990 4286 1 6 . 1 1 450 450 MET C C 450 174.658 174.658 174.813 -0.155 18990 4287 1 6 . 1 1 450 450 MET CA C 450 54.970 54.970 56.070 -1.100 18990 4288 1 6 . 1 1 450 450 MET CB C 450 34.100 34.100 31.297 2.803 18990 4289 1 6 . 1 1 450 450 MET H H 450 8.916 8.916 8.361 0.555 18990 4290 1 6 . 1 1 451 451 HIS N N 451 120.490 120.490 120.829 -0.339 18990 4291 1 6 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.182 -0.503 18990 4292 1 6 . 1 1 451 451 HIS C C 451 172.443 172.443 173.436 -0.993 18990 4293 1 6 . 1 1 451 451 HIS CA C 451 53.812 53.812 55.453 -1.641 18990 4294 1 6 . 1 1 451 451 HIS CB C 451 28.900 28.900 29.116 -0.215 18990 4295 1 6 . 1 1 451 451 HIS H H 451 7.557 7.557 6.987 0.570 18990 4296 1 6 . 1 1 452 452 MET N N 452 128.800 128.800 123.747 5.053 18990 4297 1 6 . 1 1 452 452 MET HA H 452 4.320 4.320 4.433 -0.113 18990 4298 1 6 . 1 1 452 452 MET C C 452 175.479 175.479 173.885 1.594 18990 4299 1 6 . 1 1 452 452 MET CA C 452 52.589 52.589 53.042 -0.453 18990 4300 1 6 . 1 1 452 452 MET CB C 452 28.074 28.074 31.919 -3.845 18990 4301 1 6 . 1 1 452 452 MET H H 452 9.087 9.087 7.830 1.257 18990 4302 1 6 . 1 1 453 453 VAL N N 453 122.200 122.200 124.302 -2.102 18990 4303 1 6 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.389 0.405 18990 4304 1 6 . 1 1 453 453 VAL C C 453 175.476 175.476 174.771 0.705 18990 4305 1 6 . 1 1 453 453 VAL CA C 453 61.380 61.380 60.280 1.100 18990 4306 1 6 . 1 1 453 453 VAL CB C 453 33.089 33.089 32.338 0.751 18990 4307 1 6 . 1 1 453 453 VAL H H 453 8.016 8.016 8.379 -0.363 18990 4308 1 6 . 1 1 454 454 CYS N N 454 130.353 130.353 128.610 1.743 18990 4309 1 6 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.634 -0.039 18990 4310 1 6 . 1 1 454 454 CYS C C 454 177.833 177.833 174.782 3.051 18990 4311 1 6 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.701 2.870 18990 4312 1 6 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.402 5.643 18990 4313 1 6 . 1 1 454 454 CYS H H 454 8.989 8.989 9.223 -0.234 18990 4314 1 6 . 1 1 455 455 THR N N 455 119.000 119.000 123.164 -4.164 18990 4315 1 6 . 1 1 455 455 THR HA H 455 4.393 4.393 4.318 0.075 18990 4316 1 6 . 1 1 455 455 THR C C 455 175.264 175.264 174.274 0.990 18990 4317 1 6 . 1 1 455 455 THR CA C 455 61.644 61.644 62.004 -0.360 18990 4318 1 6 . 1 1 455 455 THR CB C 455 69.400 69.400 67.975 1.425 18990 4319 1 6 . 1 1 455 455 THR H H 455 8.533 8.533 8.252 0.281 18990 4320 1 6 . 1 1 456 456 ARG N N 456 128.900 128.900 125.888 3.012 18990 4321 1 6 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.489 -0.264 18990 4322 1 6 . 1 1 456 456 ARG C C 456 177.782 177.782 175.550 2.232 18990 4323 1 6 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.682 2.268 18990 4324 1 6 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.694 -3.644 18990 4325 1 6 . 1 1 456 456 ARG H H 456 9.036 9.036 7.883 1.153 18990 4326 1 6 . 1 1 457 457 ALA N N 457 133.152 133.152 127.416 5.736 18990 4327 1 6 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.299 -0.153 18990 4328 1 6 . 1 1 457 457 ALA C C 457 178.757 178.757 177.458 1.299 18990 4329 1 6 . 1 1 457 457 ALA CA C 457 53.929 53.929 53.087 0.842 18990 4330 1 6 . 1 1 457 457 ALA CB C 457 17.710 17.710 17.302 0.408 18990 4331 1 6 . 1 1 457 457 ALA H H 457 9.042 9.042 8.670 0.372 18990 4332 1 6 . 1 1 458 458 GLY N N 458 111.200 111.200 110.741 0.459 18990 4333 1 6 . 1 1 458 458 GLY C C 458 173.558 173.558 173.891 -0.333 18990 4334 1 6 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.758 0.678 18990 4335 1 6 . 1 1 458 458 GLY H H 458 8.830 8.830 8.379 0.451 18990 4336 1 6 . 1 1 459 459 CYS N N 459 123.040 123.040 119.668 3.372 18990 4337 1 6 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.911 -0.289 18990 4338 1 6 . 1 1 459 459 CYS C C 459 176.591 176.591 174.890 1.701 18990 4339 1 6 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.059 1.440 18990 4340 1 6 . 1 1 459 459 CYS CB C 459 30.174 30.174 28.838 1.336 18990 4341 1 6 . 1 1 459 459 CYS H H 459 8.042 8.042 8.197 -0.155 18990 4342 1 6 . 1 1 460 460 GLY N N 460 104.500 104.500 110.692 -6.192 18990 4343 1 6 . 1 1 460 460 GLY C C 460 173.716 173.716 174.096 -0.380 18990 4344 1 6 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.550 0.458 18990 4345 1 6 . 1 1 460 460 GLY H H 460 7.705 7.705 8.133 -0.428 18990 4346 1 6 . 1 1 461 461 PHE N N 461 124.949 124.949 120.906 4.043 18990 4347 1 6 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.694 -0.114 18990 4348 1 6 . 1 1 461 461 PHE C C 461 174.447 174.447 173.890 0.557 18990 4349 1 6 . 1 1 461 461 PHE CA C 461 59.946 59.946 57.086 2.860 18990 4350 1 6 . 1 1 461 461 PHE CB C 461 41.300 41.300 41.463 -0.163 18990 4351 1 6 . 1 1 461 461 PHE H H 461 8.947 8.947 7.581 1.366 18990 4352 1 6 . 1 1 462 462 GLU N N 462 125.272 125.272 125.612 -0.340 18990 4353 1 6 . 1 1 462 462 GLU HA H 462 5.721 5.721 5.065 0.656 18990 4354 1 6 . 1 1 462 462 GLU C C 462 176.067 176.067 175.028 1.039 18990 4355 1 6 . 1 1 462 462 GLU CA C 462 54.624 54.624 54.772 -0.148 18990 4356 1 6 . 1 1 462 462 GLU CB C 462 31.255 31.255 32.351 -1.096 18990 4357 1 6 . 1 1 462 462 GLU H H 462 7.799 7.799 7.732 0.067 18990 4358 1 6 . 1 1 463 463 TRP N N 463 121.524 121.524 119.520 2.004 18990 4359 1 6 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.341 0.165 18990 4360 1 6 . 1 1 463 463 TRP C C 463 172.844 172.844 174.918 -2.074 18990 4361 1 6 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.795 -1.024 18990 4362 1 6 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.700 0.037 18990 4363 1 6 . 1 1 463 463 TRP H H 463 9.300 9.300 8.801 0.499 18990 4364 1 6 . 1 1 464 464 CYS N N 464 120.868 120.868 120.917 -0.049 18990 4365 1 6 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.790 0.626 18990 4366 1 6 . 1 1 464 464 CYS C C 464 177.213 177.213 176.258 0.955 18990 4367 1 6 . 1 1 464 464 CYS CA C 464 57.776 57.776 59.390 -1.614 18990 4368 1 6 . 1 1 464 464 CYS CB C 464 32.930 32.930 28.819 4.112 18990 4369 1 6 . 1 1 464 464 CYS H H 464 8.752 8.752 9.271 -0.519 18990 4370 1 6 . 1 1 465 465 TRP N N 465 131.209 131.209 128.602 2.607 18990 4371 1 6 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.563 -0.136 18990 4372 1 6 . 1 1 465 465 TRP C C 465 176.051 176.051 176.408 -0.357 18990 4373 1 6 . 1 1 465 465 TRP CA C 465 60.763 60.763 59.532 1.232 18990 4374 1 6 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.941 1.185 18990 4375 1 6 . 1 1 465 465 TRP H H 465 9.809 9.809 8.417 1.392 18990 4376 1 6 . 1 1 466 466 VAL N N 466 118.233 118.233 113.400 4.833 18990 4377 1 6 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.569 0.055 18990 4378 1 6 . 1 1 466 466 VAL C C 466 178.943 178.943 175.598 3.345 18990 4379 1 6 . 1 1 466 466 VAL CA C 466 65.602 65.602 62.821 2.781 18990 4380 1 6 . 1 1 466 466 VAL CB C 466 33.172 33.172 30.830 2.342 18990 4381 1 6 . 1 1 466 466 VAL H H 466 8.627 8.627 7.671 0.956 18990 4382 1 6 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.708 -1.277 18990 4383 1 6 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.724 0.275 18990 4384 1 6 . 1 1 467 467 CYS CB C 467 31.870 31.870 30.862 1.008 18990 4385 1 6 . 1 1 467 467 CYS H H 467 7.820 7.820 7.373 0.447 18990 4386 1 6 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.510 -0.474 18990 4387 1 6 . 1 1 468 468 GLN CA C 468 58.051 58.051 56.422 1.629 18990 4388 1 6 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.683 -2.207 18990 4389 1 6 . 1 1 469 469 THR HA H 469 4.685 4.685 4.620 0.065 18990 4390 1 6 . 1 1 469 469 THR C C 469 173.351 173.351 173.656 -0.305 18990 4391 1 6 . 1 1 469 469 THR CA C 469 59.176 59.176 60.557 -1.381 18990 4392 1 6 . 1 1 469 469 THR CB C 469 71.775 71.775 71.428 0.347 18990 4393 1 6 . 1 1 470 470 GLU N N 470 120.940 120.940 120.015 0.925 18990 4394 1 6 . 1 1 470 470 GLU HA H 470 4.293 4.293 5.010 -0.717 18990 4395 1 6 . 1 1 470 470 GLU C C 470 175.539 175.539 176.114 -0.575 18990 4396 1 6 . 1 1 470 470 GLU CA C 470 57.015 57.015 55.667 1.348 18990 4397 1 6 . 1 1 470 470 GLU CB C 470 29.965 29.965 31.919 -1.954 18990 4398 1 6 . 1 1 470 470 GLU H H 470 8.912 8.912 8.640 0.272 18990 4399 1 6 . 1 1 471 471 TRP N N 471 126.998 126.998 124.966 2.032 18990 4400 1 6 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.149 0.144 18990 4401 1 6 . 1 1 471 471 TRP C C 471 175.408 175.408 175.011 0.397 18990 4402 1 6 . 1 1 471 471 TRP CA C 471 58.220 58.220 59.494 -1.274 18990 4403 1 6 . 1 1 471 471 TRP CB C 471 29.500 29.500 28.908 0.592 18990 4404 1 6 . 1 1 471 471 TRP H H 471 8.350 8.350 8.921 -0.571 18990 4405 1 6 . 1 1 472 472 THR N N 472 117.480 117.480 116.287 1.193 18990 4406 1 6 . 1 1 472 472 THR HA H 472 4.444 4.444 4.318 0.126 18990 4407 1 6 . 1 1 472 472 THR CA C 472 58.930 58.930 59.578 -0.648 18990 4408 1 6 . 1 1 472 472 THR H H 472 8.069 8.069 7.325 0.744 18990 4409 1 6 . 1 1 473 473 ARG HA H 473 3.773 3.773 3.774 -0.001 18990 4410 1 6 . 1 1 473 473 ARG C C 473 178.053 178.053 176.704 1.349 18990 4411 1 6 . 1 1 473 473 ARG CA C 473 58.088 58.088 58.844 -0.756 18990 4412 1 6 . 1 1 473 473 ARG CB C 473 29.426 29.426 30.077 -0.651 18990 4413 1 6 . 1 1 474 474 ASP N N 474 119.900 119.900 119.081 0.819 18990 4414 1 6 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.405 -0.190 18990 4415 1 6 . 1 1 474 474 ASP C C 474 178.197 178.197 176.840 1.357 18990 4416 1 6 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.548 0.254 18990 4417 1 6 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.712 -0.530 18990 4418 1 6 . 1 1 474 474 ASP H H 474 7.718 7.718 8.579 -0.861 18990 4419 1 6 . 1 1 475 475 CYS N N 475 121.000 121.000 117.236 3.764 18990 4420 1 6 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.389 -1.022 18990 4421 1 6 . 1 1 475 475 CYS CA C 475 64.533 64.533 59.802 4.731 18990 4422 1 6 . 1 1 475 475 CYS CB C 475 29.092 29.092 27.579 1.513 18990 4423 1 6 . 1 1 475 475 CYS H H 475 6.953 6.953 7.501 -0.548 18990 4424 1 6 . 1 1 476 476 MET HA H 476 4.021 4.021 4.202 -0.181 18990 4425 1 6 . 1 1 476 476 MET CA C 476 58.010 58.010 58.072 -0.062 18990 4426 1 6 . 1 1 476 476 MET CB C 476 32.550 32.550 32.175 0.375 18990 4427 1 6 . 1 1 477 477 GLY N N 477 111.938 111.938 105.803 6.135 18990 4428 1 6 . 1 1 477 477 GLY C C 477 174.406 174.406 174.055 0.351 18990 4429 1 6 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.734 0.882 18990 4430 1 6 . 1 1 477 477 GLY H H 477 9.155 9.155 7.686 1.469 18990 4431 1 6 . 1 1 478 478 ALA N N 478 121.900 121.900 125.128 -3.228 18990 4432 1 6 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.417 -0.126 18990 4433 1 6 . 1 1 478 478 ALA C C 478 178.196 178.196 177.180 1.016 18990 4434 1 6 . 1 1 478 478 ALA CA C 478 53.440 53.440 53.093 0.347 18990 4435 1 6 . 1 1 478 478 ALA CB C 478 20.390 20.390 19.796 0.594 18990 4436 1 6 . 1 1 478 478 ALA H H 478 7.347 7.347 8.184 -0.837 18990 4437 1 6 . 1 1 479 479 HIS N N 479 115.200 115.200 111.340 3.860 18990 4438 1 6 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.409 0.494 18990 4439 1 6 . 1 1 479 479 HIS C C 479 173.325 173.325 174.960 -1.635 18990 4440 1 6 . 1 1 479 479 HIS CA C 479 54.526 54.526 54.507 0.020 18990 4441 1 6 . 1 1 479 479 HIS CB C 479 27.600 27.600 30.139 -2.539 18990 4442 1 6 . 1 1 479 479 HIS H H 479 8.297 8.297 7.582 0.715 18990 4443 1 6 . 1 1 480 480 TRP N N 480 121.780 121.780 122.705 -0.925 18990 4444 1 6 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.541 -0.246 18990 4445 1 6 . 1 1 480 480 TRP C C 480 175.568 175.568 174.402 1.166 18990 4446 1 6 . 1 1 480 480 TRP CA C 480 58.358 58.358 59.645 -1.287 18990 4447 1 6 . 1 1 480 480 TRP CB C 480 29.550 29.550 30.375 -0.825 18990 4448 1 6 . 1 1 480 480 TRP H H 480 8.081 8.081 7.551 0.530 18990 4449 1 6 . 1 1 481 481 PHE HA H 481 4.845 4.845 5.008 -0.163 18990 4450 1 6 . 1 1 481 481 PHE C C 481 175.126 175.126 174.176 0.950 18990 4451 1 6 . 1 1 481 481 PHE CA C 481 56.471 56.471 55.731 0.740 18990 4452 1 6 . 1 1 481 481 PHE CB C 481 41.006 41.006 40.744 0.262 18990 4453 1 7 . 1 1 343 343 GLU N N 343 121.045 121.045 123.192 -2.147 18990 4454 1 7 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.355 -0.190 18990 4455 1 7 . 1 1 343 343 GLU C C 343 176.529 176.529 175.448 1.081 18990 4456 1 7 . 1 1 343 343 GLU CA C 343 57.162 57.162 56.314 0.848 18990 4457 1 7 . 1 1 343 343 GLU CB C 343 30.204 30.204 28.978 1.226 18990 4458 1 7 . 1 1 343 343 GLU H H 343 8.293 8.293 8.660 -0.367 18990 4459 1 7 . 1 1 344 344 TYR N N 344 121.000 121.000 126.843 -5.843 18990 4460 1 7 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.570 -0.032 18990 4461 1 7 . 1 1 344 344 TYR C C 344 175.897 175.897 174.538 1.359 18990 4462 1 7 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.296 0.883 18990 4463 1 7 . 1 1 344 344 TYR CB C 344 38.600 38.600 37.759 0.841 18990 4464 1 7 . 1 1 344 344 TYR H H 344 8.040 8.040 8.557 -0.517 18990 4465 1 7 . 1 1 345 345 VAL N N 345 121.900 121.900 126.302 -4.402 18990 4466 1 7 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.212 -0.273 18990 4467 1 7 . 1 1 345 345 VAL C C 345 176.143 176.143 175.626 0.517 18990 4468 1 7 . 1 1 345 345 VAL CA C 345 62.867 62.867 62.177 0.690 18990 4469 1 7 . 1 1 345 345 VAL CB C 345 32.799 32.799 32.112 0.687 18990 4470 1 7 . 1 1 345 345 VAL H H 345 7.856 7.856 7.951 -0.095 18990 4471 1 7 . 1 1 346 346 LEU N N 346 124.950 124.950 123.395 1.555 18990 4472 1 7 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.474 -0.231 18990 4473 1 7 . 1 1 346 346 LEU C C 346 177.747 177.747 175.894 1.853 18990 4474 1 7 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.626 0.874 18990 4475 1 7 . 1 1 346 346 LEU CB C 346 42.252 42.252 43.097 -0.845 18990 4476 1 7 . 1 1 346 346 LEU H H 346 8.127 8.127 8.423 -0.296 18990 4477 1 7 . 1 1 347 347 GLN N N 347 121.452 121.452 119.038 2.414 18990 4478 1 7 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.436 -0.150 18990 4479 1 7 . 1 1 347 347 GLN C C 347 175.833 175.833 174.904 0.929 18990 4480 1 7 . 1 1 347 347 GLN CA C 347 55.988 55.988 54.769 1.219 18990 4481 1 7 . 1 1 347 347 GLN CB C 347 29.375 29.375 30.299 -0.924 18990 4482 1 7 . 1 1 347 347 GLN H H 347 8.270 8.270 7.356 0.914 18990 4483 1 7 . 1 1 348 348 ALA N N 348 124.466 124.466 123.433 1.033 18990 4484 1 7 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.293 0.028 18990 4485 1 7 . 1 1 348 348 ALA C C 348 177.929 177.929 177.335 0.594 18990 4486 1 7 . 1 1 348 348 ALA CA C 348 52.703 52.703 51.766 0.937 18990 4487 1 7 . 1 1 348 348 ALA CB C 348 19.002 19.002 19.735 -0.734 18990 4488 1 7 . 1 1 348 348 ALA H H 348 8.227 8.227 8.706 -0.479 18990 4489 1 7 . 1 1 349 349 GLY N N 349 108.193 108.193 107.466 0.727 18990 4490 1 7 . 1 1 349 349 GLY C C 349 174.269 174.269 173.653 0.616 18990 4491 1 7 . 1 1 349 349 GLY CA C 349 45.227 45.227 45.057 0.170 18990 4492 1 7 . 1 1 349 349 GLY H H 349 8.298 8.298 8.048 0.250 18990 4493 1 7 . 1 1 350 350 GLY N N 350 108.073 108.073 108.222 -0.149 18990 4494 1 7 . 1 1 350 350 GLY C C 350 172.979 172.979 173.173 -0.194 18990 4495 1 7 . 1 1 350 350 GLY CA C 350 44.935 44.935 44.590 0.345 18990 4496 1 7 . 1 1 350 350 GLY H H 350 8.156 8.156 7.921 0.235 18990 4497 1 7 . 1 1 351 351 VAL N N 351 119.058 119.058 122.684 -3.626 18990 4498 1 7 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.544 -0.128 18990 4499 1 7 . 1 1 351 351 VAL C C 351 173.412 173.412 174.142 -0.730 18990 4500 1 7 . 1 1 351 351 VAL CA C 351 60.663 60.663 59.784 0.879 18990 4501 1 7 . 1 1 351 351 VAL CB C 351 34.866 34.866 35.130 -0.264 18990 4502 1 7 . 1 1 351 351 VAL H H 351 8.541 8.541 8.828 -0.287 18990 4503 1 7 . 1 1 352 352 LEU N N 352 125.800 125.800 123.887 1.913 18990 4504 1 7 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.587 0.178 18990 4505 1 7 . 1 1 352 352 LEU C C 352 176.218 176.218 175.683 0.535 18990 4506 1 7 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.681 -0.340 18990 4507 1 7 . 1 1 352 352 LEU CB C 352 42.706 42.706 43.501 -0.795 18990 4508 1 7 . 1 1 352 352 LEU H H 352 8.151 8.151 8.484 -0.333 18990 4509 1 7 . 1 1 353 353 CYS N N 353 126.825 126.825 124.414 2.411 18990 4510 1 7 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.384 -0.277 18990 4511 1 7 . 1 1 353 353 CYS C C 353 176.655 176.655 174.388 2.267 18990 4512 1 7 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.159 0.572 18990 4513 1 7 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.954 3.910 18990 4514 1 7 . 1 1 353 353 CYS H H 353 8.794 8.794 8.601 0.193 18990 4515 1 7 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.313 0.107 18990 4516 1 7 . 1 1 354 354 PRO C C 354 177.512 177.512 175.966 1.546 18990 4517 1 7 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.101 -0.109 18990 4518 1 7 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.430 1.137 18990 4519 1 7 . 1 1 355 355 GLN N N 355 126.800 126.800 121.059 5.741 18990 4520 1 7 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.521 -0.246 18990 4521 1 7 . 1 1 355 355 GLN C C 355 175.516 175.516 174.114 1.402 18990 4522 1 7 . 1 1 355 355 GLN CA C 355 54.793 54.793 52.867 1.926 18990 4523 1 7 . 1 1 355 355 GLN CB C 355 28.547 28.547 29.295 -0.748 18990 4524 1 7 . 1 1 355 355 GLN H H 355 9.033 9.033 7.543 1.490 18990 4525 1 7 . 1 1 357 357 GLY C C 357 173.229 173.229 173.838 -0.609 18990 4526 1 7 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.722 0.532 18990 4527 1 7 . 1 1 358 358 CYS N N 358 123.500 123.500 119.641 3.859 18990 4528 1 7 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.964 -0.431 18990 4529 1 7 . 1 1 358 358 CYS C C 358 176.157 176.157 175.934 0.223 18990 4530 1 7 . 1 1 358 358 CYS CA C 358 60.268 60.268 59.121 1.147 18990 4531 1 7 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.923 0.452 18990 4532 1 7 . 1 1 358 358 CYS H H 358 7.720 7.720 7.968 -0.248 18990 4533 1 7 . 1 1 359 359 GLY N N 359 104.400 104.400 110.211 -5.811 18990 4534 1 7 . 1 1 359 359 GLY C C 359 174.080 174.080 174.989 -0.909 18990 4535 1 7 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.399 -0.335 18990 4536 1 7 . 1 1 359 359 GLY H H 359 7.756 7.756 8.238 -0.482 18990 4537 1 7 . 1 1 360 360 MET N N 360 121.300 121.300 120.602 0.698 18990 4538 1 7 . 1 1 360 360 MET HA H 360 4.343 4.343 4.279 0.064 18990 4539 1 7 . 1 1 360 360 MET C C 360 175.641 175.641 177.048 -1.407 18990 4540 1 7 . 1 1 360 360 MET CA C 360 55.923 55.923 57.226 -1.303 18990 4541 1 7 . 1 1 360 360 MET CB C 360 33.091 33.091 34.131 -1.040 18990 4542 1 7 . 1 1 360 360 MET H H 360 8.229 8.229 7.588 0.641 18990 4543 1 7 . 1 1 361 361 GLY N N 361 109.000 109.000 105.876 3.124 18990 4544 1 7 . 1 1 361 361 GLY C C 361 173.774 173.774 172.794 0.980 18990 4545 1 7 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.576 1.262 18990 4546 1 7 . 1 1 361 361 GLY H H 361 8.347 8.347 8.062 0.285 18990 4547 1 7 . 1 1 362 362 LEU N N 362 126.725 126.725 125.261 1.464 18990 4548 1 7 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.839 -0.164 18990 4549 1 7 . 1 1 362 362 LEU C C 362 175.865 175.865 175.747 0.118 18990 4550 1 7 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.105 1.085 18990 4551 1 7 . 1 1 362 362 LEU CB C 362 44.050 44.050 44.131 -0.081 18990 4552 1 7 . 1 1 362 362 LEU H H 362 8.935 8.935 8.953 -0.018 18990 4553 1 7 . 1 1 363 363 LEU N N 363 123.742 123.742 126.431 -2.689 18990 4554 1 7 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.487 0.190 18990 4555 1 7 . 1 1 363 363 LEU C C 363 176.162 176.162 175.459 0.703 18990 4556 1 7 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.783 -0.441 18990 4557 1 7 . 1 1 363 363 LEU CB C 363 42.210 42.210 43.158 -0.948 18990 4558 1 7 . 1 1 363 363 LEU H H 363 8.481 8.481 8.804 -0.323 18990 4559 1 7 . 1 1 364 364 VAL N N 364 120.980 120.980 128.096 -7.116 18990 4560 1 7 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.308 0.089 18990 4561 1 7 . 1 1 364 364 VAL C C 364 175.592 175.592 174.616 0.976 18990 4562 1 7 . 1 1 364 364 VAL CA C 364 60.460 60.460 61.102 -0.642 18990 4563 1 7 . 1 1 364 364 VAL CB C 364 34.125 34.125 31.726 2.399 18990 4564 1 7 . 1 1 364 364 VAL H H 364 8.155 8.155 8.118 0.037 18990 4565 1 7 . 1 1 365 365 GLU N N 365 126.950 126.950 126.206 0.744 18990 4566 1 7 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.451 0.159 18990 4567 1 7 . 1 1 365 365 GLU C C 365 175.427 175.427 176.293 -0.866 18990 4568 1 7 . 1 1 365 365 GLU CA C 365 54.551 54.551 54.899 -0.348 18990 4569 1 7 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.331 0.449 18990 4570 1 7 . 1 1 365 365 GLU H H 365 8.900 8.900 8.410 0.490 18990 4571 1 7 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.264 -0.002 18990 4572 1 7 . 1 1 366 366 PRO C C 366 177.013 177.013 176.642 0.371 18990 4573 1 7 . 1 1 366 366 PRO CA C 366 64.463 64.463 65.145 -0.682 18990 4574 1 7 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.866 0.182 18990 4575 1 7 . 1 1 367 367 ASP N N 367 115.459 115.459 115.110 0.349 18990 4576 1 7 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.737 -0.242 18990 4577 1 7 . 1 1 367 367 ASP C C 367 175.123 175.123 175.721 -0.598 18990 4578 1 7 . 1 1 367 367 ASP CA C 367 54.503 54.503 53.754 0.749 18990 4579 1 7 . 1 1 367 367 ASP CB C 367 40.123 40.123 40.729 -0.606 18990 4580 1 7 . 1 1 367 367 ASP H H 367 8.439 8.439 8.476 -0.037 18990 4581 1 7 . 1 1 368 368 CYS N N 368 118.700 118.700 121.560 -2.860 18990 4582 1 7 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.364 0.206 18990 4583 1 7 . 1 1 368 368 CYS C C 368 173.806 173.806 174.545 -0.739 18990 4584 1 7 . 1 1 368 368 CYS CA C 368 58.581 58.581 59.163 -0.582 18990 4585 1 7 . 1 1 368 368 CYS CB C 368 28.450 28.450 27.229 1.221 18990 4586 1 7 . 1 1 368 368 CYS H H 368 7.515 7.515 7.784 -0.269 18990 4587 1 7 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.553 -0.288 18990 4588 1 7 . 1 1 369 369 ARG C C 369 174.908 174.908 174.800 0.108 18990 4589 1 7 . 1 1 369 369 ARG CA C 369 57.669 57.669 55.894 1.775 18990 4590 1 7 . 1 1 369 369 ARG CB C 369 32.274 32.274 30.585 1.689 18990 4591 1 7 . 1 1 370 370 LYS N N 370 121.022 121.022 119.917 1.105 18990 4592 1 7 . 1 1 370 370 LYS HA H 370 4.170 4.170 3.741 0.429 18990 4593 1 7 . 1 1 370 370 LYS C C 370 174.868 174.868 173.922 0.946 18990 4594 1 7 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.671 0.883 18990 4595 1 7 . 1 1 370 370 LYS CB C 370 33.140 33.140 33.469 -0.329 18990 4596 1 7 . 1 1 370 370 LYS H H 370 7.740 7.740 7.306 0.434 18990 4597 1 7 . 1 1 371 371 VAL N N 371 128.362 128.362 127.310 1.052 18990 4598 1 7 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.115 0.017 18990 4599 1 7 . 1 1 371 371 VAL C C 371 173.402 173.402 173.970 -0.568 18990 4600 1 7 . 1 1 371 371 VAL CA C 371 60.777 60.777 60.398 0.379 18990 4601 1 7 . 1 1 371 371 VAL CB C 371 33.000 33.000 32.739 0.262 18990 4602 1 7 . 1 1 371 371 VAL H H 371 8.647 8.647 8.037 0.610 18990 4603 1 7 . 1 1 372 372 THR N N 372 119.667 119.667 122.543 -2.876 18990 4604 1 7 . 1 1 372 372 THR HA H 372 5.032 5.032 4.742 0.290 18990 4605 1 7 . 1 1 372 372 THR C C 372 174.339 174.339 173.859 0.480 18990 4606 1 7 . 1 1 372 372 THR CA C 372 60.881 60.881 61.654 -0.773 18990 4607 1 7 . 1 1 372 372 THR CB C 372 70.471 70.471 71.382 -0.911 18990 4608 1 7 . 1 1 372 372 THR H H 372 8.087 8.087 8.322 -0.235 18990 4609 1 7 . 1 1 373 373 CYS N N 373 132.554 132.554 126.869 5.685 18990 4610 1 7 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.600 0.202 18990 4611 1 7 . 1 1 373 373 CYS C C 373 176.791 176.791 176.202 0.589 18990 4612 1 7 . 1 1 373 373 CYS CA C 373 58.504 58.504 58.501 0.003 18990 4613 1 7 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.730 3.581 18990 4614 1 7 . 1 1 373 373 CYS H H 373 9.322 9.322 9.304 0.018 18990 4615 1 7 . 1 1 374 374 GLN N N 374 125.890 125.890 123.346 2.544 18990 4616 1 7 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.174 -0.174 18990 4617 1 7 . 1 1 374 374 GLN C C 374 176.827 176.827 176.222 0.605 18990 4618 1 7 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.857 0.443 18990 4619 1 7 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.374 1.290 18990 4620 1 7 . 1 1 374 374 GLN H H 374 7.856 7.856 8.563 -0.707 18990 4621 1 7 . 1 1 375 375 ASN N N 375 115.342 115.342 116.436 -1.094 18990 4622 1 7 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.808 0.079 18990 4623 1 7 . 1 1 375 375 ASN C C 375 174.049 174.049 174.874 -0.825 18990 4624 1 7 . 1 1 375 375 ASN CA C 375 53.047 53.047 52.836 0.211 18990 4625 1 7 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.092 -0.176 18990 4626 1 7 . 1 1 375 375 ASN H H 375 8.913 8.913 8.395 0.518 18990 4627 1 7 . 1 1 376 376 GLY N N 376 109.098 109.098 108.244 0.854 18990 4628 1 7 . 1 1 376 376 GLY C C 376 174.110 174.110 172.740 1.370 18990 4629 1 7 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.703 0.684 18990 4630 1 7 . 1 1 376 376 GLY H H 376 7.162 7.162 7.816 -0.654 18990 4631 1 7 . 1 1 377 377 CYS N N 377 132.546 132.546 122.303 10.243 18990 4632 1 7 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.825 -0.061 18990 4633 1 7 . 1 1 377 377 CYS C C 377 177.355 177.355 175.888 1.467 18990 4634 1 7 . 1 1 377 377 CYS CA C 377 59.988 59.988 56.592 3.396 18990 4635 1 7 . 1 1 377 377 CYS CB C 377 32.365 32.365 25.676 6.689 18990 4636 1 7 . 1 1 377 377 CYS H H 377 9.800 9.800 8.301 1.499 18990 4637 1 7 . 1 1 378 378 GLY N N 378 113.851 113.851 111.933 1.918 18990 4638 1 7 . 1 1 378 378 GLY C C 378 173.404 173.404 172.983 0.421 18990 4639 1 7 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.826 0.037 18990 4640 1 7 . 1 1 378 378 GLY H H 378 8.820 8.820 8.508 0.312 18990 4641 1 7 . 1 1 379 379 TYR N N 379 125.532 125.532 126.620 -1.088 18990 4642 1 7 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.632 -0.154 18990 4643 1 7 . 1 1 379 379 TYR C C 379 173.661 173.661 174.096 -0.435 18990 4644 1 7 . 1 1 379 379 TYR CA C 379 59.180 59.180 56.992 2.188 18990 4645 1 7 . 1 1 379 379 TYR CB C 379 40.108 40.108 41.976 -1.868 18990 4646 1 7 . 1 1 379 379 TYR H H 379 9.054 9.054 8.096 0.958 18990 4647 1 7 . 1 1 380 380 VAL N N 380 124.461 124.461 128.615 -4.154 18990 4648 1 7 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.543 0.275 18990 4649 1 7 . 1 1 380 380 VAL C C 380 175.876 175.876 174.110 1.766 18990 4650 1 7 . 1 1 380 380 VAL CA C 380 60.797 60.797 60.862 -0.065 18990 4651 1 7 . 1 1 380 380 VAL CB C 380 32.610 32.610 32.935 -0.325 18990 4652 1 7 . 1 1 380 380 VAL H H 380 7.238 7.238 7.978 -0.740 18990 4653 1 7 . 1 1 381 381 PHE N N 381 124.588 124.588 124.717 -0.129 18990 4654 1 7 . 1 1 381 381 PHE HA H 381 5.273 5.273 4.846 0.427 18990 4655 1 7 . 1 1 381 381 PHE C C 381 173.242 173.242 173.607 -0.365 18990 4656 1 7 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.147 0.063 18990 4657 1 7 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.800 1.290 18990 4658 1 7 . 1 1 381 381 PHE H H 381 9.424 9.424 7.341 2.083 18990 4659 1 7 . 1 1 382 382 CYS N N 382 120.221 120.221 121.203 -0.982 18990 4660 1 7 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.822 0.080 18990 4661 1 7 . 1 1 382 382 CYS C C 382 177.165 177.165 176.167 0.998 18990 4662 1 7 . 1 1 382 382 CYS CA C 382 57.691 57.691 58.229 -0.538 18990 4663 1 7 . 1 1 382 382 CYS CB C 382 32.475 32.475 30.129 2.346 18990 4664 1 7 . 1 1 382 382 CYS H H 382 8.673 8.673 8.597 0.076 18990 4665 1 7 . 1 1 383 383 ARG N N 383 129.347 129.347 123.974 5.373 18990 4666 1 7 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.361 -0.340 18990 4667 1 7 . 1 1 383 383 ARG C C 383 175.012 175.012 176.066 -1.054 18990 4668 1 7 . 1 1 383 383 ARG CA C 383 58.686 58.686 57.887 0.799 18990 4669 1 7 . 1 1 383 383 ARG CB C 383 30.900 30.900 29.568 1.332 18990 4670 1 7 . 1 1 383 383 ARG H H 383 9.534 9.534 8.787 0.747 18990 4671 1 7 . 1 1 384 384 ASN N N 384 117.772 117.772 116.741 1.031 18990 4672 1 7 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.818 -0.110 18990 4673 1 7 . 1 1 384 384 ASN C C 384 175.656 175.656 174.810 0.846 18990 4674 1 7 . 1 1 384 384 ASN CA C 384 55.778 55.778 54.123 1.655 18990 4675 1 7 . 1 1 384 384 ASN CB C 384 39.475 39.475 41.115 -1.640 18990 4676 1 7 . 1 1 384 384 ASN H H 384 8.840 8.840 7.890 0.950 18990 4677 1 7 . 1 1 385 385 CYS N N 385 115.876 115.876 113.284 2.592 18990 4678 1 7 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.935 0.093 18990 4679 1 7 . 1 1 385 385 CYS C C 385 175.703 175.703 173.964 1.739 18990 4680 1 7 . 1 1 385 385 CYS CA C 385 58.112 58.112 57.193 0.919 18990 4681 1 7 . 1 1 385 385 CYS CB C 385 32.359 32.359 30.464 1.895 18990 4682 1 7 . 1 1 385 385 CYS H H 385 7.868 7.868 7.955 -0.087 18990 4683 1 7 . 1 1 386 386 LEU N N 386 120.082 120.082 119.581 0.501 18990 4684 1 7 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.798 -0.485 18990 4685 1 7 . 1 1 386 386 LEU C C 386 175.722 175.722 176.924 -1.202 18990 4686 1 7 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.565 2.444 18990 4687 1 7 . 1 1 386 386 LEU CB C 386 38.412 38.412 41.514 -3.102 18990 4688 1 7 . 1 1 386 386 LEU H H 386 8.514 8.514 8.398 0.116 18990 4689 1 7 . 1 1 387 387 GLN N N 387 117.579 117.579 120.194 -2.615 18990 4690 1 7 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.300 0.476 18990 4691 1 7 . 1 1 387 387 GLN C C 387 175.299 175.299 176.672 -1.373 18990 4692 1 7 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.539 -1.522 18990 4693 1 7 . 1 1 387 387 GLN CB C 387 30.307 30.307 27.728 2.579 18990 4694 1 7 . 1 1 387 387 GLN H H 387 8.248 8.248 7.430 0.818 18990 4695 1 7 . 1 1 388 388 GLY N N 388 106.107 106.107 107.500 -1.393 18990 4696 1 7 . 1 1 388 388 GLY C C 388 173.693 173.693 173.938 -0.245 18990 4697 1 7 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.197 0.983 18990 4698 1 7 . 1 1 388 388 GLY H H 388 8.695 8.695 8.220 0.475 18990 4699 1 7 . 1 1 389 389 TYR N N 389 122.514 122.514 118.433 4.081 18990 4700 1 7 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.154 -0.496 18990 4701 1 7 . 1 1 389 389 TYR C C 389 172.860 172.860 174.561 -1.701 18990 4702 1 7 . 1 1 389 389 TYR CA C 389 62.987 62.987 59.188 3.799 18990 4703 1 7 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.081 0.971 18990 4704 1 7 . 1 1 389 389 TYR H H 389 7.923 7.923 8.336 -0.413 18990 4705 1 7 . 1 1 390 390 HIS N N 390 120.080 120.080 121.574 -1.494 18990 4706 1 7 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.710 -0.002 18990 4707 1 7 . 1 1 390 390 HIS C C 390 173.235 173.235 174.741 -1.506 18990 4708 1 7 . 1 1 390 390 HIS CA C 390 51.431 51.431 55.430 -3.999 18990 4709 1 7 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.170 0.730 18990 4710 1 7 . 1 1 390 390 HIS H H 390 5.291 5.291 8.042 -2.751 18990 4711 1 7 . 1 1 391 391 ILE N N 391 117.810 117.810 121.494 -3.684 18990 4712 1 7 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.002 0.114 18990 4713 1 7 . 1 1 391 391 ILE C C 391 178.208 178.208 177.067 1.141 18990 4714 1 7 . 1 1 391 391 ILE CA C 391 60.877 60.877 60.081 0.795 18990 4715 1 7 . 1 1 391 391 ILE CB C 391 39.034 39.034 37.999 1.035 18990 4716 1 7 . 1 1 391 391 ILE H H 391 8.418 8.418 6.891 1.527 18990 4717 1 7 . 1 1 392 392 GLY N N 392 112.387 112.387 112.603 -0.216 18990 4718 1 7 . 1 1 392 392 GLY C C 392 173.565 173.565 173.753 -0.188 18990 4719 1 7 . 1 1 392 392 GLY CA C 392 45.258 45.258 46.367 -1.109 18990 4720 1 7 . 1 1 392 392 GLY H H 392 8.654 8.654 8.315 0.339 18990 4721 1 7 . 1 1 393 393 GLU N N 393 119.098 119.098 118.561 0.537 18990 4722 1 7 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.690 -0.401 18990 4723 1 7 . 1 1 393 393 GLU C C 393 176.899 176.899 175.378 1.521 18990 4724 1 7 . 1 1 393 393 GLU CA C 393 56.433 56.433 54.692 1.741 18990 4725 1 7 . 1 1 393 393 GLU CB C 393 30.470 30.470 31.977 -1.507 18990 4726 1 7 . 1 1 393 393 GLU H H 393 8.391 8.391 8.205 0.186 18990 4727 1 7 . 1 1 394 394 CYS N N 394 122.845 122.845 121.663 1.182 18990 4728 1 7 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.666 -0.900 18990 4729 1 7 . 1 1 394 394 CYS C C 394 175.461 175.461 174.600 0.861 18990 4730 1 7 . 1 1 394 394 CYS CA C 394 59.835 59.835 57.913 1.922 18990 4731 1 7 . 1 1 394 394 CYS CB C 394 30.761 30.761 28.599 2.162 18990 4732 1 7 . 1 1 394 394 CYS H H 394 8.474 8.474 8.866 -0.392 18990 4733 1 7 . 1 1 395 395 LEU N N 395 124.403 124.403 122.805 1.598 18990 4734 1 7 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.534 -0.030 18990 4735 1 7 . 1 1 395 395 LEU C C 395 175.259 175.259 175.935 -0.676 18990 4736 1 7 . 1 1 395 395 LEU CA C 395 52.835 52.835 53.429 -0.594 18990 4737 1 7 . 1 1 395 395 LEU CB C 395 41.436 41.436 41.833 -0.397 18990 4738 1 7 . 1 1 395 395 LEU H H 395 8.418 8.418 8.296 0.122 18990 4739 1 7 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.582 -0.212 18990 4740 1 7 . 1 1 396 396 PRO C C 396 177.006 177.006 177.057 -0.051 18990 4741 1 7 . 1 1 396 396 PRO CA C 396 63.096 63.096 61.940 1.156 18990 4742 1 7 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.587 -0.515 18990 4743 1 7 . 1 1 397 397 GLU N N 397 121.574 121.574 119.381 2.193 18990 4744 1 7 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.061 0.164 18990 4745 1 7 . 1 1 397 397 GLU C C 397 177.202 177.202 178.450 -1.248 18990 4746 1 7 . 1 1 397 397 GLU CA C 397 57.034 57.034 58.542 -1.508 18990 4747 1 7 . 1 1 397 397 GLU CB C 397 30.263 30.263 29.731 0.532 18990 4748 1 7 . 1 1 397 397 GLU H H 397 8.568 8.568 8.576 -0.008 18990 4749 1 7 . 1 1 398 398 GLY N N 398 110.495 110.495 107.316 3.179 18990 4750 1 7 . 1 1 398 398 GLY C C 398 174.579 174.579 175.556 -0.977 18990 4751 1 7 . 1 1 398 398 GLY CA C 398 45.462 45.462 46.544 -1.082 18990 4752 1 7 . 1 1 398 398 GLY H H 398 8.515 8.515 8.318 0.197 18990 4753 1 7 . 1 1 399 399 THR N N 399 113.234 113.234 119.964 -6.730 18990 4754 1 7 . 1 1 399 399 THR HA H 399 4.398 4.398 4.547 -0.149 18990 4755 1 7 . 1 1 399 399 THR C C 399 175.333 175.333 174.964 0.369 18990 4756 1 7 . 1 1 399 399 THR CA C 399 62.233 62.233 60.755 1.478 18990 4757 1 7 . 1 1 399 399 THR CB C 399 69.833 69.833 69.863 -0.030 18990 4758 1 7 . 1 1 399 399 THR H H 399 8.090 8.090 8.184 -0.094 18990 4759 1 7 . 1 1 400 400 GLY N N 400 111.479 111.479 110.709 0.770 18990 4760 1 7 . 1 1 400 400 GLY C C 400 174.048 174.048 174.256 -0.208 18990 4761 1 7 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.597 -0.159 18990 4762 1 7 . 1 1 400 400 GLY H H 400 8.524 8.524 7.961 0.563 18990 4763 1 7 . 1 1 401 401 ALA N N 401 123.919 123.919 122.698 1.221 18990 4764 1 7 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.433 -0.182 18990 4765 1 7 . 1 1 401 401 ALA C C 401 177.942 177.942 177.150 0.792 18990 4766 1 7 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.367 1.363 18990 4767 1 7 . 1 1 401 401 ALA CB C 401 19.142 19.142 18.846 0.296 18990 4768 1 7 . 1 1 401 401 ALA H H 401 8.179 8.179 8.250 -0.071 18990 4769 1 7 . 1 1 402 402 SER N N 402 114.904 114.904 119.173 -4.269 18990 4770 1 7 . 1 1 402 402 SER HA H 402 4.448 4.448 4.441 0.007 18990 4771 1 7 . 1 1 402 402 SER C C 402 174.426 174.426 173.674 0.752 18990 4772 1 7 . 1 1 402 402 SER CA C 402 58.289 58.289 58.137 0.152 18990 4773 1 7 . 1 1 402 402 SER CB C 402 63.772 63.772 62.848 0.924 18990 4774 1 7 . 1 1 402 402 SER H H 402 8.305 8.305 8.672 -0.367 18990 4775 1 7 . 1 1 403 403 ALA N N 403 125.965 125.965 129.444 -3.479 18990 4776 1 7 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.571 -0.172 18990 4777 1 7 . 1 1 403 403 ALA C C 403 177.984 177.984 175.690 2.294 18990 4778 1 7 . 1 1 403 403 ALA CA C 403 52.655 52.655 52.700 -0.045 18990 4779 1 7 . 1 1 403 403 ALA CB C 403 19.138 19.138 20.557 -1.419 18990 4780 1 7 . 1 1 403 403 ALA H H 403 8.345 8.345 7.743 0.602 18990 4781 1 7 . 1 1 404 404 THR N N 404 112.790 112.790 114.145 -1.355 18990 4782 1 7 . 1 1 404 404 THR C C 404 174.420 174.420 173.689 0.731 18990 4783 1 7 . 1 1 404 404 THR CA C 404 61.988 61.988 61.565 0.423 18990 4784 1 7 . 1 1 404 404 THR CB C 404 69.688 69.688 70.126 -0.438 18990 4785 1 7 . 1 1 404 404 THR H H 404 8.118 8.118 7.996 0.122 18990 4786 1 7 . 1 1 405 405 ASN N N 405 121.050 121.050 121.365 -0.315 18990 4787 1 7 . 1 1 405 405 ASN H H 405 8.396 8.396 8.411 -0.015 18990 4788 1 7 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.565 0.013 18990 4789 1 7 . 1 1 407 407 CYS C C 407 174.489 174.489 173.744 0.745 18990 4790 1 7 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.818 -0.105 18990 4791 1 7 . 1 1 407 407 CYS CB C 407 28.102 28.102 28.192 -0.090 18990 4792 1 7 . 1 1 408 408 GLU N N 408 123.021 123.021 121.770 1.251 18990 4793 1 7 . 1 1 408 408 GLU C C 408 175.954 175.954 175.506 0.448 18990 4794 1 7 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.252 0.550 18990 4795 1 7 . 1 1 408 408 GLU CB C 408 30.328 30.328 28.106 2.222 18990 4796 1 7 . 1 1 408 408 GLU H H 408 8.415 8.415 8.244 0.171 18990 4797 1 7 . 1 1 409 409 TYR N N 409 121.015 121.015 124.512 -3.497 18990 4798 1 7 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.703 -0.049 18990 4799 1 7 . 1 1 409 409 TYR C C 409 175.613 175.613 174.043 1.570 18990 4800 1 7 . 1 1 409 409 TYR CA C 409 57.669 57.669 58.724 -1.055 18990 4801 1 7 . 1 1 409 409 TYR CB C 409 38.825 38.825 40.273 -1.448 18990 4802 1 7 . 1 1 409 409 TYR H H 409 8.135 8.135 7.898 0.237 18990 4803 1 7 . 1 1 410 410 THR N N 410 116.975 116.975 122.454 -5.479 18990 4804 1 7 . 1 1 410 410 THR HA H 410 4.306 4.306 4.387 -0.081 18990 4805 1 7 . 1 1 410 410 THR C C 410 173.846 173.846 173.221 0.625 18990 4806 1 7 . 1 1 410 410 THR CA C 410 61.730 61.730 61.653 0.077 18990 4807 1 7 . 1 1 410 410 THR CB C 410 69.914 69.914 69.937 -0.023 18990 4808 1 7 . 1 1 410 410 THR H H 410 8.060 8.060 7.972 0.088 18990 4809 1 7 . 1 1 411 411 VAL N N 411 122.900 122.900 122.972 -0.072 18990 4810 1 7 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.122 -0.069 18990 4811 1 7 . 1 1 411 411 VAL C C 411 175.275 175.275 175.056 0.219 18990 4812 1 7 . 1 1 411 411 VAL CA C 411 61.853 61.853 61.687 0.167 18990 4813 1 7 . 1 1 411 411 VAL CB C 411 32.976 32.976 32.546 0.430 18990 4814 1 7 . 1 1 411 411 VAL H H 411 8.089 8.089 7.824 0.265 18990 4815 1 7 . 1 1 412 412 ASP N N 412 125.924 125.924 121.235 4.689 18990 4816 1 7 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.773 0.077 18990 4817 1 7 . 1 1 412 412 ASP CA C 412 51.578 51.578 51.794 -0.216 18990 4818 1 7 . 1 1 412 412 ASP CB C 412 41.538 41.538 40.580 0.958 18990 4819 1 7 . 1 1 412 412 ASP H H 412 8.397 8.397 7.716 0.681 18990 4820 1 7 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.368 0.018 18990 4821 1 7 . 1 1 413 413 PRO C C 413 177.352 177.352 175.454 1.898 18990 4822 1 7 . 1 1 413 413 PRO CA C 413 63.910 63.910 63.164 0.746 18990 4823 1 7 . 1 1 413 413 PRO CB C 413 32.268 32.268 31.925 0.343 18990 4824 1 7 . 1 1 414 414 ASN N N 414 117.035 117.035 123.179 -6.144 18990 4825 1 7 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.664 0.013 18990 4826 1 7 . 1 1 414 414 ASN C C 414 175.532 175.532 174.762 0.770 18990 4827 1 7 . 1 1 414 414 ASN CA C 414 53.824 53.824 53.191 0.633 18990 4828 1 7 . 1 1 414 414 ASN CB C 414 38.728 38.728 38.972 -0.244 18990 4829 1 7 . 1 1 414 414 ASN H H 414 8.496 8.496 8.458 0.038 18990 4830 1 7 . 1 1 415 415 ARG N N 415 121.000 121.000 126.642 -5.642 18990 4831 1 7 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.669 -0.425 18990 4832 1 7 . 1 1 415 415 ARG C C 415 176.243 176.243 174.069 2.174 18990 4833 1 7 . 1 1 415 415 ARG CA C 415 56.404 56.404 55.195 1.209 18990 4834 1 7 . 1 1 415 415 ARG CB C 415 30.637 30.637 30.694 -0.057 18990 4835 1 7 . 1 1 415 415 ARG H H 415 7.804 7.804 8.525 -0.721 18990 4836 1 7 . 1 1 416 416 ALA N N 416 124.880 124.880 124.039 0.841 18990 4837 1 7 . 1 1 416 416 ALA C C 416 177.831 177.831 176.323 1.508 18990 4838 1 7 . 1 1 416 416 ALA CA C 416 52.957 52.957 52.437 0.520 18990 4839 1 7 . 1 1 416 416 ALA CB C 416 19.059 19.059 19.712 -0.653 18990 4840 1 7 . 1 1 416 416 ALA H H 416 8.189 8.189 8.414 -0.225 18990 4841 1 7 . 1 1 417 417 ALA N N 417 122.614 122.614 125.534 -2.920 18990 4842 1 7 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.567 -0.320 18990 4843 1 7 . 1 1 417 417 ALA C C 417 178.024 178.024 176.568 1.456 18990 4844 1 7 . 1 1 417 417 ALA CA C 417 52.789 52.789 52.582 0.207 18990 4845 1 7 . 1 1 417 417 ALA CB C 417 19.042 19.042 19.412 -0.370 18990 4846 1 7 . 1 1 417 417 ALA H H 417 8.169 8.169 8.291 -0.122 18990 4847 1 7 . 1 1 418 418 GLU N N 418 119.500 119.500 121.105 -1.605 18990 4848 1 7 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.494 -0.305 18990 4849 1 7 . 1 1 418 418 GLU C C 418 176.266 176.266 174.640 1.626 18990 4850 1 7 . 1 1 418 418 GLU CA C 418 56.576 56.576 56.765 -0.189 18990 4851 1 7 . 1 1 418 418 GLU CB C 418 30.307 30.307 30.801 -0.494 18990 4852 1 7 . 1 1 418 418 GLU H H 418 8.184 8.184 8.539 -0.355 18990 4853 1 7 . 1 1 419 419 ALA N N 419 124.643 124.643 127.084 -2.441 18990 4854 1 7 . 1 1 419 419 ALA HA H 419 4.250 4.250 5.112 -0.862 18990 4855 1 7 . 1 1 419 419 ALA C C 419 177.488 177.488 175.872 1.616 18990 4856 1 7 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.478 1.031 18990 4857 1 7 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.589 -1.428 18990 4858 1 7 . 1 1 419 419 ALA H H 419 8.135 8.135 8.546 -0.411 18990 4859 1 7 . 1 1 420 420 ARG N N 420 120.003 120.003 120.081 -0.078 18990 4860 1 7 . 1 1 420 420 ARG HA H 420 4.293 4.293 5.064 -0.771 18990 4861 1 7 . 1 1 420 420 ARG C C 420 176.297 176.297 174.315 1.982 18990 4862 1 7 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.495 0.438 18990 4863 1 7 . 1 1 420 420 ARG CB C 420 30.850 30.850 33.164 -2.314 18990 4864 1 7 . 1 1 420 420 ARG H H 420 8.135 8.135 8.937 -0.802 18990 4865 1 7 . 1 1 421 421 TRP N N 421 122.280 122.280 123.792 -1.512 18990 4866 1 7 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.713 -0.050 18990 4867 1 7 . 1 1 421 421 TRP C C 421 175.856 175.856 174.573 1.283 18990 4868 1 7 . 1 1 421 421 TRP CA C 421 57.404 57.404 57.359 0.045 18990 4869 1 7 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.447 -1.010 18990 4870 1 7 . 1 1 421 421 TRP H H 421 8.159 8.159 8.452 -0.293 18990 4871 1 7 . 1 1 422 422 ASP N N 422 121.980 121.980 127.465 -5.485 18990 4872 1 7 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.637 -0.142 18990 4873 1 7 . 1 1 422 422 ASP C C 422 176.184 176.184 174.684 1.500 18990 4874 1 7 . 1 1 422 422 ASP CA C 422 53.899 53.899 54.325 -0.426 18990 4875 1 7 . 1 1 422 422 ASP CB C 422 40.948 40.948 42.098 -1.150 18990 4876 1 7 . 1 1 422 422 ASP H H 422 8.135 8.135 8.096 0.039 18990 4877 1 7 . 1 1 423 423 GLU N N 423 121.990 121.990 122.911 -0.921 18990 4878 1 7 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.084 0.006 18990 4879 1 7 . 1 1 423 423 GLU C C 423 176.720 176.720 175.687 1.033 18990 4880 1 7 . 1 1 423 423 GLU CA C 423 57.169 57.169 55.827 1.342 18990 4881 1 7 . 1 1 423 423 GLU CB C 423 30.156 30.156 29.955 0.201 18990 4882 1 7 . 1 1 423 423 GLU H H 423 8.153 8.153 8.434 -0.281 18990 4883 1 7 . 1 1 424 424 ALA N N 424 123.900 123.900 122.964 0.936 18990 4884 1 7 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.493 -0.213 18990 4885 1 7 . 1 1 424 424 ALA C C 424 178.095 178.095 176.401 1.694 18990 4886 1 7 . 1 1 424 424 ALA CA C 424 53.017 53.017 51.947 1.070 18990 4887 1 7 . 1 1 424 424 ALA CB C 424 19.086 19.086 19.977 -0.890 18990 4888 1 7 . 1 1 424 424 ALA H H 424 8.243 8.243 7.714 0.529 18990 4889 1 7 . 1 1 425 425 SER N N 425 113.881 113.881 113.988 -0.107 18990 4890 1 7 . 1 1 425 425 SER HA H 425 4.387 4.387 4.533 -0.146 18990 4891 1 7 . 1 1 425 425 SER C C 425 174.338 174.338 173.365 0.973 18990 4892 1 7 . 1 1 425 425 SER CA C 425 58.546 58.546 57.584 0.962 18990 4893 1 7 . 1 1 425 425 SER CB C 425 63.784 63.784 64.480 -0.696 18990 4894 1 7 . 1 1 425 425 SER H H 425 8.063 8.063 8.263 -0.200 18990 4895 1 7 . 1 1 426 426 ASN N N 426 121.032 121.032 122.727 -1.695 18990 4896 1 7 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.789 -0.083 18990 4897 1 7 . 1 1 426 426 ASN C C 426 175.046 175.046 174.795 0.251 18990 4898 1 7 . 1 1 426 426 ASN CA C 426 53.445 53.445 52.553 0.892 18990 4899 1 7 . 1 1 426 426 ASN CB C 426 38.847 38.847 38.844 0.003 18990 4900 1 7 . 1 1 426 426 ASN H H 426 8.391 8.391 8.318 0.073 18990 4901 1 7 . 1 1 427 427 VAL N N 427 119.463 119.463 120.268 -0.805 18990 4902 1 7 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.099 0.094 18990 4903 1 7 . 1 1 427 427 VAL C C 427 176.213 176.213 175.755 0.458 18990 4904 1 7 . 1 1 427 427 VAL CA C 427 62.449 62.449 62.735 -0.286 18990 4905 1 7 . 1 1 427 427 VAL CB C 427 32.865 32.865 32.846 0.020 18990 4906 1 7 . 1 1 427 427 VAL H H 427 7.954 7.954 8.367 -0.413 18990 4907 1 7 . 1 1 428 428 THR N N 428 118.226 118.226 122.286 -4.060 18990 4908 1 7 . 1 1 428 428 THR HA H 428 4.353 4.353 4.659 -0.306 18990 4909 1 7 . 1 1 428 428 THR C C 428 174.361 174.361 174.413 -0.052 18990 4910 1 7 . 1 1 428 428 THR CA C 428 62.065 62.065 61.394 0.671 18990 4911 1 7 . 1 1 428 428 THR CB C 428 69.729 69.729 70.839 -1.110 18990 4912 1 7 . 1 1 428 428 THR H H 428 8.225 8.225 8.127 0.098 18990 4913 1 7 . 1 1 429 429 ILE N N 429 123.910 123.910 123.653 0.257 18990 4914 1 7 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.116 0.072 18990 4915 1 7 . 1 1 429 429 ILE C C 429 175.774 175.774 176.590 -0.816 18990 4916 1 7 . 1 1 429 429 ILE CA C 429 60.819 60.819 62.774 -1.955 18990 4917 1 7 . 1 1 429 429 ILE CB C 429 38.719 38.719 38.696 0.023 18990 4918 1 7 . 1 1 429 429 ILE H H 429 8.148 8.148 8.489 -0.341 18990 4919 1 7 . 1 1 430 430 LYS N N 430 126.453 126.453 120.945 5.508 18990 4920 1 7 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.319 0.115 18990 4921 1 7 . 1 1 430 430 LYS C C 430 176.241 176.241 176.001 0.240 18990 4922 1 7 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.313 0.624 18990 4923 1 7 . 1 1 430 430 LYS CB C 430 33.164 33.164 30.653 2.511 18990 4924 1 7 . 1 1 430 430 LYS H H 430 8.406 8.406 8.272 0.134 18990 4925 1 7 . 1 1 431 431 VAL N N 431 122.496 122.496 117.597 4.899 18990 4926 1 7 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.231 0.049 18990 4927 1 7 . 1 1 431 431 VAL CA C 431 62.303 62.303 61.404 0.899 18990 4928 1 7 . 1 1 431 431 VAL CB C 431 33.132 33.132 32.629 0.503 18990 4929 1 7 . 1 1 431 431 VAL H H 431 8.312 8.312 7.561 0.751 18990 4930 1 7 . 1 1 432 432 SER HA H 432 4.486 4.486 4.410 0.076 18990 4931 1 7 . 1 1 432 432 SER C C 432 173.834 173.834 174.558 -0.724 18990 4932 1 7 . 1 1 432 432 SER CA C 432 58.650 58.650 60.092 -1.442 18990 4933 1 7 . 1 1 432 432 SER CB C 432 64.152 64.152 63.037 1.115 18990 4934 1 7 . 1 1 433 433 THR N N 433 114.706 114.706 114.559 0.147 18990 4935 1 7 . 1 1 433 433 THR HA H 433 5.446 5.446 4.551 0.895 18990 4936 1 7 . 1 1 433 433 THR C C 433 173.979 173.979 174.382 -0.403 18990 4937 1 7 . 1 1 433 433 THR CA C 433 60.412 60.412 61.486 -1.074 18990 4938 1 7 . 1 1 433 433 THR CB C 433 71.896 71.896 69.263 2.633 18990 4939 1 7 . 1 1 433 433 THR H H 433 7.833 7.833 7.537 0.296 18990 4940 1 7 . 1 1 434 434 LYS N N 434 122.492 122.492 126.756 -4.264 18990 4941 1 7 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.711 -0.002 18990 4942 1 7 . 1 1 434 434 LYS C C 434 173.589 173.589 175.241 -1.652 18990 4943 1 7 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.867 1.508 18990 4944 1 7 . 1 1 434 434 LYS CB C 434 36.925 36.925 32.960 3.965 18990 4945 1 7 . 1 1 434 434 LYS H H 434 8.937 8.937 8.365 0.572 18990 4946 1 7 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.592 -0.325 18990 4947 1 7 . 1 1 435 435 PRO C C 435 175.238 175.238 176.610 -1.372 18990 4948 1 7 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.398 -1.475 18990 4949 1 7 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.724 -0.638 18990 4950 1 7 . 1 1 436 436 CYS N N 436 125.422 125.422 125.371 0.051 18990 4951 1 7 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.301 -0.871 18990 4952 1 7 . 1 1 436 436 CYS C C 436 176.770 176.770 175.523 1.247 18990 4953 1 7 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.950 0.066 18990 4954 1 7 . 1 1 436 436 CYS CB C 436 31.698 31.698 27.996 3.702 18990 4955 1 7 . 1 1 436 436 CYS H H 436 7.768 7.768 8.444 -0.676 18990 4956 1 7 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.039 -0.181 18990 4957 1 7 . 1 1 437 437 PRO C C 437 173.608 173.608 176.402 -2.794 18990 4958 1 7 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.393 -0.180 18990 4959 1 7 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.341 1.108 18990 4960 1 7 . 1 1 438 438 LYS N N 438 118.600 118.600 115.877 2.723 18990 4961 1 7 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.158 -0.188 18990 4962 1 7 . 1 1 438 438 LYS C C 438 176.887 176.887 176.807 0.080 18990 4963 1 7 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.616 0.071 18990 4964 1 7 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.962 -0.838 18990 4965 1 7 . 1 1 438 438 LYS H H 438 8.390 8.390 7.606 0.784 18990 4966 1 7 . 1 1 439 439 CYS N N 439 118.950 118.950 114.540 4.410 18990 4967 1 7 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.854 -0.108 18990 4968 1 7 . 1 1 439 439 CYS C C 439 176.650 176.650 175.076 1.574 18990 4969 1 7 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.534 1.814 18990 4970 1 7 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.426 2.770 18990 4971 1 7 . 1 1 439 439 CYS H H 439 8.357 8.357 7.735 0.622 18990 4972 1 7 . 1 1 440 440 ARG N N 440 117.200 117.200 117.674 -0.474 18990 4973 1 7 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.098 -0.130 18990 4974 1 7 . 1 1 440 440 ARG C C 440 175.253 175.253 175.715 -0.462 18990 4975 1 7 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.869 0.031 18990 4976 1 7 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.289 -1.248 18990 4977 1 7 . 1 1 440 440 ARG H H 440 8.065 8.065 7.964 0.101 18990 4978 1 7 . 1 1 441 441 THR N N 441 122.400 122.400 111.241 11.159 18990 4979 1 7 . 1 1 441 441 THR HA H 441 4.371 4.371 4.570 -0.199 18990 4980 1 7 . 1 1 441 441 THR C C 441 173.702 173.702 173.037 0.665 18990 4981 1 7 . 1 1 441 441 THR CA C 441 63.194 63.194 59.326 3.868 18990 4982 1 7 . 1 1 441 441 THR CB C 441 68.933 68.933 69.400 -0.467 18990 4983 1 7 . 1 1 441 441 THR H H 441 8.643 8.643 7.560 1.083 18990 4984 1 7 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.678 -0.531 18990 4985 1 7 . 1 1 442 442 PRO C C 442 176.215 176.215 176.204 0.011 18990 4986 1 7 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.663 1.534 18990 4987 1 7 . 1 1 442 442 PRO CB C 442 32.044 32.044 31.148 0.896 18990 4988 1 7 . 1 1 443 443 THR N N 443 122.932 122.932 122.332 0.600 18990 4989 1 7 . 1 1 443 443 THR HA H 443 4.665 4.665 4.384 0.281 18990 4990 1 7 . 1 1 443 443 THR C C 443 172.133 172.133 174.336 -2.203 18990 4991 1 7 . 1 1 443 443 THR CA C 443 62.566 62.566 62.668 -0.102 18990 4992 1 7 . 1 1 443 443 THR CB C 443 71.562 71.562 69.292 2.270 18990 4993 1 7 . 1 1 443 443 THR H H 443 9.116 9.116 8.832 0.284 18990 4994 1 7 . 1 1 444 444 GLU N N 444 126.390 126.390 127.499 -1.109 18990 4995 1 7 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.393 0.549 18990 4996 1 7 . 1 1 444 444 GLU C C 444 175.292 175.292 175.356 -0.064 18990 4997 1 7 . 1 1 444 444 GLU CA C 444 55.049 55.049 56.469 -1.421 18990 4998 1 7 . 1 1 444 444 GLU CB C 444 31.861 31.861 29.853 2.008 18990 4999 1 7 . 1 1 444 444 GLU H H 444 8.720 8.720 8.707 0.013 18990 5000 1 7 . 1 1 445 445 ARG N N 445 123.505 123.505 125.253 -1.748 18990 5001 1 7 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.494 -0.783 18990 5002 1 7 . 1 1 445 445 ARG C C 445 175.289 175.289 175.445 -0.156 18990 5003 1 7 . 1 1 445 445 ARG CA C 445 55.856 55.856 55.509 0.347 18990 5004 1 7 . 1 1 445 445 ARG CB C 445 30.675 30.675 31.326 -0.651 18990 5005 1 7 . 1 1 445 445 ARG H H 445 8.157 8.157 8.354 -0.197 18990 5006 1 7 . 1 1 446 446 ASP N N 446 126.800 126.800 124.771 2.029 18990 5007 1 7 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.684 -0.043 18990 5008 1 7 . 1 1 446 446 ASP C C 446 176.020 176.020 176.220 -0.200 18990 5009 1 7 . 1 1 446 446 ASP CA C 446 52.952 52.952 54.545 -1.593 18990 5010 1 7 . 1 1 446 446 ASP CB C 446 41.400 41.400 42.253 -0.853 18990 5011 1 7 . 1 1 446 446 ASP H H 446 8.476 8.476 8.575 -0.099 18990 5012 1 7 . 1 1 447 447 GLY N N 447 111.262 111.262 110.262 1.000 18990 5013 1 7 . 1 1 447 447 GLY C C 447 174.073 174.073 175.134 -1.061 18990 5014 1 7 . 1 1 447 447 GLY CA C 447 45.832 45.832 44.631 1.201 18990 5015 1 7 . 1 1 447 447 GLY H H 447 8.056 8.056 8.283 -0.227 18990 5016 1 7 . 1 1 448 448 GLY N N 448 108.655 108.655 107.775 0.880 18990 5017 1 7 . 1 1 448 448 GLY C C 448 174.020 174.020 174.394 -0.374 18990 5018 1 7 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.533 0.733 18990 5019 1 7 . 1 1 448 448 GLY H H 448 8.380 8.380 8.010 0.370 18990 5020 1 7 . 1 1 449 449 CYS N N 449 120.628 120.628 125.676 -5.048 18990 5021 1 7 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.444 -0.447 18990 5022 1 7 . 1 1 449 449 CYS C C 449 174.855 174.855 175.821 -0.966 18990 5023 1 7 . 1 1 449 449 CYS CA C 449 59.291 59.291 57.342 1.949 18990 5024 1 7 . 1 1 449 449 CYS CB C 449 28.000 28.000 27.326 0.674 18990 5025 1 7 . 1 1 449 449 CYS H H 449 7.832 7.832 8.588 -0.756 18990 5026 1 7 . 1 1 450 450 MET N N 450 123.947 123.947 119.354 4.593 18990 5027 1 7 . 1 1 450 450 MET HA H 450 4.551 4.551 3.934 0.617 18990 5028 1 7 . 1 1 450 450 MET C C 450 174.658 174.658 173.931 0.727 18990 5029 1 7 . 1 1 450 450 MET CA C 450 54.970 54.970 57.535 -2.565 18990 5030 1 7 . 1 1 450 450 MET CB C 450 34.100 34.100 31.151 2.949 18990 5031 1 7 . 1 1 450 450 MET H H 450 8.916 8.916 8.193 0.723 18990 5032 1 7 . 1 1 451 451 HIS N N 451 120.490 120.490 120.358 0.132 18990 5033 1 7 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.038 -0.359 18990 5034 1 7 . 1 1 451 451 HIS C C 451 172.443 172.443 174.124 -1.681 18990 5035 1 7 . 1 1 451 451 HIS CA C 451 53.812 53.812 55.139 -1.327 18990 5036 1 7 . 1 1 451 451 HIS CB C 451 28.900 28.900 30.082 -1.182 18990 5037 1 7 . 1 1 451 451 HIS H H 451 7.557 7.557 7.937 -0.380 18990 5038 1 7 . 1 1 452 452 MET N N 452 128.800 128.800 127.016 1.784 18990 5039 1 7 . 1 1 452 452 MET HA H 452 4.320 4.320 4.241 0.079 18990 5040 1 7 . 1 1 452 452 MET C C 452 175.479 175.479 174.033 1.446 18990 5041 1 7 . 1 1 452 452 MET CA C 452 52.589 52.589 52.761 -0.172 18990 5042 1 7 . 1 1 452 452 MET CB C 452 28.074 28.074 32.148 -4.074 18990 5043 1 7 . 1 1 452 452 MET H H 452 9.087 9.087 7.734 1.353 18990 5044 1 7 . 1 1 453 453 VAL N N 453 122.200 122.200 122.342 -0.142 18990 5045 1 7 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.204 0.590 18990 5046 1 7 . 1 1 453 453 VAL C C 453 175.476 175.476 174.748 0.728 18990 5047 1 7 . 1 1 453 453 VAL CA C 453 61.380 61.380 60.222 1.158 18990 5048 1 7 . 1 1 453 453 VAL CB C 453 33.089 33.089 33.230 -0.141 18990 5049 1 7 . 1 1 453 453 VAL H H 453 8.016 8.016 8.229 -0.213 18990 5050 1 7 . 1 1 454 454 CYS N N 454 130.353 130.353 128.257 2.096 18990 5051 1 7 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.790 -0.195 18990 5052 1 7 . 1 1 454 454 CYS C C 454 177.833 177.833 174.967 2.866 18990 5053 1 7 . 1 1 454 454 CYS CA C 454 61.571 61.571 57.819 3.752 18990 5054 1 7 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.953 5.092 18990 5055 1 7 . 1 1 454 454 CYS H H 454 8.989 8.989 8.565 0.424 18990 5056 1 7 . 1 1 455 455 THR N N 455 119.000 119.000 122.186 -3.186 18990 5057 1 7 . 1 1 455 455 THR HA H 455 4.393 4.393 4.386 0.007 18990 5058 1 7 . 1 1 455 455 THR C C 455 175.264 175.264 173.812 1.452 18990 5059 1 7 . 1 1 455 455 THR CA C 455 61.644 61.644 61.837 -0.193 18990 5060 1 7 . 1 1 455 455 THR CB C 455 69.400 69.400 68.579 0.821 18990 5061 1 7 . 1 1 455 455 THR H H 455 8.533 8.533 8.530 0.003 18990 5062 1 7 . 1 1 456 456 ARG N N 456 128.900 128.900 127.002 1.898 18990 5063 1 7 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.568 -0.343 18990 5064 1 7 . 1 1 456 456 ARG C C 456 177.782 177.782 175.152 2.630 18990 5065 1 7 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.533 2.417 18990 5066 1 7 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.867 -3.817 18990 5067 1 7 . 1 1 456 456 ARG H H 456 9.036 9.036 7.801 1.235 18990 5068 1 7 . 1 1 457 457 ALA N N 457 133.152 133.152 127.398 5.754 18990 5069 1 7 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.249 -0.103 18990 5070 1 7 . 1 1 457 457 ALA C C 457 178.757 178.757 177.624 1.133 18990 5071 1 7 . 1 1 457 457 ALA CA C 457 53.929 53.929 53.051 0.878 18990 5072 1 7 . 1 1 457 457 ALA CB C 457 17.710 17.710 17.802 -0.092 18990 5073 1 7 . 1 1 457 457 ALA H H 457 9.042 9.042 8.791 0.251 18990 5074 1 7 . 1 1 458 458 GLY N N 458 111.200 111.200 110.217 0.983 18990 5075 1 7 . 1 1 458 458 GLY C C 458 173.558 173.558 174.312 -0.754 18990 5076 1 7 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.808 0.628 18990 5077 1 7 . 1 1 458 458 GLY H H 458 8.830 8.830 8.391 0.439 18990 5078 1 7 . 1 1 459 459 CYS N N 459 123.040 123.040 120.391 2.649 18990 5079 1 7 . 1 1 459 459 CYS HA H 459 4.622 4.622 5.151 -0.529 18990 5080 1 7 . 1 1 459 459 CYS C C 459 176.591 176.591 175.164 1.427 18990 5081 1 7 . 1 1 459 459 CYS CA C 459 60.499 60.499 58.965 1.534 18990 5082 1 7 . 1 1 459 459 CYS CB C 459 30.174 30.174 28.904 1.270 18990 5083 1 7 . 1 1 459 459 CYS H H 459 8.042 8.042 8.513 -0.471 18990 5084 1 7 . 1 1 460 460 GLY N N 460 104.500 104.500 110.341 -5.841 18990 5085 1 7 . 1 1 460 460 GLY C C 460 173.716 173.716 173.889 -0.173 18990 5086 1 7 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.453 0.555 18990 5087 1 7 . 1 1 460 460 GLY H H 460 7.705 7.705 8.156 -0.451 18990 5088 1 7 . 1 1 461 461 PHE N N 461 124.949 124.949 122.747 2.202 18990 5089 1 7 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.571 0.009 18990 5090 1 7 . 1 1 461 461 PHE C C 461 174.447 174.447 174.505 -0.058 18990 5091 1 7 . 1 1 461 461 PHE CA C 461 59.946 59.946 57.031 2.915 18990 5092 1 7 . 1 1 461 461 PHE CB C 461 41.300 41.300 40.312 0.988 18990 5093 1 7 . 1 1 461 461 PHE H H 461 8.947 8.947 7.628 1.319 18990 5094 1 7 . 1 1 462 462 GLU N N 462 125.272 125.272 128.528 -3.256 18990 5095 1 7 . 1 1 462 462 GLU HA H 462 5.721 5.721 5.143 0.578 18990 5096 1 7 . 1 1 462 462 GLU C C 462 176.067 176.067 175.682 0.385 18990 5097 1 7 . 1 1 462 462 GLU CA C 462 54.624 54.624 54.594 0.030 18990 5098 1 7 . 1 1 462 462 GLU CB C 462 31.255 31.255 30.847 0.408 18990 5099 1 7 . 1 1 462 462 GLU H H 462 7.799 7.799 7.882 -0.083 18990 5100 1 7 . 1 1 463 463 TRP N N 463 121.524 121.524 120.386 1.138 18990 5101 1 7 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.694 -0.188 18990 5102 1 7 . 1 1 463 463 TRP C C 463 172.844 172.844 174.597 -1.753 18990 5103 1 7 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.166 -0.395 18990 5104 1 7 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.702 0.034 18990 5105 1 7 . 1 1 463 463 TRP H H 463 9.300 9.300 8.855 0.445 18990 5106 1 7 . 1 1 464 464 CYS N N 464 120.868 120.868 120.036 0.832 18990 5107 1 7 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.169 1.247 18990 5108 1 7 . 1 1 464 464 CYS C C 464 177.213 177.213 176.079 1.134 18990 5109 1 7 . 1 1 464 464 CYS CA C 464 57.776 57.776 59.218 -1.442 18990 5110 1 7 . 1 1 464 464 CYS CB C 464 32.930 32.930 29.311 3.619 18990 5111 1 7 . 1 1 464 464 CYS H H 464 8.752 8.752 8.870 -0.118 18990 5112 1 7 . 1 1 465 465 TRP N N 465 131.209 131.209 128.328 2.881 18990 5113 1 7 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.421 0.006 18990 5114 1 7 . 1 1 465 465 TRP C C 465 176.051 176.051 176.234 -0.183 18990 5115 1 7 . 1 1 465 465 TRP CA C 465 60.763 60.763 59.441 1.322 18990 5116 1 7 . 1 1 465 465 TRP CB C 465 31.126 31.126 30.055 1.071 18990 5117 1 7 . 1 1 465 465 TRP H H 465 9.809 9.809 8.360 1.449 18990 5118 1 7 . 1 1 466 466 VAL N N 466 118.233 118.233 114.040 4.193 18990 5119 1 7 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.747 -0.123 18990 5120 1 7 . 1 1 466 466 VAL C C 466 178.943 178.943 175.385 3.558 18990 5121 1 7 . 1 1 466 466 VAL CA C 466 65.602 65.602 62.519 3.083 18990 5122 1 7 . 1 1 466 466 VAL CB C 466 33.172 33.172 32.038 1.134 18990 5123 1 7 . 1 1 466 466 VAL H H 466 8.627 8.627 7.562 1.065 18990 5124 1 7 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.777 -1.346 18990 5125 1 7 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.683 0.316 18990 5126 1 7 . 1 1 467 467 CYS CB C 467 31.870 31.870 31.383 0.488 18990 5127 1 7 . 1 1 467 467 CYS H H 467 7.820 7.820 7.561 0.259 18990 5128 1 7 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.649 -0.613 18990 5129 1 7 . 1 1 468 468 GLN CA C 468 58.051 58.051 56.202 1.849 18990 5130 1 7 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.635 -2.159 18990 5131 1 7 . 1 1 469 469 THR HA H 469 4.685 4.685 4.771 -0.086 18990 5132 1 7 . 1 1 469 469 THR C C 469 173.351 173.351 173.231 0.120 18990 5133 1 7 . 1 1 469 469 THR CA C 469 59.176 59.176 60.869 -1.693 18990 5134 1 7 . 1 1 469 469 THR CB C 469 71.775 71.775 71.132 0.644 18990 5135 1 7 . 1 1 470 470 GLU N N 470 120.940 120.940 119.454 1.486 18990 5136 1 7 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.747 -0.454 18990 5137 1 7 . 1 1 470 470 GLU C C 470 175.539 175.539 176.850 -1.311 18990 5138 1 7 . 1 1 470 470 GLU CA C 470 57.015 57.015 54.723 2.292 18990 5139 1 7 . 1 1 470 470 GLU CB C 470 29.965 29.965 30.729 -0.764 18990 5140 1 7 . 1 1 470 470 GLU H H 470 8.912 8.912 8.591 0.321 18990 5141 1 7 . 1 1 471 471 TRP N N 471 126.998 126.998 122.071 4.927 18990 5142 1 7 . 1 1 471 471 TRP HA H 471 4.293 4.293 3.778 0.515 18990 5143 1 7 . 1 1 471 471 TRP C C 471 175.408 175.408 174.697 0.711 18990 5144 1 7 . 1 1 471 471 TRP CA C 471 58.220 58.220 57.845 0.375 18990 5145 1 7 . 1 1 471 471 TRP CB C 471 29.500 29.500 28.932 0.568 18990 5146 1 7 . 1 1 471 471 TRP H H 471 8.350 8.350 8.188 0.162 18990 5147 1 7 . 1 1 472 472 THR N N 472 117.480 117.480 113.750 3.730 18990 5148 1 7 . 1 1 472 472 THR HA H 472 4.444 4.444 4.312 0.132 18990 5149 1 7 . 1 1 472 472 THR CA C 472 58.930 58.930 59.390 -0.460 18990 5150 1 7 . 1 1 472 472 THR H H 472 8.069 8.069 7.063 1.006 18990 5151 1 7 . 1 1 473 473 ARG HA H 473 3.773 3.773 4.022 -0.249 18990 5152 1 7 . 1 1 473 473 ARG C C 473 178.053 178.053 178.118 -0.065 18990 5153 1 7 . 1 1 473 473 ARG CA C 473 58.088 58.088 57.702 0.386 18990 5154 1 7 . 1 1 473 473 ARG CB C 473 29.426 29.426 29.580 -0.154 18990 5155 1 7 . 1 1 474 474 ASP N N 474 119.900 119.900 119.790 0.110 18990 5156 1 7 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.470 -0.255 18990 5157 1 7 . 1 1 474 474 ASP C C 474 178.197 178.197 177.500 0.697 18990 5158 1 7 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.933 -0.131 18990 5159 1 7 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.713 -0.531 18990 5160 1 7 . 1 1 474 474 ASP H H 474 7.718 7.718 8.520 -0.802 18990 5161 1 7 . 1 1 475 475 CYS N N 475 121.000 121.000 118.688 2.312 18990 5162 1 7 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.349 -0.982 18990 5163 1 7 . 1 1 475 475 CYS CA C 475 64.533 64.533 60.141 4.392 18990 5164 1 7 . 1 1 475 475 CYS CB C 475 29.092 29.092 26.952 2.140 18990 5165 1 7 . 1 1 475 475 CYS H H 475 6.953 6.953 7.775 -0.822 18990 5166 1 7 . 1 1 476 476 MET HA H 476 4.021 4.021 4.146 -0.125 18990 5167 1 7 . 1 1 476 476 MET CA C 476 58.010 58.010 58.853 -0.843 18990 5168 1 7 . 1 1 476 476 MET CB C 476 32.550 32.550 32.447 0.103 18990 5169 1 7 . 1 1 477 477 GLY N N 477 111.938 111.938 103.276 8.662 18990 5170 1 7 . 1 1 477 477 GLY C C 477 174.406 174.406 173.748 0.658 18990 5171 1 7 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.806 0.810 18990 5172 1 7 . 1 1 477 477 GLY H H 477 9.155 9.155 7.762 1.393 18990 5173 1 7 . 1 1 478 478 ALA N N 478 121.900 121.900 124.655 -2.755 18990 5174 1 7 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.497 -0.206 18990 5175 1 7 . 1 1 478 478 ALA C C 478 178.196 178.196 177.208 0.988 18990 5176 1 7 . 1 1 478 478 ALA CA C 478 53.440 53.440 52.961 0.479 18990 5177 1 7 . 1 1 478 478 ALA CB C 478 20.390 20.390 19.974 0.415 18990 5178 1 7 . 1 1 478 478 ALA H H 478 7.347 7.347 8.202 -0.855 18990 5179 1 7 . 1 1 479 479 HIS N N 479 115.200 115.200 111.632 3.568 18990 5180 1 7 . 1 1 479 479 HIS HA H 479 4.903 4.903 5.361 -0.458 18990 5181 1 7 . 1 1 479 479 HIS C C 479 173.325 173.325 176.067 -2.742 18990 5182 1 7 . 1 1 479 479 HIS CA C 479 54.526 54.526 54.695 -0.169 18990 5183 1 7 . 1 1 479 479 HIS CB C 479 27.600 27.600 31.011 -3.411 18990 5184 1 7 . 1 1 479 479 HIS H H 479 8.297 8.297 8.110 0.187 18990 5185 1 7 . 1 1 480 480 TRP N N 480 121.780 121.780 124.294 -2.514 18990 5186 1 7 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.567 -0.272 18990 5187 1 7 . 1 1 480 480 TRP C C 480 175.568 175.568 174.741 0.827 18990 5188 1 7 . 1 1 480 480 TRP CA C 480 58.358 58.358 61.320 -2.962 18990 5189 1 7 . 1 1 480 480 TRP CB C 480 29.550 29.550 30.504 -0.954 18990 5190 1 7 . 1 1 480 480 TRP H H 480 8.081 8.081 8.164 -0.083 18990 5191 1 7 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.482 0.363 18990 5192 1 7 . 1 1 481 481 PHE C C 481 175.126 175.126 175.005 0.121 18990 5193 1 7 . 1 1 481 481 PHE CA C 481 56.471 56.471 57.363 -0.892 18990 5194 1 7 . 1 1 481 481 PHE CB C 481 41.006 41.006 40.091 0.915 18990 5195 1 8 . 1 1 343 343 GLU N N 343 121.045 121.045 122.047 -1.002 18990 5196 1 8 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.350 -0.185 18990 5197 1 8 . 1 1 343 343 GLU C C 343 176.529 176.529 175.219 1.310 18990 5198 1 8 . 1 1 343 343 GLU CA C 343 57.162 57.162 56.234 0.928 18990 5199 1 8 . 1 1 343 343 GLU CB C 343 30.204 30.204 28.964 1.240 18990 5200 1 8 . 1 1 343 343 GLU H H 343 8.293 8.293 8.169 0.124 18990 5201 1 8 . 1 1 344 344 TYR N N 344 121.000 121.000 123.400 -2.400 18990 5202 1 8 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.728 -0.190 18990 5203 1 8 . 1 1 344 344 TYR C C 344 175.897 175.897 174.788 1.109 18990 5204 1 8 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.554 0.625 18990 5205 1 8 . 1 1 344 344 TYR CB C 344 38.600 38.600 40.314 -1.714 18990 5206 1 8 . 1 1 344 344 TYR H H 344 8.040 8.040 8.291 -0.251 18990 5207 1 8 . 1 1 345 345 VAL N N 345 121.900 121.900 125.447 -3.547 18990 5208 1 8 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.492 -0.553 18990 5209 1 8 . 1 1 345 345 VAL C C 345 176.143 176.143 174.441 1.702 18990 5210 1 8 . 1 1 345 345 VAL CA C 345 62.867 62.867 62.150 0.717 18990 5211 1 8 . 1 1 345 345 VAL CB C 345 32.799 32.799 32.669 0.130 18990 5212 1 8 . 1 1 345 345 VAL H H 345 7.856 7.856 8.545 -0.689 18990 5213 1 8 . 1 1 346 346 LEU N N 346 124.950 124.950 126.756 -1.806 18990 5214 1 8 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.897 -0.654 18990 5215 1 8 . 1 1 346 346 LEU C C 346 177.747 177.747 175.196 2.551 18990 5216 1 8 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.706 0.794 18990 5217 1 8 . 1 1 346 346 LEU CB C 346 42.252 42.252 44.151 -1.899 18990 5218 1 8 . 1 1 346 346 LEU H H 346 8.127 8.127 8.234 -0.107 18990 5219 1 8 . 1 1 347 347 GLN N N 347 121.452 121.452 121.316 0.136 18990 5220 1 8 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.571 -0.285 18990 5221 1 8 . 1 1 347 347 GLN C C 347 175.833 175.833 173.942 1.891 18990 5222 1 8 . 1 1 347 347 GLN CA C 347 55.988 55.988 54.994 0.994 18990 5223 1 8 . 1 1 347 347 GLN CB C 347 29.375 29.375 31.460 -2.085 18990 5224 1 8 . 1 1 347 347 GLN H H 347 8.270 8.270 8.682 -0.412 18990 5225 1 8 . 1 1 348 348 ALA N N 348 124.466 124.466 125.654 -1.188 18990 5226 1 8 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.732 -0.411 18990 5227 1 8 . 1 1 348 348 ALA C C 348 177.929 177.929 176.796 1.133 18990 5228 1 8 . 1 1 348 348 ALA CA C 348 52.703 52.703 52.172 0.531 18990 5229 1 8 . 1 1 348 348 ALA CB C 348 19.002 19.002 18.471 0.531 18990 5230 1 8 . 1 1 348 348 ALA H H 348 8.227 8.227 8.596 -0.369 18990 5231 1 8 . 1 1 349 349 GLY N N 349 108.193 108.193 110.768 -2.575 18990 5232 1 8 . 1 1 349 349 GLY C C 349 174.269 174.269 173.949 0.320 18990 5233 1 8 . 1 1 349 349 GLY CA C 349 45.227 45.227 45.801 -0.574 18990 5234 1 8 . 1 1 349 349 GLY H H 349 8.298 8.298 8.584 -0.286 18990 5235 1 8 . 1 1 350 350 GLY N N 350 108.073 108.073 107.670 0.403 18990 5236 1 8 . 1 1 350 350 GLY C C 350 172.979 172.979 173.075 -0.096 18990 5237 1 8 . 1 1 350 350 GLY CA C 350 44.935 44.935 44.136 0.799 18990 5238 1 8 . 1 1 350 350 GLY H H 350 8.156 8.156 7.779 0.377 18990 5239 1 8 . 1 1 351 351 VAL N N 351 119.058 119.058 118.274 0.784 18990 5240 1 8 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.570 -0.154 18990 5241 1 8 . 1 1 351 351 VAL C C 351 173.412 173.412 174.802 -1.390 18990 5242 1 8 . 1 1 351 351 VAL CA C 351 60.663 60.663 60.079 0.584 18990 5243 1 8 . 1 1 351 351 VAL CB C 351 34.866 34.866 35.034 -0.168 18990 5244 1 8 . 1 1 351 351 VAL H H 351 8.541 8.541 8.546 -0.005 18990 5245 1 8 . 1 1 352 352 LEU N N 352 125.800 125.800 121.965 3.835 18990 5246 1 8 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.688 0.077 18990 5247 1 8 . 1 1 352 352 LEU C C 352 176.218 176.218 175.705 0.513 18990 5248 1 8 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.194 0.147 18990 5249 1 8 . 1 1 352 352 LEU CB C 352 42.706 42.706 43.653 -0.947 18990 5250 1 8 . 1 1 352 352 LEU H H 352 8.151 8.151 8.258 -0.107 18990 5251 1 8 . 1 1 353 353 CYS N N 353 126.825 126.825 123.732 3.093 18990 5252 1 8 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.242 -0.135 18990 5253 1 8 . 1 1 353 353 CYS C C 353 176.655 176.655 174.475 2.180 18990 5254 1 8 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.259 0.472 18990 5255 1 8 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.418 4.447 18990 5256 1 8 . 1 1 353 353 CYS H H 353 8.794 8.794 8.469 0.325 18990 5257 1 8 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.250 0.170 18990 5258 1 8 . 1 1 354 354 PRO C C 354 177.512 177.512 175.963 1.549 18990 5259 1 8 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.227 -0.235 18990 5260 1 8 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.334 1.233 18990 5261 1 8 . 1 1 355 355 GLN N N 355 126.800 126.800 119.832 6.968 18990 5262 1 8 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.557 -0.282 18990 5263 1 8 . 1 1 355 355 GLN C C 355 175.516 175.516 174.250 1.266 18990 5264 1 8 . 1 1 355 355 GLN CA C 355 54.793 54.793 52.502 2.291 18990 5265 1 8 . 1 1 355 355 GLN CB C 355 28.547 28.547 28.119 0.428 18990 5266 1 8 . 1 1 355 355 GLN H H 355 9.033 9.033 7.474 1.559 18990 5267 1 8 . 1 1 357 357 GLY C C 357 173.229 173.229 174.710 -1.481 18990 5268 1 8 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.768 0.486 18990 5269 1 8 . 1 1 358 358 CYS N N 358 123.500 123.500 120.494 3.006 18990 5270 1 8 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.670 -0.137 18990 5271 1 8 . 1 1 358 358 CYS C C 358 176.157 176.157 176.340 -0.183 18990 5272 1 8 . 1 1 358 358 CYS CA C 358 60.268 60.268 59.916 0.352 18990 5273 1 8 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.223 1.152 18990 5274 1 8 . 1 1 358 358 CYS H H 358 7.720 7.720 7.934 -0.214 18990 5275 1 8 . 1 1 359 359 GLY N N 359 104.400 104.400 109.164 -4.764 18990 5276 1 8 . 1 1 359 359 GLY C C 359 174.080 174.080 175.328 -1.248 18990 5277 1 8 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.279 -0.215 18990 5278 1 8 . 1 1 359 359 GLY H H 359 7.756 7.756 8.470 -0.714 18990 5279 1 8 . 1 1 360 360 MET N N 360 121.300 121.300 119.625 1.675 18990 5280 1 8 . 1 1 360 360 MET HA H 360 4.343 4.343 4.253 0.090 18990 5281 1 8 . 1 1 360 360 MET C C 360 175.641 175.641 177.576 -1.935 18990 5282 1 8 . 1 1 360 360 MET CA C 360 55.923 55.923 57.029 -1.106 18990 5283 1 8 . 1 1 360 360 MET CB C 360 33.091 33.091 33.569 -0.478 18990 5284 1 8 . 1 1 360 360 MET H H 360 8.229 8.229 7.626 0.603 18990 5285 1 8 . 1 1 361 361 GLY N N 361 109.000 109.000 105.886 3.114 18990 5286 1 8 . 1 1 361 361 GLY C C 361 173.774 173.774 173.268 0.506 18990 5287 1 8 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.332 1.506 18990 5288 1 8 . 1 1 361 361 GLY H H 361 8.347 8.347 7.902 0.445 18990 5289 1 8 . 1 1 362 362 LEU N N 362 126.725 126.725 125.130 1.595 18990 5290 1 8 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.843 -0.168 18990 5291 1 8 . 1 1 362 362 LEU C C 362 175.865 175.865 176.047 -0.182 18990 5292 1 8 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.205 0.985 18990 5293 1 8 . 1 1 362 362 LEU CB C 362 44.050 44.050 43.644 0.406 18990 5294 1 8 . 1 1 362 362 LEU H H 362 8.935 8.935 8.922 0.013 18990 5295 1 8 . 1 1 363 363 LEU N N 363 123.742 123.742 125.657 -1.915 18990 5296 1 8 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.720 -0.043 18990 5297 1 8 . 1 1 363 363 LEU C C 363 176.162 176.162 175.378 0.784 18990 5298 1 8 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.299 0.043 18990 5299 1 8 . 1 1 363 363 LEU CB C 363 42.210 42.210 42.634 -0.424 18990 5300 1 8 . 1 1 363 363 LEU H H 363 8.481 8.481 8.569 -0.088 18990 5301 1 8 . 1 1 364 364 VAL N N 364 120.980 120.980 126.506 -5.526 18990 5302 1 8 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.186 0.211 18990 5303 1 8 . 1 1 364 364 VAL C C 364 175.592 175.592 175.306 0.286 18990 5304 1 8 . 1 1 364 364 VAL CA C 364 60.460 60.460 60.727 -0.268 18990 5305 1 8 . 1 1 364 364 VAL CB C 364 34.125 34.125 33.365 0.760 18990 5306 1 8 . 1 1 364 364 VAL H H 364 8.155 8.155 8.333 -0.178 18990 5307 1 8 . 1 1 365 365 GLU N N 365 126.950 126.950 127.711 -0.761 18990 5308 1 8 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.618 -0.008 18990 5309 1 8 . 1 1 365 365 GLU C C 365 175.427 175.427 176.155 -0.728 18990 5310 1 8 . 1 1 365 365 GLU CA C 365 54.551 54.551 53.466 1.085 18990 5311 1 8 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.520 0.260 18990 5312 1 8 . 1 1 365 365 GLU H H 365 8.900 8.900 8.507 0.393 18990 5313 1 8 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.139 0.123 18990 5314 1 8 . 1 1 366 366 PRO C C 366 177.013 177.013 176.503 0.510 18990 5315 1 8 . 1 1 366 366 PRO CA C 366 64.463 64.463 65.689 -1.226 18990 5316 1 8 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.965 0.083 18990 5317 1 8 . 1 1 367 367 ASP N N 367 115.459 115.459 113.543 1.916 18990 5318 1 8 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.611 -0.116 18990 5319 1 8 . 1 1 367 367 ASP C C 367 175.123 175.123 176.306 -1.183 18990 5320 1 8 . 1 1 367 367 ASP CA C 367 54.503 54.503 53.201 1.302 18990 5321 1 8 . 1 1 367 367 ASP CB C 367 40.123 40.123 39.611 0.512 18990 5322 1 8 . 1 1 367 367 ASP H H 367 8.439 8.439 8.371 0.068 18990 5323 1 8 . 1 1 368 368 CYS N N 368 118.700 118.700 120.499 -1.799 18990 5324 1 8 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.242 0.328 18990 5325 1 8 . 1 1 368 368 CYS C C 368 173.806 173.806 175.974 -2.168 18990 5326 1 8 . 1 1 368 368 CYS CA C 368 58.581 58.581 61.499 -2.918 18990 5327 1 8 . 1 1 368 368 CYS CB C 368 28.450 28.450 28.482 -0.032 18990 5328 1 8 . 1 1 368 368 CYS H H 368 7.515 7.515 8.280 -0.765 18990 5329 1 8 . 1 1 369 369 ARG HA H 369 4.265 4.265 3.946 0.319 18990 5330 1 8 . 1 1 369 369 ARG C C 369 174.908 174.908 175.269 -0.361 18990 5331 1 8 . 1 1 369 369 ARG CA C 369 57.669 57.669 58.054 -0.385 18990 5332 1 8 . 1 1 369 369 ARG CB C 369 32.274 32.274 28.573 3.701 18990 5333 1 8 . 1 1 370 370 LYS N N 370 121.022 121.022 123.202 -2.180 18990 5334 1 8 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.040 0.130 18990 5335 1 8 . 1 1 370 370 LYS C C 370 174.868 174.868 175.505 -0.637 18990 5336 1 8 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.767 0.787 18990 5337 1 8 . 1 1 370 370 LYS CB C 370 33.140 33.140 32.099 1.041 18990 5338 1 8 . 1 1 370 370 LYS H H 370 7.740 7.740 8.211 -0.471 18990 5339 1 8 . 1 1 371 371 VAL N N 371 128.362 128.362 123.036 5.326 18990 5340 1 8 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.291 -0.158 18990 5341 1 8 . 1 1 371 371 VAL C C 371 173.402 173.402 174.353 -0.951 18990 5342 1 8 . 1 1 371 371 VAL CA C 371 60.777 60.777 60.936 -0.159 18990 5343 1 8 . 1 1 371 371 VAL CB C 371 33.000 33.000 33.326 -0.326 18990 5344 1 8 . 1 1 371 371 VAL H H 371 8.647 8.647 7.853 0.794 18990 5345 1 8 . 1 1 372 372 THR N N 372 119.667 119.667 119.689 -0.022 18990 5346 1 8 . 1 1 372 372 THR HA H 372 5.032 5.032 4.954 0.078 18990 5347 1 8 . 1 1 372 372 THR C C 372 174.339 174.339 173.825 0.514 18990 5348 1 8 . 1 1 372 372 THR CA C 372 60.881 60.881 61.127 -0.246 18990 5349 1 8 . 1 1 372 372 THR CB C 372 70.471 70.471 71.755 -1.284 18990 5350 1 8 . 1 1 372 372 THR H H 372 8.087 8.087 8.165 -0.078 18990 5351 1 8 . 1 1 373 373 CYS N N 373 132.554 132.554 125.998 6.556 18990 5352 1 8 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.523 0.279 18990 5353 1 8 . 1 1 373 373 CYS C C 373 176.791 176.791 176.389 0.402 18990 5354 1 8 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.612 -1.108 18990 5355 1 8 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.654 3.656 18990 5356 1 8 . 1 1 373 373 CYS H H 373 9.322 9.322 9.553 -0.231 18990 5357 1 8 . 1 1 374 374 GLN N N 374 125.890 125.890 125.390 0.500 18990 5358 1 8 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.175 -0.175 18990 5359 1 8 . 1 1 374 374 GLN C C 374 176.827 176.827 177.081 -0.254 18990 5360 1 8 . 1 1 374 374 GLN CA C 374 58.300 58.300 58.150 0.150 18990 5361 1 8 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.784 0.880 18990 5362 1 8 . 1 1 374 374 GLN H H 374 7.856 7.856 8.574 -0.718 18990 5363 1 8 . 1 1 375 375 ASN N N 375 115.342 115.342 115.469 -0.127 18990 5364 1 8 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.799 0.088 18990 5365 1 8 . 1 1 375 375 ASN C C 375 174.049 174.049 174.921 -0.872 18990 5366 1 8 . 1 1 375 375 ASN CA C 375 53.047 53.047 53.152 -0.105 18990 5367 1 8 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.356 -0.440 18990 5368 1 8 . 1 1 375 375 ASN H H 375 8.913 8.913 8.441 0.472 18990 5369 1 8 . 1 1 376 376 GLY N N 376 109.098 109.098 108.347 0.751 18990 5370 1 8 . 1 1 376 376 GLY C C 376 174.110 174.110 172.974 1.136 18990 5371 1 8 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.147 1.239 18990 5372 1 8 . 1 1 376 376 GLY H H 376 7.162 7.162 7.320 -0.158 18990 5373 1 8 . 1 1 377 377 CYS N N 377 132.546 132.546 121.643 10.903 18990 5374 1 8 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.650 0.114 18990 5375 1 8 . 1 1 377 377 CYS C C 377 177.355 177.355 176.057 1.298 18990 5376 1 8 . 1 1 377 377 CYS CA C 377 59.988 59.988 56.822 3.166 18990 5377 1 8 . 1 1 377 377 CYS CB C 377 32.365 32.365 25.232 7.133 18990 5378 1 8 . 1 1 377 377 CYS H H 377 9.800 9.800 8.354 1.446 18990 5379 1 8 . 1 1 378 378 GLY N N 378 113.851 113.851 111.290 2.561 18990 5380 1 8 . 1 1 378 378 GLY C C 378 173.404 173.404 172.932 0.472 18990 5381 1 8 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.670 0.193 18990 5382 1 8 . 1 1 378 378 GLY H H 378 8.820 8.820 8.325 0.495 18990 5383 1 8 . 1 1 379 379 TYR N N 379 125.532 125.532 124.583 0.949 18990 5384 1 8 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.735 -0.257 18990 5385 1 8 . 1 1 379 379 TYR C C 379 173.661 173.661 173.563 0.098 18990 5386 1 8 . 1 1 379 379 TYR CA C 379 59.180 59.180 56.807 2.373 18990 5387 1 8 . 1 1 379 379 TYR CB C 379 40.108 40.108 42.035 -1.927 18990 5388 1 8 . 1 1 379 379 TYR H H 379 9.054 9.054 8.022 1.032 18990 5389 1 8 . 1 1 380 380 VAL N N 380 124.461 124.461 123.660 0.801 18990 5390 1 8 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.281 0.537 18990 5391 1 8 . 1 1 380 380 VAL C C 380 175.876 175.876 174.393 1.483 18990 5392 1 8 . 1 1 380 380 VAL CA C 380 60.797 60.797 60.829 -0.032 18990 5393 1 8 . 1 1 380 380 VAL CB C 380 32.610 32.610 31.628 0.982 18990 5394 1 8 . 1 1 380 380 VAL H H 380 7.238 7.238 7.662 -0.424 18990 5395 1 8 . 1 1 381 381 PHE N N 381 124.588 124.588 123.420 1.168 18990 5396 1 8 . 1 1 381 381 PHE HA H 381 5.273 5.273 5.021 0.252 18990 5397 1 8 . 1 1 381 381 PHE C C 381 173.242 173.242 173.677 -0.435 18990 5398 1 8 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.257 -0.047 18990 5399 1 8 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.503 1.587 18990 5400 1 8 . 1 1 381 381 PHE H H 381 9.424 9.424 7.830 1.594 18990 5401 1 8 . 1 1 382 382 CYS N N 382 120.221 120.221 120.072 0.149 18990 5402 1 8 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.863 0.039 18990 5403 1 8 . 1 1 382 382 CYS C C 382 177.165 177.165 175.512 1.653 18990 5404 1 8 . 1 1 382 382 CYS CA C 382 57.691 57.691 56.933 0.758 18990 5405 1 8 . 1 1 382 382 CYS CB C 382 32.475 32.475 30.360 2.115 18990 5406 1 8 . 1 1 382 382 CYS H H 382 8.673 8.673 8.347 0.326 18990 5407 1 8 . 1 1 383 383 ARG N N 383 129.347 129.347 121.450 7.897 18990 5408 1 8 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.351 -0.330 18990 5409 1 8 . 1 1 383 383 ARG C C 383 175.012 175.012 176.704 -1.692 18990 5410 1 8 . 1 1 383 383 ARG CA C 383 58.686 58.686 58.595 0.091 18990 5411 1 8 . 1 1 383 383 ARG CB C 383 30.900 30.900 30.221 0.678 18990 5412 1 8 . 1 1 383 383 ARG H H 383 9.534 9.534 8.790 0.744 18990 5413 1 8 . 1 1 384 384 ASN N N 384 117.772 117.772 116.954 0.818 18990 5414 1 8 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.782 -0.074 18990 5415 1 8 . 1 1 384 384 ASN C C 384 175.656 175.656 174.302 1.354 18990 5416 1 8 . 1 1 384 384 ASN CA C 384 55.778 55.778 53.910 1.868 18990 5417 1 8 . 1 1 384 384 ASN CB C 384 39.475 39.475 39.851 -0.376 18990 5418 1 8 . 1 1 384 384 ASN H H 384 8.840 8.840 8.413 0.427 18990 5419 1 8 . 1 1 385 385 CYS N N 385 115.876 115.876 115.536 0.340 18990 5420 1 8 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.765 0.263 18990 5421 1 8 . 1 1 385 385 CYS C C 385 175.703 175.703 173.279 2.424 18990 5422 1 8 . 1 1 385 385 CYS CA C 385 58.112 58.112 57.459 0.653 18990 5423 1 8 . 1 1 385 385 CYS CB C 385 32.359 32.359 31.196 1.163 18990 5424 1 8 . 1 1 385 385 CYS H H 385 7.868 7.868 7.748 0.120 18990 5425 1 8 . 1 1 386 386 LEU N N 386 120.082 120.082 120.640 -0.558 18990 5426 1 8 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.708 -0.395 18990 5427 1 8 . 1 1 386 386 LEU C C 386 175.722 175.722 177.086 -1.364 18990 5428 1 8 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.473 2.536 18990 5429 1 8 . 1 1 386 386 LEU CB C 386 38.412 38.412 42.117 -3.705 18990 5430 1 8 . 1 1 386 386 LEU H H 386 8.514 8.514 8.566 -0.052 18990 5431 1 8 . 1 1 387 387 GLN N N 387 117.579 117.579 118.422 -0.843 18990 5432 1 8 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.374 0.402 18990 5433 1 8 . 1 1 387 387 GLN C C 387 175.299 175.299 176.440 -1.141 18990 5434 1 8 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.338 -1.321 18990 5435 1 8 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.956 1.351 18990 5436 1 8 . 1 1 387 387 GLN H H 387 8.248 8.248 7.949 0.299 18990 5437 1 8 . 1 1 388 388 GLY N N 388 106.107 106.107 107.035 -0.928 18990 5438 1 8 . 1 1 388 388 GLY C C 388 173.693 173.693 173.714 -0.021 18990 5439 1 8 . 1 1 388 388 GLY CA C 388 46.180 46.180 44.890 1.290 18990 5440 1 8 . 1 1 388 388 GLY H H 388 8.695 8.695 8.084 0.611 18990 5441 1 8 . 1 1 389 389 TYR N N 389 122.514 122.514 117.576 4.938 18990 5442 1 8 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.021 -0.363 18990 5443 1 8 . 1 1 389 389 TYR C C 389 172.860 172.860 173.805 -0.945 18990 5444 1 8 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.329 4.658 18990 5445 1 8 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.381 0.671 18990 5446 1 8 . 1 1 389 389 TYR H H 389 7.923 7.923 7.756 0.167 18990 5447 1 8 . 1 1 390 390 HIS N N 390 120.080 120.080 122.657 -2.577 18990 5448 1 8 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.511 0.197 18990 5449 1 8 . 1 1 390 390 HIS C C 390 173.235 173.235 172.300 0.935 18990 5450 1 8 . 1 1 390 390 HIS CA C 390 51.431 51.431 53.950 -2.518 18990 5451 1 8 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.764 0.136 18990 5452 1 8 . 1 1 390 390 HIS H H 390 5.291 5.291 7.557 -2.266 18990 5453 1 8 . 1 1 391 391 ILE N N 391 117.810 117.810 115.179 2.631 18990 5454 1 8 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.473 -0.357 18990 5455 1 8 . 1 1 391 391 ILE C C 391 178.208 178.208 176.789 1.419 18990 5456 1 8 . 1 1 391 391 ILE CA C 391 60.877 60.877 60.261 0.616 18990 5457 1 8 . 1 1 391 391 ILE CB C 391 39.034 39.034 40.332 -1.298 18990 5458 1 8 . 1 1 391 391 ILE H H 391 8.418 8.418 8.254 0.164 18990 5459 1 8 . 1 1 392 392 GLY N N 392 112.387 112.387 114.405 -2.018 18990 5460 1 8 . 1 1 392 392 GLY C C 392 173.565 173.565 174.986 -1.421 18990 5461 1 8 . 1 1 392 392 GLY CA C 392 45.258 45.258 46.162 -0.904 18990 5462 1 8 . 1 1 392 392 GLY H H 392 8.654 8.654 8.724 -0.070 18990 5463 1 8 . 1 1 393 393 GLU N N 393 119.098 119.098 119.421 -0.323 18990 5464 1 8 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.164 0.125 18990 5465 1 8 . 1 1 393 393 GLU C C 393 176.899 176.899 176.213 0.686 18990 5466 1 8 . 1 1 393 393 GLU CA C 393 56.433 56.433 56.548 -0.115 18990 5467 1 8 . 1 1 393 393 GLU CB C 393 30.470 30.470 29.587 0.883 18990 5468 1 8 . 1 1 393 393 GLU H H 393 8.391 8.391 8.006 0.385 18990 5469 1 8 . 1 1 394 394 CYS N N 394 122.845 122.845 115.683 7.162 18990 5470 1 8 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.717 -0.951 18990 5471 1 8 . 1 1 394 394 CYS C C 394 175.461 175.461 173.535 1.926 18990 5472 1 8 . 1 1 394 394 CYS CA C 394 59.835 59.835 56.584 3.251 18990 5473 1 8 . 1 1 394 394 CYS CB C 394 30.761 30.761 29.763 0.998 18990 5474 1 8 . 1 1 394 394 CYS H H 394 8.474 8.474 7.495 0.979 18990 5475 1 8 . 1 1 395 395 LEU N N 395 124.403 124.403 122.145 2.258 18990 5476 1 8 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.800 -0.296 18990 5477 1 8 . 1 1 395 395 LEU C C 395 175.259 175.259 175.126 0.133 18990 5478 1 8 . 1 1 395 395 LEU CA C 395 52.835 52.835 52.810 0.025 18990 5479 1 8 . 1 1 395 395 LEU CB C 395 41.436 41.436 43.164 -1.728 18990 5480 1 8 . 1 1 395 395 LEU H H 395 8.418 8.418 8.291 0.127 18990 5481 1 8 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.528 -0.158 18990 5482 1 8 . 1 1 396 396 PRO C C 396 177.006 177.006 175.970 1.036 18990 5483 1 8 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.015 1.081 18990 5484 1 8 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.352 -0.280 18990 5485 1 8 . 1 1 397 397 GLU N N 397 121.574 121.574 118.576 2.998 18990 5486 1 8 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.213 0.012 18990 5487 1 8 . 1 1 397 397 GLU C C 397 177.202 177.202 176.981 0.221 18990 5488 1 8 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.727 0.306 18990 5489 1 8 . 1 1 397 397 GLU CB C 397 30.263 30.263 29.723 0.540 18990 5490 1 8 . 1 1 397 397 GLU H H 397 8.568 8.568 8.369 0.199 18990 5491 1 8 . 1 1 398 398 GLY N N 398 110.495 110.495 111.172 -0.677 18990 5492 1 8 . 1 1 398 398 GLY C C 398 174.579 174.579 174.268 0.311 18990 5493 1 8 . 1 1 398 398 GLY CA C 398 45.462 45.462 44.813 0.649 18990 5494 1 8 . 1 1 398 398 GLY H H 398 8.515 8.515 8.553 -0.038 18990 5495 1 8 . 1 1 399 399 THR N N 399 113.234 113.234 116.264 -3.030 18990 5496 1 8 . 1 1 399 399 THR HA H 399 4.398 4.398 4.355 0.043 18990 5497 1 8 . 1 1 399 399 THR C C 399 175.333 175.333 175.231 0.102 18990 5498 1 8 . 1 1 399 399 THR CA C 399 62.233 62.233 61.859 0.374 18990 5499 1 8 . 1 1 399 399 THR CB C 399 69.833 69.833 69.289 0.544 18990 5500 1 8 . 1 1 399 399 THR H H 399 8.090 8.090 8.611 -0.521 18990 5501 1 8 . 1 1 400 400 GLY N N 400 111.479 111.479 110.712 0.767 18990 5502 1 8 . 1 1 400 400 GLY C C 400 174.048 174.048 172.546 1.502 18990 5503 1 8 . 1 1 400 400 GLY CA C 400 45.439 45.439 44.255 1.184 18990 5504 1 8 . 1 1 400 400 GLY H H 400 8.524 8.524 7.693 0.831 18990 5505 1 8 . 1 1 401 401 ALA N N 401 123.919 123.919 123.753 0.166 18990 5506 1 8 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.662 -0.411 18990 5507 1 8 . 1 1 401 401 ALA C C 401 177.942 177.942 175.713 2.229 18990 5508 1 8 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.679 1.051 18990 5509 1 8 . 1 1 401 401 ALA CB C 401 19.142 19.142 20.301 -1.159 18990 5510 1 8 . 1 1 401 401 ALA H H 401 8.179 8.179 8.191 -0.012 18990 5511 1 8 . 1 1 402 402 SER N N 402 114.904 114.904 116.068 -1.164 18990 5512 1 8 . 1 1 402 402 SER HA H 402 4.448 4.448 4.690 -0.242 18990 5513 1 8 . 1 1 402 402 SER C C 402 174.426 174.426 173.178 1.248 18990 5514 1 8 . 1 1 402 402 SER CA C 402 58.289 58.289 58.542 -0.253 18990 5515 1 8 . 1 1 402 402 SER CB C 402 63.772 63.772 63.896 -0.124 18990 5516 1 8 . 1 1 402 402 SER H H 402 8.305 8.305 8.579 -0.274 18990 5517 1 8 . 1 1 403 403 ALA N N 403 125.965 125.965 126.823 -0.858 18990 5518 1 8 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.868 -0.469 18990 5519 1 8 . 1 1 403 403 ALA C C 403 177.984 177.984 176.166 1.818 18990 5520 1 8 . 1 1 403 403 ALA CA C 403 52.655 52.655 52.151 0.504 18990 5521 1 8 . 1 1 403 403 ALA CB C 403 19.138 19.138 20.401 -1.264 18990 5522 1 8 . 1 1 403 403 ALA H H 403 8.345 8.345 8.187 0.158 18990 5523 1 8 . 1 1 404 404 THR N N 404 112.790 112.790 113.874 -1.084 18990 5524 1 8 . 1 1 404 404 THR C C 404 174.420 174.420 173.220 1.200 18990 5525 1 8 . 1 1 404 404 THR CA C 404 61.988 61.988 61.424 0.564 18990 5526 1 8 . 1 1 404 404 THR CB C 404 69.688 69.688 70.398 -0.710 18990 5527 1 8 . 1 1 404 404 THR H H 404 8.118 8.118 7.999 0.119 18990 5528 1 8 . 1 1 405 405 ASN N N 405 121.050 121.050 119.251 1.799 18990 5529 1 8 . 1 1 405 405 ASN H H 405 8.396 8.396 8.486 -0.090 18990 5530 1 8 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.766 -0.188 18990 5531 1 8 . 1 1 407 407 CYS C C 407 174.489 174.489 173.984 0.505 18990 5532 1 8 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.354 0.359 18990 5533 1 8 . 1 1 407 407 CYS CB C 407 28.102 28.102 29.552 -1.450 18990 5534 1 8 . 1 1 408 408 GLU N N 408 123.021 123.021 124.727 -1.706 18990 5535 1 8 . 1 1 408 408 GLU C C 408 175.954 175.954 174.907 1.047 18990 5536 1 8 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.556 0.246 18990 5537 1 8 . 1 1 408 408 GLU CB C 408 30.328 30.328 31.507 -1.179 18990 5538 1 8 . 1 1 408 408 GLU H H 408 8.415 8.415 8.726 -0.311 18990 5539 1 8 . 1 1 409 409 TYR N N 409 121.015 121.015 125.240 -4.225 18990 5540 1 8 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.745 -0.091 18990 5541 1 8 . 1 1 409 409 TYR C C 409 175.613 175.613 174.116 1.497 18990 5542 1 8 . 1 1 409 409 TYR CA C 409 57.669 57.669 59.122 -1.453 18990 5543 1 8 . 1 1 409 409 TYR CB C 409 38.825 38.825 38.867 -0.042 18990 5544 1 8 . 1 1 409 409 TYR H H 409 8.135 8.135 8.564 -0.429 18990 5545 1 8 . 1 1 410 410 THR N N 410 116.975 116.975 121.971 -4.996 18990 5546 1 8 . 1 1 410 410 THR HA H 410 4.306 4.306 4.447 -0.141 18990 5547 1 8 . 1 1 410 410 THR C C 410 173.846 173.846 172.948 0.898 18990 5548 1 8 . 1 1 410 410 THR CA C 410 61.730 61.730 61.488 0.242 18990 5549 1 8 . 1 1 410 410 THR CB C 410 69.914 69.914 69.593 0.321 18990 5550 1 8 . 1 1 410 410 THR H H 410 8.060 8.060 8.065 -0.005 18990 5551 1 8 . 1 1 411 411 VAL N N 411 122.900 122.900 121.281 1.619 18990 5552 1 8 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.678 -0.625 18990 5553 1 8 . 1 1 411 411 VAL C C 411 175.275 175.275 174.313 0.962 18990 5554 1 8 . 1 1 411 411 VAL CA C 411 61.853 61.853 60.894 0.959 18990 5555 1 8 . 1 1 411 411 VAL CB C 411 32.976 32.976 35.259 -2.283 18990 5556 1 8 . 1 1 411 411 VAL H H 411 8.089 8.089 8.254 -0.165 18990 5557 1 8 . 1 1 412 412 ASP N N 412 125.924 125.924 121.663 4.261 18990 5558 1 8 . 1 1 412 412 ASP HA H 412 4.850 4.850 5.061 -0.211 18990 5559 1 8 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.811 -1.233 18990 5560 1 8 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.824 -0.286 18990 5561 1 8 . 1 1 412 412 ASP H H 412 8.397 8.397 8.323 0.074 18990 5562 1 8 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.598 -0.212 18990 5563 1 8 . 1 1 413 413 PRO C C 413 177.352 177.352 175.705 1.647 18990 5564 1 8 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.664 1.246 18990 5565 1 8 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.483 -0.215 18990 5566 1 8 . 1 1 414 414 ASN N N 414 117.035 117.035 116.222 0.813 18990 5567 1 8 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.753 -0.076 18990 5568 1 8 . 1 1 414 414 ASN C C 414 175.532 175.532 174.400 1.132 18990 5569 1 8 . 1 1 414 414 ASN CA C 414 53.824 53.824 52.841 0.983 18990 5570 1 8 . 1 1 414 414 ASN CB C 414 38.728 38.728 40.362 -1.634 18990 5571 1 8 . 1 1 414 414 ASN H H 414 8.496 8.496 8.398 0.098 18990 5572 1 8 . 1 1 415 415 ARG N N 415 121.000 121.000 121.912 -0.912 18990 5573 1 8 . 1 1 415 415 ARG HA H 415 4.244 4.244 5.062 -0.818 18990 5574 1 8 . 1 1 415 415 ARG C C 415 176.243 176.243 174.636 1.607 18990 5575 1 8 . 1 1 415 415 ARG CA C 415 56.404 56.404 55.407 0.997 18990 5576 1 8 . 1 1 415 415 ARG CB C 415 30.637 30.637 31.898 -1.261 18990 5577 1 8 . 1 1 415 415 ARG H H 415 7.804 7.804 8.565 -0.761 18990 5578 1 8 . 1 1 416 416 ALA N N 416 124.880 124.880 123.014 1.866 18990 5579 1 8 . 1 1 416 416 ALA C C 416 177.831 177.831 176.529 1.302 18990 5580 1 8 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.783 1.174 18990 5581 1 8 . 1 1 416 416 ALA CB C 416 19.059 19.059 19.538 -0.479 18990 5582 1 8 . 1 1 416 416 ALA H H 416 8.189 8.189 8.422 -0.233 18990 5583 1 8 . 1 1 417 417 ALA N N 417 122.614 122.614 121.693 0.921 18990 5584 1 8 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.967 -0.720 18990 5585 1 8 . 1 1 417 417 ALA C C 417 178.024 178.024 176.860 1.164 18990 5586 1 8 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.611 1.178 18990 5587 1 8 . 1 1 417 417 ALA CB C 417 19.042 19.042 20.028 -0.986 18990 5588 1 8 . 1 1 417 417 ALA H H 417 8.169 8.169 8.826 -0.657 18990 5589 1 8 . 1 1 418 418 GLU N N 418 119.500 119.500 120.410 -0.910 18990 5590 1 8 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.455 -0.266 18990 5591 1 8 . 1 1 418 418 GLU C C 418 176.266 176.266 175.377 0.889 18990 5592 1 8 . 1 1 418 418 GLU CA C 418 56.576 56.576 56.058 0.518 18990 5593 1 8 . 1 1 418 418 GLU CB C 418 30.307 30.307 30.664 -0.357 18990 5594 1 8 . 1 1 418 418 GLU H H 418 8.184 8.184 8.582 -0.398 18990 5595 1 8 . 1 1 419 419 ALA N N 419 124.643 124.643 124.635 0.008 18990 5596 1 8 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.587 -0.337 18990 5597 1 8 . 1 1 419 419 ALA C C 419 177.488 177.488 176.763 0.725 18990 5598 1 8 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.806 0.703 18990 5599 1 8 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.861 -1.700 18990 5600 1 8 . 1 1 419 419 ALA H H 419 8.135 8.135 8.414 -0.279 18990 5601 1 8 . 1 1 420 420 ARG N N 420 120.003 120.003 122.851 -2.848 18990 5602 1 8 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.572 -0.279 18990 5603 1 8 . 1 1 420 420 ARG C C 420 176.297 176.297 175.129 1.168 18990 5604 1 8 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.761 0.172 18990 5605 1 8 . 1 1 420 420 ARG CB C 420 30.850 30.850 29.909 0.941 18990 5606 1 8 . 1 1 420 420 ARG H H 420 8.135 8.135 8.330 -0.195 18990 5607 1 8 . 1 1 421 421 TRP N N 421 122.280 122.280 125.875 -3.595 18990 5608 1 8 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.825 -0.162 18990 5609 1 8 . 1 1 421 421 TRP C C 421 175.856 175.856 175.481 0.375 18990 5610 1 8 . 1 1 421 421 TRP CA C 421 57.404 57.404 57.026 0.378 18990 5611 1 8 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.005 -0.568 18990 5612 1 8 . 1 1 421 421 TRP H H 421 8.159 8.159 8.466 -0.307 18990 5613 1 8 . 1 1 422 422 ASP N N 422 121.980 121.980 119.091 2.889 18990 5614 1 8 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.847 -0.352 18990 5615 1 8 . 1 1 422 422 ASP C C 422 176.184 176.184 175.719 0.465 18990 5616 1 8 . 1 1 422 422 ASP CA C 422 53.899 53.899 54.028 -0.129 18990 5617 1 8 . 1 1 422 422 ASP CB C 422 40.948 40.948 42.473 -1.525 18990 5618 1 8 . 1 1 422 422 ASP H H 422 8.135 8.135 8.213 -0.078 18990 5619 1 8 . 1 1 423 423 GLU N N 423 121.990 121.990 123.159 -1.169 18990 5620 1 8 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.315 -0.225 18990 5621 1 8 . 1 1 423 423 GLU C C 423 176.720 176.720 176.898 -0.178 18990 5622 1 8 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.565 0.604 18990 5623 1 8 . 1 1 423 423 GLU CB C 423 30.156 30.156 29.589 0.567 18990 5624 1 8 . 1 1 423 423 GLU H H 423 8.153 8.153 8.830 -0.677 18990 5625 1 8 . 1 1 424 424 ALA N N 424 123.900 123.900 125.073 -1.173 18990 5626 1 8 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.156 0.124 18990 5627 1 8 . 1 1 424 424 ALA C C 424 178.095 178.095 176.319 1.776 18990 5628 1 8 . 1 1 424 424 ALA CA C 424 53.017 53.017 52.890 0.127 18990 5629 1 8 . 1 1 424 424 ALA CB C 424 19.086 19.086 17.213 1.873 18990 5630 1 8 . 1 1 424 424 ALA H H 424 8.243 8.243 8.403 -0.160 18990 5631 1 8 . 1 1 425 425 SER N N 425 113.881 113.881 114.097 -0.216 18990 5632 1 8 . 1 1 425 425 SER HA H 425 4.387 4.387 5.060 -0.673 18990 5633 1 8 . 1 1 425 425 SER C C 425 174.338 174.338 173.480 0.858 18990 5634 1 8 . 1 1 425 425 SER CA C 425 58.546 58.546 57.391 1.155 18990 5635 1 8 . 1 1 425 425 SER CB C 425 63.784 63.784 65.492 -1.708 18990 5636 1 8 . 1 1 425 425 SER H H 425 8.063 8.063 8.310 -0.247 18990 5637 1 8 . 1 1 426 426 ASN N N 426 121.032 121.032 120.411 0.621 18990 5638 1 8 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.930 -0.224 18990 5639 1 8 . 1 1 426 426 ASN C C 426 175.046 175.046 173.724 1.322 18990 5640 1 8 . 1 1 426 426 ASN CA C 426 53.445 53.445 52.761 0.683 18990 5641 1 8 . 1 1 426 426 ASN CB C 426 38.847 38.847 40.122 -1.275 18990 5642 1 8 . 1 1 426 426 ASN H H 426 8.391 8.391 8.435 -0.044 18990 5643 1 8 . 1 1 427 427 VAL N N 427 119.463 119.463 122.649 -3.186 18990 5644 1 8 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.310 -0.117 18990 5645 1 8 . 1 1 427 427 VAL C C 427 176.213 176.213 176.303 -0.090 18990 5646 1 8 . 1 1 427 427 VAL CA C 427 62.449 62.449 61.526 0.923 18990 5647 1 8 . 1 1 427 427 VAL CB C 427 32.865 32.865 33.355 -0.490 18990 5648 1 8 . 1 1 427 427 VAL H H 427 7.954 7.954 8.378 -0.424 18990 5649 1 8 . 1 1 428 428 THR N N 428 118.226 118.226 120.304 -2.078 18990 5650 1 8 . 1 1 428 428 THR HA H 428 4.353 4.353 4.454 -0.101 18990 5651 1 8 . 1 1 428 428 THR C C 428 174.361 174.361 175.015 -0.654 18990 5652 1 8 . 1 1 428 428 THR CA C 428 62.065 62.065 62.108 -0.043 18990 5653 1 8 . 1 1 428 428 THR CB C 428 69.729 69.729 69.710 0.019 18990 5654 1 8 . 1 1 428 428 THR H H 428 8.225 8.225 8.204 0.021 18990 5655 1 8 . 1 1 429 429 ILE N N 429 123.910 123.910 117.314 6.596 18990 5656 1 8 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.370 -0.182 18990 5657 1 8 . 1 1 429 429 ILE C C 429 175.774 175.774 175.505 0.269 18990 5658 1 8 . 1 1 429 429 ILE CA C 429 60.819 60.819 60.888 -0.069 18990 5659 1 8 . 1 1 429 429 ILE CB C 429 38.719 38.719 38.481 0.238 18990 5660 1 8 . 1 1 429 429 ILE H H 429 8.148 8.148 8.289 -0.141 18990 5661 1 8 . 1 1 430 430 LYS N N 430 126.453 126.453 123.093 3.360 18990 5662 1 8 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.337 0.097 18990 5663 1 8 . 1 1 430 430 LYS C C 430 176.241 176.241 175.642 0.599 18990 5664 1 8 . 1 1 430 430 LYS CA C 430 55.937 55.937 56.700 -0.763 18990 5665 1 8 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.195 -0.031 18990 5666 1 8 . 1 1 430 430 LYS H H 430 8.406 8.406 7.779 0.627 18990 5667 1 8 . 1 1 431 431 VAL N N 431 122.496 122.496 122.668 -0.172 18990 5668 1 8 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.341 -0.061 18990 5669 1 8 . 1 1 431 431 VAL CA C 431 62.303 62.303 61.905 0.398 18990 5670 1 8 . 1 1 431 431 VAL CB C 431 33.132 33.132 34.074 -0.942 18990 5671 1 8 . 1 1 431 431 VAL H H 431 8.312 8.312 8.250 0.062 18990 5672 1 8 . 1 1 432 432 SER HA H 432 4.486 4.486 4.795 -0.309 18990 5673 1 8 . 1 1 432 432 SER C C 432 173.834 173.834 173.701 0.133 18990 5674 1 8 . 1 1 432 432 SER CA C 432 58.650 58.650 58.280 0.370 18990 5675 1 8 . 1 1 432 432 SER CB C 432 64.152 64.152 64.197 -0.045 18990 5676 1 8 . 1 1 433 433 THR N N 433 114.706 114.706 113.711 0.995 18990 5677 1 8 . 1 1 433 433 THR HA H 433 5.446 5.446 4.543 0.903 18990 5678 1 8 . 1 1 433 433 THR C C 433 173.979 173.979 174.008 -0.029 18990 5679 1 8 . 1 1 433 433 THR CA C 433 60.412 60.412 61.064 -0.652 18990 5680 1 8 . 1 1 433 433 THR CB C 433 71.896 71.896 70.712 1.184 18990 5681 1 8 . 1 1 433 433 THR H H 433 7.833 7.833 7.530 0.303 18990 5682 1 8 . 1 1 434 434 LYS N N 434 122.492 122.492 120.863 1.629 18990 5683 1 8 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.967 -0.258 18990 5684 1 8 . 1 1 434 434 LYS C C 434 173.589 173.589 174.999 -1.410 18990 5685 1 8 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.753 1.622 18990 5686 1 8 . 1 1 434 434 LYS CB C 434 36.925 36.925 34.243 2.682 18990 5687 1 8 . 1 1 434 434 LYS H H 434 8.937 8.937 9.040 -0.103 18990 5688 1 8 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.577 -0.310 18990 5689 1 8 . 1 1 435 435 PRO C C 435 175.238 175.238 176.481 -1.243 18990 5690 1 8 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.726 -1.803 18990 5691 1 8 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.113 -0.026 18990 5692 1 8 . 1 1 436 436 CYS N N 436 125.422 125.422 125.229 0.193 18990 5693 1 8 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.332 -0.902 18990 5694 1 8 . 1 1 436 436 CYS C C 436 176.770 176.770 175.555 1.215 18990 5695 1 8 . 1 1 436 436 CYS CA C 436 57.016 57.016 57.182 -0.166 18990 5696 1 8 . 1 1 436 436 CYS CB C 436 31.698 31.698 28.016 3.682 18990 5697 1 8 . 1 1 436 436 CYS H H 436 7.768 7.768 8.697 -0.929 18990 5698 1 8 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.117 -0.259 18990 5699 1 8 . 1 1 437 437 PRO C C 437 173.608 173.608 176.140 -2.532 18990 5700 1 8 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.157 0.056 18990 5701 1 8 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.458 0.991 18990 5702 1 8 . 1 1 438 438 LYS N N 438 118.600 118.600 116.187 2.413 18990 5703 1 8 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.288 -0.318 18990 5704 1 8 . 1 1 438 438 LYS C C 438 176.887 176.887 178.131 -1.244 18990 5705 1 8 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.288 0.399 18990 5706 1 8 . 1 1 438 438 LYS CB C 438 33.124 33.124 32.973 0.151 18990 5707 1 8 . 1 1 438 438 LYS H H 438 8.390 8.390 7.591 0.799 18990 5708 1 8 . 1 1 439 439 CYS N N 439 118.950 118.950 114.315 4.635 18990 5709 1 8 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.625 0.121 18990 5710 1 8 . 1 1 439 439 CYS C C 439 176.650 176.650 175.233 1.417 18990 5711 1 8 . 1 1 439 439 CYS CA C 439 59.348 59.348 58.069 1.279 18990 5712 1 8 . 1 1 439 439 CYS CB C 439 31.196 31.196 27.532 3.664 18990 5713 1 8 . 1 1 439 439 CYS H H 439 8.357 8.357 7.901 0.456 18990 5714 1 8 . 1 1 440 440 ARG N N 440 117.200 117.200 117.443 -0.243 18990 5715 1 8 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.216 -0.248 18990 5716 1 8 . 1 1 440 440 ARG C C 440 175.253 175.253 175.805 -0.552 18990 5717 1 8 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.870 0.030 18990 5718 1 8 . 1 1 440 440 ARG CB C 440 26.041 26.041 26.898 -0.857 18990 5719 1 8 . 1 1 440 440 ARG H H 440 8.065 8.065 7.980 0.085 18990 5720 1 8 . 1 1 441 441 THR N N 441 122.400 122.400 111.746 10.654 18990 5721 1 8 . 1 1 441 441 THR HA H 441 4.371 4.371 4.703 -0.332 18990 5722 1 8 . 1 1 441 441 THR C C 441 173.702 173.702 173.319 0.383 18990 5723 1 8 . 1 1 441 441 THR CA C 441 63.194 63.194 59.031 4.163 18990 5724 1 8 . 1 1 441 441 THR CB C 441 68.933 68.933 69.839 -0.906 18990 5725 1 8 . 1 1 441 441 THR H H 441 8.643 8.643 7.485 1.158 18990 5726 1 8 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.457 -0.310 18990 5727 1 8 . 1 1 442 442 PRO C C 442 176.215 176.215 175.951 0.264 18990 5728 1 8 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.917 1.280 18990 5729 1 8 . 1 1 442 442 PRO CB C 442 32.044 32.044 31.103 0.941 18990 5730 1 8 . 1 1 443 443 THR N N 443 122.932 122.932 122.081 0.851 18990 5731 1 8 . 1 1 443 443 THR HA H 443 4.665 4.665 4.606 0.059 18990 5732 1 8 . 1 1 443 443 THR C C 443 172.133 172.133 174.531 -2.398 18990 5733 1 8 . 1 1 443 443 THR CA C 443 62.566 62.566 62.158 0.408 18990 5734 1 8 . 1 1 443 443 THR CB C 443 71.562 71.562 70.791 0.770 18990 5735 1 8 . 1 1 443 443 THR H H 443 9.116 9.116 8.842 0.274 18990 5736 1 8 . 1 1 444 444 GLU N N 444 126.390 126.390 126.159 0.231 18990 5737 1 8 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.352 0.590 18990 5738 1 8 . 1 1 444 444 GLU C C 444 175.292 175.292 175.985 -0.693 18990 5739 1 8 . 1 1 444 444 GLU CA C 444 55.049 55.049 56.947 -1.898 18990 5740 1 8 . 1 1 444 444 GLU CB C 444 31.861 31.861 31.237 0.624 18990 5741 1 8 . 1 1 444 444 GLU H H 444 8.720 8.720 8.758 -0.038 18990 5742 1 8 . 1 1 445 445 ARG N N 445 123.505 123.505 120.982 2.523 18990 5743 1 8 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.663 -0.952 18990 5744 1 8 . 1 1 445 445 ARG C C 445 175.289 175.289 175.085 0.204 18990 5745 1 8 . 1 1 445 445 ARG CA C 445 55.856 55.856 54.447 1.409 18990 5746 1 8 . 1 1 445 445 ARG CB C 445 30.675 30.675 32.068 -1.393 18990 5747 1 8 . 1 1 445 445 ARG H H 445 8.157 8.157 8.143 0.014 18990 5748 1 8 . 1 1 446 446 ASP N N 446 126.800 126.800 120.828 5.972 18990 5749 1 8 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.561 0.080 18990 5750 1 8 . 1 1 446 446 ASP C C 446 176.020 176.020 175.916 0.104 18990 5751 1 8 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.255 -0.303 18990 5752 1 8 . 1 1 446 446 ASP CB C 446 41.400 41.400 43.194 -1.794 18990 5753 1 8 . 1 1 446 446 ASP H H 446 8.476 8.476 7.734 0.742 18990 5754 1 8 . 1 1 447 447 GLY N N 447 111.262 111.262 109.521 1.741 18990 5755 1 8 . 1 1 447 447 GLY C C 447 174.073 174.073 174.174 -0.101 18990 5756 1 8 . 1 1 447 447 GLY CA C 447 45.832 45.832 44.453 1.379 18990 5757 1 8 . 1 1 447 447 GLY H H 447 8.056 8.056 8.480 -0.424 18990 5758 1 8 . 1 1 448 448 GLY N N 448 108.655 108.655 108.064 0.591 18990 5759 1 8 . 1 1 448 448 GLY C C 448 174.020 174.020 173.687 0.333 18990 5760 1 8 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.452 0.815 18990 5761 1 8 . 1 1 448 448 GLY H H 448 8.380 8.380 8.324 0.056 18990 5762 1 8 . 1 1 449 449 CYS N N 449 120.628 120.628 121.850 -1.222 18990 5763 1 8 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.564 -0.567 18990 5764 1 8 . 1 1 449 449 CYS C C 449 174.855 174.855 174.392 0.463 18990 5765 1 8 . 1 1 449 449 CYS CA C 449 59.291 59.291 58.044 1.248 18990 5766 1 8 . 1 1 449 449 CYS CB C 449 28.000 28.000 29.840 -1.840 18990 5767 1 8 . 1 1 449 449 CYS H H 449 7.832 7.832 8.757 -0.925 18990 5768 1 8 . 1 1 450 450 MET N N 450 123.947 123.947 122.873 1.074 18990 5769 1 8 . 1 1 450 450 MET HA H 450 4.551 4.551 4.710 -0.159 18990 5770 1 8 . 1 1 450 450 MET C C 450 174.658 174.658 174.527 0.131 18990 5771 1 8 . 1 1 450 450 MET CA C 450 54.970 54.970 54.536 0.434 18990 5772 1 8 . 1 1 450 450 MET CB C 450 34.100 34.100 31.468 2.632 18990 5773 1 8 . 1 1 450 450 MET H H 450 8.916 8.916 8.381 0.535 18990 5774 1 8 . 1 1 451 451 HIS N N 451 120.490 120.490 121.606 -1.116 18990 5775 1 8 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.464 -0.785 18990 5776 1 8 . 1 1 451 451 HIS C C 451 172.443 172.443 174.006 -1.563 18990 5777 1 8 . 1 1 451 451 HIS CA C 451 53.812 53.812 54.547 -0.735 18990 5778 1 8 . 1 1 451 451 HIS CB C 451 28.900 28.900 30.847 -1.947 18990 5779 1 8 . 1 1 451 451 HIS H H 451 7.557 7.557 7.209 0.348 18990 5780 1 8 . 1 1 452 452 MET N N 452 128.800 128.800 127.598 1.202 18990 5781 1 8 . 1 1 452 452 MET HA H 452 4.320 4.320 4.493 -0.173 18990 5782 1 8 . 1 1 452 452 MET C C 452 175.479 175.479 174.350 1.129 18990 5783 1 8 . 1 1 452 452 MET CA C 452 52.589 52.589 53.261 -0.672 18990 5784 1 8 . 1 1 452 452 MET CB C 452 28.074 28.074 31.801 -3.727 18990 5785 1 8 . 1 1 452 452 MET H H 452 9.087 9.087 8.575 0.512 18990 5786 1 8 . 1 1 453 453 VAL N N 453 122.200 122.200 123.697 -1.497 18990 5787 1 8 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.314 0.480 18990 5788 1 8 . 1 1 453 453 VAL C C 453 175.476 175.476 175.227 0.249 18990 5789 1 8 . 1 1 453 453 VAL CA C 453 61.380 61.380 61.163 0.217 18990 5790 1 8 . 1 1 453 453 VAL CB C 453 33.089 33.089 33.431 -0.342 18990 5791 1 8 . 1 1 453 453 VAL H H 453 8.016 8.016 8.355 -0.339 18990 5792 1 8 . 1 1 454 454 CYS N N 454 130.353 130.353 127.807 2.546 18990 5793 1 8 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.808 -0.213 18990 5794 1 8 . 1 1 454 454 CYS C C 454 177.833 177.833 174.423 3.410 18990 5795 1 8 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.500 3.071 18990 5796 1 8 . 1 1 454 454 CYS CB C 454 32.045 32.045 28.343 3.702 18990 5797 1 8 . 1 1 454 454 CYS H H 454 8.989 8.989 8.834 0.155 18990 5798 1 8 . 1 1 455 455 THR N N 455 119.000 119.000 120.679 -1.679 18990 5799 1 8 . 1 1 455 455 THR HA H 455 4.393 4.393 4.527 -0.134 18990 5800 1 8 . 1 1 455 455 THR C C 455 175.264 175.264 173.715 1.549 18990 5801 1 8 . 1 1 455 455 THR CA C 455 61.644 61.644 61.053 0.591 18990 5802 1 8 . 1 1 455 455 THR CB C 455 69.400 69.400 68.848 0.552 18990 5803 1 8 . 1 1 455 455 THR H H 455 8.533 8.533 8.552 -0.019 18990 5804 1 8 . 1 1 456 456 ARG N N 456 128.900 128.900 126.562 2.338 18990 5805 1 8 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.580 -0.355 18990 5806 1 8 . 1 1 456 456 ARG C C 456 177.782 177.782 175.370 2.412 18990 5807 1 8 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.774 2.176 18990 5808 1 8 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.575 -3.525 18990 5809 1 8 . 1 1 456 456 ARG H H 456 9.036 9.036 8.156 0.880 18990 5810 1 8 . 1 1 457 457 ALA N N 457 133.152 133.152 127.815 5.337 18990 5811 1 8 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.307 -0.161 18990 5812 1 8 . 1 1 457 457 ALA C C 457 178.757 178.757 177.595 1.162 18990 5813 1 8 . 1 1 457 457 ALA CA C 457 53.929 53.929 52.921 1.008 18990 5814 1 8 . 1 1 457 457 ALA CB C 457 17.710 17.710 17.768 -0.058 18990 5815 1 8 . 1 1 457 457 ALA H H 457 9.042 9.042 8.835 0.207 18990 5816 1 8 . 1 1 458 458 GLY N N 458 111.200 111.200 111.413 -0.213 18990 5817 1 8 . 1 1 458 458 GLY C C 458 173.558 173.558 174.157 -0.599 18990 5818 1 8 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.621 0.815 18990 5819 1 8 . 1 1 458 458 GLY H H 458 8.830 8.830 8.393 0.437 18990 5820 1 8 . 1 1 459 459 CYS N N 459 123.040 123.040 120.425 2.615 18990 5821 1 8 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.857 -0.235 18990 5822 1 8 . 1 1 459 459 CYS C C 459 176.591 176.591 175.255 1.336 18990 5823 1 8 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.173 1.326 18990 5824 1 8 . 1 1 459 459 CYS CB C 459 30.174 30.174 28.567 1.607 18990 5825 1 8 . 1 1 459 459 CYS H H 459 8.042 8.042 8.134 -0.092 18990 5826 1 8 . 1 1 460 460 GLY N N 460 104.500 104.500 110.790 -6.290 18990 5827 1 8 . 1 1 460 460 GLY C C 460 173.716 173.716 174.160 -0.444 18990 5828 1 8 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.409 0.599 18990 5829 1 8 . 1 1 460 460 GLY H H 460 7.705 7.705 8.433 -0.728 18990 5830 1 8 . 1 1 461 461 PHE N N 461 124.949 124.949 120.822 4.127 18990 5831 1 8 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.823 -0.243 18990 5832 1 8 . 1 1 461 461 PHE C C 461 174.447 174.447 173.817 0.630 18990 5833 1 8 . 1 1 461 461 PHE CA C 461 59.946 59.946 56.996 2.950 18990 5834 1 8 . 1 1 461 461 PHE CB C 461 41.300 41.300 41.720 -0.420 18990 5835 1 8 . 1 1 461 461 PHE H H 461 8.947 8.947 7.658 1.289 18990 5836 1 8 . 1 1 462 462 GLU N N 462 125.272 125.272 125.403 -0.131 18990 5837 1 8 . 1 1 462 462 GLU HA H 462 5.721 5.721 5.349 0.372 18990 5838 1 8 . 1 1 462 462 GLU C C 462 176.067 176.067 175.139 0.928 18990 5839 1 8 . 1 1 462 462 GLU CA C 462 54.624 54.624 54.845 -0.221 18990 5840 1 8 . 1 1 462 462 GLU CB C 462 31.255 31.255 32.966 -1.711 18990 5841 1 8 . 1 1 462 462 GLU H H 462 7.799 7.799 7.986 -0.187 18990 5842 1 8 . 1 1 463 463 TRP N N 463 121.524 121.524 119.643 1.881 18990 5843 1 8 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.393 0.113 18990 5844 1 8 . 1 1 463 463 TRP C C 463 172.844 172.844 174.655 -1.811 18990 5845 1 8 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.907 -1.136 18990 5846 1 8 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.273 0.463 18990 5847 1 8 . 1 1 463 463 TRP H H 463 9.300 9.300 9.073 0.227 18990 5848 1 8 . 1 1 464 464 CYS N N 464 120.868 120.868 119.620 1.248 18990 5849 1 8 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.795 0.621 18990 5850 1 8 . 1 1 464 464 CYS C C 464 177.213 177.213 176.624 0.589 18990 5851 1 8 . 1 1 464 464 CYS CA C 464 57.776 57.776 60.336 -2.560 18990 5852 1 8 . 1 1 464 464 CYS CB C 464 32.930 32.930 28.005 4.925 18990 5853 1 8 . 1 1 464 464 CYS H H 464 8.752 8.752 9.255 -0.503 18990 5854 1 8 . 1 1 465 465 TRP N N 465 131.209 131.209 127.075 4.134 18990 5855 1 8 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.290 0.137 18990 5856 1 8 . 1 1 465 465 TRP C C 465 176.051 176.051 175.957 0.094 18990 5857 1 8 . 1 1 465 465 TRP CA C 465 60.763 60.763 59.940 0.823 18990 5858 1 8 . 1 1 465 465 TRP CB C 465 31.126 31.126 30.177 0.949 18990 5859 1 8 . 1 1 465 465 TRP H H 465 9.809 9.809 8.635 1.174 18990 5860 1 8 . 1 1 466 466 VAL N N 466 118.233 118.233 112.571 5.662 18990 5861 1 8 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.501 0.123 18990 5862 1 8 . 1 1 466 466 VAL C C 466 178.943 178.943 175.958 2.985 18990 5863 1 8 . 1 1 466 466 VAL CA C 466 65.602 65.602 63.629 1.973 18990 5864 1 8 . 1 1 466 466 VAL CB C 466 33.172 33.172 31.465 1.707 18990 5865 1 8 . 1 1 466 466 VAL H H 466 8.627 8.627 7.884 0.743 18990 5866 1 8 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.743 -1.312 18990 5867 1 8 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.731 0.268 18990 5868 1 8 . 1 1 467 467 CYS CB C 467 31.870 31.870 29.920 1.950 18990 5869 1 8 . 1 1 467 467 CYS H H 467 7.820 7.820 7.582 0.238 18990 5870 1 8 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.800 -0.764 18990 5871 1 8 . 1 1 468 468 GLN CA C 468 58.051 58.051 55.949 2.103 18990 5872 1 8 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.989 -2.513 18990 5873 1 8 . 1 1 469 469 THR HA H 469 4.685 4.685 4.488 0.197 18990 5874 1 8 . 1 1 469 469 THR C C 469 173.351 173.351 172.644 0.707 18990 5875 1 8 . 1 1 469 469 THR CA C 469 59.176 59.176 60.694 -1.518 18990 5876 1 8 . 1 1 469 469 THR CB C 469 71.775 71.775 70.040 1.734 18990 5877 1 8 . 1 1 470 470 GLU N N 470 120.940 120.940 121.874 -0.934 18990 5878 1 8 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.793 -0.500 18990 5879 1 8 . 1 1 470 470 GLU C C 470 175.539 175.539 176.703 -1.164 18990 5880 1 8 . 1 1 470 470 GLU CA C 470 57.015 57.015 55.420 1.595 18990 5881 1 8 . 1 1 470 470 GLU CB C 470 29.965 29.965 31.412 -1.447 18990 5882 1 8 . 1 1 470 470 GLU H H 470 8.912 8.912 8.539 0.373 18990 5883 1 8 . 1 1 471 471 TRP N N 471 126.998 126.998 126.048 0.950 18990 5884 1 8 . 1 1 471 471 TRP HA H 471 4.293 4.293 3.882 0.411 18990 5885 1 8 . 1 1 471 471 TRP C C 471 175.408 175.408 174.918 0.490 18990 5886 1 8 . 1 1 471 471 TRP CA C 471 58.220 58.220 55.851 2.369 18990 5887 1 8 . 1 1 471 471 TRP CB C 471 29.500 29.500 27.325 2.175 18990 5888 1 8 . 1 1 471 471 TRP H H 471 8.350 8.350 8.451 -0.101 18990 5889 1 8 . 1 1 472 472 THR N N 472 117.480 117.480 115.442 2.038 18990 5890 1 8 . 1 1 472 472 THR HA H 472 4.444 4.444 4.494 -0.050 18990 5891 1 8 . 1 1 472 472 THR CA C 472 58.930 58.930 59.499 -0.569 18990 5892 1 8 . 1 1 472 472 THR H H 472 8.069 8.069 7.343 0.726 18990 5893 1 8 . 1 1 473 473 ARG HA H 473 3.773 3.773 4.068 -0.295 18990 5894 1 8 . 1 1 473 473 ARG C C 473 178.053 178.053 177.616 0.437 18990 5895 1 8 . 1 1 473 473 ARG CA C 473 58.088 58.088 59.355 -1.268 18990 5896 1 8 . 1 1 473 473 ARG CB C 473 29.426 29.426 30.207 -0.781 18990 5897 1 8 . 1 1 474 474 ASP N N 474 119.900 119.900 119.381 0.519 18990 5898 1 8 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.441 -0.227 18990 5899 1 8 . 1 1 474 474 ASP C C 474 178.197 178.197 177.416 0.781 18990 5900 1 8 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.809 -0.007 18990 5901 1 8 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.335 -0.153 18990 5902 1 8 . 1 1 474 474 ASP H H 474 7.718 7.718 8.351 -0.633 18990 5903 1 8 . 1 1 475 475 CYS N N 475 121.000 121.000 117.935 3.065 18990 5904 1 8 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.353 -0.986 18990 5905 1 8 . 1 1 475 475 CYS CA C 475 64.533 64.533 59.509 5.024 18990 5906 1 8 . 1 1 475 475 CYS CB C 475 29.092 29.092 26.872 2.220 18990 5907 1 8 . 1 1 475 475 CYS H H 475 6.953 6.953 7.837 -0.884 18990 5908 1 8 . 1 1 476 476 MET HA H 476 4.021 4.021 4.086 -0.065 18990 5909 1 8 . 1 1 476 476 MET CA C 476 58.010 58.010 59.107 -1.097 18990 5910 1 8 . 1 1 476 476 MET CB C 476 32.550 32.550 32.556 -0.006 18990 5911 1 8 . 1 1 477 477 GLY N N 477 111.938 111.938 103.092 8.846 18990 5912 1 8 . 1 1 477 477 GLY C C 477 174.406 174.406 173.739 0.667 18990 5913 1 8 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.737 0.879 18990 5914 1 8 . 1 1 477 477 GLY H H 477 9.155 9.155 7.740 1.415 18990 5915 1 8 . 1 1 478 478 ALA N N 478 121.900 121.900 124.697 -2.797 18990 5916 1 8 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.667 -0.376 18990 5917 1 8 . 1 1 478 478 ALA C C 478 178.196 178.196 177.529 0.667 18990 5918 1 8 . 1 1 478 478 ALA CA C 478 53.440 53.440 52.905 0.535 18990 5919 1 8 . 1 1 478 478 ALA CB C 478 20.390 20.390 20.186 0.204 18990 5920 1 8 . 1 1 478 478 ALA H H 478 7.347 7.347 7.714 -0.367 18990 5921 1 8 . 1 1 479 479 HIS N N 479 115.200 115.200 110.830 4.370 18990 5922 1 8 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.942 -0.039 18990 5923 1 8 . 1 1 479 479 HIS C C 479 173.325 173.325 175.389 -2.064 18990 5924 1 8 . 1 1 479 479 HIS CA C 479 54.526 54.526 55.055 -0.529 18990 5925 1 8 . 1 1 479 479 HIS CB C 479 27.600 27.600 30.907 -3.307 18990 5926 1 8 . 1 1 479 479 HIS H H 479 8.297 8.297 7.932 0.365 18990 5927 1 8 . 1 1 480 480 TRP N N 480 121.780 121.780 123.382 -1.602 18990 5928 1 8 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.481 -0.186 18990 5929 1 8 . 1 1 480 480 TRP C C 480 175.568 175.568 175.002 0.566 18990 5930 1 8 . 1 1 480 480 TRP CA C 480 58.358 58.358 59.560 -1.202 18990 5931 1 8 . 1 1 480 480 TRP CB C 480 29.550 29.550 30.422 -0.872 18990 5932 1 8 . 1 1 480 480 TRP H H 480 8.081 8.081 7.999 0.082 18990 5933 1 8 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.704 0.141 18990 5934 1 8 . 1 1 481 481 PHE C C 481 175.126 175.126 174.718 0.408 18990 5935 1 8 . 1 1 481 481 PHE CA C 481 56.471 56.471 57.151 -0.680 18990 5936 1 8 . 1 1 481 481 PHE CB C 481 41.006 41.006 40.311 0.695 18990 5937 1 9 . 1 1 343 343 GLU N N 343 121.045 121.045 120.898 0.147 18990 5938 1 9 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.845 -0.680 18990 5939 1 9 . 1 1 343 343 GLU C C 343 176.529 176.529 175.160 1.369 18990 5940 1 9 . 1 1 343 343 GLU CA C 343 57.162 57.162 55.539 1.623 18990 5941 1 9 . 1 1 343 343 GLU CB C 343 30.204 30.204 30.617 -0.413 18990 5942 1 9 . 1 1 343 343 GLU H H 343 8.293 8.293 8.706 -0.413 18990 5943 1 9 . 1 1 344 344 TYR N N 344 121.000 121.000 118.663 2.337 18990 5944 1 9 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.679 -0.141 18990 5945 1 9 . 1 1 344 344 TYR C C 344 175.897 175.897 176.309 -0.412 18990 5946 1 9 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.421 0.758 18990 5947 1 9 . 1 1 344 344 TYR CB C 344 38.600 38.600 40.218 -1.618 18990 5948 1 9 . 1 1 344 344 TYR H H 344 8.040 8.040 8.260 -0.220 18990 5949 1 9 . 1 1 345 345 VAL N N 345 121.900 121.900 120.122 1.778 18990 5950 1 9 . 1 1 345 345 VAL HA H 345 3.939 3.939 3.893 0.046 18990 5951 1 9 . 1 1 345 345 VAL C C 345 176.143 176.143 176.648 -0.505 18990 5952 1 9 . 1 1 345 345 VAL CA C 345 62.867 62.867 64.102 -1.235 18990 5953 1 9 . 1 1 345 345 VAL CB C 345 32.799 32.799 32.309 0.490 18990 5954 1 9 . 1 1 345 345 VAL H H 345 7.856 7.856 8.644 -0.788 18990 5955 1 9 . 1 1 346 346 LEU N N 346 124.950 124.950 116.590 8.360 18990 5956 1 9 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.709 -0.466 18990 5957 1 9 . 1 1 346 346 LEU C C 346 177.747 177.747 175.512 2.235 18990 5958 1 9 . 1 1 346 346 LEU CA C 346 55.500 55.500 53.735 1.765 18990 5959 1 9 . 1 1 346 346 LEU CB C 346 42.252 42.252 43.213 -0.961 18990 5960 1 9 . 1 1 346 346 LEU H H 346 8.127 8.127 7.506 0.621 18990 5961 1 9 . 1 1 347 347 GLN N N 347 121.452 121.452 119.448 2.004 18990 5962 1 9 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.509 -0.223 18990 5963 1 9 . 1 1 347 347 GLN C C 347 175.833 175.833 175.108 0.725 18990 5964 1 9 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.278 0.710 18990 5965 1 9 . 1 1 347 347 GLN CB C 347 29.375 29.375 30.780 -1.405 18990 5966 1 9 . 1 1 347 347 GLN H H 347 8.270 8.270 8.323 -0.053 18990 5967 1 9 . 1 1 348 348 ALA N N 348 124.466 124.466 127.010 -2.544 18990 5968 1 9 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.367 -0.046 18990 5969 1 9 . 1 1 348 348 ALA C C 348 177.929 177.929 177.458 0.471 18990 5970 1 9 . 1 1 348 348 ALA CA C 348 52.703 52.703 52.882 -0.179 18990 5971 1 9 . 1 1 348 348 ALA CB C 348 19.002 19.002 19.049 -0.047 18990 5972 1 9 . 1 1 348 348 ALA H H 348 8.227 8.227 8.465 -0.238 18990 5973 1 9 . 1 1 349 349 GLY N N 349 108.193 108.193 111.090 -2.897 18990 5974 1 9 . 1 1 349 349 GLY C C 349 174.269 174.269 173.116 1.153 18990 5975 1 9 . 1 1 349 349 GLY CA C 349 45.227 45.227 44.930 0.297 18990 5976 1 9 . 1 1 349 349 GLY H H 349 8.298 8.298 8.666 -0.368 18990 5977 1 9 . 1 1 350 350 GLY N N 350 108.073 108.073 107.823 0.250 18990 5978 1 9 . 1 1 350 350 GLY C C 350 172.979 172.979 173.279 -0.300 18990 5979 1 9 . 1 1 350 350 GLY CA C 350 44.935 44.935 44.920 0.015 18990 5980 1 9 . 1 1 350 350 GLY H H 350 8.156 8.156 7.811 0.345 18990 5981 1 9 . 1 1 351 351 VAL N N 351 119.058 119.058 115.380 3.678 18990 5982 1 9 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.910 -0.494 18990 5983 1 9 . 1 1 351 351 VAL C C 351 173.412 173.412 174.675 -1.263 18990 5984 1 9 . 1 1 351 351 VAL CA C 351 60.663 60.663 59.476 1.187 18990 5985 1 9 . 1 1 351 351 VAL CB C 351 34.866 34.866 35.573 -0.707 18990 5986 1 9 . 1 1 351 351 VAL H H 351 8.541 8.541 8.922 -0.381 18990 5987 1 9 . 1 1 352 352 LEU N N 352 125.800 125.800 119.654 6.146 18990 5988 1 9 . 1 1 352 352 LEU HA H 352 4.765 4.765 5.217 -0.452 18990 5989 1 9 . 1 1 352 352 LEU C C 352 176.218 176.218 176.372 -0.154 18990 5990 1 9 . 1 1 352 352 LEU CA C 352 53.341 53.341 52.867 0.474 18990 5991 1 9 . 1 1 352 352 LEU CB C 352 42.706 42.706 45.359 -2.653 18990 5992 1 9 . 1 1 352 352 LEU H H 352 8.151 8.151 8.178 -0.027 18990 5993 1 9 . 1 1 353 353 CYS N N 353 126.825 126.825 122.606 4.219 18990 5994 1 9 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.204 -0.097 18990 5995 1 9 . 1 1 353 353 CYS C C 353 176.655 176.655 174.382 2.273 18990 5996 1 9 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.731 0.000 18990 5997 1 9 . 1 1 353 353 CYS CB C 353 31.865 31.865 28.185 3.680 18990 5998 1 9 . 1 1 353 353 CYS H H 353 8.794 8.794 8.503 0.291 18990 5999 1 9 . 1 1 354 354 PRO HA H 354 4.420 4.420 3.969 0.451 18990 6000 1 9 . 1 1 354 354 PRO C C 354 177.512 177.512 176.430 1.082 18990 6001 1 9 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.318 -0.326 18990 6002 1 9 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.210 1.357 18990 6003 1 9 . 1 1 355 355 GLN N N 355 126.800 126.800 119.978 6.822 18990 6004 1 9 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.343 -0.068 18990 6005 1 9 . 1 1 355 355 GLN C C 355 175.516 175.516 174.867 0.649 18990 6006 1 9 . 1 1 355 355 GLN CA C 355 54.793 54.793 53.761 1.032 18990 6007 1 9 . 1 1 355 355 GLN CB C 355 28.547 28.547 29.459 -0.912 18990 6008 1 9 . 1 1 355 355 GLN H H 355 9.033 9.033 7.276 1.757 18990 6009 1 9 . 1 1 357 357 GLY C C 357 173.229 173.229 174.748 -1.519 18990 6010 1 9 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.961 0.293 18990 6011 1 9 . 1 1 358 358 CYS N N 358 123.500 123.500 120.024 3.476 18990 6012 1 9 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.415 0.118 18990 6013 1 9 . 1 1 358 358 CYS C C 358 176.157 176.157 176.207 -0.050 18990 6014 1 9 . 1 1 358 358 CYS CA C 358 60.268 60.268 60.133 0.135 18990 6015 1 9 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.723 0.652 18990 6016 1 9 . 1 1 358 358 CYS H H 358 7.720 7.720 7.489 0.231 18990 6017 1 9 . 1 1 359 359 GLY N N 359 104.400 104.400 109.049 -4.649 18990 6018 1 9 . 1 1 359 359 GLY C C 359 174.080 174.080 173.818 0.262 18990 6019 1 9 . 1 1 359 359 GLY CA C 359 46.064 46.064 45.639 0.425 18990 6020 1 9 . 1 1 359 359 GLY H H 359 7.756 7.756 7.930 -0.174 18990 6021 1 9 . 1 1 360 360 MET N N 360 121.300 121.300 119.081 2.219 18990 6022 1 9 . 1 1 360 360 MET HA H 360 4.343 4.343 4.643 -0.300 18990 6023 1 9 . 1 1 360 360 MET C C 360 175.641 175.641 175.076 0.565 18990 6024 1 9 . 1 1 360 360 MET CA C 360 55.923 55.923 55.127 0.796 18990 6025 1 9 . 1 1 360 360 MET CB C 360 33.091 33.091 34.846 -1.755 18990 6026 1 9 . 1 1 360 360 MET H H 360 8.229 8.229 7.731 0.498 18990 6027 1 9 . 1 1 361 361 GLY N N 361 109.000 109.000 110.763 -1.763 18990 6028 1 9 . 1 1 361 361 GLY C C 361 173.774 173.774 173.757 0.017 18990 6029 1 9 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.338 1.500 18990 6030 1 9 . 1 1 361 361 GLY H H 361 8.347 8.347 8.500 -0.153 18990 6031 1 9 . 1 1 362 362 LEU N N 362 126.725 126.725 126.871 -0.146 18990 6032 1 9 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.722 -0.047 18990 6033 1 9 . 1 1 362 362 LEU C C 362 175.865 175.865 175.931 -0.066 18990 6034 1 9 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.482 0.708 18990 6035 1 9 . 1 1 362 362 LEU CB C 362 44.050 44.050 43.590 0.460 18990 6036 1 9 . 1 1 362 362 LEU H H 362 8.935 8.935 8.732 0.203 18990 6037 1 9 . 1 1 363 363 LEU N N 363 123.742 123.742 124.448 -0.706 18990 6038 1 9 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.593 0.084 18990 6039 1 9 . 1 1 363 363 LEU C C 363 176.162 176.162 176.163 -0.001 18990 6040 1 9 . 1 1 363 363 LEU CA C 363 54.342 54.342 53.985 0.357 18990 6041 1 9 . 1 1 363 363 LEU CB C 363 42.210 42.210 43.593 -1.383 18990 6042 1 9 . 1 1 363 363 LEU H H 363 8.481 8.481 8.702 -0.221 18990 6043 1 9 . 1 1 364 364 VAL N N 364 120.980 120.980 126.611 -5.631 18990 6044 1 9 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.065 0.332 18990 6045 1 9 . 1 1 364 364 VAL C C 364 175.592 175.592 175.132 0.460 18990 6046 1 9 . 1 1 364 364 VAL CA C 364 60.460 60.460 61.568 -1.108 18990 6047 1 9 . 1 1 364 364 VAL CB C 364 34.125 34.125 31.637 2.488 18990 6048 1 9 . 1 1 364 364 VAL H H 364 8.155 8.155 8.325 -0.170 18990 6049 1 9 . 1 1 365 365 GLU N N 365 126.950 126.950 127.480 -0.530 18990 6050 1 9 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.429 0.181 18990 6051 1 9 . 1 1 365 365 GLU C C 365 175.427 175.427 176.362 -0.935 18990 6052 1 9 . 1 1 365 365 GLU CA C 365 54.551 54.551 54.520 0.031 18990 6053 1 9 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.288 0.492 18990 6054 1 9 . 1 1 365 365 GLU H H 365 8.900 8.900 8.259 0.641 18990 6055 1 9 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.299 -0.037 18990 6056 1 9 . 1 1 366 366 PRO C C 366 177.013 177.013 176.247 0.766 18990 6057 1 9 . 1 1 366 366 PRO CA C 366 64.463 64.463 64.781 -0.318 18990 6058 1 9 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.666 0.382 18990 6059 1 9 . 1 1 367 367 ASP N N 367 115.459 115.459 115.834 -0.375 18990 6060 1 9 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.617 -0.122 18990 6061 1 9 . 1 1 367 367 ASP C C 367 175.123 175.123 175.420 -0.297 18990 6062 1 9 . 1 1 367 367 ASP CA C 367 54.503 54.503 52.029 2.474 18990 6063 1 9 . 1 1 367 367 ASP CB C 367 40.123 40.123 39.714 0.409 18990 6064 1 9 . 1 1 367 367 ASP H H 367 8.439 8.439 8.537 -0.099 18990 6065 1 9 . 1 1 368 368 CYS N N 368 118.700 118.700 121.047 -2.347 18990 6066 1 9 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.142 0.428 18990 6067 1 9 . 1 1 368 368 CYS C C 368 173.806 173.806 176.421 -2.615 18990 6068 1 9 . 1 1 368 368 CYS CA C 368 58.581 58.581 60.600 -2.019 18990 6069 1 9 . 1 1 368 368 CYS CB C 368 28.450 28.450 29.297 -0.847 18990 6070 1 9 . 1 1 368 368 CYS H H 368 7.515 7.515 7.802 -0.287 18990 6071 1 9 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.342 -0.077 18990 6072 1 9 . 1 1 369 369 ARG C C 369 174.908 174.908 176.321 -1.413 18990 6073 1 9 . 1 1 369 369 ARG CA C 369 57.669 57.669 56.658 1.011 18990 6074 1 9 . 1 1 369 369 ARG CB C 369 32.274 32.274 30.523 1.750 18990 6075 1 9 . 1 1 370 370 LYS N N 370 121.022 121.022 119.008 2.014 18990 6076 1 9 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.709 -0.539 18990 6077 1 9 . 1 1 370 370 LYS C C 370 174.868 174.868 175.047 -0.179 18990 6078 1 9 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.032 1.522 18990 6079 1 9 . 1 1 370 370 LYS CB C 370 33.140 33.140 34.438 -1.298 18990 6080 1 9 . 1 1 370 370 LYS H H 370 7.740 7.740 8.098 -0.358 18990 6081 1 9 . 1 1 371 371 VAL N N 371 128.362 128.362 125.615 2.747 18990 6082 1 9 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.041 0.092 18990 6083 1 9 . 1 1 371 371 VAL C C 371 173.402 173.402 174.498 -1.096 18990 6084 1 9 . 1 1 371 371 VAL CA C 371 60.777 60.777 62.001 -1.224 18990 6085 1 9 . 1 1 371 371 VAL CB C 371 33.000 33.000 31.962 1.038 18990 6086 1 9 . 1 1 371 371 VAL H H 371 8.647 8.647 8.637 0.010 18990 6087 1 9 . 1 1 372 372 THR N N 372 119.667 119.667 123.683 -4.016 18990 6088 1 9 . 1 1 372 372 THR HA H 372 5.032 5.032 5.081 -0.049 18990 6089 1 9 . 1 1 372 372 THR C C 372 174.339 174.339 173.636 0.703 18990 6090 1 9 . 1 1 372 372 THR CA C 372 60.881 60.881 60.977 -0.096 18990 6091 1 9 . 1 1 372 372 THR CB C 372 70.471 70.471 71.788 -1.317 18990 6092 1 9 . 1 1 372 372 THR H H 372 8.087 8.087 7.975 0.112 18990 6093 1 9 . 1 1 373 373 CYS N N 373 132.554 132.554 126.125 6.429 18990 6094 1 9 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.532 0.270 18990 6095 1 9 . 1 1 373 373 CYS C C 373 176.791 176.791 175.459 1.332 18990 6096 1 9 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.274 -0.770 18990 6097 1 9 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.965 3.346 18990 6098 1 9 . 1 1 373 373 CYS H H 373 9.322 9.322 9.223 0.099 18990 6099 1 9 . 1 1 374 374 GLN N N 374 125.890 125.890 123.185 2.705 18990 6100 1 9 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.425 -0.425 18990 6101 1 9 . 1 1 374 374 GLN C C 374 176.827 176.827 176.530 0.297 18990 6102 1 9 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.053 1.246 18990 6103 1 9 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.701 0.963 18990 6104 1 9 . 1 1 374 374 GLN H H 374 7.856 7.856 8.463 -0.607 18990 6105 1 9 . 1 1 375 375 ASN N N 375 115.342 115.342 115.721 -0.379 18990 6106 1 9 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.901 -0.014 18990 6107 1 9 . 1 1 375 375 ASN C C 375 174.049 174.049 175.023 -0.974 18990 6108 1 9 . 1 1 375 375 ASN CA C 375 53.047 53.047 53.334 -0.287 18990 6109 1 9 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.497 -0.581 18990 6110 1 9 . 1 1 375 375 ASN H H 375 8.913 8.913 8.287 0.626 18990 6111 1 9 . 1 1 376 376 GLY N N 376 109.098 109.098 108.559 0.539 18990 6112 1 9 . 1 1 376 376 GLY C C 376 174.110 174.110 174.075 0.035 18990 6113 1 9 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.804 0.582 18990 6114 1 9 . 1 1 376 376 GLY H H 376 7.162 7.162 8.007 -0.845 18990 6115 1 9 . 1 1 377 377 CYS N N 377 132.546 132.546 118.771 13.775 18990 6116 1 9 . 1 1 377 377 CYS HA H 377 4.764 4.764 5.044 -0.280 18990 6117 1 9 . 1 1 377 377 CYS C C 377 177.355 177.355 174.175 3.180 18990 6118 1 9 . 1 1 377 377 CYS CA C 377 59.988 59.988 57.326 2.662 18990 6119 1 9 . 1 1 377 377 CYS CB C 377 32.365 32.365 29.737 2.628 18990 6120 1 9 . 1 1 377 377 CYS H H 377 9.800 9.800 7.957 1.843 18990 6121 1 9 . 1 1 378 378 GLY N N 378 113.851 113.851 108.326 5.525 18990 6122 1 9 . 1 1 378 378 GLY C C 378 173.404 173.404 172.486 0.918 18990 6123 1 9 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.758 0.105 18990 6124 1 9 . 1 1 378 378 GLY H H 378 8.820 8.820 8.183 0.637 18990 6125 1 9 . 1 1 379 379 TYR N N 379 125.532 125.532 124.637 0.895 18990 6126 1 9 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.759 -0.281 18990 6127 1 9 . 1 1 379 379 TYR C C 379 173.661 173.661 173.739 -0.078 18990 6128 1 9 . 1 1 379 379 TYR CA C 379 59.180 59.180 57.891 1.289 18990 6129 1 9 . 1 1 379 379 TYR CB C 379 40.108 40.108 41.798 -1.690 18990 6130 1 9 . 1 1 379 379 TYR H H 379 9.054 9.054 8.193 0.861 18990 6131 1 9 . 1 1 380 380 VAL N N 380 124.461 124.461 129.028 -4.567 18990 6132 1 9 . 1 1 380 380 VAL HA H 380 4.818 4.818 5.198 -0.380 18990 6133 1 9 . 1 1 380 380 VAL C C 380 175.876 175.876 174.277 1.599 18990 6134 1 9 . 1 1 380 380 VAL CA C 380 60.797 60.797 60.746 0.051 18990 6135 1 9 . 1 1 380 380 VAL CB C 380 32.610 32.610 33.420 -0.810 18990 6136 1 9 . 1 1 380 380 VAL H H 380 7.238 7.238 8.131 -0.893 18990 6137 1 9 . 1 1 381 381 PHE N N 381 124.588 124.588 124.535 0.053 18990 6138 1 9 . 1 1 381 381 PHE HA H 381 5.273 5.273 5.157 0.116 18990 6139 1 9 . 1 1 381 381 PHE C C 381 173.242 173.242 173.342 -0.100 18990 6140 1 9 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.356 -0.146 18990 6141 1 9 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.113 1.977 18990 6142 1 9 . 1 1 381 381 PHE H H 381 9.424 9.424 7.937 1.487 18990 6143 1 9 . 1 1 382 382 CYS N N 382 120.221 120.221 120.131 0.090 18990 6144 1 9 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.187 0.715 18990 6145 1 9 . 1 1 382 382 CYS C C 382 177.165 177.165 175.674 1.491 18990 6146 1 9 . 1 1 382 382 CYS CA C 382 57.691 57.691 58.000 -0.309 18990 6147 1 9 . 1 1 382 382 CYS CB C 382 32.475 32.475 29.964 2.511 18990 6148 1 9 . 1 1 382 382 CYS H H 382 8.673 8.673 8.539 0.135 18990 6149 1 9 . 1 1 383 383 ARG N N 383 129.347 129.347 120.558 8.789 18990 6150 1 9 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.222 -0.201 18990 6151 1 9 . 1 1 383 383 ARG C C 383 175.012 175.012 175.969 -0.957 18990 6152 1 9 . 1 1 383 383 ARG CA C 383 58.686 58.686 57.719 0.967 18990 6153 1 9 . 1 1 383 383 ARG CB C 383 30.900 30.900 29.817 1.083 18990 6154 1 9 . 1 1 383 383 ARG H H 383 9.534 9.534 8.407 1.127 18990 6155 1 9 . 1 1 384 384 ASN N N 384 117.772 117.772 117.611 0.161 18990 6156 1 9 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.665 0.043 18990 6157 1 9 . 1 1 384 384 ASN C C 384 175.656 175.656 174.568 1.088 18990 6158 1 9 . 1 1 384 384 ASN CA C 384 55.778 55.778 54.060 1.718 18990 6159 1 9 . 1 1 384 384 ASN CB C 384 39.475 39.475 39.944 -0.469 18990 6160 1 9 . 1 1 384 384 ASN H H 384 8.840 8.840 8.013 0.827 18990 6161 1 9 . 1 1 385 385 CYS N N 385 115.876 115.876 114.322 1.554 18990 6162 1 9 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.950 0.078 18990 6163 1 9 . 1 1 385 385 CYS C C 385 175.703 175.703 173.626 2.077 18990 6164 1 9 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.627 1.486 18990 6165 1 9 . 1 1 385 385 CYS CB C 385 32.359 32.359 30.477 1.882 18990 6166 1 9 . 1 1 385 385 CYS H H 385 7.868 7.868 7.896 -0.028 18990 6167 1 9 . 1 1 386 386 LEU N N 386 120.082 120.082 119.294 0.788 18990 6168 1 9 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.723 -0.410 18990 6169 1 9 . 1 1 386 386 LEU C C 386 175.722 175.722 177.134 -1.412 18990 6170 1 9 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.265 2.744 18990 6171 1 9 . 1 1 386 386 LEU CB C 386 38.412 38.412 42.006 -3.594 18990 6172 1 9 . 1 1 386 386 LEU H H 386 8.514 8.514 8.382 0.132 18990 6173 1 9 . 1 1 387 387 GLN N N 387 117.579 117.579 120.238 -2.659 18990 6174 1 9 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.367 0.409 18990 6175 1 9 . 1 1 387 387 GLN C C 387 175.299 175.299 176.860 -1.561 18990 6176 1 9 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.920 -1.903 18990 6177 1 9 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.778 1.529 18990 6178 1 9 . 1 1 387 387 GLN H H 387 8.248 8.248 7.667 0.581 18990 6179 1 9 . 1 1 388 388 GLY N N 388 106.107 106.107 107.898 -1.791 18990 6180 1 9 . 1 1 388 388 GLY C C 388 173.693 173.693 174.015 -0.322 18990 6181 1 9 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.270 0.910 18990 6182 1 9 . 1 1 388 388 GLY H H 388 8.695 8.695 8.406 0.289 18990 6183 1 9 . 1 1 389 389 TYR N N 389 122.514 122.514 117.468 5.046 18990 6184 1 9 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.277 -0.619 18990 6185 1 9 . 1 1 389 389 TYR C C 389 172.860 172.860 173.911 -1.051 18990 6186 1 9 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.602 4.385 18990 6187 1 9 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.700 0.352 18990 6188 1 9 . 1 1 389 389 TYR H H 389 7.923 7.923 8.265 -0.342 18990 6189 1 9 . 1 1 390 390 HIS N N 390 120.080 120.080 124.841 -4.761 18990 6190 1 9 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.902 -0.194 18990 6191 1 9 . 1 1 390 390 HIS C C 390 173.235 173.235 173.136 0.099 18990 6192 1 9 . 1 1 390 390 HIS CA C 390 51.431 51.431 54.368 -2.937 18990 6193 1 9 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.960 -0.060 18990 6194 1 9 . 1 1 390 390 HIS H H 390 5.291 5.291 8.131 -2.840 18990 6195 1 9 . 1 1 391 391 ILE N N 391 117.810 117.810 119.946 -2.136 18990 6196 1 9 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.356 -0.240 18990 6197 1 9 . 1 1 391 391 ILE C C 391 178.208 178.208 176.469 1.739 18990 6198 1 9 . 1 1 391 391 ILE CA C 391 60.877 60.877 61.251 -0.374 18990 6199 1 9 . 1 1 391 391 ILE CB C 391 39.034 39.034 39.077 -0.043 18990 6200 1 9 . 1 1 391 391 ILE H H 391 8.418 8.418 8.490 -0.072 18990 6201 1 9 . 1 1 392 392 GLY N N 392 112.387 112.387 112.780 -0.393 18990 6202 1 9 . 1 1 392 392 GLY C C 392 173.565 173.565 174.190 -0.625 18990 6203 1 9 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.518 0.740 18990 6204 1 9 . 1 1 392 392 GLY H H 392 8.654 8.654 8.814 -0.160 18990 6205 1 9 . 1 1 393 393 GLU N N 393 119.098 119.098 117.868 1.230 18990 6206 1 9 . 1 1 393 393 GLU HA H 393 4.289 4.289 3.953 0.336 18990 6207 1 9 . 1 1 393 393 GLU C C 393 176.899 176.899 174.679 2.220 18990 6208 1 9 . 1 1 393 393 GLU CA C 393 56.433 56.433 57.128 -0.695 18990 6209 1 9 . 1 1 393 393 GLU CB C 393 30.470 30.470 29.653 0.817 18990 6210 1 9 . 1 1 393 393 GLU H H 393 8.391 8.391 8.031 0.360 18990 6211 1 9 . 1 1 394 394 CYS N N 394 122.845 122.845 116.338 6.507 18990 6212 1 9 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.729 -0.963 18990 6213 1 9 . 1 1 394 394 CYS C C 394 175.461 175.461 174.770 0.691 18990 6214 1 9 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.718 1.117 18990 6215 1 9 . 1 1 394 394 CYS CB C 394 30.761 30.761 28.804 1.957 18990 6216 1 9 . 1 1 394 394 CYS H H 394 8.474 8.474 8.243 0.231 18990 6217 1 9 . 1 1 395 395 LEU N N 395 124.403 124.403 121.343 3.060 18990 6218 1 9 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.724 -0.220 18990 6219 1 9 . 1 1 395 395 LEU C C 395 175.259 175.259 175.067 0.192 18990 6220 1 9 . 1 1 395 395 LEU CA C 395 52.835 52.835 54.748 -1.913 18990 6221 1 9 . 1 1 395 395 LEU CB C 395 41.436 41.436 41.588 -0.152 18990 6222 1 9 . 1 1 395 395 LEU H H 395 8.418 8.418 7.828 0.590 18990 6223 1 9 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.779 -0.409 18990 6224 1 9 . 1 1 396 396 PRO C C 396 177.006 177.006 176.204 0.802 18990 6225 1 9 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.380 0.716 18990 6226 1 9 . 1 1 396 396 PRO CB C 396 32.072 32.072 33.154 -1.082 18990 6227 1 9 . 1 1 397 397 GLU N N 397 121.574 121.574 119.160 2.414 18990 6228 1 9 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.346 -0.121 18990 6229 1 9 . 1 1 397 397 GLU C C 397 177.202 177.202 177.030 0.172 18990 6230 1 9 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.162 0.872 18990 6231 1 9 . 1 1 397 397 GLU CB C 397 30.263 30.263 30.089 0.174 18990 6232 1 9 . 1 1 397 397 GLU H H 397 8.568 8.568 8.690 -0.122 18990 6233 1 9 . 1 1 398 398 GLY N N 398 110.495 110.495 109.462 1.033 18990 6234 1 9 . 1 1 398 398 GLY C C 398 174.579 174.579 173.277 1.302 18990 6235 1 9 . 1 1 398 398 GLY CA C 398 45.462 45.462 44.399 1.063 18990 6236 1 9 . 1 1 398 398 GLY H H 398 8.515 8.515 7.796 0.719 18990 6237 1 9 . 1 1 399 399 THR N N 399 113.234 113.234 113.698 -0.464 18990 6238 1 9 . 1 1 399 399 THR HA H 399 4.398 4.398 4.441 -0.043 18990 6239 1 9 . 1 1 399 399 THR C C 399 175.333 175.333 173.639 1.694 18990 6240 1 9 . 1 1 399 399 THR CA C 399 62.233 62.233 61.990 0.243 18990 6241 1 9 . 1 1 399 399 THR CB C 399 69.833 69.833 69.839 -0.006 18990 6242 1 9 . 1 1 399 399 THR H H 399 8.090 8.090 8.204 -0.114 18990 6243 1 9 . 1 1 400 400 GLY N N 400 111.479 111.479 110.724 0.755 18990 6244 1 9 . 1 1 400 400 GLY C C 400 174.048 174.048 173.041 1.007 18990 6245 1 9 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.599 -0.160 18990 6246 1 9 . 1 1 400 400 GLY H H 400 8.524 8.524 8.282 0.242 18990 6247 1 9 . 1 1 401 401 ALA N N 401 123.919 123.919 125.349 -1.430 18990 6248 1 9 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.715 -0.464 18990 6249 1 9 . 1 1 401 401 ALA C C 401 177.942 177.942 177.240 0.702 18990 6250 1 9 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.479 1.251 18990 6251 1 9 . 1 1 401 401 ALA CB C 401 19.142 19.142 20.486 -1.344 18990 6252 1 9 . 1 1 401 401 ALA H H 401 8.179 8.179 8.247 -0.068 18990 6253 1 9 . 1 1 402 402 SER N N 402 114.904 114.904 118.144 -3.240 18990 6254 1 9 . 1 1 402 402 SER HA H 402 4.448 4.448 4.695 -0.247 18990 6255 1 9 . 1 1 402 402 SER C C 402 174.426 174.426 173.789 0.637 18990 6256 1 9 . 1 1 402 402 SER CA C 402 58.289 58.289 58.024 0.265 18990 6257 1 9 . 1 1 402 402 SER CB C 402 63.772 63.772 63.825 -0.053 18990 6258 1 9 . 1 1 402 402 SER H H 402 8.305 8.305 8.494 -0.189 18990 6259 1 9 . 1 1 403 403 ALA N N 403 125.965 125.965 127.228 -1.263 18990 6260 1 9 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.597 -0.198 18990 6261 1 9 . 1 1 403 403 ALA C C 403 177.984 177.984 176.367 1.617 18990 6262 1 9 . 1 1 403 403 ALA CA C 403 52.655 52.655 52.587 0.068 18990 6263 1 9 . 1 1 403 403 ALA CB C 403 19.138 19.138 20.305 -1.167 18990 6264 1 9 . 1 1 403 403 ALA H H 403 8.345 8.345 8.422 -0.077 18990 6265 1 9 . 1 1 404 404 THR N N 404 112.790 112.790 115.356 -2.566 18990 6266 1 9 . 1 1 404 404 THR C C 404 174.420 174.420 173.163 1.257 18990 6267 1 9 . 1 1 404 404 THR CA C 404 61.988 61.988 62.046 -0.058 18990 6268 1 9 . 1 1 404 404 THR CB C 404 69.688 69.688 70.033 -0.345 18990 6269 1 9 . 1 1 404 404 THR H H 404 8.118 8.118 8.253 -0.135 18990 6270 1 9 . 1 1 405 405 ASN N N 405 121.050 121.050 122.517 -1.467 18990 6271 1 9 . 1 1 405 405 ASN H H 405 8.396 8.396 8.387 0.009 18990 6272 1 9 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.634 -0.056 18990 6273 1 9 . 1 1 407 407 CYS C C 407 174.489 174.489 174.843 -0.354 18990 6274 1 9 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.545 0.168 18990 6275 1 9 . 1 1 407 407 CYS CB C 407 28.102 28.102 29.439 -1.337 18990 6276 1 9 . 1 1 408 408 GLU N N 408 123.021 123.021 124.426 -1.405 18990 6277 1 9 . 1 1 408 408 GLU C C 408 175.954 175.954 175.528 0.426 18990 6278 1 9 . 1 1 408 408 GLU CA C 408 56.802 56.802 55.749 1.052 18990 6279 1 9 . 1 1 408 408 GLU CB C 408 30.328 30.328 30.574 -0.246 18990 6280 1 9 . 1 1 408 408 GLU H H 408 8.415 8.415 8.691 -0.276 18990 6281 1 9 . 1 1 409 409 TYR N N 409 121.015 121.015 120.865 0.150 18990 6282 1 9 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.733 -0.079 18990 6283 1 9 . 1 1 409 409 TYR C C 409 175.613 175.613 174.707 0.906 18990 6284 1 9 . 1 1 409 409 TYR CA C 409 57.669 57.669 57.788 -0.119 18990 6285 1 9 . 1 1 409 409 TYR CB C 409 38.825 38.825 40.016 -1.191 18990 6286 1 9 . 1 1 409 409 TYR H H 409 8.135 8.135 8.403 -0.268 18990 6287 1 9 . 1 1 410 410 THR N N 410 116.975 116.975 119.166 -2.191 18990 6288 1 9 . 1 1 410 410 THR HA H 410 4.306 4.306 4.477 -0.171 18990 6289 1 9 . 1 1 410 410 THR C C 410 173.846 173.846 172.656 1.190 18990 6290 1 9 . 1 1 410 410 THR CA C 410 61.730 61.730 60.632 1.098 18990 6291 1 9 . 1 1 410 410 THR CB C 410 69.914 69.914 70.793 -0.879 18990 6292 1 9 . 1 1 410 410 THR H H 410 8.060 8.060 7.891 0.169 18990 6293 1 9 . 1 1 411 411 VAL N N 411 122.900 122.900 117.366 5.534 18990 6294 1 9 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.338 -0.285 18990 6295 1 9 . 1 1 411 411 VAL C C 411 175.275 175.275 174.394 0.881 18990 6296 1 9 . 1 1 411 411 VAL CA C 411 61.853 61.853 60.056 1.796 18990 6297 1 9 . 1 1 411 411 VAL CB C 411 32.976 32.976 33.849 -0.873 18990 6298 1 9 . 1 1 411 411 VAL H H 411 8.089 8.089 7.893 0.196 18990 6299 1 9 . 1 1 412 412 ASP N N 412 125.924 125.924 123.802 2.122 18990 6300 1 9 . 1 1 412 412 ASP HA H 412 4.850 4.850 5.044 -0.194 18990 6301 1 9 . 1 1 412 412 ASP CA C 412 51.578 51.578 53.016 -1.438 18990 6302 1 9 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.263 0.275 18990 6303 1 9 . 1 1 412 412 ASP H H 412 8.397 8.397 8.421 -0.024 18990 6304 1 9 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.703 -0.317 18990 6305 1 9 . 1 1 413 413 PRO C C 413 177.352 177.352 176.167 1.185 18990 6306 1 9 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.301 1.609 18990 6307 1 9 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.803 -0.535 18990 6308 1 9 . 1 1 414 414 ASN N N 414 117.035 117.035 116.507 0.528 18990 6309 1 9 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.907 -0.230 18990 6310 1 9 . 1 1 414 414 ASN C C 414 175.532 175.532 175.344 0.188 18990 6311 1 9 . 1 1 414 414 ASN CA C 414 53.824 53.824 52.661 1.163 18990 6312 1 9 . 1 1 414 414 ASN CB C 414 38.728 38.728 39.522 -0.793 18990 6313 1 9 . 1 1 414 414 ASN H H 414 8.496 8.496 8.455 0.041 18990 6314 1 9 . 1 1 415 415 ARG N N 415 121.000 121.000 120.055 0.945 18990 6315 1 9 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.913 -0.669 18990 6316 1 9 . 1 1 415 415 ARG C C 415 176.243 176.243 174.690 1.553 18990 6317 1 9 . 1 1 415 415 ARG CA C 415 56.404 56.404 56.669 -0.265 18990 6318 1 9 . 1 1 415 415 ARG CB C 415 30.637 30.637 30.837 -0.200 18990 6319 1 9 . 1 1 415 415 ARG H H 415 7.804 7.804 8.777 -0.973 18990 6320 1 9 . 1 1 416 416 ALA N N 416 124.880 124.880 121.951 2.929 18990 6321 1 9 . 1 1 416 416 ALA C C 416 177.831 177.831 175.763 2.068 18990 6322 1 9 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.793 1.164 18990 6323 1 9 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.259 -1.200 18990 6324 1 9 . 1 1 416 416 ALA H H 416 8.189 8.189 8.400 -0.211 18990 6325 1 9 . 1 1 417 417 ALA N N 417 122.614 122.614 122.300 0.314 18990 6326 1 9 . 1 1 417 417 ALA HA H 417 4.247 4.247 5.150 -0.903 18990 6327 1 9 . 1 1 417 417 ALA C C 417 178.024 178.024 176.808 1.216 18990 6328 1 9 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.624 1.165 18990 6329 1 9 . 1 1 417 417 ALA CB C 417 19.042 19.042 19.632 -0.590 18990 6330 1 9 . 1 1 417 417 ALA H H 417 8.169 8.169 8.642 -0.473 18990 6331 1 9 . 1 1 418 418 GLU N N 418 119.500 119.500 119.065 0.435 18990 6332 1 9 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.916 -0.727 18990 6333 1 9 . 1 1 418 418 GLU C C 418 176.266 176.266 175.469 0.797 18990 6334 1 9 . 1 1 418 418 GLU CA C 418 56.576 56.576 56.032 0.544 18990 6335 1 9 . 1 1 418 418 GLU CB C 418 30.307 30.307 31.524 -1.218 18990 6336 1 9 . 1 1 418 418 GLU H H 418 8.184 8.184 8.844 -0.660 18990 6337 1 9 . 1 1 419 419 ALA N N 419 124.643 124.643 124.346 0.297 18990 6338 1 9 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.285 -0.035 18990 6339 1 9 . 1 1 419 419 ALA C C 419 177.488 177.488 176.000 1.488 18990 6340 1 9 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.630 0.879 18990 6341 1 9 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.645 -1.484 18990 6342 1 9 . 1 1 419 419 ALA H H 419 8.135 8.135 8.240 -0.105 18990 6343 1 9 . 1 1 420 420 ARG N N 420 120.003 120.003 125.516 -5.513 18990 6344 1 9 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.674 -0.381 18990 6345 1 9 . 1 1 420 420 ARG C C 420 176.297 176.297 174.934 1.363 18990 6346 1 9 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.726 0.207 18990 6347 1 9 . 1 1 420 420 ARG CB C 420 30.850 30.850 31.030 -0.180 18990 6348 1 9 . 1 1 420 420 ARG H H 420 8.135 8.135 8.197 -0.062 18990 6349 1 9 . 1 1 421 421 TRP N N 421 122.280 122.280 123.608 -1.328 18990 6350 1 9 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.863 -0.200 18990 6351 1 9 . 1 1 421 421 TRP C C 421 175.856 175.856 175.741 0.115 18990 6352 1 9 . 1 1 421 421 TRP CA C 421 57.404 57.404 56.676 0.728 18990 6353 1 9 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.661 -1.224 18990 6354 1 9 . 1 1 421 421 TRP H H 421 8.159 8.159 8.396 -0.237 18990 6355 1 9 . 1 1 422 422 ASP N N 422 121.980 121.980 122.016 -0.036 18990 6356 1 9 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.858 -0.363 18990 6357 1 9 . 1 1 422 422 ASP C C 422 176.184 176.184 175.817 0.367 18990 6358 1 9 . 1 1 422 422 ASP CA C 422 53.899 53.899 53.546 0.353 18990 6359 1 9 . 1 1 422 422 ASP CB C 422 40.948 40.948 43.650 -2.702 18990 6360 1 9 . 1 1 422 422 ASP H H 422 8.135 8.135 8.584 -0.449 18990 6361 1 9 . 1 1 423 423 GLU N N 423 121.990 121.990 124.078 -2.088 18990 6362 1 9 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.392 -0.302 18990 6363 1 9 . 1 1 423 423 GLU C C 423 176.720 176.720 176.053 0.667 18990 6364 1 9 . 1 1 423 423 GLU CA C 423 57.169 57.169 57.015 0.154 18990 6365 1 9 . 1 1 423 423 GLU CB C 423 30.156 30.156 30.322 -0.166 18990 6366 1 9 . 1 1 423 423 GLU H H 423 8.153 8.153 8.549 -0.396 18990 6367 1 9 . 1 1 424 424 ALA N N 424 123.900 123.900 121.478 2.422 18990 6368 1 9 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.415 -0.135 18990 6369 1 9 . 1 1 424 424 ALA C C 424 178.095 178.095 175.483 2.612 18990 6370 1 9 . 1 1 424 424 ALA CA C 424 53.017 53.017 51.474 1.543 18990 6371 1 9 . 1 1 424 424 ALA CB C 424 19.086 19.086 20.006 -0.920 18990 6372 1 9 . 1 1 424 424 ALA H H 424 8.243 8.243 7.659 0.584 18990 6373 1 9 . 1 1 425 425 SER N N 425 113.881 113.881 115.359 -1.478 18990 6374 1 9 . 1 1 425 425 SER HA H 425 4.387 4.387 4.683 -0.296 18990 6375 1 9 . 1 1 425 425 SER C C 425 174.338 174.338 172.992 1.346 18990 6376 1 9 . 1 1 425 425 SER CA C 425 58.546 58.546 57.827 0.720 18990 6377 1 9 . 1 1 425 425 SER CB C 425 63.784 63.784 64.819 -1.035 18990 6378 1 9 . 1 1 425 425 SER H H 425 8.063 8.063 8.295 -0.232 18990 6379 1 9 . 1 1 426 426 ASN N N 426 121.032 121.032 121.346 -0.314 18990 6380 1 9 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.926 -0.220 18990 6381 1 9 . 1 1 426 426 ASN C C 426 175.046 175.046 174.641 0.405 18990 6382 1 9 . 1 1 426 426 ASN CA C 426 53.445 53.445 53.299 0.146 18990 6383 1 9 . 1 1 426 426 ASN CB C 426 38.847 38.847 39.400 -0.553 18990 6384 1 9 . 1 1 426 426 ASN H H 426 8.391 8.391 8.595 -0.204 18990 6385 1 9 . 1 1 427 427 VAL N N 427 119.463 119.463 126.753 -7.290 18990 6386 1 9 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.108 0.085 18990 6387 1 9 . 1 1 427 427 VAL C C 427 176.213 176.213 175.539 0.674 18990 6388 1 9 . 1 1 427 427 VAL CA C 427 62.449 62.449 62.294 0.155 18990 6389 1 9 . 1 1 427 427 VAL CB C 427 32.865 32.865 31.351 1.514 18990 6390 1 9 . 1 1 427 427 VAL H H 427 7.954 7.954 8.407 -0.453 18990 6391 1 9 . 1 1 428 428 THR N N 428 118.226 118.226 121.663 -3.437 18990 6392 1 9 . 1 1 428 428 THR HA H 428 4.353 4.353 4.570 -0.217 18990 6393 1 9 . 1 1 428 428 THR C C 428 174.361 174.361 173.995 0.366 18990 6394 1 9 . 1 1 428 428 THR CA C 428 62.065 62.065 62.031 0.034 18990 6395 1 9 . 1 1 428 428 THR CB C 428 69.729 69.729 68.741 0.988 18990 6396 1 9 . 1 1 428 428 THR H H 428 8.225 8.225 8.057 0.168 18990 6397 1 9 . 1 1 429 429 ILE N N 429 123.910 123.910 121.074 2.836 18990 6398 1 9 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.631 -0.443 18990 6399 1 9 . 1 1 429 429 ILE C C 429 175.774 175.774 174.130 1.644 18990 6400 1 9 . 1 1 429 429 ILE CA C 429 60.819 60.819 60.368 0.451 18990 6401 1 9 . 1 1 429 429 ILE CB C 429 38.719 38.719 40.288 -1.569 18990 6402 1 9 . 1 1 429 429 ILE H H 429 8.148 8.148 8.642 -0.494 18990 6403 1 9 . 1 1 430 430 LYS N N 430 126.453 126.453 123.590 2.863 18990 6404 1 9 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.440 -0.006 18990 6405 1 9 . 1 1 430 430 LYS C C 430 176.241 176.241 175.003 1.238 18990 6406 1 9 . 1 1 430 430 LYS CA C 430 55.937 55.937 56.163 -0.226 18990 6407 1 9 . 1 1 430 430 LYS CB C 430 33.164 33.164 34.074 -0.910 18990 6408 1 9 . 1 1 430 430 LYS H H 430 8.406 8.406 8.371 0.035 18990 6409 1 9 . 1 1 431 431 VAL N N 431 122.496 122.496 127.218 -4.722 18990 6410 1 9 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.280 -0.000 18990 6411 1 9 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.644 -0.341 18990 6412 1 9 . 1 1 431 431 VAL CB C 431 33.132 33.132 32.292 0.840 18990 6413 1 9 . 1 1 431 431 VAL H H 431 8.312 8.312 8.547 -0.235 18990 6414 1 9 . 1 1 432 432 SER HA H 432 4.486 4.486 4.722 -0.236 18990 6415 1 9 . 1 1 432 432 SER C C 432 173.834 173.834 174.183 -0.349 18990 6416 1 9 . 1 1 432 432 SER CA C 432 58.650 58.650 57.943 0.707 18990 6417 1 9 . 1 1 432 432 SER CB C 432 64.152 64.152 64.296 -0.144 18990 6418 1 9 . 1 1 433 433 THR N N 433 114.706 114.706 114.065 0.641 18990 6419 1 9 . 1 1 433 433 THR HA H 433 5.446 5.446 4.594 0.852 18990 6420 1 9 . 1 1 433 433 THR C C 433 173.979 173.979 174.318 -0.339 18990 6421 1 9 . 1 1 433 433 THR CA C 433 60.412 60.412 61.168 -0.756 18990 6422 1 9 . 1 1 433 433 THR CB C 433 71.896 71.896 70.247 1.649 18990 6423 1 9 . 1 1 433 433 THR H H 433 7.833 7.833 7.609 0.224 18990 6424 1 9 . 1 1 434 434 LYS N N 434 122.492 122.492 122.581 -0.089 18990 6425 1 9 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.916 -0.207 18990 6426 1 9 . 1 1 434 434 LYS C C 434 173.589 173.589 174.447 -0.858 18990 6427 1 9 . 1 1 434 434 LYS CA C 434 54.375 54.375 53.206 1.169 18990 6428 1 9 . 1 1 434 434 LYS CB C 434 36.925 36.925 33.650 3.275 18990 6429 1 9 . 1 1 434 434 LYS H H 434 8.937 8.937 9.068 -0.131 18990 6430 1 9 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.547 -0.280 18990 6431 1 9 . 1 1 435 435 PRO C C 435 175.238 175.238 176.722 -1.484 18990 6432 1 9 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.445 -1.522 18990 6433 1 9 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.339 -0.253 18990 6434 1 9 . 1 1 436 436 CYS N N 436 125.422 125.422 126.211 -0.789 18990 6435 1 9 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.118 -0.688 18990 6436 1 9 . 1 1 436 436 CYS C C 436 176.770 176.770 175.418 1.352 18990 6437 1 9 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.563 0.453 18990 6438 1 9 . 1 1 436 436 CYS CB C 436 31.698 31.698 27.850 3.848 18990 6439 1 9 . 1 1 436 436 CYS H H 436 7.768 7.768 8.701 -0.933 18990 6440 1 9 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.167 -0.309 18990 6441 1 9 . 1 1 437 437 PRO C C 437 173.608 173.608 176.018 -2.410 18990 6442 1 9 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.028 0.185 18990 6443 1 9 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.264 1.185 18990 6444 1 9 . 1 1 438 438 LYS N N 438 118.600 118.600 119.105 -0.505 18990 6445 1 9 . 1 1 438 438 LYS HA H 438 3.970 3.970 3.944 0.026 18990 6446 1 9 . 1 1 438 438 LYS C C 438 176.887 176.887 177.185 -0.298 18990 6447 1 9 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.451 0.236 18990 6448 1 9 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.103 0.021 18990 6449 1 9 . 1 1 438 438 LYS H H 438 8.390 8.390 7.509 0.881 18990 6450 1 9 . 1 1 439 439 CYS N N 439 118.950 118.950 115.025 3.925 18990 6451 1 9 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.919 -0.173 18990 6452 1 9 . 1 1 439 439 CYS C C 439 176.650 176.650 175.006 1.644 18990 6453 1 9 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.550 1.798 18990 6454 1 9 . 1 1 439 439 CYS CB C 439 31.196 31.196 29.566 1.630 18990 6455 1 9 . 1 1 439 439 CYS H H 439 8.357 8.357 7.643 0.714 18990 6456 1 9 . 1 1 440 440 ARG N N 440 117.200 117.200 118.613 -1.413 18990 6457 1 9 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.106 -0.138 18990 6458 1 9 . 1 1 440 440 ARG C C 440 175.253 175.253 175.601 -0.348 18990 6459 1 9 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.786 0.114 18990 6460 1 9 . 1 1 440 440 ARG CB C 440 26.041 26.041 26.716 -0.675 18990 6461 1 9 . 1 1 440 440 ARG H H 440 8.065 8.065 8.191 -0.126 18990 6462 1 9 . 1 1 441 441 THR N N 441 122.400 122.400 111.748 10.652 18990 6463 1 9 . 1 1 441 441 THR HA H 441 4.371 4.371 4.686 -0.315 18990 6464 1 9 . 1 1 441 441 THR C C 441 173.702 173.702 173.022 0.680 18990 6465 1 9 . 1 1 441 441 THR CA C 441 63.194 63.194 58.775 4.419 18990 6466 1 9 . 1 1 441 441 THR CB C 441 68.933 68.933 69.564 -0.631 18990 6467 1 9 . 1 1 441 441 THR H H 441 8.643 8.643 7.590 1.053 18990 6468 1 9 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.484 -0.337 18990 6469 1 9 . 1 1 442 442 PRO C C 442 176.215 176.215 175.881 0.334 18990 6470 1 9 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.573 1.624 18990 6471 1 9 . 1 1 442 442 PRO CB C 442 32.044 32.044 30.764 1.280 18990 6472 1 9 . 1 1 443 443 THR N N 443 122.932 122.932 121.682 1.250 18990 6473 1 9 . 1 1 443 443 THR HA H 443 4.665 4.665 4.526 0.139 18990 6474 1 9 . 1 1 443 443 THR C C 443 172.133 172.133 174.578 -2.445 18990 6475 1 9 . 1 1 443 443 THR CA C 443 62.566 62.566 62.093 0.473 18990 6476 1 9 . 1 1 443 443 THR CB C 443 71.562 71.562 70.268 1.294 18990 6477 1 9 . 1 1 443 443 THR H H 443 9.116 9.116 8.609 0.507 18990 6478 1 9 . 1 1 444 444 GLU N N 444 126.390 126.390 126.727 -0.337 18990 6479 1 9 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.275 0.667 18990 6480 1 9 . 1 1 444 444 GLU C C 444 175.292 175.292 176.383 -1.091 18990 6481 1 9 . 1 1 444 444 GLU CA C 444 55.049 55.049 56.832 -1.783 18990 6482 1 9 . 1 1 444 444 GLU CB C 444 31.861 31.861 30.461 1.400 18990 6483 1 9 . 1 1 444 444 GLU H H 444 8.720 8.720 8.813 -0.093 18990 6484 1 9 . 1 1 445 445 ARG N N 445 123.505 123.505 123.125 0.380 18990 6485 1 9 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.402 -0.691 18990 6486 1 9 . 1 1 445 445 ARG C C 445 175.289 175.289 176.107 -0.818 18990 6487 1 9 . 1 1 445 445 ARG CA C 445 55.856 55.856 54.698 1.158 18990 6488 1 9 . 1 1 445 445 ARG CB C 445 30.675 30.675 31.271 -0.596 18990 6489 1 9 . 1 1 445 445 ARG H H 445 8.157 8.157 8.313 -0.156 18990 6490 1 9 . 1 1 446 446 ASP N N 446 126.800 126.800 125.782 1.018 18990 6491 1 9 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.760 -0.119 18990 6492 1 9 . 1 1 446 446 ASP C C 446 176.020 176.020 176.166 -0.146 18990 6493 1 9 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.719 -0.767 18990 6494 1 9 . 1 1 446 446 ASP CB C 446 41.400 41.400 41.665 -0.265 18990 6495 1 9 . 1 1 446 446 ASP H H 446 8.476 8.476 7.926 0.550 18990 6496 1 9 . 1 1 447 447 GLY N N 447 111.262 111.262 112.916 -1.654 18990 6497 1 9 . 1 1 447 447 GLY C C 447 174.073 174.073 174.589 -0.516 18990 6498 1 9 . 1 1 447 447 GLY CA C 447 45.832 45.832 45.434 0.398 18990 6499 1 9 . 1 1 447 447 GLY H H 447 8.056 8.056 8.101 -0.045 18990 6500 1 9 . 1 1 448 448 GLY N N 448 108.655 108.655 109.228 -0.573 18990 6501 1 9 . 1 1 448 448 GLY C C 448 174.020 174.020 174.012 0.008 18990 6502 1 9 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.048 1.219 18990 6503 1 9 . 1 1 448 448 GLY H H 448 8.380 8.380 8.289 0.091 18990 6504 1 9 . 1 1 449 449 CYS N N 449 120.628 120.628 120.788 -0.160 18990 6505 1 9 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.165 -0.168 18990 6506 1 9 . 1 1 449 449 CYS C C 449 174.855 174.855 175.422 -0.567 18990 6507 1 9 . 1 1 449 449 CYS CA C 449 59.291 59.291 59.863 -0.572 18990 6508 1 9 . 1 1 449 449 CYS CB C 449 28.000 28.000 28.955 -0.955 18990 6509 1 9 . 1 1 449 449 CYS H H 449 7.832 7.832 7.209 0.623 18990 6510 1 9 . 1 1 450 450 MET N N 450 123.947 123.947 124.750 -0.803 18990 6511 1 9 . 1 1 450 450 MET HA H 450 4.551 4.551 4.241 0.310 18990 6512 1 9 . 1 1 450 450 MET C C 450 174.658 174.658 176.389 -1.731 18990 6513 1 9 . 1 1 450 450 MET CA C 450 54.970 54.970 56.733 -1.763 18990 6514 1 9 . 1 1 450 450 MET CB C 450 34.100 34.100 32.508 1.592 18990 6515 1 9 . 1 1 450 450 MET H H 450 8.916 8.916 8.192 0.724 18990 6516 1 9 . 1 1 451 451 HIS N N 451 120.490 120.490 120.733 -0.243 18990 6517 1 9 . 1 1 451 451 HIS HA H 451 3.679 3.679 5.061 -1.382 18990 6518 1 9 . 1 1 451 451 HIS C C 451 172.443 172.443 173.827 -1.384 18990 6519 1 9 . 1 1 451 451 HIS CA C 451 53.812 53.812 55.902 -2.090 18990 6520 1 9 . 1 1 451 451 HIS CB C 451 28.900 28.900 29.710 -0.810 18990 6521 1 9 . 1 1 451 451 HIS H H 451 7.557 7.557 7.701 -0.144 18990 6522 1 9 . 1 1 452 452 MET N N 452 128.800 128.800 127.706 1.094 18990 6523 1 9 . 1 1 452 452 MET HA H 452 4.320 4.320 4.489 -0.169 18990 6524 1 9 . 1 1 452 452 MET C C 452 175.479 175.479 173.382 2.097 18990 6525 1 9 . 1 1 452 452 MET CA C 452 52.589 52.589 53.356 -0.767 18990 6526 1 9 . 1 1 452 452 MET CB C 452 28.074 28.074 33.805 -5.731 18990 6527 1 9 . 1 1 452 452 MET H H 452 9.087 9.087 8.145 0.942 18990 6528 1 9 . 1 1 453 453 VAL N N 453 122.200 122.200 117.754 4.446 18990 6529 1 9 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.626 0.168 18990 6530 1 9 . 1 1 453 453 VAL C C 453 175.476 175.476 174.510 0.966 18990 6531 1 9 . 1 1 453 453 VAL CA C 453 61.380 61.380 58.641 2.739 18990 6532 1 9 . 1 1 453 453 VAL CB C 453 33.089 33.089 34.010 -0.921 18990 6533 1 9 . 1 1 453 453 VAL H H 453 8.016 8.016 8.064 -0.048 18990 6534 1 9 . 1 1 454 454 CYS N N 454 130.353 130.353 125.195 5.158 18990 6535 1 9 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.882 -0.287 18990 6536 1 9 . 1 1 454 454 CYS C C 454 177.833 177.833 174.840 2.993 18990 6537 1 9 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.420 3.151 18990 6538 1 9 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.340 5.705 18990 6539 1 9 . 1 1 454 454 CYS H H 454 8.989 8.989 9.146 -0.157 18990 6540 1 9 . 1 1 455 455 THR N N 455 119.000 119.000 122.726 -3.726 18990 6541 1 9 . 1 1 455 455 THR HA H 455 4.393 4.393 4.358 0.035 18990 6542 1 9 . 1 1 455 455 THR C C 455 175.264 175.264 173.912 1.352 18990 6543 1 9 . 1 1 455 455 THR CA C 455 61.644 61.644 62.147 -0.503 18990 6544 1 9 . 1 1 455 455 THR CB C 455 69.400 69.400 68.638 0.762 18990 6545 1 9 . 1 1 455 455 THR H H 455 8.533 8.533 8.410 0.123 18990 6546 1 9 . 1 1 456 456 ARG N N 456 128.900 128.900 127.294 1.606 18990 6547 1 9 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.586 -0.361 18990 6548 1 9 . 1 1 456 456 ARG C C 456 177.782 177.782 177.038 0.744 18990 6549 1 9 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.075 2.875 18990 6550 1 9 . 1 1 456 456 ARG CB C 456 30.050 30.050 32.787 -2.737 18990 6551 1 9 . 1 1 456 456 ARG H H 456 9.036 9.036 7.821 1.215 18990 6552 1 9 . 1 1 457 457 ALA N N 457 133.152 133.152 127.526 5.626 18990 6553 1 9 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.162 -0.016 18990 6554 1 9 . 1 1 457 457 ALA C C 457 178.757 178.757 177.077 1.680 18990 6555 1 9 . 1 1 457 457 ALA CA C 457 53.929 53.929 54.298 -0.369 18990 6556 1 9 . 1 1 457 457 ALA CB C 457 17.710 17.710 18.654 -0.944 18990 6557 1 9 . 1 1 457 457 ALA H H 457 9.042 9.042 8.577 0.465 18990 6558 1 9 . 1 1 458 458 GLY N N 458 111.200 111.200 104.488 6.712 18990 6559 1 9 . 1 1 458 458 GLY C C 458 173.558 173.558 173.559 -0.001 18990 6560 1 9 . 1 1 458 458 GLY CA C 458 45.436 45.436 43.810 1.626 18990 6561 1 9 . 1 1 458 458 GLY H H 458 8.830 8.830 7.957 0.873 18990 6562 1 9 . 1 1 459 459 CYS N N 459 123.040 123.040 120.225 2.815 18990 6563 1 9 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.996 -0.374 18990 6564 1 9 . 1 1 459 459 CYS C C 459 176.591 176.591 174.494 2.097 18990 6565 1 9 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.180 1.319 18990 6566 1 9 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.721 0.453 18990 6567 1 9 . 1 1 459 459 CYS H H 459 8.042 8.042 7.935 0.107 18990 6568 1 9 . 1 1 460 460 GLY N N 460 104.500 104.500 111.950 -7.450 18990 6569 1 9 . 1 1 460 460 GLY C C 460 173.716 173.716 173.888 -0.172 18990 6570 1 9 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.718 0.290 18990 6571 1 9 . 1 1 460 460 GLY H H 460 7.705 7.705 8.226 -0.521 18990 6572 1 9 . 1 1 461 461 PHE N N 461 124.949 124.949 121.106 3.843 18990 6573 1 9 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.719 -0.139 18990 6574 1 9 . 1 1 461 461 PHE C C 461 174.447 174.447 173.926 0.521 18990 6575 1 9 . 1 1 461 461 PHE CA C 461 59.946 59.946 56.917 3.029 18990 6576 1 9 . 1 1 461 461 PHE CB C 461 41.300 41.300 41.048 0.252 18990 6577 1 9 . 1 1 461 461 PHE H H 461 8.947 8.947 7.675 1.272 18990 6578 1 9 . 1 1 462 462 GLU N N 462 125.272 125.272 127.733 -2.461 18990 6579 1 9 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.321 1.400 18990 6580 1 9 . 1 1 462 462 GLU C C 462 176.067 176.067 175.007 1.060 18990 6581 1 9 . 1 1 462 462 GLU CA C 462 54.624 54.624 55.617 -0.993 18990 6582 1 9 . 1 1 462 462 GLU CB C 462 31.255 31.255 30.678 0.577 18990 6583 1 9 . 1 1 462 462 GLU H H 462 7.799 7.799 8.514 -0.715 18990 6584 1 9 . 1 1 463 463 TRP N N 463 121.524 121.524 120.122 1.402 18990 6585 1 9 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.780 -0.274 18990 6586 1 9 . 1 1 463 463 TRP C C 463 172.844 172.844 176.197 -3.353 18990 6587 1 9 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.864 -1.093 18990 6588 1 9 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.334 0.402 18990 6589 1 9 . 1 1 463 463 TRP H H 463 9.300 9.300 7.942 1.358 18990 6590 1 9 . 1 1 464 464 CYS N N 464 120.868 120.868 121.521 -0.653 18990 6591 1 9 . 1 1 464 464 CYS HA H 464 5.416 5.416 5.074 0.342 18990 6592 1 9 . 1 1 464 464 CYS C C 464 177.213 177.213 176.268 0.945 18990 6593 1 9 . 1 1 464 464 CYS CA C 464 57.776 57.776 60.467 -2.691 18990 6594 1 9 . 1 1 464 464 CYS CB C 464 32.930 32.930 27.409 5.521 18990 6595 1 9 . 1 1 464 464 CYS H H 464 8.752 8.752 8.910 -0.158 18990 6596 1 9 . 1 1 465 465 TRP N N 465 131.209 131.209 126.682 4.527 18990 6597 1 9 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.244 0.183 18990 6598 1 9 . 1 1 465 465 TRP C C 465 176.051 176.051 175.390 0.661 18990 6599 1 9 . 1 1 465 465 TRP CA C 465 60.763 60.763 60.309 0.453 18990 6600 1 9 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.498 1.627 18990 6601 1 9 . 1 1 465 465 TRP H H 465 9.809 9.809 8.334 1.475 18990 6602 1 9 . 1 1 466 466 VAL N N 466 118.233 118.233 117.245 0.988 18990 6603 1 9 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.466 0.158 18990 6604 1 9 . 1 1 466 466 VAL C C 466 178.943 178.943 175.961 2.982 18990 6605 1 9 . 1 1 466 466 VAL CA C 466 65.602 65.602 63.646 1.956 18990 6606 1 9 . 1 1 466 466 VAL CB C 466 33.172 33.172 31.582 1.590 18990 6607 1 9 . 1 1 466 466 VAL H H 466 8.627 8.627 7.586 1.041 18990 6608 1 9 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.619 -1.188 18990 6609 1 9 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.122 0.877 18990 6610 1 9 . 1 1 467 467 CYS CB C 467 31.870 31.870 27.104 4.766 18990 6611 1 9 . 1 1 467 467 CYS H H 467 7.820 7.820 7.697 0.123 18990 6612 1 9 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.733 -0.697 18990 6613 1 9 . 1 1 468 468 GLN CA C 468 58.051 58.051 56.550 1.501 18990 6614 1 9 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.543 -2.067 18990 6615 1 9 . 1 1 469 469 THR HA H 469 4.685 4.685 4.626 0.059 18990 6616 1 9 . 1 1 469 469 THR C C 469 173.351 173.351 173.102 0.249 18990 6617 1 9 . 1 1 469 469 THR CA C 469 59.176 59.176 60.481 -1.305 18990 6618 1 9 . 1 1 469 469 THR CB C 469 71.775 71.775 71.944 -0.168 18990 6619 1 9 . 1 1 470 470 GLU N N 470 120.940 120.940 122.683 -1.743 18990 6620 1 9 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.653 -0.360 18990 6621 1 9 . 1 1 470 470 GLU C C 470 175.539 175.539 176.773 -1.234 18990 6622 1 9 . 1 1 470 470 GLU CA C 470 57.015 57.015 55.045 1.970 18990 6623 1 9 . 1 1 470 470 GLU CB C 470 29.965 29.965 31.394 -1.429 18990 6624 1 9 . 1 1 470 470 GLU H H 470 8.912 8.912 8.852 0.060 18990 6625 1 9 . 1 1 471 471 TRP N N 471 126.998 126.998 130.166 -3.168 18990 6626 1 9 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.700 -0.407 18990 6627 1 9 . 1 1 471 471 TRP C C 471 175.408 175.408 176.536 -1.128 18990 6628 1 9 . 1 1 471 471 TRP CA C 471 58.220 58.220 58.634 -0.414 18990 6629 1 9 . 1 1 471 471 TRP CB C 471 29.500 29.500 28.331 1.169 18990 6630 1 9 . 1 1 471 471 TRP H H 471 8.350 8.350 8.410 -0.060 18990 6631 1 9 . 1 1 472 472 THR N N 472 117.480 117.480 117.597 -0.117 18990 6632 1 9 . 1 1 472 472 THR HA H 472 4.444 4.444 4.883 -0.439 18990 6633 1 9 . 1 1 472 472 THR CA C 472 58.930 58.930 60.238 -1.308 18990 6634 1 9 . 1 1 472 472 THR H H 472 8.069 8.069 7.799 0.270 18990 6635 1 9 . 1 1 473 473 ARG HA H 473 3.773 3.773 4.133 -0.360 18990 6636 1 9 . 1 1 473 473 ARG C C 473 178.053 178.053 177.912 0.141 18990 6637 1 9 . 1 1 473 473 ARG CA C 473 58.088 58.088 58.541 -0.453 18990 6638 1 9 . 1 1 473 473 ARG CB C 473 29.426 29.426 29.981 -0.555 18990 6639 1 9 . 1 1 474 474 ASP N N 474 119.900 119.900 120.545 -0.645 18990 6640 1 9 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.537 -0.322 18990 6641 1 9 . 1 1 474 474 ASP C C 474 178.197 178.197 176.335 1.862 18990 6642 1 9 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.581 0.221 18990 6643 1 9 . 1 1 474 474 ASP CB C 474 40.182 40.182 41.037 -0.855 18990 6644 1 9 . 1 1 474 474 ASP H H 474 7.718 7.718 8.180 -0.462 18990 6645 1 9 . 1 1 475 475 CYS N N 475 121.000 121.000 121.158 -0.158 18990 6646 1 9 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.701 -1.334 18990 6647 1 9 . 1 1 475 475 CYS CA C 475 64.533 64.533 58.028 6.505 18990 6648 1 9 . 1 1 475 475 CYS CB C 475 29.092 29.092 25.283 3.809 18990 6649 1 9 . 1 1 475 475 CYS H H 475 6.953 6.953 7.902 -0.949 18990 6650 1 9 . 1 1 476 476 MET HA H 476 4.021 4.021 4.593 -0.572 18990 6651 1 9 . 1 1 476 476 MET CA C 476 58.010 58.010 54.712 3.298 18990 6652 1 9 . 1 1 476 476 MET CB C 476 32.550 32.550 31.872 0.678 18990 6653 1 9 . 1 1 477 477 GLY N N 477 111.938 111.938 106.523 5.415 18990 6654 1 9 . 1 1 477 477 GLY C C 477 174.406 174.406 174.830 -0.424 18990 6655 1 9 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.563 1.053 18990 6656 1 9 . 1 1 477 477 GLY H H 477 9.155 9.155 7.784 1.371 18990 6657 1 9 . 1 1 478 478 ALA N N 478 121.900 121.900 123.270 -1.370 18990 6658 1 9 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.045 0.246 18990 6659 1 9 . 1 1 478 478 ALA C C 478 178.196 178.196 177.034 1.162 18990 6660 1 9 . 1 1 478 478 ALA CA C 478 53.440 53.440 54.590 -1.149 18990 6661 1 9 . 1 1 478 478 ALA CB C 478 20.390 20.390 18.847 1.543 18990 6662 1 9 . 1 1 478 478 ALA H H 478 7.347 7.347 7.903 -0.556 18990 6663 1 9 . 1 1 479 479 HIS N N 479 115.200 115.200 109.870 5.330 18990 6664 1 9 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.764 0.139 18990 6665 1 9 . 1 1 479 479 HIS C C 479 173.325 173.325 174.495 -1.170 18990 6666 1 9 . 1 1 479 479 HIS CA C 479 54.526 54.526 53.121 1.405 18990 6667 1 9 . 1 1 479 479 HIS CB C 479 27.600 27.600 29.394 -1.794 18990 6668 1 9 . 1 1 479 479 HIS H H 479 8.297 8.297 7.344 0.953 18990 6669 1 9 . 1 1 480 480 TRP N N 480 121.780 121.780 124.666 -2.886 18990 6670 1 9 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.717 -0.422 18990 6671 1 9 . 1 1 480 480 TRP C C 480 175.568 175.568 175.052 0.516 18990 6672 1 9 . 1 1 480 480 TRP CA C 480 58.358 58.358 57.624 0.734 18990 6673 1 9 . 1 1 480 480 TRP CB C 480 29.550 29.550 27.517 2.033 18990 6674 1 9 . 1 1 480 480 TRP H H 480 8.081 8.081 7.397 0.684 18990 6675 1 9 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.845 0.000 18990 6676 1 9 . 1 1 481 481 PHE C C 481 175.126 175.126 174.469 0.657 18990 6677 1 9 . 1 1 481 481 PHE CA C 481 56.471 56.471 58.199 -1.728 18990 6678 1 9 . 1 1 481 481 PHE CB C 481 41.006 41.006 41.020 -0.014 18990 6679 1 10 . 1 1 343 343 GLU N N 343 121.045 121.045 121.045 0.000 18990 6680 1 10 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.779 -0.614 18990 6681 1 10 . 1 1 343 343 GLU C C 343 176.529 176.529 175.445 1.084 18990 6682 1 10 . 1 1 343 343 GLU CA C 343 57.162 57.162 55.960 1.202 18990 6683 1 10 . 1 1 343 343 GLU CB C 343 30.204 30.204 30.835 -0.631 18990 6684 1 10 . 1 1 343 343 GLU H H 343 8.293 8.293 8.596 -0.303 18990 6685 1 10 . 1 1 344 344 TYR N N 344 121.000 121.000 123.885 -2.885 18990 6686 1 10 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.704 -0.166 18990 6687 1 10 . 1 1 344 344 TYR C C 344 175.897 175.897 175.662 0.235 18990 6688 1 10 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.607 0.572 18990 6689 1 10 . 1 1 344 344 TYR CB C 344 38.600 38.600 38.964 -0.364 18990 6690 1 10 . 1 1 344 344 TYR H H 344 8.040 8.040 8.645 -0.605 18990 6691 1 10 . 1 1 345 345 VAL N N 345 121.900 121.900 125.205 -3.305 18990 6692 1 10 . 1 1 345 345 VAL HA H 345 3.939 3.939 3.980 -0.041 18990 6693 1 10 . 1 1 345 345 VAL C C 345 176.143 176.143 174.788 1.355 18990 6694 1 10 . 1 1 345 345 VAL CA C 345 62.867 62.867 63.536 -0.669 18990 6695 1 10 . 1 1 345 345 VAL CB C 345 32.799 32.799 32.457 0.342 18990 6696 1 10 . 1 1 345 345 VAL H H 345 7.856 7.856 8.477 -0.621 18990 6697 1 10 . 1 1 346 346 LEU N N 346 124.950 124.950 118.767 6.183 18990 6698 1 10 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.164 0.079 18990 6699 1 10 . 1 1 346 346 LEU C C 346 177.747 177.747 174.691 3.056 18990 6700 1 10 . 1 1 346 346 LEU CA C 346 55.500 55.500 55.458 0.042 18990 6701 1 10 . 1 1 346 346 LEU CB C 346 42.252 42.252 41.968 0.284 18990 6702 1 10 . 1 1 346 346 LEU H H 346 8.127 8.127 7.386 0.741 18990 6703 1 10 . 1 1 347 347 GLN N N 347 121.452 121.452 125.909 -4.457 18990 6704 1 10 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.444 -0.158 18990 6705 1 10 . 1 1 347 347 GLN C C 347 175.833 175.833 173.954 1.879 18990 6706 1 10 . 1 1 347 347 GLN CA C 347 55.988 55.988 56.049 -0.061 18990 6707 1 10 . 1 1 347 347 GLN CB C 347 29.375 29.375 30.918 -1.542 18990 6708 1 10 . 1 1 347 347 GLN H H 347 8.270 8.270 8.315 -0.045 18990 6709 1 10 . 1 1 348 348 ALA N N 348 124.466 124.466 126.471 -2.005 18990 6710 1 10 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.747 -0.426 18990 6711 1 10 . 1 1 348 348 ALA C C 348 177.929 177.929 177.229 0.700 18990 6712 1 10 . 1 1 348 348 ALA CA C 348 52.703 52.703 52.046 0.657 18990 6713 1 10 . 1 1 348 348 ALA CB C 348 19.002 19.002 21.286 -2.284 18990 6714 1 10 . 1 1 348 348 ALA H H 348 8.227 8.227 8.534 -0.307 18990 6715 1 10 . 1 1 349 349 GLY N N 349 108.193 108.193 110.209 -2.016 18990 6716 1 10 . 1 1 349 349 GLY C C 349 174.269 174.269 174.354 -0.085 18990 6717 1 10 . 1 1 349 349 GLY CA C 349 45.227 45.227 44.787 0.440 18990 6718 1 10 . 1 1 349 349 GLY H H 349 8.298 8.298 8.518 -0.220 18990 6719 1 10 . 1 1 350 350 GLY N N 350 108.073 108.073 108.451 -0.378 18990 6720 1 10 . 1 1 350 350 GLY C C 350 172.979 172.979 172.934 0.045 18990 6721 1 10 . 1 1 350 350 GLY CA C 350 44.935 44.935 43.421 1.514 18990 6722 1 10 . 1 1 350 350 GLY H H 350 8.156 8.156 7.758 0.398 18990 6723 1 10 . 1 1 351 351 VAL N N 351 119.058 119.058 118.838 0.220 18990 6724 1 10 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.534 -0.118 18990 6725 1 10 . 1 1 351 351 VAL C C 351 173.412 173.412 174.029 -0.617 18990 6726 1 10 . 1 1 351 351 VAL CA C 351 60.663 60.663 59.434 1.228 18990 6727 1 10 . 1 1 351 351 VAL CB C 351 34.866 34.866 34.381 0.485 18990 6728 1 10 . 1 1 351 351 VAL H H 351 8.541 8.541 8.686 -0.145 18990 6729 1 10 . 1 1 352 352 LEU N N 352 125.800 125.800 123.462 2.338 18990 6730 1 10 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.594 0.171 18990 6731 1 10 . 1 1 352 352 LEU C C 352 176.218 176.218 175.655 0.563 18990 6732 1 10 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.710 -0.369 18990 6733 1 10 . 1 1 352 352 LEU CB C 352 42.706 42.706 43.591 -0.885 18990 6734 1 10 . 1 1 352 352 LEU H H 352 8.151 8.151 8.489 -0.338 18990 6735 1 10 . 1 1 353 353 CYS N N 353 126.825 126.825 123.793 3.032 18990 6736 1 10 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.573 -0.466 18990 6737 1 10 . 1 1 353 353 CYS C C 353 176.655 176.655 174.497 2.158 18990 6738 1 10 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.210 0.521 18990 6739 1 10 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.907 3.958 18990 6740 1 10 . 1 1 353 353 CYS H H 353 8.794 8.794 8.553 0.241 18990 6741 1 10 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.299 0.121 18990 6742 1 10 . 1 1 354 354 PRO C C 354 177.512 177.512 175.958 1.554 18990 6743 1 10 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.210 -0.218 18990 6744 1 10 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.517 1.050 18990 6745 1 10 . 1 1 355 355 GLN N N 355 126.800 126.800 121.388 5.412 18990 6746 1 10 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.460 -0.185 18990 6747 1 10 . 1 1 355 355 GLN C C 355 175.516 175.516 173.953 1.563 18990 6748 1 10 . 1 1 355 355 GLN CA C 355 54.793 54.793 53.241 1.552 18990 6749 1 10 . 1 1 355 355 GLN CB C 355 28.547 28.547 28.981 -0.434 18990 6750 1 10 . 1 1 355 355 GLN H H 355 9.033 9.033 7.503 1.530 18990 6751 1 10 . 1 1 357 357 GLY C C 357 173.229 173.229 174.366 -1.137 18990 6752 1 10 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.811 0.443 18990 6753 1 10 . 1 1 358 358 CYS N N 358 123.500 123.500 119.960 3.540 18990 6754 1 10 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.816 -0.283 18990 6755 1 10 . 1 1 358 358 CYS C C 358 176.157 176.157 176.226 -0.069 18990 6756 1 10 . 1 1 358 358 CYS CA C 358 60.268 60.268 59.400 0.869 18990 6757 1 10 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.470 0.905 18990 6758 1 10 . 1 1 358 358 CYS H H 358 7.720 7.720 8.148 -0.428 18990 6759 1 10 . 1 1 359 359 GLY N N 359 104.400 104.400 109.941 -5.541 18990 6760 1 10 . 1 1 359 359 GLY C C 359 174.080 174.080 175.201 -1.121 18990 6761 1 10 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.139 -0.076 18990 6762 1 10 . 1 1 359 359 GLY H H 359 7.756 7.756 8.348 -0.592 18990 6763 1 10 . 1 1 360 360 MET N N 360 121.300 121.300 120.761 0.539 18990 6764 1 10 . 1 1 360 360 MET HA H 360 4.343 4.343 4.252 0.091 18990 6765 1 10 . 1 1 360 360 MET C C 360 175.641 175.641 177.085 -1.444 18990 6766 1 10 . 1 1 360 360 MET CA C 360 55.923 55.923 57.167 -1.244 18990 6767 1 10 . 1 1 360 360 MET CB C 360 33.091 33.091 33.898 -0.807 18990 6768 1 10 . 1 1 360 360 MET H H 360 8.229 8.229 7.626 0.603 18990 6769 1 10 . 1 1 361 361 GLY N N 361 109.000 109.000 106.268 2.732 18990 6770 1 10 . 1 1 361 361 GLY C C 361 173.774 173.774 172.883 0.891 18990 6771 1 10 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.349 1.489 18990 6772 1 10 . 1 1 361 361 GLY H H 361 8.347 8.347 7.979 0.368 18990 6773 1 10 . 1 1 362 362 LEU N N 362 126.725 126.725 125.010 1.715 18990 6774 1 10 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.862 -0.187 18990 6775 1 10 . 1 1 362 362 LEU C C 362 175.865 175.865 175.686 0.179 18990 6776 1 10 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.098 1.092 18990 6777 1 10 . 1 1 362 362 LEU CB C 362 44.050 44.050 44.210 -0.160 18990 6778 1 10 . 1 1 362 362 LEU H H 362 8.935 8.935 8.897 0.038 18990 6779 1 10 . 1 1 363 363 LEU N N 363 123.742 123.742 126.801 -3.059 18990 6780 1 10 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.704 -0.027 18990 6781 1 10 . 1 1 363 363 LEU C C 363 176.162 176.162 175.355 0.807 18990 6782 1 10 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.025 0.317 18990 6783 1 10 . 1 1 363 363 LEU CB C 363 42.210 42.210 41.749 0.461 18990 6784 1 10 . 1 1 363 363 LEU H H 363 8.481 8.481 8.570 -0.089 18990 6785 1 10 . 1 1 364 364 VAL N N 364 120.980 120.980 127.174 -6.194 18990 6786 1 10 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.368 0.029 18990 6787 1 10 . 1 1 364 364 VAL C C 364 175.592 175.592 174.818 0.774 18990 6788 1 10 . 1 1 364 364 VAL CA C 364 60.460 60.460 60.615 -0.155 18990 6789 1 10 . 1 1 364 364 VAL CB C 364 34.125 34.125 34.865 -0.740 18990 6790 1 10 . 1 1 364 364 VAL H H 364 8.155 8.155 8.277 -0.122 18990 6791 1 10 . 1 1 365 365 GLU N N 365 126.950 126.950 128.108 -1.158 18990 6792 1 10 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.717 -0.107 18990 6793 1 10 . 1 1 365 365 GLU C C 365 175.427 175.427 175.752 -0.325 18990 6794 1 10 . 1 1 365 365 GLU CA C 365 54.551 54.551 53.945 0.606 18990 6795 1 10 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.322 0.458 18990 6796 1 10 . 1 1 365 365 GLU H H 365 8.900 8.900 8.625 0.275 18990 6797 1 10 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.292 -0.030 18990 6798 1 10 . 1 1 366 366 PRO C C 366 177.013 177.013 176.537 0.476 18990 6799 1 10 . 1 1 366 366 PRO CA C 366 64.463 64.463 64.762 -0.299 18990 6800 1 10 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.778 0.270 18990 6801 1 10 . 1 1 367 367 ASP N N 367 115.459 115.459 116.135 -0.676 18990 6802 1 10 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.718 -0.223 18990 6803 1 10 . 1 1 367 367 ASP C C 367 175.123 175.123 175.053 0.070 18990 6804 1 10 . 1 1 367 367 ASP CA C 367 54.503 54.503 53.410 1.093 18990 6805 1 10 . 1 1 367 367 ASP CB C 367 40.123 40.123 40.751 -0.628 18990 6806 1 10 . 1 1 367 367 ASP H H 367 8.439 8.439 8.574 -0.135 18990 6807 1 10 . 1 1 368 368 CYS N N 368 118.700 118.700 121.068 -2.368 18990 6808 1 10 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.508 0.062 18990 6809 1 10 . 1 1 368 368 CYS C C 368 173.806 173.806 174.531 -0.725 18990 6810 1 10 . 1 1 368 368 CYS CA C 368 58.581 58.581 59.780 -1.199 18990 6811 1 10 . 1 1 368 368 CYS CB C 368 28.450 28.450 27.924 0.526 18990 6812 1 10 . 1 1 368 368 CYS H H 368 7.515 7.515 7.956 -0.441 18990 6813 1 10 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.355 -0.090 18990 6814 1 10 . 1 1 369 369 ARG C C 369 174.908 174.908 176.332 -1.424 18990 6815 1 10 . 1 1 369 369 ARG CA C 369 57.669 57.669 56.707 0.962 18990 6816 1 10 . 1 1 369 369 ARG CB C 369 32.274 32.274 30.587 1.687 18990 6817 1 10 . 1 1 370 370 LYS N N 370 121.022 121.022 120.601 0.421 18990 6818 1 10 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.237 -0.067 18990 6819 1 10 . 1 1 370 370 LYS C C 370 174.868 174.868 175.365 -0.497 18990 6820 1 10 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.361 1.193 18990 6821 1 10 . 1 1 370 370 LYS CB C 370 33.140 33.140 31.635 1.505 18990 6822 1 10 . 1 1 370 370 LYS H H 370 7.740 7.740 7.975 -0.235 18990 6823 1 10 . 1 1 371 371 VAL N N 371 128.362 128.362 127.994 0.368 18990 6824 1 10 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.147 -0.014 18990 6825 1 10 . 1 1 371 371 VAL C C 371 173.402 173.402 174.207 -0.805 18990 6826 1 10 . 1 1 371 371 VAL CA C 371 60.777 60.777 61.014 -0.237 18990 6827 1 10 . 1 1 371 371 VAL CB C 371 33.000 33.000 32.724 0.276 18990 6828 1 10 . 1 1 371 371 VAL H H 371 8.647 8.647 8.046 0.601 18990 6829 1 10 . 1 1 372 372 THR N N 372 119.667 119.667 122.460 -2.793 18990 6830 1 10 . 1 1 372 372 THR HA H 372 5.032 5.032 4.837 0.195 18990 6831 1 10 . 1 1 372 372 THR C C 372 174.339 174.339 173.803 0.536 18990 6832 1 10 . 1 1 372 372 THR CA C 372 60.881 60.881 61.643 -0.762 18990 6833 1 10 . 1 1 372 372 THR CB C 372 70.471 70.471 71.807 -1.336 18990 6834 1 10 . 1 1 372 372 THR H H 372 8.087 8.087 8.253 -0.166 18990 6835 1 10 . 1 1 373 373 CYS N N 373 132.554 132.554 126.447 6.107 18990 6836 1 10 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.520 0.282 18990 6837 1 10 . 1 1 373 373 CYS C C 373 176.791 176.791 176.335 0.456 18990 6838 1 10 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.413 -0.909 18990 6839 1 10 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.855 3.457 18990 6840 1 10 . 1 1 373 373 CYS H H 373 9.322 9.322 9.582 -0.260 18990 6841 1 10 . 1 1 374 374 GLN N N 374 125.890 125.890 124.539 1.351 18990 6842 1 10 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.146 -0.146 18990 6843 1 10 . 1 1 374 374 GLN C C 374 176.827 176.827 176.610 0.217 18990 6844 1 10 . 1 1 374 374 GLN CA C 374 58.300 58.300 58.298 0.002 18990 6845 1 10 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.771 0.892 18990 6846 1 10 . 1 1 374 374 GLN H H 374 7.856 7.856 8.599 -0.743 18990 6847 1 10 . 1 1 375 375 ASN N N 375 115.342 115.342 114.579 0.763 18990 6848 1 10 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.876 0.011 18990 6849 1 10 . 1 1 375 375 ASN C C 375 174.049 174.049 174.667 -0.618 18990 6850 1 10 . 1 1 375 375 ASN CA C 375 53.047 53.047 53.108 -0.061 18990 6851 1 10 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.188 -0.272 18990 6852 1 10 . 1 1 375 375 ASN H H 375 8.913 8.913 8.287 0.626 18990 6853 1 10 . 1 1 376 376 GLY N N 376 109.098 109.098 108.413 0.685 18990 6854 1 10 . 1 1 376 376 GLY C C 376 174.110 174.110 172.880 1.230 18990 6855 1 10 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.721 0.665 18990 6856 1 10 . 1 1 376 376 GLY H H 376 7.162 7.162 7.859 -0.697 18990 6857 1 10 . 1 1 377 377 CYS N N 377 132.546 132.546 121.878 10.668 18990 6858 1 10 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.692 0.072 18990 6859 1 10 . 1 1 377 377 CYS C C 377 177.355 177.355 176.100 1.255 18990 6860 1 10 . 1 1 377 377 CYS CA C 377 59.988 59.988 56.950 3.038 18990 6861 1 10 . 1 1 377 377 CYS CB C 377 32.365 32.365 25.301 7.064 18990 6862 1 10 . 1 1 377 377 CYS H H 377 9.800 9.800 8.412 1.388 18990 6863 1 10 . 1 1 378 378 GLY N N 378 113.851 113.851 111.092 2.759 18990 6864 1 10 . 1 1 378 378 GLY C C 378 173.404 173.404 172.921 0.483 18990 6865 1 10 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.712 0.151 18990 6866 1 10 . 1 1 378 378 GLY H H 378 8.820 8.820 8.361 0.459 18990 6867 1 10 . 1 1 379 379 TYR N N 379 125.532 125.532 124.703 0.829 18990 6868 1 10 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.693 -0.215 18990 6869 1 10 . 1 1 379 379 TYR C C 379 173.661 173.661 174.003 -0.342 18990 6870 1 10 . 1 1 379 379 TYR CA C 379 59.180 59.180 56.264 2.916 18990 6871 1 10 . 1 1 379 379 TYR CB C 379 40.108 40.108 41.638 -1.530 18990 6872 1 10 . 1 1 379 379 TYR H H 379 9.054 9.054 8.099 0.955 18990 6873 1 10 . 1 1 380 380 VAL N N 380 124.461 124.461 124.371 0.090 18990 6874 1 10 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.728 0.090 18990 6875 1 10 . 1 1 380 380 VAL C C 380 175.876 175.876 174.236 1.640 18990 6876 1 10 . 1 1 380 380 VAL CA C 380 60.797 60.797 60.928 -0.131 18990 6877 1 10 . 1 1 380 380 VAL CB C 380 32.610 32.610 32.095 0.515 18990 6878 1 10 . 1 1 380 380 VAL H H 380 7.238 7.238 7.885 -0.647 18990 6879 1 10 . 1 1 381 381 PHE N N 381 124.588 124.588 123.847 0.741 18990 6880 1 10 . 1 1 381 381 PHE HA H 381 5.273 5.273 4.923 0.350 18990 6881 1 10 . 1 1 381 381 PHE C C 381 173.242 173.242 174.054 -0.812 18990 6882 1 10 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.260 -0.049 18990 6883 1 10 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.254 1.836 18990 6884 1 10 . 1 1 381 381 PHE H H 381 9.424 9.424 7.434 1.990 18990 6885 1 10 . 1 1 382 382 CYS N N 382 120.221 120.221 122.284 -2.063 18990 6886 1 10 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.708 0.194 18990 6887 1 10 . 1 1 382 382 CYS C C 382 177.165 177.165 176.098 1.067 18990 6888 1 10 . 1 1 382 382 CYS CA C 382 57.691 57.691 58.361 -0.670 18990 6889 1 10 . 1 1 382 382 CYS CB C 382 32.475 32.475 30.014 2.461 18990 6890 1 10 . 1 1 382 382 CYS H H 382 8.673 8.673 8.508 0.165 18990 6891 1 10 . 1 1 383 383 ARG N N 383 129.347 129.347 125.825 3.522 18990 6892 1 10 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.195 -0.174 18990 6893 1 10 . 1 1 383 383 ARG C C 383 175.012 175.012 176.265 -1.253 18990 6894 1 10 . 1 1 383 383 ARG CA C 383 58.686 58.686 58.380 0.306 18990 6895 1 10 . 1 1 383 383 ARG CB C 383 30.900 30.900 29.735 1.165 18990 6896 1 10 . 1 1 383 383 ARG H H 383 9.534 9.534 8.525 1.009 18990 6897 1 10 . 1 1 384 384 ASN N N 384 117.772 117.772 116.799 0.973 18990 6898 1 10 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.817 -0.109 18990 6899 1 10 . 1 1 384 384 ASN C C 384 175.656 175.656 174.651 1.005 18990 6900 1 10 . 1 1 384 384 ASN CA C 384 55.778 55.778 54.235 1.543 18990 6901 1 10 . 1 1 384 384 ASN CB C 384 39.475 39.475 39.891 -0.416 18990 6902 1 10 . 1 1 384 384 ASN H H 384 8.840 8.840 7.902 0.938 18990 6903 1 10 . 1 1 385 385 CYS N N 385 115.876 115.876 116.629 -0.753 18990 6904 1 10 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.946 0.082 18990 6905 1 10 . 1 1 385 385 CYS C C 385 175.703 175.703 174.162 1.541 18990 6906 1 10 . 1 1 385 385 CYS CA C 385 58.112 58.112 57.248 0.864 18990 6907 1 10 . 1 1 385 385 CYS CB C 385 32.359 32.359 31.427 0.932 18990 6908 1 10 . 1 1 385 385 CYS H H 385 7.868 7.868 7.946 -0.078 18990 6909 1 10 . 1 1 386 386 LEU N N 386 120.082 120.082 121.681 -1.599 18990 6910 1 10 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.739 -0.426 18990 6911 1 10 . 1 1 386 386 LEU C C 386 175.722 175.722 177.106 -1.384 18990 6912 1 10 . 1 1 386 386 LEU CA C 386 57.009 57.009 55.046 1.963 18990 6913 1 10 . 1 1 386 386 LEU CB C 386 38.412 38.412 41.121 -2.709 18990 6914 1 10 . 1 1 386 386 LEU H H 386 8.514 8.514 8.584 -0.070 18990 6915 1 10 . 1 1 387 387 GLN N N 387 117.579 117.579 118.878 -1.299 18990 6916 1 10 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.327 0.449 18990 6917 1 10 . 1 1 387 387 GLN C C 387 175.299 175.299 177.020 -1.721 18990 6918 1 10 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.456 -1.439 18990 6919 1 10 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.380 1.927 18990 6920 1 10 . 1 1 387 387 GLN H H 387 8.248 8.248 8.242 0.006 18990 6921 1 10 . 1 1 388 388 GLY N N 388 106.107 106.107 107.411 -1.304 18990 6922 1 10 . 1 1 388 388 GLY C C 388 173.693 173.693 174.189 -0.496 18990 6923 1 10 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.344 0.836 18990 6924 1 10 . 1 1 388 388 GLY H H 388 8.695 8.695 8.197 0.498 18990 6925 1 10 . 1 1 389 389 TYR N N 389 122.514 122.514 117.640 4.874 18990 6926 1 10 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.185 -0.527 18990 6927 1 10 . 1 1 389 389 TYR C C 389 172.860 172.860 173.966 -1.106 18990 6928 1 10 . 1 1 389 389 TYR CA C 389 62.987 62.987 59.043 3.944 18990 6929 1 10 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.792 0.260 18990 6930 1 10 . 1 1 389 389 TYR H H 389 7.923 7.923 8.222 -0.299 18990 6931 1 10 . 1 1 390 390 HIS N N 390 120.080 120.080 122.243 -2.163 18990 6932 1 10 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.718 -0.010 18990 6933 1 10 . 1 1 390 390 HIS C C 390 173.235 173.235 173.881 -0.646 18990 6934 1 10 . 1 1 390 390 HIS CA C 390 51.431 51.431 53.381 -1.950 18990 6935 1 10 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.916 -0.016 18990 6936 1 10 . 1 1 390 390 HIS H H 390 5.291 5.291 7.700 -2.409 18990 6937 1 10 . 1 1 391 391 ILE N N 391 117.810 117.810 117.738 0.072 18990 6938 1 10 . 1 1 391 391 ILE HA H 391 4.116 4.116 3.925 0.191 18990 6939 1 10 . 1 1 391 391 ILE C C 391 178.208 178.208 176.430 1.778 18990 6940 1 10 . 1 1 391 391 ILE CA C 391 60.877 60.877 61.183 -0.306 18990 6941 1 10 . 1 1 391 391 ILE CB C 391 39.034 39.034 38.003 1.031 18990 6942 1 10 . 1 1 391 391 ILE H H 391 8.418 8.418 8.407 0.011 18990 6943 1 10 . 1 1 392 392 GLY N N 392 112.387 112.387 109.568 2.819 18990 6944 1 10 . 1 1 392 392 GLY C C 392 173.565 173.565 173.723 -0.158 18990 6945 1 10 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.977 0.281 18990 6946 1 10 . 1 1 392 392 GLY H H 392 8.654 8.654 8.469 0.185 18990 6947 1 10 . 1 1 393 393 GLU N N 393 119.098 119.098 119.761 -0.663 18990 6948 1 10 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.537 -0.248 18990 6949 1 10 . 1 1 393 393 GLU C C 393 176.899 176.899 175.002 1.897 18990 6950 1 10 . 1 1 393 393 GLU CA C 393 56.433 56.433 54.811 1.622 18990 6951 1 10 . 1 1 393 393 GLU CB C 393 30.470 30.470 31.126 -0.656 18990 6952 1 10 . 1 1 393 393 GLU H H 393 8.391 8.391 7.738 0.653 18990 6953 1 10 . 1 1 394 394 CYS N N 394 122.845 122.845 121.779 1.066 18990 6954 1 10 . 1 1 394 394 CYS HA H 394 3.766 3.766 5.069 -1.303 18990 6955 1 10 . 1 1 394 394 CYS C C 394 175.461 175.461 174.339 1.122 18990 6956 1 10 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.329 1.506 18990 6957 1 10 . 1 1 394 394 CYS CB C 394 30.761 30.761 28.689 2.072 18990 6958 1 10 . 1 1 394 394 CYS H H 394 8.474 8.474 8.713 -0.239 18990 6959 1 10 . 1 1 395 395 LEU N N 395 124.403 124.403 123.731 0.672 18990 6960 1 10 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.974 -0.470 18990 6961 1 10 . 1 1 395 395 LEU C C 395 175.259 175.259 175.117 0.142 18990 6962 1 10 . 1 1 395 395 LEU CA C 395 52.835 52.835 53.015 -0.180 18990 6963 1 10 . 1 1 395 395 LEU CB C 395 41.436 41.436 42.930 -1.494 18990 6964 1 10 . 1 1 395 395 LEU H H 395 8.418 8.418 8.490 -0.072 18990 6965 1 10 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.566 -0.196 18990 6966 1 10 . 1 1 396 396 PRO C C 396 177.006 177.006 175.553 1.453 18990 6967 1 10 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.564 0.532 18990 6968 1 10 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.403 -0.331 18990 6969 1 10 . 1 1 397 397 GLU N N 397 121.574 121.574 119.044 2.530 18990 6970 1 10 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.481 -0.256 18990 6971 1 10 . 1 1 397 397 GLU C C 397 177.202 177.202 176.085 1.117 18990 6972 1 10 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.265 0.769 18990 6973 1 10 . 1 1 397 397 GLU CB C 397 30.263 30.263 30.665 -0.402 18990 6974 1 10 . 1 1 397 397 GLU H H 397 8.568 8.568 8.530 0.038 18990 6975 1 10 . 1 1 398 398 GLY N N 398 110.495 110.495 111.695 -1.200 18990 6976 1 10 . 1 1 398 398 GLY C C 398 174.579 174.579 173.633 0.946 18990 6977 1 10 . 1 1 398 398 GLY CA C 398 45.462 45.462 44.453 1.009 18990 6978 1 10 . 1 1 398 398 GLY H H 398 8.515 8.515 8.410 0.105 18990 6979 1 10 . 1 1 399 399 THR N N 399 113.234 113.234 115.084 -1.850 18990 6980 1 10 . 1 1 399 399 THR HA H 399 4.398 4.398 5.175 -0.777 18990 6981 1 10 . 1 1 399 399 THR C C 399 175.333 175.333 174.400 0.933 18990 6982 1 10 . 1 1 399 399 THR CA C 399 62.233 62.233 62.580 -0.347 18990 6983 1 10 . 1 1 399 399 THR CB C 399 69.833 69.833 70.868 -1.035 18990 6984 1 10 . 1 1 399 399 THR H H 399 8.090 8.090 9.524 -1.434 18990 6985 1 10 . 1 1 400 400 GLY N N 400 111.479 111.479 109.657 1.822 18990 6986 1 10 . 1 1 400 400 GLY C C 400 174.048 174.048 172.411 1.637 18990 6987 1 10 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.012 0.427 18990 6988 1 10 . 1 1 400 400 GLY H H 400 8.524 8.524 8.882 -0.358 18990 6989 1 10 . 1 1 401 401 ALA N N 401 123.919 123.919 124.425 -0.506 18990 6990 1 10 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.704 -0.453 18990 6991 1 10 . 1 1 401 401 ALA C C 401 177.942 177.942 176.601 1.341 18990 6992 1 10 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.816 0.914 18990 6993 1 10 . 1 1 401 401 ALA CB C 401 19.142 19.142 20.595 -1.452 18990 6994 1 10 . 1 1 401 401 ALA H H 401 8.179 8.179 8.298 -0.119 18990 6995 1 10 . 1 1 402 402 SER N N 402 114.904 114.904 116.221 -1.317 18990 6996 1 10 . 1 1 402 402 SER HA H 402 4.448 4.448 4.887 -0.439 18990 6997 1 10 . 1 1 402 402 SER C C 402 174.426 174.426 173.192 1.234 18990 6998 1 10 . 1 1 402 402 SER CA C 402 58.289 58.289 57.919 0.370 18990 6999 1 10 . 1 1 402 402 SER CB C 402 63.772 63.772 64.294 -0.522 18990 7000 1 10 . 1 1 402 402 SER H H 402 8.305 8.305 8.410 -0.105 18990 7001 1 10 . 1 1 403 403 ALA N N 403 125.965 125.965 125.505 0.460 18990 7002 1 10 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.609 -0.210 18990 7003 1 10 . 1 1 403 403 ALA C C 403 177.984 177.984 175.957 2.027 18990 7004 1 10 . 1 1 403 403 ALA CA C 403 52.655 52.655 52.239 0.416 18990 7005 1 10 . 1 1 403 403 ALA CB C 403 19.138 19.138 20.053 -0.915 18990 7006 1 10 . 1 1 403 403 ALA H H 403 8.345 8.345 8.505 -0.160 18990 7007 1 10 . 1 1 404 404 THR N N 404 112.790 112.790 116.074 -3.284 18990 7008 1 10 . 1 1 404 404 THR C C 404 174.420 174.420 173.022 1.398 18990 7009 1 10 . 1 1 404 404 THR CA C 404 61.988 61.988 61.669 0.319 18990 7010 1 10 . 1 1 404 404 THR CB C 404 69.688 69.688 70.374 -0.686 18990 7011 1 10 . 1 1 404 404 THR H H 404 8.118 8.118 8.593 -0.475 18990 7012 1 10 . 1 1 405 405 ASN N N 405 121.050 121.050 121.093 -0.043 18990 7013 1 10 . 1 1 405 405 ASN H H 405 8.396 8.396 8.974 -0.578 18990 7014 1 10 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.822 -0.244 18990 7015 1 10 . 1 1 407 407 CYS C C 407 174.489 174.489 173.737 0.752 18990 7016 1 10 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.679 0.034 18990 7017 1 10 . 1 1 407 407 CYS CB C 407 28.102 28.102 28.546 -0.444 18990 7018 1 10 . 1 1 408 408 GLU N N 408 123.021 123.021 123.911 -0.890 18990 7019 1 10 . 1 1 408 408 GLU C C 408 175.954 175.954 175.181 0.773 18990 7020 1 10 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.468 0.334 18990 7021 1 10 . 1 1 408 408 GLU CB C 408 30.328 30.328 31.830 -1.502 18990 7022 1 10 . 1 1 408 408 GLU H H 408 8.415 8.415 8.699 -0.284 18990 7023 1 10 . 1 1 409 409 TYR N N 409 121.015 121.015 122.258 -1.243 18990 7024 1 10 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.725 -0.071 18990 7025 1 10 . 1 1 409 409 TYR C C 409 175.613 175.613 174.345 1.268 18990 7026 1 10 . 1 1 409 409 TYR CA C 409 57.669 57.669 58.151 -0.482 18990 7027 1 10 . 1 1 409 409 TYR CB C 409 38.825 38.825 39.558 -0.733 18990 7028 1 10 . 1 1 409 409 TYR H H 409 8.135 8.135 8.408 -0.273 18990 7029 1 10 . 1 1 410 410 THR N N 410 116.975 116.975 119.847 -2.872 18990 7030 1 10 . 1 1 410 410 THR HA H 410 4.306 4.306 4.441 -0.135 18990 7031 1 10 . 1 1 410 410 THR C C 410 173.846 173.846 172.095 1.751 18990 7032 1 10 . 1 1 410 410 THR CA C 410 61.730 61.730 60.606 1.124 18990 7033 1 10 . 1 1 410 410 THR CB C 410 69.914 69.914 69.903 0.011 18990 7034 1 10 . 1 1 410 410 THR H H 410 8.060 8.060 7.698 0.362 18990 7035 1 10 . 1 1 411 411 VAL N N 411 122.900 122.900 123.472 -0.572 18990 7036 1 10 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.152 -0.099 18990 7037 1 10 . 1 1 411 411 VAL C C 411 175.275 175.275 175.278 -0.003 18990 7038 1 10 . 1 1 411 411 VAL CA C 411 61.853 61.853 61.199 0.654 18990 7039 1 10 . 1 1 411 411 VAL CB C 411 32.976 32.976 33.470 -0.494 18990 7040 1 10 . 1 1 411 411 VAL H H 411 8.089 8.089 8.184 -0.095 18990 7041 1 10 . 1 1 412 412 ASP N N 412 125.924 125.924 127.862 -1.938 18990 7042 1 10 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.851 -0.001 18990 7043 1 10 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.486 -0.908 18990 7044 1 10 . 1 1 412 412 ASP CB C 412 41.538 41.538 40.864 0.674 18990 7045 1 10 . 1 1 412 412 ASP H H 412 8.397 8.397 8.359 0.038 18990 7046 1 10 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.518 -0.132 18990 7047 1 10 . 1 1 413 413 PRO C C 413 177.352 177.352 176.063 1.289 18990 7048 1 10 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.600 1.310 18990 7049 1 10 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.502 -0.234 18990 7050 1 10 . 1 1 414 414 ASN N N 414 117.035 117.035 118.287 -1.252 18990 7051 1 10 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.713 -0.036 18990 7052 1 10 . 1 1 414 414 ASN C C 414 175.532 175.532 174.218 1.314 18990 7053 1 10 . 1 1 414 414 ASN CA C 414 53.824 53.824 52.434 1.390 18990 7054 1 10 . 1 1 414 414 ASN CB C 414 38.728 38.728 40.167 -1.440 18990 7055 1 10 . 1 1 414 414 ASN H H 414 8.496 8.496 8.402 0.094 18990 7056 1 10 . 1 1 415 415 ARG N N 415 121.000 121.000 119.922 1.078 18990 7057 1 10 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.646 -0.402 18990 7058 1 10 . 1 1 415 415 ARG C C 415 176.243 176.243 175.004 1.239 18990 7059 1 10 . 1 1 415 415 ARG CA C 415 56.404 56.404 55.591 0.813 18990 7060 1 10 . 1 1 415 415 ARG CB C 415 30.637 30.637 31.628 -0.991 18990 7061 1 10 . 1 1 415 415 ARG H H 415 7.804 7.804 8.484 -0.680 18990 7062 1 10 . 1 1 416 416 ALA N N 416 124.880 124.880 126.062 -1.182 18990 7063 1 10 . 1 1 416 416 ALA C C 416 177.831 177.831 176.044 1.787 18990 7064 1 10 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.573 1.384 18990 7065 1 10 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.788 -1.728 18990 7066 1 10 . 1 1 416 416 ALA H H 416 8.189 8.189 8.336 -0.147 18990 7067 1 10 . 1 1 417 417 ALA N N 417 122.614 122.614 124.161 -1.547 18990 7068 1 10 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.601 -0.354 18990 7069 1 10 . 1 1 417 417 ALA C C 417 178.024 178.024 177.097 0.927 18990 7070 1 10 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.699 1.090 18990 7071 1 10 . 1 1 417 417 ALA CB C 417 19.042 19.042 20.034 -0.992 18990 7072 1 10 . 1 1 417 417 ALA H H 417 8.169 8.169 8.210 -0.041 18990 7073 1 10 . 1 1 418 418 GLU N N 418 119.500 119.500 120.514 -1.014 18990 7074 1 10 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.764 -0.575 18990 7075 1 10 . 1 1 418 418 GLU C C 418 176.266 176.266 175.954 0.312 18990 7076 1 10 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.639 0.937 18990 7077 1 10 . 1 1 418 418 GLU CB C 418 30.307 30.307 30.919 -0.612 18990 7078 1 10 . 1 1 418 418 GLU H H 418 8.184 8.184 8.711 -0.527 18990 7079 1 10 . 1 1 419 419 ALA N N 419 124.643 124.643 122.545 2.098 18990 7080 1 10 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.596 -0.346 18990 7081 1 10 . 1 1 419 419 ALA C C 419 177.488 177.488 175.611 1.877 18990 7082 1 10 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.451 1.058 18990 7083 1 10 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.337 -1.175 18990 7084 1 10 . 1 1 419 419 ALA H H 419 8.135 8.135 8.150 -0.015 18990 7085 1 10 . 1 1 420 420 ARG N N 420 120.003 120.003 118.236 1.767 18990 7086 1 10 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.523 -0.230 18990 7087 1 10 . 1 1 420 420 ARG C C 420 176.297 176.297 174.511 1.786 18990 7088 1 10 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.274 0.659 18990 7089 1 10 . 1 1 420 420 ARG CB C 420 30.850 30.850 31.535 -0.685 18990 7090 1 10 . 1 1 420 420 ARG H H 420 8.135 8.135 8.018 0.117 18990 7091 1 10 . 1 1 421 421 TRP N N 421 122.280 122.280 121.530 0.750 18990 7092 1 10 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.895 -0.232 18990 7093 1 10 . 1 1 421 421 TRP C C 421 175.856 175.856 175.406 0.450 18990 7094 1 10 . 1 1 421 421 TRP CA C 421 57.404 57.404 56.552 0.852 18990 7095 1 10 . 1 1 421 421 TRP CB C 421 29.437 29.437 31.167 -1.730 18990 7096 1 10 . 1 1 421 421 TRP H H 421 8.159 8.159 8.277 -0.118 18990 7097 1 10 . 1 1 422 422 ASP N N 422 121.980 121.980 123.166 -1.186 18990 7098 1 10 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.802 -0.307 18990 7099 1 10 . 1 1 422 422 ASP C C 422 176.184 176.184 175.975 0.209 18990 7100 1 10 . 1 1 422 422 ASP CA C 422 53.899 53.899 54.177 -0.278 18990 7101 1 10 . 1 1 422 422 ASP CB C 422 40.948 40.948 42.700 -1.752 18990 7102 1 10 . 1 1 422 422 ASP H H 422 8.135 8.135 8.677 -0.542 18990 7103 1 10 . 1 1 423 423 GLU N N 423 121.990 121.990 123.784 -1.794 18990 7104 1 10 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.274 -0.184 18990 7105 1 10 . 1 1 423 423 GLU C C 423 176.720 176.720 176.299 0.421 18990 7106 1 10 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.550 0.619 18990 7107 1 10 . 1 1 423 423 GLU CB C 423 30.156 30.156 29.607 0.549 18990 7108 1 10 . 1 1 423 423 GLU H H 423 8.153 8.153 8.910 -0.757 18990 7109 1 10 . 1 1 424 424 ALA N N 424 123.900 123.900 123.954 -0.054 18990 7110 1 10 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.129 0.151 18990 7111 1 10 . 1 1 424 424 ALA C C 424 178.095 178.095 176.491 1.604 18990 7112 1 10 . 1 1 424 424 ALA CA C 424 53.017 53.017 52.326 0.691 18990 7113 1 10 . 1 1 424 424 ALA CB C 424 19.086 19.086 18.158 0.928 18990 7114 1 10 . 1 1 424 424 ALA H H 424 8.243 8.243 8.263 -0.020 18990 7115 1 10 . 1 1 425 425 SER N N 425 113.881 113.881 116.085 -2.204 18990 7116 1 10 . 1 1 425 425 SER HA H 425 4.387 4.387 4.490 -0.103 18990 7117 1 10 . 1 1 425 425 SER C C 425 174.338 174.338 174.765 -0.427 18990 7118 1 10 . 1 1 425 425 SER CA C 425 58.546 58.546 57.986 0.560 18990 7119 1 10 . 1 1 425 425 SER CB C 425 63.784 63.784 63.614 0.171 18990 7120 1 10 . 1 1 425 425 SER H H 425 8.063 8.063 8.323 -0.260 18990 7121 1 10 . 1 1 426 426 ASN N N 426 121.032 121.032 124.551 -3.519 18990 7122 1 10 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.943 -0.237 18990 7123 1 10 . 1 1 426 426 ASN C C 426 175.046 175.046 174.133 0.913 18990 7124 1 10 . 1 1 426 426 ASN CA C 426 53.445 53.445 53.025 0.420 18990 7125 1 10 . 1 1 426 426 ASN CB C 426 38.847 38.847 39.191 -0.344 18990 7126 1 10 . 1 1 426 426 ASN H H 426 8.391 8.391 8.750 -0.359 18990 7127 1 10 . 1 1 427 427 VAL N N 427 119.463 119.463 118.734 0.729 18990 7128 1 10 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.338 -0.145 18990 7129 1 10 . 1 1 427 427 VAL C C 427 176.213 176.213 174.985 1.228 18990 7130 1 10 . 1 1 427 427 VAL CA C 427 62.449 62.449 61.604 0.845 18990 7131 1 10 . 1 1 427 427 VAL CB C 427 32.865 32.865 34.321 -1.456 18990 7132 1 10 . 1 1 427 427 VAL H H 427 7.954 7.954 8.113 -0.159 18990 7133 1 10 . 1 1 428 428 THR N N 428 118.226 118.226 119.984 -1.758 18990 7134 1 10 . 1 1 428 428 THR HA H 428 4.353 4.353 4.720 -0.367 18990 7135 1 10 . 1 1 428 428 THR C C 428 174.361 174.361 173.598 0.763 18990 7136 1 10 . 1 1 428 428 THR CA C 428 62.065 62.065 61.273 0.791 18990 7137 1 10 . 1 1 428 428 THR CB C 428 69.729 69.729 69.116 0.613 18990 7138 1 10 . 1 1 428 428 THR H H 428 8.225 8.225 8.147 0.078 18990 7139 1 10 . 1 1 429 429 ILE N N 429 123.910 123.910 120.596 3.314 18990 7140 1 10 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.655 -0.467 18990 7141 1 10 . 1 1 429 429 ILE C C 429 175.774 175.774 174.945 0.829 18990 7142 1 10 . 1 1 429 429 ILE CA C 429 60.819 60.819 59.859 0.960 18990 7143 1 10 . 1 1 429 429 ILE CB C 429 38.719 38.719 39.785 -1.066 18990 7144 1 10 . 1 1 429 429 ILE H H 429 8.148 8.148 8.218 -0.070 18990 7145 1 10 . 1 1 430 430 LYS N N 430 126.453 126.453 122.268 4.185 18990 7146 1 10 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.514 -0.080 18990 7147 1 10 . 1 1 430 430 LYS C C 430 176.241 176.241 175.848 0.393 18990 7148 1 10 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.502 0.435 18990 7149 1 10 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.008 0.156 18990 7150 1 10 . 1 1 430 430 LYS H H 430 8.406 8.406 8.226 0.180 18990 7151 1 10 . 1 1 431 431 VAL N N 431 122.496 122.496 119.340 3.156 18990 7152 1 10 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.222 0.058 18990 7153 1 10 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.614 -0.311 18990 7154 1 10 . 1 1 431 431 VAL CB C 431 33.132 33.132 32.740 0.392 18990 7155 1 10 . 1 1 431 431 VAL H H 431 8.312 8.312 8.106 0.206 18990 7156 1 10 . 1 1 432 432 SER HA H 432 4.486 4.486 4.748 -0.262 18990 7157 1 10 . 1 1 432 432 SER C C 432 173.834 173.834 173.820 0.014 18990 7158 1 10 . 1 1 432 432 SER CA C 432 58.650 58.650 58.816 -0.166 18990 7159 1 10 . 1 1 432 432 SER CB C 432 64.152 64.152 63.861 0.291 18990 7160 1 10 . 1 1 433 433 THR N N 433 114.706 114.706 112.605 2.101 18990 7161 1 10 . 1 1 433 433 THR HA H 433 5.446 5.446 5.208 0.238 18990 7162 1 10 . 1 1 433 433 THR C C 433 173.979 173.979 173.975 0.004 18990 7163 1 10 . 1 1 433 433 THR CA C 433 60.412 60.412 60.037 0.375 18990 7164 1 10 . 1 1 433 433 THR CB C 433 71.896 71.896 71.400 0.497 18990 7165 1 10 . 1 1 433 433 THR H H 433 7.833 7.833 7.504 0.329 18990 7166 1 10 . 1 1 434 434 LYS N N 434 122.492 122.492 121.238 1.254 18990 7167 1 10 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.979 -0.270 18990 7168 1 10 . 1 1 434 434 LYS C C 434 173.589 173.589 174.233 -0.644 18990 7169 1 10 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.826 1.549 18990 7170 1 10 . 1 1 434 434 LYS CB C 434 36.925 36.925 33.754 3.171 18990 7171 1 10 . 1 1 434 434 LYS H H 434 8.937 8.937 8.952 -0.015 18990 7172 1 10 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.787 -0.520 18990 7173 1 10 . 1 1 435 435 PRO C C 435 175.238 175.238 176.669 -1.431 18990 7174 1 10 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.192 -1.269 18990 7175 1 10 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.064 0.022 18990 7176 1 10 . 1 1 436 436 CYS N N 436 125.422 125.422 126.208 -0.786 18990 7177 1 10 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.141 -0.711 18990 7178 1 10 . 1 1 436 436 CYS C C 436 176.770 176.770 175.490 1.280 18990 7179 1 10 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.765 0.251 18990 7180 1 10 . 1 1 436 436 CYS CB C 436 31.698 31.698 28.146 3.552 18990 7181 1 10 . 1 1 436 436 CYS H H 436 7.768 7.768 8.617 -0.849 18990 7182 1 10 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.255 -0.397 18990 7183 1 10 . 1 1 437 437 PRO C C 437 173.608 173.608 176.377 -2.769 18990 7184 1 10 . 1 1 437 437 PRO CA C 437 64.213 64.213 63.895 0.317 18990 7185 1 10 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.290 1.159 18990 7186 1 10 . 1 1 438 438 LYS N N 438 118.600 118.600 117.252 1.348 18990 7187 1 10 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.385 -0.415 18990 7188 1 10 . 1 1 438 438 LYS C C 438 176.887 176.887 176.747 0.140 18990 7189 1 10 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.258 0.429 18990 7190 1 10 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.623 -0.499 18990 7191 1 10 . 1 1 438 438 LYS H H 438 8.390 8.390 7.808 0.582 18990 7192 1 10 . 1 1 439 439 CYS N N 439 118.950 118.950 114.659 4.291 18990 7193 1 10 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.671 0.075 18990 7194 1 10 . 1 1 439 439 CYS C C 439 176.650 176.650 174.969 1.681 18990 7195 1 10 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.308 2.040 18990 7196 1 10 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.003 3.193 18990 7197 1 10 . 1 1 439 439 CYS H H 439 8.357 8.357 7.630 0.727 18990 7198 1 10 . 1 1 440 440 ARG N N 440 117.200 117.200 118.817 -1.617 18990 7199 1 10 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.093 -0.125 18990 7200 1 10 . 1 1 440 440 ARG C C 440 175.253 175.253 175.715 -0.462 18990 7201 1 10 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.887 0.013 18990 7202 1 10 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.247 -1.206 18990 7203 1 10 . 1 1 440 440 ARG H H 440 8.065 8.065 8.037 0.028 18990 7204 1 10 . 1 1 441 441 THR N N 441 122.400 122.400 110.810 11.590 18990 7205 1 10 . 1 1 441 441 THR HA H 441 4.371 4.371 4.722 -0.351 18990 7206 1 10 . 1 1 441 441 THR C C 441 173.702 173.702 172.922 0.780 18990 7207 1 10 . 1 1 441 441 THR CA C 441 63.194 63.194 58.790 4.404 18990 7208 1 10 . 1 1 441 441 THR CB C 441 68.933 68.933 69.926 -0.993 18990 7209 1 10 . 1 1 441 441 THR H H 441 8.643 8.643 7.679 0.964 18990 7210 1 10 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.766 -0.619 18990 7211 1 10 . 1 1 442 442 PRO C C 442 176.215 176.215 176.049 0.166 18990 7212 1 10 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.563 1.634 18990 7213 1 10 . 1 1 442 442 PRO CB C 442 32.044 32.044 30.988 1.056 18990 7214 1 10 . 1 1 443 443 THR N N 443 122.932 122.932 122.217 0.715 18990 7215 1 10 . 1 1 443 443 THR HA H 443 4.665 4.665 4.495 0.170 18990 7216 1 10 . 1 1 443 443 THR C C 443 172.133 172.133 174.182 -2.049 18990 7217 1 10 . 1 1 443 443 THR CA C 443 62.566 62.566 62.539 0.027 18990 7218 1 10 . 1 1 443 443 THR CB C 443 71.562 71.562 70.108 1.454 18990 7219 1 10 . 1 1 443 443 THR H H 443 9.116 9.116 9.048 0.068 18990 7220 1 10 . 1 1 444 444 GLU N N 444 126.390 126.390 128.613 -2.223 18990 7221 1 10 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.499 0.443 18990 7222 1 10 . 1 1 444 444 GLU C C 444 175.292 175.292 176.263 -0.971 18990 7223 1 10 . 1 1 444 444 GLU CA C 444 55.049 55.049 56.340 -1.291 18990 7224 1 10 . 1 1 444 444 GLU CB C 444 31.861 31.861 30.594 1.267 18990 7225 1 10 . 1 1 444 444 GLU H H 444 8.720 8.720 8.854 -0.134 18990 7226 1 10 . 1 1 445 445 ARG N N 445 123.505 123.505 126.994 -3.489 18990 7227 1 10 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.668 -0.957 18990 7228 1 10 . 1 1 445 445 ARG C C 445 175.289 175.289 175.521 -0.232 18990 7229 1 10 . 1 1 445 445 ARG CA C 445 55.856 55.856 54.613 1.243 18990 7230 1 10 . 1 1 445 445 ARG CB C 445 30.675 30.675 32.368 -1.693 18990 7231 1 10 . 1 1 445 445 ARG H H 445 8.157 8.157 8.113 0.044 18990 7232 1 10 . 1 1 446 446 ASP N N 446 126.800 126.800 119.665 7.135 18990 7233 1 10 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.592 0.049 18990 7234 1 10 . 1 1 446 446 ASP C C 446 176.020 176.020 175.621 0.399 18990 7235 1 10 . 1 1 446 446 ASP CA C 446 52.952 52.952 52.689 0.263 18990 7236 1 10 . 1 1 446 446 ASP CB C 446 41.400 41.400 43.558 -2.158 18990 7237 1 10 . 1 1 446 446 ASP H H 446 8.476 8.476 8.328 0.148 18990 7238 1 10 . 1 1 447 447 GLY N N 447 111.262 111.262 105.998 5.264 18990 7239 1 10 . 1 1 447 447 GLY C C 447 174.073 174.073 174.419 -0.346 18990 7240 1 10 . 1 1 447 447 GLY CA C 447 45.832 45.832 45.050 0.782 18990 7241 1 10 . 1 1 447 447 GLY H H 447 8.056 8.056 8.615 -0.559 18990 7242 1 10 . 1 1 448 448 GLY N N 448 108.655 108.655 114.105 -5.450 18990 7243 1 10 . 1 1 448 448 GLY C C 448 174.020 174.020 174.172 -0.152 18990 7244 1 10 . 1 1 448 448 GLY CA C 448 45.267 45.267 45.037 0.230 18990 7245 1 10 . 1 1 448 448 GLY H H 448 8.380 8.380 8.384 -0.004 18990 7246 1 10 . 1 1 449 449 CYS N N 449 120.628 120.628 121.183 -0.555 18990 7247 1 10 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.415 -0.418 18990 7248 1 10 . 1 1 449 449 CYS C C 449 174.855 174.855 173.966 0.889 18990 7249 1 10 . 1 1 449 449 CYS CA C 449 59.291 59.291 58.316 0.975 18990 7250 1 10 . 1 1 449 449 CYS CB C 449 28.000 28.000 28.677 -0.677 18990 7251 1 10 . 1 1 449 449 CYS H H 449 7.832 7.832 7.251 0.581 18990 7252 1 10 . 1 1 450 450 MET N N 450 123.947 123.947 121.930 2.017 18990 7253 1 10 . 1 1 450 450 MET HA H 450 4.551 4.551 4.105 0.446 18990 7254 1 10 . 1 1 450 450 MET C C 450 174.658 174.658 175.081 -0.423 18990 7255 1 10 . 1 1 450 450 MET CA C 450 54.970 54.970 55.243 -0.273 18990 7256 1 10 . 1 1 450 450 MET CB C 450 34.100 34.100 32.795 1.305 18990 7257 1 10 . 1 1 450 450 MET H H 450 8.916 8.916 8.494 0.422 18990 7258 1 10 . 1 1 451 451 HIS N N 451 120.490 120.490 117.246 3.244 18990 7259 1 10 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.255 -0.576 18990 7260 1 10 . 1 1 451 451 HIS C C 451 172.443 172.443 173.708 -1.265 18990 7261 1 10 . 1 1 451 451 HIS CA C 451 53.812 53.812 54.416 -0.604 18990 7262 1 10 . 1 1 451 451 HIS CB C 451 28.900 28.900 30.403 -1.503 18990 7263 1 10 . 1 1 451 451 HIS H H 451 7.557 7.557 7.574 -0.017 18990 7264 1 10 . 1 1 452 452 MET N N 452 128.800 128.800 127.247 1.553 18990 7265 1 10 . 1 1 452 452 MET HA H 452 4.320 4.320 4.590 -0.270 18990 7266 1 10 . 1 1 452 452 MET C C 452 175.479 175.479 173.720 1.759 18990 7267 1 10 . 1 1 452 452 MET CA C 452 52.589 52.589 53.912 -1.323 18990 7268 1 10 . 1 1 452 452 MET CB C 452 28.074 28.074 33.792 -5.718 18990 7269 1 10 . 1 1 452 452 MET H H 452 9.087 9.087 7.992 1.095 18990 7270 1 10 . 1 1 453 453 VAL N N 453 122.200 122.200 125.030 -2.830 18990 7271 1 10 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.467 0.327 18990 7272 1 10 . 1 1 453 453 VAL C C 453 175.476 175.476 174.818 0.658 18990 7273 1 10 . 1 1 453 453 VAL CA C 453 61.380 61.380 61.098 0.282 18990 7274 1 10 . 1 1 453 453 VAL CB C 453 33.089 33.089 34.975 -1.886 18990 7275 1 10 . 1 1 453 453 VAL H H 453 8.016 8.016 8.179 -0.163 18990 7276 1 10 . 1 1 454 454 CYS N N 454 130.353 130.353 127.442 2.911 18990 7277 1 10 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.879 -0.284 18990 7278 1 10 . 1 1 454 454 CYS C C 454 177.833 177.833 175.006 2.827 18990 7279 1 10 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.599 2.972 18990 7280 1 10 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.115 5.930 18990 7281 1 10 . 1 1 454 454 CYS H H 454 8.989 8.989 9.370 -0.381 18990 7282 1 10 . 1 1 455 455 THR N N 455 119.000 119.000 121.697 -2.697 18990 7283 1 10 . 1 1 455 455 THR HA H 455 4.393 4.393 4.351 0.042 18990 7284 1 10 . 1 1 455 455 THR C C 455 175.264 175.264 173.928 1.336 18990 7285 1 10 . 1 1 455 455 THR CA C 455 61.644 61.644 62.148 -0.504 18990 7286 1 10 . 1 1 455 455 THR CB C 455 69.400 69.400 68.645 0.755 18990 7287 1 10 . 1 1 455 455 THR H H 455 8.533 8.533 8.330 0.203 18990 7288 1 10 . 1 1 456 456 ARG N N 456 128.900 128.900 127.108 1.792 18990 7289 1 10 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.599 -0.374 18990 7290 1 10 . 1 1 456 456 ARG C C 456 177.782 177.782 175.190 2.592 18990 7291 1 10 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.535 2.415 18990 7292 1 10 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.994 -3.944 18990 7293 1 10 . 1 1 456 456 ARG H H 456 9.036 9.036 7.860 1.176 18990 7294 1 10 . 1 1 457 457 ALA N N 457 133.152 133.152 126.914 6.238 18990 7295 1 10 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.286 -0.140 18990 7296 1 10 . 1 1 457 457 ALA C C 457 178.757 178.757 177.754 1.003 18990 7297 1 10 . 1 1 457 457 ALA CA C 457 53.929 53.929 53.051 0.878 18990 7298 1 10 . 1 1 457 457 ALA CB C 457 17.710 17.710 18.010 -0.300 18990 7299 1 10 . 1 1 457 457 ALA H H 457 9.042 9.042 8.770 0.272 18990 7300 1 10 . 1 1 458 458 GLY N N 458 111.200 111.200 111.450 -0.250 18990 7301 1 10 . 1 1 458 458 GLY C C 458 173.558 173.558 174.063 -0.505 18990 7302 1 10 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.698 0.738 18990 7303 1 10 . 1 1 458 458 GLY H H 458 8.830 8.830 8.675 0.155 18990 7304 1 10 . 1 1 459 459 CYS N N 459 123.040 123.040 120.218 2.822 18990 7305 1 10 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.935 -0.313 18990 7306 1 10 . 1 1 459 459 CYS C C 459 176.591 176.591 174.315 2.276 18990 7307 1 10 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.065 1.434 18990 7308 1 10 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.342 0.832 18990 7309 1 10 . 1 1 459 459 CYS H H 459 8.042 8.042 8.169 -0.127 18990 7310 1 10 . 1 1 460 460 GLY N N 460 104.500 104.500 110.554 -6.054 18990 7311 1 10 . 1 1 460 460 GLY C C 460 173.716 173.716 173.923 -0.207 18990 7312 1 10 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.569 0.439 18990 7313 1 10 . 1 1 460 460 GLY H H 460 7.705 7.705 8.159 -0.454 18990 7314 1 10 . 1 1 461 461 PHE N N 461 124.949 124.949 120.853 4.096 18990 7315 1 10 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.741 -0.161 18990 7316 1 10 . 1 1 461 461 PHE C C 461 174.447 174.447 173.748 0.699 18990 7317 1 10 . 1 1 461 461 PHE CA C 461 59.946 59.946 56.669 3.277 18990 7318 1 10 . 1 1 461 461 PHE CB C 461 41.300 41.300 41.910 -0.610 18990 7319 1 10 . 1 1 461 461 PHE H H 461 8.947 8.947 7.632 1.315 18990 7320 1 10 . 1 1 462 462 GLU N N 462 125.272 125.272 128.671 -3.399 18990 7321 1 10 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.521 1.200 18990 7322 1 10 . 1 1 462 462 GLU C C 462 176.067 176.067 174.686 1.381 18990 7323 1 10 . 1 1 462 462 GLU CA C 462 54.624 54.624 54.584 0.040 18990 7324 1 10 . 1 1 462 462 GLU CB C 462 31.255 31.255 31.788 -0.533 18990 7325 1 10 . 1 1 462 462 GLU H H 462 7.799 7.799 8.248 -0.449 18990 7326 1 10 . 1 1 463 463 TRP N N 463 121.524 121.524 122.590 -1.066 18990 7327 1 10 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.141 0.365 18990 7328 1 10 . 1 1 463 463 TRP C C 463 172.844 172.844 174.336 -1.492 18990 7329 1 10 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.392 -0.621 18990 7330 1 10 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.276 0.460 18990 7331 1 10 . 1 1 463 463 TRP H H 463 9.300 9.300 8.005 1.295 18990 7332 1 10 . 1 1 464 464 CYS N N 464 120.868 120.868 120.249 0.619 18990 7333 1 10 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.616 0.800 18990 7334 1 10 . 1 1 464 464 CYS C C 464 177.213 177.213 176.330 0.883 18990 7335 1 10 . 1 1 464 464 CYS CA C 464 57.776 57.776 60.552 -2.776 18990 7336 1 10 . 1 1 464 464 CYS CB C 464 32.930 32.930 27.429 5.501 18990 7337 1 10 . 1 1 464 464 CYS H H 464 8.752 8.752 8.903 -0.151 18990 7338 1 10 . 1 1 465 465 TRP N N 465 131.209 131.209 127.197 4.012 18990 7339 1 10 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.082 0.345 18990 7340 1 10 . 1 1 465 465 TRP C C 465 176.051 176.051 175.877 0.174 18990 7341 1 10 . 1 1 465 465 TRP CA C 465 60.763 60.763 59.871 0.892 18990 7342 1 10 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.346 1.780 18990 7343 1 10 . 1 1 465 465 TRP H H 465 9.809 9.809 8.434 1.375 18990 7344 1 10 . 1 1 466 466 VAL N N 466 118.233 118.233 118.471 -0.238 18990 7345 1 10 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.386 0.238 18990 7346 1 10 . 1 1 466 466 VAL C C 466 178.943 178.943 176.105 2.838 18990 7347 1 10 . 1 1 466 466 VAL CA C 466 65.602 65.602 63.785 1.817 18990 7348 1 10 . 1 1 466 466 VAL CB C 466 33.172 33.172 31.154 2.018 18990 7349 1 10 . 1 1 466 466 VAL H H 466 8.627 8.627 7.874 0.753 18990 7350 1 10 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.588 -1.157 18990 7351 1 10 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.398 0.601 18990 7352 1 10 . 1 1 467 467 CYS CB C 467 31.870 31.870 27.434 4.436 18990 7353 1 10 . 1 1 467 467 CYS H H 467 7.820 7.820 7.603 0.217 18990 7354 1 10 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.506 -0.470 18990 7355 1 10 . 1 1 468 468 GLN CA C 468 58.051 58.051 56.412 1.639 18990 7356 1 10 . 1 1 468 468 GLN CB C 468 26.476 26.476 27.961 -1.485 18990 7357 1 10 . 1 1 469 469 THR HA H 469 4.685 4.685 4.755 -0.070 18990 7358 1 10 . 1 1 469 469 THR C C 469 173.351 173.351 173.101 0.250 18990 7359 1 10 . 1 1 469 469 THR CA C 469 59.176 59.176 60.160 -0.984 18990 7360 1 10 . 1 1 469 469 THR CB C 469 71.775 71.775 71.365 0.410 18990 7361 1 10 . 1 1 470 470 GLU N N 470 120.940 120.940 119.926 1.014 18990 7362 1 10 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.983 -0.690 18990 7363 1 10 . 1 1 470 470 GLU C C 470 175.539 175.539 176.039 -0.500 18990 7364 1 10 . 1 1 470 470 GLU CA C 470 57.015 57.015 54.573 2.442 18990 7365 1 10 . 1 1 470 470 GLU CB C 470 29.965 29.965 32.017 -2.052 18990 7366 1 10 . 1 1 470 470 GLU H H 470 8.912 8.912 8.652 0.260 18990 7367 1 10 . 1 1 471 471 TRP N N 471 126.998 126.998 129.451 -2.453 18990 7368 1 10 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.633 -0.340 18990 7369 1 10 . 1 1 471 471 TRP C C 471 175.408 175.408 175.624 -0.216 18990 7370 1 10 . 1 1 471 471 TRP CA C 471 58.220 58.220 59.308 -1.088 18990 7371 1 10 . 1 1 471 471 TRP CB C 471 29.500 29.500 28.565 0.935 18990 7372 1 10 . 1 1 471 471 TRP H H 471 8.350 8.350 8.853 -0.503 18990 7373 1 10 . 1 1 472 472 THR N N 472 117.480 117.480 120.670 -3.190 18990 7374 1 10 . 1 1 472 472 THR HA H 472 4.444 4.444 4.328 0.116 18990 7375 1 10 . 1 1 472 472 THR CA C 472 58.930 58.930 60.146 -1.216 18990 7376 1 10 . 1 1 472 472 THR H H 472 8.069 8.069 7.413 0.656 18990 7377 1 10 . 1 1 473 473 ARG HA H 473 3.773 3.773 3.996 -0.223 18990 7378 1 10 . 1 1 473 473 ARG C C 473 178.053 178.053 177.882 0.171 18990 7379 1 10 . 1 1 473 473 ARG CA C 473 58.088 58.088 58.392 -0.304 18990 7380 1 10 . 1 1 473 473 ARG CB C 473 29.426 29.426 30.108 -0.682 18990 7381 1 10 . 1 1 474 474 ASP N N 474 119.900 119.900 121.228 -1.328 18990 7382 1 10 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.528 -0.313 18990 7383 1 10 . 1 1 474 474 ASP C C 474 178.197 178.197 176.637 1.560 18990 7384 1 10 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.451 0.351 18990 7385 1 10 . 1 1 474 474 ASP CB C 474 40.182 40.182 41.019 -0.837 18990 7386 1 10 . 1 1 474 474 ASP H H 474 7.718 7.718 8.182 -0.464 18990 7387 1 10 . 1 1 475 475 CYS N N 475 121.000 121.000 119.268 1.732 18990 7388 1 10 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.773 -1.406 18990 7389 1 10 . 1 1 475 475 CYS CA C 475 64.533 64.533 58.232 6.301 18990 7390 1 10 . 1 1 475 475 CYS CB C 475 29.092 29.092 25.576 3.516 18990 7391 1 10 . 1 1 475 475 CYS H H 475 6.953 6.953 8.579 -1.626 18990 7392 1 10 . 1 1 476 476 MET HA H 476 4.021 4.021 4.395 -0.374 18990 7393 1 10 . 1 1 476 476 MET CA C 476 58.010 58.010 57.082 0.928 18990 7394 1 10 . 1 1 476 476 MET CB C 476 32.550 32.550 34.191 -1.641 18990 7395 1 10 . 1 1 477 477 GLY N N 477 111.938 111.938 104.090 7.848 18990 7396 1 10 . 1 1 477 477 GLY C C 477 174.406 174.406 174.203 0.203 18990 7397 1 10 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.882 0.735 18990 7398 1 10 . 1 1 477 477 GLY H H 477 9.155 9.155 8.163 0.992 18990 7399 1 10 . 1 1 478 478 ALA N N 478 121.900 121.900 122.109 -0.209 18990 7400 1 10 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.472 -0.181 18990 7401 1 10 . 1 1 478 478 ALA C C 478 178.196 178.196 177.152 1.044 18990 7402 1 10 . 1 1 478 478 ALA CA C 478 53.440 53.440 53.905 -0.465 18990 7403 1 10 . 1 1 478 478 ALA CB C 478 20.390 20.390 19.155 1.235 18990 7404 1 10 . 1 1 478 478 ALA H H 478 7.347 7.347 8.262 -0.915 18990 7405 1 10 . 1 1 479 479 HIS N N 479 115.200 115.200 110.268 4.932 18990 7406 1 10 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.903 0.000 18990 7407 1 10 . 1 1 479 479 HIS C C 479 173.325 173.325 175.008 -1.683 18990 7408 1 10 . 1 1 479 479 HIS CA C 479 54.526 54.526 53.889 0.637 18990 7409 1 10 . 1 1 479 479 HIS CB C 479 27.600 27.600 29.089 -1.489 18990 7410 1 10 . 1 1 479 479 HIS H H 479 8.297 8.297 7.386 0.911 18990 7411 1 10 . 1 1 480 480 TRP N N 480 121.780 121.780 121.464 0.316 18990 7412 1 10 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.619 -0.324 18990 7413 1 10 . 1 1 480 480 TRP C C 480 175.568 175.568 175.474 0.094 18990 7414 1 10 . 1 1 480 480 TRP CA C 480 58.358 58.358 57.538 0.820 18990 7415 1 10 . 1 1 480 480 TRP CB C 480 29.550 29.550 29.461 0.089 18990 7416 1 10 . 1 1 480 480 TRP H H 480 8.081 8.081 7.345 0.736 18990 7417 1 10 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.395 0.450 18990 7418 1 10 . 1 1 481 481 PHE C C 481 175.126 175.126 176.085 -0.959 18990 7419 1 10 . 1 1 481 481 PHE CA C 481 56.471 56.471 59.082 -2.611 18990 7420 1 10 . 1 1 481 481 PHE CB C 481 41.006 41.006 38.803 2.203 18990 7421 1 11 . 1 1 343 343 GLU N N 343 121.045 121.045 124.907 -3.862 18990 7422 1 11 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.680 -0.515 18990 7423 1 11 . 1 1 343 343 GLU C C 343 176.529 176.529 175.527 1.002 18990 7424 1 11 . 1 1 343 343 GLU CA C 343 57.162 57.162 55.874 1.288 18990 7425 1 11 . 1 1 343 343 GLU CB C 343 30.204 30.204 30.663 -0.459 18990 7426 1 11 . 1 1 343 343 GLU H H 343 8.293 8.293 8.405 -0.112 18990 7427 1 11 . 1 1 344 344 TYR N N 344 121.000 121.000 122.182 -1.182 18990 7428 1 11 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.622 -0.084 18990 7429 1 11 . 1 1 344 344 TYR C C 344 175.897 175.897 175.467 0.430 18990 7430 1 11 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.694 0.485 18990 7431 1 11 . 1 1 344 344 TYR CB C 344 38.600 38.600 39.627 -1.027 18990 7432 1 11 . 1 1 344 344 TYR H H 344 8.040 8.040 8.721 -0.681 18990 7433 1 11 . 1 1 345 345 VAL N N 345 121.900 121.900 126.409 -4.509 18990 7434 1 11 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.367 -0.428 18990 7435 1 11 . 1 1 345 345 VAL C C 345 176.143 176.143 175.169 0.974 18990 7436 1 11 . 1 1 345 345 VAL CA C 345 62.867 62.867 61.864 1.003 18990 7437 1 11 . 1 1 345 345 VAL CB C 345 32.799 32.799 32.251 0.548 18990 7438 1 11 . 1 1 345 345 VAL H H 345 7.856 7.856 8.468 -0.612 18990 7439 1 11 . 1 1 346 346 LEU N N 346 124.950 124.950 126.862 -1.912 18990 7440 1 11 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.909 -0.666 18990 7441 1 11 . 1 1 346 346 LEU C C 346 177.747 177.747 175.723 2.024 18990 7442 1 11 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.438 1.062 18990 7443 1 11 . 1 1 346 346 LEU CB C 346 42.252 42.252 42.288 -0.036 18990 7444 1 11 . 1 1 346 346 LEU H H 346 8.127 8.127 8.458 -0.331 18990 7445 1 11 . 1 1 347 347 GLN N N 347 121.452 121.452 120.991 0.461 18990 7446 1 11 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.744 -0.458 18990 7447 1 11 . 1 1 347 347 GLN C C 347 175.833 175.833 173.828 2.005 18990 7448 1 11 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.105 0.883 18990 7449 1 11 . 1 1 347 347 GLN CB C 347 29.375 29.375 30.458 -1.083 18990 7450 1 11 . 1 1 347 347 GLN H H 347 8.270 8.270 8.391 -0.121 18990 7451 1 11 . 1 1 348 348 ALA N N 348 124.466 124.466 122.447 2.019 18990 7452 1 11 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.689 -0.368 18990 7453 1 11 . 1 1 348 348 ALA C C 348 177.929 177.929 176.205 1.724 18990 7454 1 11 . 1 1 348 348 ALA CA C 348 52.703 52.703 51.587 1.116 18990 7455 1 11 . 1 1 348 348 ALA CB C 348 19.002 19.002 20.413 -1.411 18990 7456 1 11 . 1 1 348 348 ALA H H 348 8.227 8.227 8.683 -0.456 18990 7457 1 11 . 1 1 349 349 GLY N N 349 108.193 108.193 109.866 -1.673 18990 7458 1 11 . 1 1 349 349 GLY C C 349 174.269 174.269 174.784 -0.515 18990 7459 1 11 . 1 1 349 349 GLY CA C 349 45.227 45.227 44.803 0.424 18990 7460 1 11 . 1 1 349 349 GLY H H 349 8.298 8.298 8.384 -0.086 18990 7461 1 11 . 1 1 350 350 GLY N N 350 108.073 108.073 109.830 -1.757 18990 7462 1 11 . 1 1 350 350 GLY C C 350 172.979 172.979 173.721 -0.742 18990 7463 1 11 . 1 1 350 350 GLY CA C 350 44.935 44.935 43.964 0.971 18990 7464 1 11 . 1 1 350 350 GLY H H 350 8.156 8.156 7.811 0.345 18990 7465 1 11 . 1 1 351 351 VAL N N 351 119.058 119.058 119.834 -0.776 18990 7466 1 11 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.357 0.059 18990 7467 1 11 . 1 1 351 351 VAL C C 351 173.412 173.412 174.800 -1.388 18990 7468 1 11 . 1 1 351 351 VAL CA C 351 60.663 60.663 61.588 -0.925 18990 7469 1 11 . 1 1 351 351 VAL CB C 351 34.866 34.866 33.840 1.026 18990 7470 1 11 . 1 1 351 351 VAL H H 351 8.541 8.541 8.005 0.536 18990 7471 1 11 . 1 1 352 352 LEU N N 352 125.800 125.800 121.326 4.474 18990 7472 1 11 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.690 0.075 18990 7473 1 11 . 1 1 352 352 LEU C C 352 176.218 176.218 176.347 -0.129 18990 7474 1 11 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.096 0.244 18990 7475 1 11 . 1 1 352 352 LEU CB C 352 42.706 42.706 43.884 -1.178 18990 7476 1 11 . 1 1 352 352 LEU H H 352 8.151 8.151 8.414 -0.263 18990 7477 1 11 . 1 1 353 353 CYS N N 353 126.825 126.825 124.436 2.389 18990 7478 1 11 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.159 -0.052 18990 7479 1 11 . 1 1 353 353 CYS C C 353 176.655 176.655 173.780 2.875 18990 7480 1 11 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.279 0.452 18990 7481 1 11 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.797 4.068 18990 7482 1 11 . 1 1 353 353 CYS H H 353 8.794 8.794 8.638 0.156 18990 7483 1 11 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.230 0.190 18990 7484 1 11 . 1 1 354 354 PRO C C 354 177.512 177.512 176.182 1.330 18990 7485 1 11 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.352 -0.360 18990 7486 1 11 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.790 0.777 18990 7487 1 11 . 1 1 355 355 GLN N N 355 126.800 126.800 118.519 8.281 18990 7488 1 11 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.302 -0.027 18990 7489 1 11 . 1 1 355 355 GLN C C 355 175.516 175.516 176.678 -1.162 18990 7490 1 11 . 1 1 355 355 GLN CA C 355 54.793 54.793 53.723 1.070 18990 7491 1 11 . 1 1 355 355 GLN CB C 355 28.547 28.547 27.804 0.743 18990 7492 1 11 . 1 1 355 355 GLN H H 355 9.033 9.033 7.232 1.801 18990 7493 1 11 . 1 1 357 357 GLY C C 357 173.229 173.229 174.582 -1.353 18990 7494 1 11 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.387 0.867 18990 7495 1 11 . 1 1 358 358 CYS N N 358 123.500 123.500 120.360 3.140 18990 7496 1 11 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.410 0.123 18990 7497 1 11 . 1 1 358 358 CYS C C 358 176.157 176.157 175.775 0.382 18990 7498 1 11 . 1 1 358 358 CYS CA C 358 60.268 60.268 59.648 0.620 18990 7499 1 11 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.678 0.697 18990 7500 1 11 . 1 1 358 358 CYS H H 358 7.720 7.720 7.316 0.404 18990 7501 1 11 . 1 1 359 359 GLY N N 359 104.400 104.400 109.913 -5.513 18990 7502 1 11 . 1 1 359 359 GLY C C 359 174.080 174.080 174.844 -0.764 18990 7503 1 11 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.101 -0.037 18990 7504 1 11 . 1 1 359 359 GLY H H 359 7.756 7.756 8.366 -0.610 18990 7505 1 11 . 1 1 360 360 MET N N 360 121.300 121.300 120.651 0.649 18990 7506 1 11 . 1 1 360 360 MET HA H 360 4.343 4.343 4.330 0.013 18990 7507 1 11 . 1 1 360 360 MET C C 360 175.641 175.641 176.910 -1.269 18990 7508 1 11 . 1 1 360 360 MET CA C 360 55.923 55.923 57.028 -1.105 18990 7509 1 11 . 1 1 360 360 MET CB C 360 33.091 33.091 34.186 -1.095 18990 7510 1 11 . 1 1 360 360 MET H H 360 8.229 8.229 7.627 0.602 18990 7511 1 11 . 1 1 361 361 GLY N N 361 109.000 109.000 106.090 2.910 18990 7512 1 11 . 1 1 361 361 GLY C C 361 173.774 173.774 172.770 1.004 18990 7513 1 11 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.526 1.312 18990 7514 1 11 . 1 1 361 361 GLY H H 361 8.347 8.347 8.060 0.287 18990 7515 1 11 . 1 1 362 362 LEU N N 362 126.725 126.725 123.873 2.852 18990 7516 1 11 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.928 -0.253 18990 7517 1 11 . 1 1 362 362 LEU C C 362 175.865 175.865 175.421 0.444 18990 7518 1 11 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.174 1.016 18990 7519 1 11 . 1 1 362 362 LEU CB C 362 44.050 44.050 44.966 -0.916 18990 7520 1 11 . 1 1 362 362 LEU H H 362 8.935 8.935 8.961 -0.026 18990 7521 1 11 . 1 1 363 363 LEU N N 363 123.742 123.742 124.505 -0.763 18990 7522 1 11 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.687 -0.010 18990 7523 1 11 . 1 1 363 363 LEU C C 363 176.162 176.162 175.411 0.751 18990 7524 1 11 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.184 0.157 18990 7525 1 11 . 1 1 363 363 LEU CB C 363 42.210 42.210 43.355 -1.145 18990 7526 1 11 . 1 1 363 363 LEU H H 363 8.481 8.481 8.612 -0.131 18990 7527 1 11 . 1 1 364 364 VAL N N 364 120.980 120.980 126.661 -5.681 18990 7528 1 11 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.241 0.156 18990 7529 1 11 . 1 1 364 364 VAL C C 364 175.592 175.592 175.251 0.341 18990 7530 1 11 . 1 1 364 364 VAL CA C 364 60.460 60.460 61.311 -0.851 18990 7531 1 11 . 1 1 364 364 VAL CB C 364 34.125 34.125 33.127 0.998 18990 7532 1 11 . 1 1 364 364 VAL H H 364 8.155 8.155 8.390 -0.235 18990 7533 1 11 . 1 1 365 365 GLU N N 365 126.950 126.950 128.431 -1.481 18990 7534 1 11 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.520 0.090 18990 7535 1 11 . 1 1 365 365 GLU C C 365 175.427 175.427 175.976 -0.549 18990 7536 1 11 . 1 1 365 365 GLU CA C 365 54.551 54.551 54.228 0.323 18990 7537 1 11 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.604 0.176 18990 7538 1 11 . 1 1 365 365 GLU H H 365 8.900 8.900 8.550 0.350 18990 7539 1 11 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.128 0.134 18990 7540 1 11 . 1 1 366 366 PRO C C 366 177.013 177.013 177.312 -0.299 18990 7541 1 11 . 1 1 366 366 PRO CA C 366 64.463 64.463 65.493 -1.030 18990 7542 1 11 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.965 0.083 18990 7543 1 11 . 1 1 367 367 ASP N N 367 115.459 115.459 113.439 2.020 18990 7544 1 11 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.520 -0.025 18990 7545 1 11 . 1 1 367 367 ASP C C 367 175.123 175.123 175.760 -0.637 18990 7546 1 11 . 1 1 367 367 ASP CA C 367 54.503 54.503 54.218 0.285 18990 7547 1 11 . 1 1 367 367 ASP CB C 367 40.123 40.123 40.260 -0.137 18990 7548 1 11 . 1 1 367 367 ASP H H 367 8.439 8.439 8.503 -0.064 18990 7549 1 11 . 1 1 368 368 CYS N N 368 118.700 118.700 118.787 -0.087 18990 7550 1 11 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.552 0.018 18990 7551 1 11 . 1 1 368 368 CYS C C 368 173.806 173.806 173.375 0.431 18990 7552 1 11 . 1 1 368 368 CYS CA C 368 58.581 58.581 58.102 0.479 18990 7553 1 11 . 1 1 368 368 CYS CB C 368 28.450 28.450 30.396 -1.946 18990 7554 1 11 . 1 1 368 368 CYS H H 368 7.515 7.515 7.823 -0.308 18990 7555 1 11 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.466 -0.201 18990 7556 1 11 . 1 1 369 369 ARG C C 369 174.908 174.908 175.330 -0.422 18990 7557 1 11 . 1 1 369 369 ARG CA C 369 57.669 57.669 55.046 2.623 18990 7558 1 11 . 1 1 369 369 ARG CB C 369 32.274 32.274 31.080 1.194 18990 7559 1 11 . 1 1 370 370 LYS N N 370 121.022 121.022 123.067 -2.045 18990 7560 1 11 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.271 -0.101 18990 7561 1 11 . 1 1 370 370 LYS C C 370 174.868 174.868 175.665 -0.797 18990 7562 1 11 . 1 1 370 370 LYS CA C 370 56.554 56.554 56.021 0.533 18990 7563 1 11 . 1 1 370 370 LYS CB C 370 33.140 33.140 31.582 1.558 18990 7564 1 11 . 1 1 370 370 LYS H H 370 7.740 7.740 7.568 0.172 18990 7565 1 11 . 1 1 371 371 VAL N N 371 128.362 128.362 125.525 2.837 18990 7566 1 11 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.347 -0.214 18990 7567 1 11 . 1 1 371 371 VAL C C 371 173.402 173.402 174.252 -0.850 18990 7568 1 11 . 1 1 371 371 VAL CA C 371 60.777 60.777 60.465 0.312 18990 7569 1 11 . 1 1 371 371 VAL CB C 371 33.000 33.000 31.556 1.444 18990 7570 1 11 . 1 1 371 371 VAL H H 371 8.647 8.647 7.905 0.742 18990 7571 1 11 . 1 1 372 372 THR N N 372 119.667 119.667 120.090 -0.423 18990 7572 1 11 . 1 1 372 372 THR HA H 372 5.032 5.032 4.790 0.242 18990 7573 1 11 . 1 1 372 372 THR C C 372 174.339 174.339 174.120 0.219 18990 7574 1 11 . 1 1 372 372 THR CA C 372 60.881 60.881 61.894 -1.013 18990 7575 1 11 . 1 1 372 372 THR CB C 372 70.471 70.471 71.825 -1.354 18990 7576 1 11 . 1 1 372 372 THR H H 372 8.087 8.087 8.286 -0.199 18990 7577 1 11 . 1 1 373 373 CYS N N 373 132.554 132.554 127.076 5.478 18990 7578 1 11 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.555 0.247 18990 7579 1 11 . 1 1 373 373 CYS C C 373 176.791 176.791 176.188 0.603 18990 7580 1 11 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.417 -0.913 18990 7581 1 11 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.804 3.507 18990 7582 1 11 . 1 1 373 373 CYS H H 373 9.322 9.322 9.625 -0.303 18990 7583 1 11 . 1 1 374 374 GLN N N 374 125.890 125.890 124.570 1.320 18990 7584 1 11 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.232 -0.232 18990 7585 1 11 . 1 1 374 374 GLN C C 374 176.827 176.827 176.537 0.290 18990 7586 1 11 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.962 0.338 18990 7587 1 11 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.815 0.849 18990 7588 1 11 . 1 1 374 374 GLN H H 374 7.856 7.856 8.680 -0.824 18990 7589 1 11 . 1 1 375 375 ASN N N 375 115.342 115.342 115.205 0.137 18990 7590 1 11 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.889 -0.002 18990 7591 1 11 . 1 1 375 375 ASN C C 375 174.049 174.049 174.497 -0.448 18990 7592 1 11 . 1 1 375 375 ASN CA C 375 53.047 53.047 53.007 0.040 18990 7593 1 11 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.080 -0.163 18990 7594 1 11 . 1 1 375 375 ASN H H 375 8.913 8.913 8.308 0.605 18990 7595 1 11 . 1 1 376 376 GLY N N 376 109.098 109.098 108.393 0.705 18990 7596 1 11 . 1 1 376 376 GLY C C 376 174.110 174.110 172.863 1.247 18990 7597 1 11 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.861 0.526 18990 7598 1 11 . 1 1 376 376 GLY H H 376 7.162 7.162 7.741 -0.579 18990 7599 1 11 . 1 1 377 377 CYS N N 377 132.546 132.546 122.142 10.404 18990 7600 1 11 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.807 -0.043 18990 7601 1 11 . 1 1 377 377 CYS C C 377 177.355 177.355 175.946 1.409 18990 7602 1 11 . 1 1 377 377 CYS CA C 377 59.988 59.988 56.547 3.441 18990 7603 1 11 . 1 1 377 377 CYS CB C 377 32.365 32.365 25.497 6.867 18990 7604 1 11 . 1 1 377 377 CYS H H 377 9.800 9.800 8.291 1.509 18990 7605 1 11 . 1 1 378 378 GLY N N 378 113.851 113.851 111.891 1.960 18990 7606 1 11 . 1 1 378 378 GLY C C 378 173.404 173.404 173.084 0.320 18990 7607 1 11 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.737 0.126 18990 7608 1 11 . 1 1 378 378 GLY H H 378 8.820 8.820 8.449 0.371 18990 7609 1 11 . 1 1 379 379 TYR N N 379 125.532 125.532 126.796 -1.264 18990 7610 1 11 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.777 -0.299 18990 7611 1 11 . 1 1 379 379 TYR C C 379 173.661 173.661 174.253 -0.592 18990 7612 1 11 . 1 1 379 379 TYR CA C 379 59.180 59.180 55.908 3.272 18990 7613 1 11 . 1 1 379 379 TYR CB C 379 40.108 40.108 42.212 -2.104 18990 7614 1 11 . 1 1 379 379 TYR H H 379 9.054 9.054 8.137 0.917 18990 7615 1 11 . 1 1 380 380 VAL N N 380 124.461 124.461 123.088 1.373 18990 7616 1 11 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.189 0.629 18990 7617 1 11 . 1 1 380 380 VAL C C 380 175.876 175.876 174.557 1.319 18990 7618 1 11 . 1 1 380 380 VAL CA C 380 60.797 60.797 61.722 -0.925 18990 7619 1 11 . 1 1 380 380 VAL CB C 380 32.610 32.610 31.557 1.053 18990 7620 1 11 . 1 1 380 380 VAL H H 380 7.238 7.238 7.723 -0.485 18990 7621 1 11 . 1 1 381 381 PHE N N 381 124.588 124.588 123.950 0.638 18990 7622 1 11 . 1 1 381 381 PHE HA H 381 5.273 5.273 5.112 0.161 18990 7623 1 11 . 1 1 381 381 PHE C C 381 173.242 173.242 173.136 0.106 18990 7624 1 11 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.895 -0.685 18990 7625 1 11 . 1 1 381 381 PHE CB C 381 42.090 42.090 39.946 2.144 18990 7626 1 11 . 1 1 381 381 PHE H H 381 9.424 9.424 7.876 1.548 18990 7627 1 11 . 1 1 382 382 CYS N N 382 120.221 120.221 119.720 0.501 18990 7628 1 11 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.779 0.123 18990 7629 1 11 . 1 1 382 382 CYS C C 382 177.165 177.165 175.680 1.485 18990 7630 1 11 . 1 1 382 382 CYS CA C 382 57.691 57.691 56.746 0.945 18990 7631 1 11 . 1 1 382 382 CYS CB C 382 32.475 32.475 30.866 1.609 18990 7632 1 11 . 1 1 382 382 CYS H H 382 8.673 8.673 8.313 0.360 18990 7633 1 11 . 1 1 383 383 ARG N N 383 129.347 129.347 119.775 9.572 18990 7634 1 11 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.249 -0.228 18990 7635 1 11 . 1 1 383 383 ARG C C 383 175.012 175.012 176.962 -1.950 18990 7636 1 11 . 1 1 383 383 ARG CA C 383 58.686 58.686 58.522 0.165 18990 7637 1 11 . 1 1 383 383 ARG CB C 383 30.900 30.900 30.318 0.582 18990 7638 1 11 . 1 1 383 383 ARG H H 383 9.534 9.534 8.622 0.912 18990 7639 1 11 . 1 1 384 384 ASN N N 384 117.772 117.772 116.911 0.861 18990 7640 1 11 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.862 -0.154 18990 7641 1 11 . 1 1 384 384 ASN C C 384 175.656 175.656 174.627 1.029 18990 7642 1 11 . 1 1 384 384 ASN CA C 384 55.778 55.778 53.610 2.168 18990 7643 1 11 . 1 1 384 384 ASN CB C 384 39.475 39.475 39.793 -0.318 18990 7644 1 11 . 1 1 384 384 ASN H H 384 8.840 8.840 8.371 0.469 18990 7645 1 11 . 1 1 385 385 CYS N N 385 115.876 115.876 113.624 2.252 18990 7646 1 11 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.901 0.127 18990 7647 1 11 . 1 1 385 385 CYS C C 385 175.703 175.703 173.447 2.256 18990 7648 1 11 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.899 1.213 18990 7649 1 11 . 1 1 385 385 CYS CB C 385 32.359 32.359 30.683 1.676 18990 7650 1 11 . 1 1 385 385 CYS H H 385 7.868 7.868 7.643 0.225 18990 7651 1 11 . 1 1 386 386 LEU N N 386 120.082 120.082 120.448 -0.366 18990 7652 1 11 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.865 -0.552 18990 7653 1 11 . 1 1 386 386 LEU C C 386 175.722 175.722 177.013 -1.291 18990 7654 1 11 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.729 2.280 18990 7655 1 11 . 1 1 386 386 LEU CB C 386 38.412 38.412 41.338 -2.926 18990 7656 1 11 . 1 1 386 386 LEU H H 386 8.514 8.514 8.568 -0.054 18990 7657 1 11 . 1 1 387 387 GLN N N 387 117.579 117.579 119.487 -1.908 18990 7658 1 11 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.368 0.408 18990 7659 1 11 . 1 1 387 387 GLN C C 387 175.299 175.299 176.458 -1.159 18990 7660 1 11 . 1 1 387 387 GLN CA C 387 54.017 54.017 56.049 -2.032 18990 7661 1 11 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.791 1.516 18990 7662 1 11 . 1 1 387 387 GLN H H 387 8.248 8.248 7.973 0.275 18990 7663 1 11 . 1 1 388 388 GLY N N 388 106.107 106.107 106.815 -0.708 18990 7664 1 11 . 1 1 388 388 GLY C C 388 173.693 173.693 174.284 -0.591 18990 7665 1 11 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.042 1.138 18990 7666 1 11 . 1 1 388 388 GLY H H 388 8.695 8.695 8.293 0.402 18990 7667 1 11 . 1 1 389 389 TYR N N 389 122.514 122.514 117.408 5.106 18990 7668 1 11 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.056 -0.398 18990 7669 1 11 . 1 1 389 389 TYR C C 389 172.860 172.860 174.015 -1.155 18990 7670 1 11 . 1 1 389 389 TYR CA C 389 62.987 62.987 59.193 3.794 18990 7671 1 11 . 1 1 389 389 TYR CB C 389 38.052 38.052 38.110 -0.058 18990 7672 1 11 . 1 1 389 389 TYR H H 389 7.923 7.923 8.123 -0.200 18990 7673 1 11 . 1 1 390 390 HIS N N 390 120.080 120.080 124.231 -4.151 18990 7674 1 11 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.752 -0.044 18990 7675 1 11 . 1 1 390 390 HIS C C 390 173.235 173.235 173.063 0.172 18990 7676 1 11 . 1 1 390 390 HIS CA C 390 51.431 51.431 54.049 -2.618 18990 7677 1 11 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.439 0.461 18990 7678 1 11 . 1 1 390 390 HIS H H 390 5.291 5.291 7.525 -2.234 18990 7679 1 11 . 1 1 391 391 ILE N N 391 117.810 117.810 121.319 -3.509 18990 7680 1 11 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.149 -0.033 18990 7681 1 11 . 1 1 391 391 ILE C C 391 178.208 178.208 176.506 1.702 18990 7682 1 11 . 1 1 391 391 ILE CA C 391 60.877 60.877 60.903 -0.026 18990 7683 1 11 . 1 1 391 391 ILE CB C 391 39.034 39.034 38.285 0.749 18990 7684 1 11 . 1 1 391 391 ILE H H 391 8.418 8.418 8.450 -0.032 18990 7685 1 11 . 1 1 392 392 GLY N N 392 112.387 112.387 114.456 -2.069 18990 7686 1 11 . 1 1 392 392 GLY C C 392 173.565 173.565 174.023 -0.458 18990 7687 1 11 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.565 0.693 18990 7688 1 11 . 1 1 392 392 GLY H H 392 8.654 8.654 8.310 0.344 18990 7689 1 11 . 1 1 393 393 GLU N N 393 119.098 119.098 119.846 -0.748 18990 7690 1 11 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.594 -0.305 18990 7691 1 11 . 1 1 393 393 GLU C C 393 176.899 176.899 175.951 0.948 18990 7692 1 11 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.347 1.086 18990 7693 1 11 . 1 1 393 393 GLU CB C 393 30.470 30.470 31.200 -0.730 18990 7694 1 11 . 1 1 393 393 GLU H H 393 8.391 8.391 8.343 0.048 18990 7695 1 11 . 1 1 394 394 CYS N N 394 122.845 122.845 117.591 5.254 18990 7696 1 11 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.503 -0.737 18990 7697 1 11 . 1 1 394 394 CYS C C 394 175.461 175.461 174.517 0.944 18990 7698 1 11 . 1 1 394 394 CYS CA C 394 59.835 59.835 59.061 0.774 18990 7699 1 11 . 1 1 394 394 CYS CB C 394 30.761 30.761 27.720 3.041 18990 7700 1 11 . 1 1 394 394 CYS H H 394 8.474 8.474 8.360 0.114 18990 7701 1 11 . 1 1 395 395 LEU N N 395 124.403 124.403 123.134 1.269 18990 7702 1 11 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.654 -0.150 18990 7703 1 11 . 1 1 395 395 LEU C C 395 175.259 175.259 176.011 -0.752 18990 7704 1 11 . 1 1 395 395 LEU CA C 395 52.835 52.835 53.531 -0.696 18990 7705 1 11 . 1 1 395 395 LEU CB C 395 41.436 41.436 40.427 1.009 18990 7706 1 11 . 1 1 395 395 LEU H H 395 8.418 8.418 7.941 0.477 18990 7707 1 11 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.738 -0.368 18990 7708 1 11 . 1 1 396 396 PRO C C 396 177.006 177.006 176.767 0.239 18990 7709 1 11 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.647 0.449 18990 7710 1 11 . 1 1 396 396 PRO CB C 396 32.072 32.072 33.501 -1.429 18990 7711 1 11 . 1 1 397 397 GLU N N 397 121.574 121.574 119.558 2.016 18990 7712 1 11 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.320 -0.095 18990 7713 1 11 . 1 1 397 397 GLU C C 397 177.202 177.202 176.916 0.286 18990 7714 1 11 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.447 0.587 18990 7715 1 11 . 1 1 397 397 GLU CB C 397 30.263 30.263 29.979 0.284 18990 7716 1 11 . 1 1 397 397 GLU H H 397 8.568 8.568 8.595 -0.027 18990 7717 1 11 . 1 1 398 398 GLY N N 398 110.495 110.495 111.436 -0.941 18990 7718 1 11 . 1 1 398 398 GLY C C 398 174.579 174.579 173.743 0.836 18990 7719 1 11 . 1 1 398 398 GLY CA C 398 45.462 45.462 45.012 0.450 18990 7720 1 11 . 1 1 398 398 GLY H H 398 8.515 8.515 8.198 0.317 18990 7721 1 11 . 1 1 399 399 THR N N 399 113.234 113.234 116.274 -3.040 18990 7722 1 11 . 1 1 399 399 THR HA H 399 4.398 4.398 4.499 -0.101 18990 7723 1 11 . 1 1 399 399 THR C C 399 175.333 175.333 174.415 0.918 18990 7724 1 11 . 1 1 399 399 THR CA C 399 62.233 62.233 62.348 -0.115 18990 7725 1 11 . 1 1 399 399 THR CB C 399 69.833 69.833 69.489 0.344 18990 7726 1 11 . 1 1 399 399 THR H H 399 8.090 8.090 8.026 0.064 18990 7727 1 11 . 1 1 400 400 GLY N N 400 111.479 111.479 112.648 -1.169 18990 7728 1 11 . 1 1 400 400 GLY C C 400 174.048 174.048 173.458 0.590 18990 7729 1 11 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.178 0.261 18990 7730 1 11 . 1 1 400 400 GLY H H 400 8.524 8.524 8.448 0.076 18990 7731 1 11 . 1 1 401 401 ALA N N 401 123.919 123.919 127.387 -3.468 18990 7732 1 11 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.499 -0.248 18990 7733 1 11 . 1 1 401 401 ALA C C 401 177.942 177.942 177.118 0.824 18990 7734 1 11 . 1 1 401 401 ALA CA C 401 52.730 52.730 52.464 0.266 18990 7735 1 11 . 1 1 401 401 ALA CB C 401 19.142 19.142 19.436 -0.294 18990 7736 1 11 . 1 1 401 401 ALA H H 401 8.179 8.179 8.479 -0.300 18990 7737 1 11 . 1 1 402 402 SER N N 402 114.904 114.904 114.438 0.466 18990 7738 1 11 . 1 1 402 402 SER HA H 402 4.448 4.448 4.257 0.191 18990 7739 1 11 . 1 1 402 402 SER C C 402 174.426 174.426 173.480 0.946 18990 7740 1 11 . 1 1 402 402 SER CA C 402 58.289 58.289 58.361 -0.072 18990 7741 1 11 . 1 1 402 402 SER CB C 402 63.772 63.772 62.461 1.311 18990 7742 1 11 . 1 1 402 402 SER H H 402 8.305 8.305 8.131 0.174 18990 7743 1 11 . 1 1 403 403 ALA N N 403 125.965 125.965 126.178 -0.213 18990 7744 1 11 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.553 -0.154 18990 7745 1 11 . 1 1 403 403 ALA C C 403 177.984 177.984 176.215 1.769 18990 7746 1 11 . 1 1 403 403 ALA CA C 403 52.655 52.655 52.329 0.326 18990 7747 1 11 . 1 1 403 403 ALA CB C 403 19.138 19.138 20.311 -1.173 18990 7748 1 11 . 1 1 403 403 ALA H H 403 8.345 8.345 8.032 0.313 18990 7749 1 11 . 1 1 404 404 THR N N 404 112.790 112.790 115.923 -3.133 18990 7750 1 11 . 1 1 404 404 THR C C 404 174.420 174.420 173.113 1.307 18990 7751 1 11 . 1 1 404 404 THR CA C 404 61.988 61.988 62.391 -0.403 18990 7752 1 11 . 1 1 404 404 THR CB C 404 69.688 69.688 69.562 0.126 18990 7753 1 11 . 1 1 404 404 THR H H 404 8.118 8.118 8.174 -0.056 18990 7754 1 11 . 1 1 405 405 ASN N N 405 121.050 121.050 121.543 -0.493 18990 7755 1 11 . 1 1 405 405 ASN H H 405 8.396 8.396 8.783 -0.387 18990 7756 1 11 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.290 0.288 18990 7757 1 11 . 1 1 407 407 CYS C C 407 174.489 174.489 173.532 0.957 18990 7758 1 11 . 1 1 407 407 CYS CA C 407 58.713 58.713 59.663 -0.949 18990 7759 1 11 . 1 1 407 407 CYS CB C 407 28.102 28.102 27.235 0.867 18990 7760 1 11 . 1 1 408 408 GLU N N 408 123.021 123.021 124.884 -1.863 18990 7761 1 11 . 1 1 408 408 GLU C C 408 175.954 175.954 174.739 1.215 18990 7762 1 11 . 1 1 408 408 GLU CA C 408 56.802 56.802 55.889 0.913 18990 7763 1 11 . 1 1 408 408 GLU CB C 408 30.328 30.328 31.080 -0.752 18990 7764 1 11 . 1 1 408 408 GLU H H 408 8.415 8.415 8.255 0.160 18990 7765 1 11 . 1 1 409 409 TYR N N 409 121.015 121.015 122.136 -1.121 18990 7766 1 11 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.636 0.018 18990 7767 1 11 . 1 1 409 409 TYR C C 409 175.613 175.613 174.114 1.499 18990 7768 1 11 . 1 1 409 409 TYR CA C 409 57.669 57.669 58.761 -1.092 18990 7769 1 11 . 1 1 409 409 TYR CB C 409 38.825 38.825 39.810 -0.985 18990 7770 1 11 . 1 1 409 409 TYR H H 409 8.135 8.135 8.444 -0.309 18990 7771 1 11 . 1 1 410 410 THR N N 410 116.975 116.975 120.379 -3.404 18990 7772 1 11 . 1 1 410 410 THR HA H 410 4.306 4.306 4.511 -0.205 18990 7773 1 11 . 1 1 410 410 THR C C 410 173.846 173.846 172.214 1.632 18990 7774 1 11 . 1 1 410 410 THR CA C 410 61.730 61.730 60.617 1.113 18990 7775 1 11 . 1 1 410 410 THR CB C 410 69.914 69.914 69.750 0.164 18990 7776 1 11 . 1 1 410 410 THR H H 410 8.060 8.060 7.763 0.297 18990 7777 1 11 . 1 1 411 411 VAL N N 411 122.900 122.900 120.131 2.769 18990 7778 1 11 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.322 -0.269 18990 7779 1 11 . 1 1 411 411 VAL C C 411 175.275 175.275 174.678 0.597 18990 7780 1 11 . 1 1 411 411 VAL CA C 411 61.853 61.853 60.983 0.870 18990 7781 1 11 . 1 1 411 411 VAL CB C 411 32.976 32.976 33.515 -0.539 18990 7782 1 11 . 1 1 411 411 VAL H H 411 8.089 8.089 8.074 0.015 18990 7783 1 11 . 1 1 412 412 ASP N N 412 125.924 125.924 124.061 1.863 18990 7784 1 11 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.899 -0.049 18990 7785 1 11 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.409 -0.831 18990 7786 1 11 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.197 0.341 18990 7787 1 11 . 1 1 412 412 ASP H H 412 8.397 8.397 8.104 0.293 18990 7788 1 11 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.799 -0.413 18990 7789 1 11 . 1 1 413 413 PRO C C 413 177.352 177.352 175.563 1.789 18990 7790 1 11 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.340 1.571 18990 7791 1 11 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.959 -0.691 18990 7792 1 11 . 1 1 414 414 ASN N N 414 117.035 117.035 118.553 -1.518 18990 7793 1 11 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.793 -0.116 18990 7794 1 11 . 1 1 414 414 ASN C C 414 175.532 175.532 173.613 1.919 18990 7795 1 11 . 1 1 414 414 ASN CA C 414 53.824 53.824 52.635 1.189 18990 7796 1 11 . 1 1 414 414 ASN CB C 414 38.728 38.728 40.331 -1.603 18990 7797 1 11 . 1 1 414 414 ASN H H 414 8.496 8.496 8.370 0.126 18990 7798 1 11 . 1 1 415 415 ARG N N 415 121.000 121.000 121.350 -0.350 18990 7799 1 11 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.679 -0.435 18990 7800 1 11 . 1 1 415 415 ARG C C 415 176.243 176.243 174.530 1.713 18990 7801 1 11 . 1 1 415 415 ARG CA C 415 56.404 56.404 56.683 -0.279 18990 7802 1 11 . 1 1 415 415 ARG CB C 415 30.637 30.637 31.517 -0.880 18990 7803 1 11 . 1 1 415 415 ARG H H 415 7.804 7.804 8.648 -0.844 18990 7804 1 11 . 1 1 416 416 ALA N N 416 124.880 124.880 126.102 -1.222 18990 7805 1 11 . 1 1 416 416 ALA C C 416 177.831 177.831 175.435 2.396 18990 7806 1 11 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.975 0.982 18990 7807 1 11 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.098 -1.039 18990 7808 1 11 . 1 1 416 416 ALA H H 416 8.189 8.189 8.480 -0.291 18990 7809 1 11 . 1 1 417 417 ALA N N 417 122.614 122.614 125.355 -2.741 18990 7810 1 11 . 1 1 417 417 ALA HA H 417 4.247 4.247 5.001 -0.754 18990 7811 1 11 . 1 1 417 417 ALA C C 417 178.024 178.024 176.144 1.880 18990 7812 1 11 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.883 0.907 18990 7813 1 11 . 1 1 417 417 ALA CB C 417 19.042 19.042 20.448 -1.406 18990 7814 1 11 . 1 1 417 417 ALA H H 417 8.169 8.169 8.874 -0.705 18990 7815 1 11 . 1 1 418 418 GLU N N 418 119.500 119.500 121.569 -2.069 18990 7816 1 11 . 1 1 418 418 GLU HA H 418 4.189 4.189 5.147 -0.958 18990 7817 1 11 . 1 1 418 418 GLU C C 418 176.266 176.266 174.885 1.381 18990 7818 1 11 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.529 1.047 18990 7819 1 11 . 1 1 418 418 GLU CB C 418 30.307 30.307 32.108 -1.801 18990 7820 1 11 . 1 1 418 418 GLU H H 418 8.184 8.184 9.207 -1.023 18990 7821 1 11 . 1 1 419 419 ALA N N 419 124.643 124.643 125.355 -0.712 18990 7822 1 11 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.891 -0.641 18990 7823 1 11 . 1 1 419 419 ALA C C 419 177.488 177.488 175.741 1.747 18990 7824 1 11 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.195 1.314 18990 7825 1 11 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.811 -1.650 18990 7826 1 11 . 1 1 419 419 ALA H H 419 8.135 8.135 8.564 -0.429 18990 7827 1 11 . 1 1 420 420 ARG N N 420 120.003 120.003 120.923 -0.920 18990 7828 1 11 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.406 -0.113 18990 7829 1 11 . 1 1 420 420 ARG C C 420 176.297 176.297 174.140 2.157 18990 7830 1 11 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.652 0.281 18990 7831 1 11 . 1 1 420 420 ARG CB C 420 30.850 30.850 32.414 -1.564 18990 7832 1 11 . 1 1 420 420 ARG H H 420 8.135 8.135 8.027 0.108 18990 7833 1 11 . 1 1 421 421 TRP N N 421 122.280 122.280 123.072 -0.792 18990 7834 1 11 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.866 -0.203 18990 7835 1 11 . 1 1 421 421 TRP C C 421 175.856 175.856 175.851 0.005 18990 7836 1 11 . 1 1 421 421 TRP CA C 421 57.404 57.404 57.127 0.277 18990 7837 1 11 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.849 -1.412 18990 7838 1 11 . 1 1 421 421 TRP H H 421 8.159 8.159 8.429 -0.270 18990 7839 1 11 . 1 1 422 422 ASP N N 422 121.980 121.980 122.477 -0.497 18990 7840 1 11 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.811 -0.316 18990 7841 1 11 . 1 1 422 422 ASP C C 422 176.184 176.184 176.007 0.177 18990 7842 1 11 . 1 1 422 422 ASP CA C 422 53.899 53.899 54.099 -0.200 18990 7843 1 11 . 1 1 422 422 ASP CB C 422 40.948 40.948 42.463 -1.515 18990 7844 1 11 . 1 1 422 422 ASP H H 422 8.135 8.135 8.637 -0.502 18990 7845 1 11 . 1 1 423 423 GLU N N 423 121.990 121.990 122.171 -0.181 18990 7846 1 11 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.322 -0.232 18990 7847 1 11 . 1 1 423 423 GLU C C 423 176.720 176.720 176.368 0.352 18990 7848 1 11 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.668 0.501 18990 7849 1 11 . 1 1 423 423 GLU CB C 423 30.156 30.156 29.790 0.366 18990 7850 1 11 . 1 1 423 423 GLU H H 423 8.153 8.153 8.901 -0.748 18990 7851 1 11 . 1 1 424 424 ALA N N 424 123.900 123.900 123.797 0.103 18990 7852 1 11 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.260 0.020 18990 7853 1 11 . 1 1 424 424 ALA C C 424 178.095 178.095 177.617 0.478 18990 7854 1 11 . 1 1 424 424 ALA CA C 424 53.017 53.017 52.963 0.054 18990 7855 1 11 . 1 1 424 424 ALA CB C 424 19.086 19.086 18.705 0.381 18990 7856 1 11 . 1 1 424 424 ALA H H 424 8.243 8.243 7.863 0.380 18990 7857 1 11 . 1 1 425 425 SER N N 425 113.881 113.881 117.278 -3.397 18990 7858 1 11 . 1 1 425 425 SER HA H 425 4.387 4.387 4.579 -0.192 18990 7859 1 11 . 1 1 425 425 SER C C 425 174.338 174.338 172.264 2.074 18990 7860 1 11 . 1 1 425 425 SER CA C 425 58.546 58.546 57.945 0.601 18990 7861 1 11 . 1 1 425 425 SER CB C 425 63.784 63.784 64.357 -0.573 18990 7862 1 11 . 1 1 425 425 SER H H 425 8.063 8.063 8.692 -0.629 18990 7863 1 11 . 1 1 426 426 ASN N N 426 121.032 121.032 123.737 -2.705 18990 7864 1 11 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.939 -0.233 18990 7865 1 11 . 1 1 426 426 ASN C C 426 175.046 175.046 173.212 1.834 18990 7866 1 11 . 1 1 426 426 ASN CA C 426 53.445 53.445 52.935 0.510 18990 7867 1 11 . 1 1 426 426 ASN CB C 426 38.847 38.847 40.093 -1.246 18990 7868 1 11 . 1 1 426 426 ASN H H 426 8.391 8.391 8.590 -0.199 18990 7869 1 11 . 1 1 427 427 VAL N N 427 119.463 119.463 123.216 -3.753 18990 7870 1 11 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.296 -0.103 18990 7871 1 11 . 1 1 427 427 VAL C C 427 176.213 176.213 175.182 1.031 18990 7872 1 11 . 1 1 427 427 VAL CA C 427 62.449 62.449 62.000 0.449 18990 7873 1 11 . 1 1 427 427 VAL CB C 427 32.865 32.865 33.127 -0.262 18990 7874 1 11 . 1 1 427 427 VAL H H 427 7.954 7.954 8.362 -0.408 18990 7875 1 11 . 1 1 428 428 THR N N 428 118.226 118.226 122.053 -3.827 18990 7876 1 11 . 1 1 428 428 THR HA H 428 4.353 4.353 4.675 -0.322 18990 7877 1 11 . 1 1 428 428 THR C C 428 174.361 174.361 173.297 1.064 18990 7878 1 11 . 1 1 428 428 THR CA C 428 62.065 62.065 62.212 -0.147 18990 7879 1 11 . 1 1 428 428 THR CB C 428 69.729 69.729 69.877 -0.149 18990 7880 1 11 . 1 1 428 428 THR H H 428 8.225 8.225 8.405 -0.180 18990 7881 1 11 . 1 1 429 429 ILE N N 429 123.910 123.910 121.422 2.488 18990 7882 1 11 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.445 -0.257 18990 7883 1 11 . 1 1 429 429 ILE C C 429 175.774 175.774 174.588 1.186 18990 7884 1 11 . 1 1 429 429 ILE CA C 429 60.819 60.819 59.440 1.379 18990 7885 1 11 . 1 1 429 429 ILE CB C 429 38.719 38.719 39.389 -0.669 18990 7886 1 11 . 1 1 429 429 ILE H H 429 8.148 8.148 8.102 0.046 18990 7887 1 11 . 1 1 430 430 LYS N N 430 126.453 126.453 123.289 3.164 18990 7888 1 11 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.577 -0.143 18990 7889 1 11 . 1 1 430 430 LYS C C 430 176.241 176.241 176.102 0.139 18990 7890 1 11 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.233 0.704 18990 7891 1 11 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.290 -0.126 18990 7892 1 11 . 1 1 430 430 LYS H H 430 8.406 8.406 8.410 -0.004 18990 7893 1 11 . 1 1 431 431 VAL N N 431 122.496 122.496 127.078 -4.582 18990 7894 1 11 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.003 0.277 18990 7895 1 11 . 1 1 431 431 VAL CA C 431 62.303 62.303 63.546 -1.243 18990 7896 1 11 . 1 1 431 431 VAL CB C 431 33.132 33.132 32.240 0.892 18990 7897 1 11 . 1 1 431 431 VAL H H 431 8.312 8.312 8.784 -0.472 18990 7898 1 11 . 1 1 432 432 SER HA H 432 4.486 4.486 4.751 -0.265 18990 7899 1 11 . 1 1 432 432 SER C C 432 173.834 173.834 173.119 0.715 18990 7900 1 11 . 1 1 432 432 SER CA C 432 58.650 58.650 58.245 0.406 18990 7901 1 11 . 1 1 432 432 SER CB C 432 64.152 64.152 64.013 0.139 18990 7902 1 11 . 1 1 433 433 THR N N 433 114.706 114.706 112.625 2.081 18990 7903 1 11 . 1 1 433 433 THR HA H 433 5.446 5.446 4.873 0.573 18990 7904 1 11 . 1 1 433 433 THR C C 433 173.979 173.979 174.647 -0.668 18990 7905 1 11 . 1 1 433 433 THR CA C 433 60.412 60.412 60.397 0.015 18990 7906 1 11 . 1 1 433 433 THR CB C 433 71.896 71.896 69.881 2.015 18990 7907 1 11 . 1 1 433 433 THR H H 433 7.833 7.833 7.505 0.328 18990 7908 1 11 . 1 1 434 434 LYS N N 434 122.492 122.492 126.342 -3.850 18990 7909 1 11 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.863 -0.154 18990 7910 1 11 . 1 1 434 434 LYS C C 434 173.589 173.589 174.584 -0.995 18990 7911 1 11 . 1 1 434 434 LYS CA C 434 54.375 54.375 53.213 1.162 18990 7912 1 11 . 1 1 434 434 LYS CB C 434 36.925 36.925 32.983 3.942 18990 7913 1 11 . 1 1 434 434 LYS H H 434 8.937 8.937 8.489 0.448 18990 7914 1 11 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.841 -0.574 18990 7915 1 11 . 1 1 435 435 PRO C C 435 175.238 175.238 176.580 -1.342 18990 7916 1 11 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.003 -1.080 18990 7917 1 11 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.724 -0.638 18990 7918 1 11 . 1 1 436 436 CYS N N 436 125.422 125.422 126.007 -0.585 18990 7919 1 11 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.430 -1.000 18990 7920 1 11 . 1 1 436 436 CYS C C 436 176.770 176.770 175.818 0.952 18990 7921 1 11 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.993 0.023 18990 7922 1 11 . 1 1 436 436 CYS CB C 436 31.698 31.698 28.164 3.534 18990 7923 1 11 . 1 1 436 436 CYS H H 436 7.768 7.768 8.674 -0.906 18990 7924 1 11 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.133 -0.275 18990 7925 1 11 . 1 1 437 437 PRO C C 437 173.608 173.608 176.604 -2.996 18990 7926 1 11 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.377 -0.164 18990 7927 1 11 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.572 0.877 18990 7928 1 11 . 1 1 438 438 LYS N N 438 118.600 118.600 117.721 0.879 18990 7929 1 11 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.148 -0.178 18990 7930 1 11 . 1 1 438 438 LYS C C 438 176.887 176.887 177.944 -1.057 18990 7931 1 11 . 1 1 438 438 LYS CA C 438 57.687 57.687 58.113 -0.426 18990 7932 1 11 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.236 -0.112 18990 7933 1 11 . 1 1 438 438 LYS H H 438 8.390 8.390 7.640 0.750 18990 7934 1 11 . 1 1 439 439 CYS N N 439 118.950 118.950 114.815 4.135 18990 7935 1 11 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.686 0.060 18990 7936 1 11 . 1 1 439 439 CYS C C 439 176.650 176.650 174.937 1.713 18990 7937 1 11 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.959 1.389 18990 7938 1 11 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.314 2.882 18990 7939 1 11 . 1 1 439 439 CYS H H 439 8.357 8.357 7.762 0.595 18990 7940 1 11 . 1 1 440 440 ARG N N 440 117.200 117.200 117.892 -0.692 18990 7941 1 11 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.188 -0.220 18990 7942 1 11 . 1 1 440 440 ARG C C 440 175.253 175.253 175.883 -0.630 18990 7943 1 11 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.838 0.062 18990 7944 1 11 . 1 1 440 440 ARG CB C 440 26.041 26.041 26.720 -0.679 18990 7945 1 11 . 1 1 440 440 ARG H H 440 8.065 8.065 8.129 -0.064 18990 7946 1 11 . 1 1 441 441 THR N N 441 122.400 122.400 111.460 10.940 18990 7947 1 11 . 1 1 441 441 THR HA H 441 4.371 4.371 4.680 -0.309 18990 7948 1 11 . 1 1 441 441 THR C C 441 173.702 173.702 173.206 0.496 18990 7949 1 11 . 1 1 441 441 THR CA C 441 63.194 63.194 59.090 4.104 18990 7950 1 11 . 1 1 441 441 THR CB C 441 68.933 68.933 69.762 -0.829 18990 7951 1 11 . 1 1 441 441 THR H H 441 8.643 8.643 7.522 1.121 18990 7952 1 11 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.642 -0.495 18990 7953 1 11 . 1 1 442 442 PRO C C 442 176.215 176.215 176.342 -0.127 18990 7954 1 11 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.781 1.416 18990 7955 1 11 . 1 1 442 442 PRO CB C 442 32.044 32.044 31.167 0.877 18990 7956 1 11 . 1 1 443 443 THR N N 443 122.932 122.932 122.429 0.503 18990 7957 1 11 . 1 1 443 443 THR HA H 443 4.665 4.665 4.538 0.127 18990 7958 1 11 . 1 1 443 443 THR C C 443 172.133 172.133 173.719 -1.586 18990 7959 1 11 . 1 1 443 443 THR CA C 443 62.566 62.566 62.263 0.303 18990 7960 1 11 . 1 1 443 443 THR CB C 443 71.562 71.562 69.546 2.016 18990 7961 1 11 . 1 1 443 443 THR H H 443 9.116 9.116 9.083 0.033 18990 7962 1 11 . 1 1 444 444 GLU N N 444 126.390 126.390 126.339 0.051 18990 7963 1 11 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.680 0.262 18990 7964 1 11 . 1 1 444 444 GLU C C 444 175.292 175.292 176.133 -0.841 18990 7965 1 11 . 1 1 444 444 GLU CA C 444 55.049 55.049 54.497 0.552 18990 7966 1 11 . 1 1 444 444 GLU CB C 444 31.861 31.861 32.175 -0.314 18990 7967 1 11 . 1 1 444 444 GLU H H 444 8.720 8.720 8.608 0.112 18990 7968 1 11 . 1 1 445 445 ARG N N 445 123.505 123.505 126.411 -2.906 18990 7969 1 11 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.281 -0.570 18990 7970 1 11 . 1 1 445 445 ARG C C 445 175.289 175.289 175.005 0.284 18990 7971 1 11 . 1 1 445 445 ARG CA C 445 55.856 55.856 55.928 -0.072 18990 7972 1 11 . 1 1 445 445 ARG CB C 445 30.675 30.675 29.425 1.250 18990 7973 1 11 . 1 1 445 445 ARG H H 445 8.157 8.157 8.554 -0.397 18990 7974 1 11 . 1 1 446 446 ASP N N 446 126.800 126.800 125.299 1.501 18990 7975 1 11 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.646 -0.005 18990 7976 1 11 . 1 1 446 446 ASP C C 446 176.020 176.020 176.514 -0.494 18990 7977 1 11 . 1 1 446 446 ASP CA C 446 52.952 52.952 54.420 -1.468 18990 7978 1 11 . 1 1 446 446 ASP CB C 446 41.400 41.400 42.225 -0.825 18990 7979 1 11 . 1 1 446 446 ASP H H 446 8.476 8.476 8.008 0.468 18990 7980 1 11 . 1 1 447 447 GLY N N 447 111.262 111.262 111.987 -0.725 18990 7981 1 11 . 1 1 447 447 GLY C C 447 174.073 174.073 173.262 0.811 18990 7982 1 11 . 1 1 447 447 GLY CA C 447 45.832 45.832 45.306 0.526 18990 7983 1 11 . 1 1 447 447 GLY H H 447 8.056 8.056 8.647 -0.591 18990 7984 1 11 . 1 1 448 448 GLY N N 448 108.655 108.655 106.591 2.064 18990 7985 1 11 . 1 1 448 448 GLY C C 448 174.020 174.020 173.922 0.098 18990 7986 1 11 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.018 1.249 18990 7987 1 11 . 1 1 448 448 GLY H H 448 8.380 8.380 7.545 0.835 18990 7988 1 11 . 1 1 449 449 CYS N N 449 120.628 120.628 121.750 -1.122 18990 7989 1 11 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.215 -0.218 18990 7990 1 11 . 1 1 449 449 CYS C C 449 174.855 174.855 175.625 -0.770 18990 7991 1 11 . 1 1 449 449 CYS CA C 449 59.291 59.291 60.427 -1.136 18990 7992 1 11 . 1 1 449 449 CYS CB C 449 28.000 28.000 27.865 0.135 18990 7993 1 11 . 1 1 449 449 CYS H H 449 7.832 7.832 8.838 -1.006 18990 7994 1 11 . 1 1 450 450 MET N N 450 123.947 123.947 115.059 8.888 18990 7995 1 11 . 1 1 450 450 MET HA H 450 4.551 4.551 4.442 0.109 18990 7996 1 11 . 1 1 450 450 MET C C 450 174.658 174.658 175.064 -0.406 18990 7997 1 11 . 1 1 450 450 MET CA C 450 54.970 54.970 55.039 -0.069 18990 7998 1 11 . 1 1 450 450 MET CB C 450 34.100 34.100 32.359 1.741 18990 7999 1 11 . 1 1 450 450 MET H H 450 8.916 8.916 7.986 0.930 18990 8000 1 11 . 1 1 451 451 HIS N N 451 120.490 120.490 119.968 0.522 18990 8001 1 11 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.802 -1.123 18990 8002 1 11 . 1 1 451 451 HIS C C 451 172.443 172.443 174.462 -2.019 18990 8003 1 11 . 1 1 451 451 HIS CA C 451 53.812 53.812 54.859 -1.047 18990 8004 1 11 . 1 1 451 451 HIS CB C 451 28.900 28.900 30.423 -1.523 18990 8005 1 11 . 1 1 451 451 HIS H H 451 7.557 7.557 7.875 -0.318 18990 8006 1 11 . 1 1 452 452 MET N N 452 128.800 128.800 127.320 1.480 18990 8007 1 11 . 1 1 452 452 MET HA H 452 4.320 4.320 4.326 -0.006 18990 8008 1 11 . 1 1 452 452 MET C C 452 175.479 175.479 174.035 1.444 18990 8009 1 11 . 1 1 452 452 MET CA C 452 52.589 52.589 52.959 -0.370 18990 8010 1 11 . 1 1 452 452 MET CB C 452 28.074 28.074 30.267 -2.193 18990 8011 1 11 . 1 1 452 452 MET H H 452 9.087 9.087 8.236 0.851 18990 8012 1 11 . 1 1 453 453 VAL N N 453 122.200 122.200 124.015 -1.815 18990 8013 1 11 . 1 1 453 453 VAL HA H 453 4.794 4.794 3.970 0.824 18990 8014 1 11 . 1 1 453 453 VAL C C 453 175.476 175.476 174.728 0.748 18990 8015 1 11 . 1 1 453 453 VAL CA C 453 61.380 61.380 61.464 -0.084 18990 8016 1 11 . 1 1 453 453 VAL CB C 453 33.089 33.089 31.590 1.499 18990 8017 1 11 . 1 1 453 453 VAL H H 453 8.016 8.016 7.960 0.056 18990 8018 1 11 . 1 1 454 454 CYS N N 454 130.353 130.353 129.254 1.099 18990 8019 1 11 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.685 -0.090 18990 8020 1 11 . 1 1 454 454 CYS C C 454 177.833 177.833 174.671 3.162 18990 8021 1 11 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.349 3.222 18990 8022 1 11 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.625 5.420 18990 8023 1 11 . 1 1 454 454 CYS H H 454 8.989 8.989 8.593 0.396 18990 8024 1 11 . 1 1 455 455 THR N N 455 119.000 119.000 122.587 -3.587 18990 8025 1 11 . 1 1 455 455 THR HA H 455 4.393 4.393 4.368 0.025 18990 8026 1 11 . 1 1 455 455 THR C C 455 175.264 175.264 173.546 1.718 18990 8027 1 11 . 1 1 455 455 THR CA C 455 61.644 61.644 62.401 -0.757 18990 8028 1 11 . 1 1 455 455 THR CB C 455 69.400 69.400 68.721 0.679 18990 8029 1 11 . 1 1 455 455 THR H H 455 8.533 8.533 8.362 0.171 18990 8030 1 11 . 1 1 456 456 ARG N N 456 128.900 128.900 128.213 0.687 18990 8031 1 11 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.599 -0.374 18990 8032 1 11 . 1 1 456 456 ARG C C 456 177.782 177.782 176.791 0.991 18990 8033 1 11 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.302 2.648 18990 8034 1 11 . 1 1 456 456 ARG CB C 456 30.050 30.050 32.311 -2.261 18990 8035 1 11 . 1 1 456 456 ARG H H 456 9.036 9.036 7.937 1.099 18990 8036 1 11 . 1 1 457 457 ALA N N 457 133.152 133.152 127.446 5.706 18990 8037 1 11 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.123 0.023 18990 8038 1 11 . 1 1 457 457 ALA C C 457 178.757 178.757 178.061 0.696 18990 8039 1 11 . 1 1 457 457 ALA CA C 457 53.929 53.929 54.426 -0.497 18990 8040 1 11 . 1 1 457 457 ALA CB C 457 17.710 17.710 18.575 -0.865 18990 8041 1 11 . 1 1 457 457 ALA H H 457 9.042 9.042 8.570 0.472 18990 8042 1 11 . 1 1 458 458 GLY N N 458 111.200 111.200 104.686 6.514 18990 8043 1 11 . 1 1 458 458 GLY C C 458 173.558 173.558 173.371 0.187 18990 8044 1 11 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.380 1.056 18990 8045 1 11 . 1 1 458 458 GLY H H 458 8.830 8.830 8.204 0.626 18990 8046 1 11 . 1 1 459 459 CYS N N 459 123.040 123.040 119.383 3.657 18990 8047 1 11 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.900 -0.278 18990 8048 1 11 . 1 1 459 459 CYS C C 459 176.591 176.591 174.681 1.910 18990 8049 1 11 . 1 1 459 459 CYS CA C 459 60.499 60.499 58.613 1.886 18990 8050 1 11 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.446 0.728 18990 8051 1 11 . 1 1 459 459 CYS H H 459 8.042 8.042 7.835 0.207 18990 8052 1 11 . 1 1 460 460 GLY N N 460 104.500 104.500 110.623 -6.123 18990 8053 1 11 . 1 1 460 460 GLY C C 460 173.716 173.716 173.790 -0.074 18990 8054 1 11 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.403 0.605 18990 8055 1 11 . 1 1 460 460 GLY H H 460 7.705 7.705 8.225 -0.520 18990 8056 1 11 . 1 1 461 461 PHE N N 461 124.949 124.949 122.951 1.998 18990 8057 1 11 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.666 -0.086 18990 8058 1 11 . 1 1 461 461 PHE C C 461 174.447 174.447 174.082 0.365 18990 8059 1 11 . 1 1 461 461 PHE CA C 461 59.946 59.946 56.727 3.219 18990 8060 1 11 . 1 1 461 461 PHE CB C 461 41.300 41.300 40.546 0.754 18990 8061 1 11 . 1 1 461 461 PHE H H 461 8.947 8.947 7.707 1.240 18990 8062 1 11 . 1 1 462 462 GLU N N 462 125.272 125.272 127.342 -2.070 18990 8063 1 11 . 1 1 462 462 GLU HA H 462 5.721 5.721 5.168 0.553 18990 8064 1 11 . 1 1 462 462 GLU C C 462 176.067 176.067 175.119 0.948 18990 8065 1 11 . 1 1 462 462 GLU CA C 462 54.624 54.624 54.047 0.577 18990 8066 1 11 . 1 1 462 462 GLU CB C 462 31.255 31.255 31.827 -0.572 18990 8067 1 11 . 1 1 462 462 GLU H H 462 7.799 7.799 7.799 -0.000 18990 8068 1 11 . 1 1 463 463 TRP N N 463 121.524 121.524 117.971 3.553 18990 8069 1 11 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.395 0.111 18990 8070 1 11 . 1 1 463 463 TRP C C 463 172.844 172.844 175.167 -2.323 18990 8071 1 11 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.367 -0.596 18990 8072 1 11 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.494 0.242 18990 8073 1 11 . 1 1 463 463 TRP H H 463 9.300 9.300 8.553 0.747 18990 8074 1 11 . 1 1 464 464 CYS N N 464 120.868 120.868 119.713 1.155 18990 8075 1 11 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.638 0.778 18990 8076 1 11 . 1 1 464 464 CYS C C 464 177.213 177.213 176.766 0.447 18990 8077 1 11 . 1 1 464 464 CYS CA C 464 57.776 57.776 60.778 -3.002 18990 8078 1 11 . 1 1 464 464 CYS CB C 464 32.930 32.930 27.723 5.207 18990 8079 1 11 . 1 1 464 464 CYS H H 464 8.752 8.752 8.710 0.042 18990 8080 1 11 . 1 1 465 465 TRP N N 465 131.209 131.209 126.561 4.648 18990 8081 1 11 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.306 0.121 18990 8082 1 11 . 1 1 465 465 TRP C C 465 176.051 176.051 176.069 -0.018 18990 8083 1 11 . 1 1 465 465 TRP CA C 465 60.763 60.763 60.190 0.573 18990 8084 1 11 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.471 1.655 18990 8085 1 11 . 1 1 465 465 TRP H H 465 9.809 9.809 8.245 1.564 18990 8086 1 11 . 1 1 466 466 VAL N N 466 118.233 118.233 118.721 -0.488 18990 8087 1 11 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.233 0.391 18990 8088 1 11 . 1 1 466 466 VAL C C 466 178.943 178.943 176.621 2.322 18990 8089 1 11 . 1 1 466 466 VAL CA C 466 65.602 65.602 64.665 0.937 18990 8090 1 11 . 1 1 466 466 VAL CB C 466 33.172 33.172 30.921 2.251 18990 8091 1 11 . 1 1 466 466 VAL H H 466 8.627 8.627 8.167 0.460 18990 8092 1 11 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.789 -1.358 18990 8093 1 11 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.518 0.481 18990 8094 1 11 . 1 1 467 467 CYS CB C 467 31.870 31.870 30.035 1.835 18990 8095 1 11 . 1 1 467 467 CYS H H 467 7.820 7.820 7.987 -0.167 18990 8096 1 11 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.779 -0.743 18990 8097 1 11 . 1 1 468 468 GLN CA C 468 58.051 58.051 55.701 2.350 18990 8098 1 11 . 1 1 468 468 GLN CB C 468 26.476 26.476 29.298 -2.822 18990 8099 1 11 . 1 1 469 469 THR HA H 469 4.685 4.685 4.661 0.024 18990 8100 1 11 . 1 1 469 469 THR C C 469 173.351 173.351 173.166 0.185 18990 8101 1 11 . 1 1 469 469 THR CA C 469 59.176 59.176 60.574 -1.397 18990 8102 1 11 . 1 1 469 469 THR CB C 469 71.775 71.775 71.825 -0.050 18990 8103 1 11 . 1 1 470 470 GLU N N 470 120.940 120.940 122.001 -1.061 18990 8104 1 11 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.459 -0.166 18990 8105 1 11 . 1 1 470 470 GLU C C 470 175.539 175.539 177.030 -1.491 18990 8106 1 11 . 1 1 470 470 GLU CA C 470 57.015 57.015 55.657 1.357 18990 8107 1 11 . 1 1 470 470 GLU CB C 470 29.965 29.965 30.225 -0.260 18990 8108 1 11 . 1 1 470 470 GLU H H 470 8.912 8.912 8.625 0.287 18990 8109 1 11 . 1 1 471 471 TRP N N 471 126.998 126.998 120.504 6.494 18990 8110 1 11 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.549 -0.256 18990 8111 1 11 . 1 1 471 471 TRP C C 471 175.408 175.408 175.380 0.028 18990 8112 1 11 . 1 1 471 471 TRP CA C 471 58.220 58.220 55.097 3.123 18990 8113 1 11 . 1 1 471 471 TRP CB C 471 29.500 29.500 27.316 2.184 18990 8114 1 11 . 1 1 471 471 TRP H H 471 8.350 8.350 8.499 -0.149 18990 8115 1 11 . 1 1 472 472 THR N N 472 117.480 117.480 118.038 -0.558 18990 8116 1 11 . 1 1 472 472 THR HA H 472 4.444 4.444 4.582 -0.138 18990 8117 1 11 . 1 1 472 472 THR CA C 472 58.930 58.930 59.471 -0.541 18990 8118 1 11 . 1 1 472 472 THR H H 472 8.069 8.069 7.883 0.186 18990 8119 1 11 . 1 1 473 473 ARG HA H 473 3.773 3.773 3.997 -0.224 18990 8120 1 11 . 1 1 473 473 ARG C C 473 178.053 178.053 177.807 0.246 18990 8121 1 11 . 1 1 473 473 ARG CA C 473 58.088 58.088 59.558 -1.470 18990 8122 1 11 . 1 1 473 473 ARG CB C 473 29.426 29.426 30.181 -0.755 18990 8123 1 11 . 1 1 474 474 ASP N N 474 119.900 119.900 118.085 1.815 18990 8124 1 11 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.467 -0.252 18990 8125 1 11 . 1 1 474 474 ASP C C 474 178.197 178.197 176.604 1.593 18990 8126 1 11 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.327 0.475 18990 8127 1 11 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.698 -0.516 18990 8128 1 11 . 1 1 474 474 ASP H H 474 7.718 7.718 8.131 -0.413 18990 8129 1 11 . 1 1 475 475 CYS N N 475 121.000 121.000 117.656 3.344 18990 8130 1 11 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.857 -1.490 18990 8131 1 11 . 1 1 475 475 CYS CA C 475 64.533 64.533 59.327 5.206 18990 8132 1 11 . 1 1 475 475 CYS CB C 475 29.092 29.092 28.661 0.431 18990 8133 1 11 . 1 1 475 475 CYS H H 475 6.953 6.953 7.684 -0.731 18990 8134 1 11 . 1 1 476 476 MET HA H 476 4.021 4.021 4.194 -0.173 18990 8135 1 11 . 1 1 476 476 MET CA C 476 58.010 58.010 57.145 0.865 18990 8136 1 11 . 1 1 476 476 MET CB C 476 32.550 32.550 32.671 -0.121 18990 8137 1 11 . 1 1 477 477 GLY N N 477 111.938 111.938 103.652 8.286 18990 8138 1 11 . 1 1 477 477 GLY C C 477 174.406 174.406 173.858 0.548 18990 8139 1 11 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.776 0.840 18990 8140 1 11 . 1 1 477 477 GLY H H 477 9.155 9.155 7.948 1.207 18990 8141 1 11 . 1 1 478 478 ALA N N 478 121.900 121.900 124.543 -2.643 18990 8142 1 11 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.405 -0.114 18990 8143 1 11 . 1 1 478 478 ALA C C 478 178.196 178.196 177.839 0.357 18990 8144 1 11 . 1 1 478 478 ALA CA C 478 53.440 53.440 53.662 -0.222 18990 8145 1 11 . 1 1 478 478 ALA CB C 478 20.390 20.390 19.668 0.722 18990 8146 1 11 . 1 1 478 478 ALA H H 478 7.347 7.347 8.058 -0.711 18990 8147 1 11 . 1 1 479 479 HIS N N 479 115.200 115.200 114.447 0.753 18990 8148 1 11 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.817 0.086 18990 8149 1 11 . 1 1 479 479 HIS C C 479 173.325 173.325 177.215 -3.890 18990 8150 1 11 . 1 1 479 479 HIS CA C 479 54.526 54.526 55.819 -1.293 18990 8151 1 11 . 1 1 479 479 HIS CB C 479 27.600 27.600 30.468 -2.868 18990 8152 1 11 . 1 1 479 479 HIS H H 479 8.297 8.297 7.820 0.477 18990 8153 1 11 . 1 1 480 480 TRP N N 480 121.780 121.780 119.973 1.807 18990 8154 1 11 . 1 1 480 480 TRP HA H 480 4.295 4.295 3.870 0.425 18990 8155 1 11 . 1 1 480 480 TRP C C 480 175.568 175.568 175.105 0.463 18990 8156 1 11 . 1 1 480 480 TRP CA C 480 58.358 58.358 58.575 -0.216 18990 8157 1 11 . 1 1 480 480 TRP CB C 480 29.550 29.550 28.338 1.212 18990 8158 1 11 . 1 1 480 480 TRP H H 480 8.081 8.081 7.029 1.052 18990 8159 1 11 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.377 0.468 18990 8160 1 11 . 1 1 481 481 PHE C C 481 175.126 175.126 175.027 0.099 18990 8161 1 11 . 1 1 481 481 PHE CA C 481 56.471 56.471 59.634 -3.163 18990 8162 1 11 . 1 1 481 481 PHE CB C 481 41.006 41.006 39.648 1.358 18990 8163 1 12 . 1 1 343 343 GLU N N 343 121.045 121.045 121.028 0.017 18990 8164 1 12 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.663 -0.498 18990 8165 1 12 . 1 1 343 343 GLU C C 343 176.529 176.529 175.562 0.967 18990 8166 1 12 . 1 1 343 343 GLU CA C 343 57.162 57.162 55.891 1.271 18990 8167 1 12 . 1 1 343 343 GLU CB C 343 30.204 30.204 30.730 -0.526 18990 8168 1 12 . 1 1 343 343 GLU H H 343 8.293 8.293 8.377 -0.084 18990 8169 1 12 . 1 1 344 344 TYR N N 344 121.000 121.000 125.522 -4.522 18990 8170 1 12 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.624 -0.086 18990 8171 1 12 . 1 1 344 344 TYR C C 344 175.897 175.897 174.470 1.427 18990 8172 1 12 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.593 0.586 18990 8173 1 12 . 1 1 344 344 TYR CB C 344 38.600 38.600 38.016 0.584 18990 8174 1 12 . 1 1 344 344 TYR H H 344 8.040 8.040 8.656 -0.616 18990 8175 1 12 . 1 1 345 345 VAL N N 345 121.900 121.900 127.122 -5.222 18990 8176 1 12 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.268 -0.329 18990 8177 1 12 . 1 1 345 345 VAL C C 345 176.143 176.143 173.988 2.155 18990 8178 1 12 . 1 1 345 345 VAL CA C 345 62.867 62.867 61.696 1.171 18990 8179 1 12 . 1 1 345 345 VAL CB C 345 32.799 32.799 32.303 0.496 18990 8180 1 12 . 1 1 345 345 VAL H H 345 7.856 7.856 8.082 -0.226 18990 8181 1 12 . 1 1 346 346 LEU N N 346 124.950 124.950 128.951 -4.001 18990 8182 1 12 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.665 -0.422 18990 8183 1 12 . 1 1 346 346 LEU C C 346 177.747 177.747 176.740 1.007 18990 8184 1 12 . 1 1 346 346 LEU CA C 346 55.500 55.500 53.836 1.664 18990 8185 1 12 . 1 1 346 346 LEU CB C 346 42.252 42.252 44.724 -2.472 18990 8186 1 12 . 1 1 346 346 LEU H H 346 8.127 8.127 7.953 0.174 18990 8187 1 12 . 1 1 347 347 GLN N N 347 121.452 121.452 119.730 1.722 18990 8188 1 12 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.746 -0.460 18990 8189 1 12 . 1 1 347 347 GLN C C 347 175.833 175.833 173.641 2.192 18990 8190 1 12 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.114 0.875 18990 8191 1 12 . 1 1 347 347 GLN CB C 347 29.375 29.375 29.836 -0.461 18990 8192 1 12 . 1 1 347 347 GLN H H 347 8.270 8.270 8.471 -0.201 18990 8193 1 12 . 1 1 348 348 ALA N N 348 124.466 124.466 122.205 2.261 18990 8194 1 12 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.739 -0.418 18990 8195 1 12 . 1 1 348 348 ALA C C 348 177.929 177.929 178.148 -0.219 18990 8196 1 12 . 1 1 348 348 ALA CA C 348 52.703 52.703 51.858 0.845 18990 8197 1 12 . 1 1 348 348 ALA CB C 348 19.002 19.002 20.067 -1.065 18990 8198 1 12 . 1 1 348 348 ALA H H 348 8.227 8.227 8.345 -0.118 18990 8199 1 12 . 1 1 349 349 GLY N N 349 108.193 108.193 110.758 -2.565 18990 8200 1 12 . 1 1 349 349 GLY C C 349 174.269 174.269 174.491 -0.222 18990 8201 1 12 . 1 1 349 349 GLY CA C 349 45.227 45.227 45.711 -0.484 18990 8202 1 12 . 1 1 349 349 GLY H H 349 8.298 8.298 8.615 -0.317 18990 8203 1 12 . 1 1 350 350 GLY N N 350 108.073 108.073 108.411 -0.338 18990 8204 1 12 . 1 1 350 350 GLY C C 350 172.979 172.979 172.386 0.593 18990 8205 1 12 . 1 1 350 350 GLY CA C 350 44.935 44.935 45.251 -0.316 18990 8206 1 12 . 1 1 350 350 GLY H H 350 8.156 8.156 7.820 0.336 18990 8207 1 12 . 1 1 351 351 VAL N N 351 119.058 119.058 115.017 4.041 18990 8208 1 12 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.672 -0.256 18990 8209 1 12 . 1 1 351 351 VAL C C 351 173.412 173.412 173.596 -0.184 18990 8210 1 12 . 1 1 351 351 VAL CA C 351 60.663 60.663 59.851 0.812 18990 8211 1 12 . 1 1 351 351 VAL CB C 351 34.866 34.866 34.834 0.032 18990 8212 1 12 . 1 1 351 351 VAL H H 351 8.541 8.541 8.372 0.169 18990 8213 1 12 . 1 1 352 352 LEU N N 352 125.800 125.800 119.406 6.394 18990 8214 1 12 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.719 0.046 18990 8215 1 12 . 1 1 352 352 LEU C C 352 176.218 176.218 175.877 0.341 18990 8216 1 12 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.660 -0.319 18990 8217 1 12 . 1 1 352 352 LEU CB C 352 42.706 42.706 45.181 -2.474 18990 8218 1 12 . 1 1 352 352 LEU H H 352 8.151 8.151 8.142 0.009 18990 8219 1 12 . 1 1 353 353 CYS N N 353 126.825 126.825 123.075 3.750 18990 8220 1 12 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.011 0.096 18990 8221 1 12 . 1 1 353 353 CYS C C 353 176.655 176.655 174.715 1.940 18990 8222 1 12 . 1 1 353 353 CYS CA C 353 57.731 57.731 58.003 -0.272 18990 8223 1 12 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.278 4.587 18990 8224 1 12 . 1 1 353 353 CYS H H 353 8.794 8.794 8.519 0.275 18990 8225 1 12 . 1 1 354 354 PRO HA H 354 4.420 4.420 3.968 0.452 18990 8226 1 12 . 1 1 354 354 PRO C C 354 177.512 177.512 176.209 1.303 18990 8227 1 12 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.800 -0.808 18990 8228 1 12 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.244 1.323 18990 8229 1 12 . 1 1 355 355 GLN N N 355 126.800 126.800 119.486 7.314 18990 8230 1 12 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.483 -0.208 18990 8231 1 12 . 1 1 355 355 GLN C C 355 175.516 175.516 175.098 0.418 18990 8232 1 12 . 1 1 355 355 GLN CA C 355 54.793 54.793 52.882 1.911 18990 8233 1 12 . 1 1 355 355 GLN CB C 355 28.547 28.547 29.654 -1.107 18990 8234 1 12 . 1 1 355 355 GLN H H 355 9.033 9.033 7.352 1.681 18990 8235 1 12 . 1 1 357 357 GLY C C 357 173.229 173.229 175.101 -1.872 18990 8236 1 12 . 1 1 357 357 GLY CA C 357 45.254 45.254 45.536 -0.282 18990 8237 1 12 . 1 1 358 358 CYS N N 358 123.500 123.500 120.771 2.729 18990 8238 1 12 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.448 0.085 18990 8239 1 12 . 1 1 358 358 CYS C C 358 176.157 176.157 176.488 -0.331 18990 8240 1 12 . 1 1 358 358 CYS CA C 358 60.268 60.268 60.111 0.157 18990 8241 1 12 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.141 1.234 18990 8242 1 12 . 1 1 358 358 CYS H H 358 7.720 7.720 7.563 0.157 18990 8243 1 12 . 1 1 359 359 GLY N N 359 104.400 104.400 108.778 -4.378 18990 8244 1 12 . 1 1 359 359 GLY C C 359 174.080 174.080 174.863 -0.783 18990 8245 1 12 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.386 -0.322 18990 8246 1 12 . 1 1 359 359 GLY H H 359 7.756 7.756 7.936 -0.180 18990 8247 1 12 . 1 1 360 360 MET N N 360 121.300 121.300 120.246 1.054 18990 8248 1 12 . 1 1 360 360 MET HA H 360 4.343 4.343 4.307 0.036 18990 8249 1 12 . 1 1 360 360 MET C C 360 175.641 175.641 177.173 -1.532 18990 8250 1 12 . 1 1 360 360 MET CA C 360 55.923 55.923 57.356 -1.433 18990 8251 1 12 . 1 1 360 360 MET CB C 360 33.091 33.091 33.923 -0.832 18990 8252 1 12 . 1 1 360 360 MET H H 360 8.229 8.229 7.727 0.502 18990 8253 1 12 . 1 1 361 361 GLY N N 361 109.000 109.000 106.285 2.715 18990 8254 1 12 . 1 1 361 361 GLY C C 361 173.774 173.774 173.017 0.757 18990 8255 1 12 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.393 1.445 18990 8256 1 12 . 1 1 361 361 GLY H H 361 8.347 8.347 7.894 0.453 18990 8257 1 12 . 1 1 362 362 LEU N N 362 126.725 126.725 124.837 1.888 18990 8258 1 12 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.885 -0.210 18990 8259 1 12 . 1 1 362 362 LEU C C 362 175.865 175.865 175.369 0.496 18990 8260 1 12 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.082 1.108 18990 8261 1 12 . 1 1 362 362 LEU CB C 362 44.050 44.050 44.363 -0.313 18990 8262 1 12 . 1 1 362 362 LEU H H 362 8.935 8.935 8.957 -0.022 18990 8263 1 12 . 1 1 363 363 LEU N N 363 123.742 123.742 125.080 -1.338 18990 8264 1 12 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.544 0.133 18990 8265 1 12 . 1 1 363 363 LEU C C 363 176.162 176.162 175.860 0.302 18990 8266 1 12 . 1 1 363 363 LEU CA C 363 54.342 54.342 53.741 0.601 18990 8267 1 12 . 1 1 363 363 LEU CB C 363 42.210 42.210 42.936 -0.726 18990 8268 1 12 . 1 1 363 363 LEU H H 363 8.481 8.481 8.678 -0.197 18990 8269 1 12 . 1 1 364 364 VAL N N 364 120.980 120.980 128.719 -7.739 18990 8270 1 12 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.055 0.342 18990 8271 1 12 . 1 1 364 364 VAL C C 364 175.592 175.592 175.183 0.409 18990 8272 1 12 . 1 1 364 364 VAL CA C 364 60.460 60.460 62.279 -1.819 18990 8273 1 12 . 1 1 364 364 VAL CB C 364 34.125 34.125 31.762 2.363 18990 8274 1 12 . 1 1 364 364 VAL H H 364 8.155 8.155 8.016 0.139 18990 8275 1 12 . 1 1 365 365 GLU N N 365 126.950 126.950 128.793 -1.843 18990 8276 1 12 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.702 -0.092 18990 8277 1 12 . 1 1 365 365 GLU C C 365 175.427 175.427 175.747 -0.320 18990 8278 1 12 . 1 1 365 365 GLU CA C 365 54.551 54.551 53.471 1.080 18990 8279 1 12 . 1 1 365 365 GLU CB C 365 29.780 29.780 30.375 -0.595 18990 8280 1 12 . 1 1 365 365 GLU H H 365 8.900 8.900 8.172 0.728 18990 8281 1 12 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.318 -0.056 18990 8282 1 12 . 1 1 366 366 PRO C C 366 177.013 177.013 176.023 0.990 18990 8283 1 12 . 1 1 366 366 PRO CA C 366 64.463 64.463 64.396 0.067 18990 8284 1 12 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.989 0.059 18990 8285 1 12 . 1 1 367 367 ASP N N 367 115.459 115.459 118.698 -3.239 18990 8286 1 12 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.719 -0.224 18990 8287 1 12 . 1 1 367 367 ASP C C 367 175.123 175.123 176.255 -1.132 18990 8288 1 12 . 1 1 367 367 ASP CA C 367 54.503 54.503 53.712 0.791 18990 8289 1 12 . 1 1 367 367 ASP CB C 367 40.123 40.123 40.369 -0.246 18990 8290 1 12 . 1 1 367 367 ASP H H 367 8.439 8.439 8.465 -0.026 18990 8291 1 12 . 1 1 368 368 CYS N N 368 118.700 118.700 120.203 -1.503 18990 8292 1 12 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.448 0.122 18990 8293 1 12 . 1 1 368 368 CYS C C 368 173.806 173.806 175.610 -1.804 18990 8294 1 12 . 1 1 368 368 CYS CA C 368 58.581 58.581 57.930 0.651 18990 8295 1 12 . 1 1 368 368 CYS CB C 368 28.450 28.450 26.082 2.368 18990 8296 1 12 . 1 1 368 368 CYS H H 368 7.515 7.515 7.715 -0.200 18990 8297 1 12 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.171 0.094 18990 8298 1 12 . 1 1 369 369 ARG C C 369 174.908 174.908 176.121 -1.213 18990 8299 1 12 . 1 1 369 369 ARG CA C 369 57.669 57.669 57.291 0.378 18990 8300 1 12 . 1 1 369 369 ARG CB C 369 32.274 32.274 30.183 2.091 18990 8301 1 12 . 1 1 370 370 LYS N N 370 121.022 121.022 118.997 2.025 18990 8302 1 12 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.547 -0.377 18990 8303 1 12 . 1 1 370 370 LYS C C 370 174.868 174.868 174.572 0.296 18990 8304 1 12 . 1 1 370 370 LYS CA C 370 56.554 56.554 56.246 0.308 18990 8305 1 12 . 1 1 370 370 LYS CB C 370 33.140 33.140 33.809 -0.668 18990 8306 1 12 . 1 1 370 370 LYS H H 370 7.740 7.740 7.415 0.325 18990 8307 1 12 . 1 1 371 371 VAL N N 371 128.362 128.362 127.105 1.257 18990 8308 1 12 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.287 -0.154 18990 8309 1 12 . 1 1 371 371 VAL C C 371 173.402 173.402 173.805 -0.403 18990 8310 1 12 . 1 1 371 371 VAL CA C 371 60.777 60.777 61.921 -1.144 18990 8311 1 12 . 1 1 371 371 VAL CB C 371 33.000 33.000 32.218 0.783 18990 8312 1 12 . 1 1 371 371 VAL H H 371 8.647 8.647 8.927 -0.280 18990 8313 1 12 . 1 1 372 372 THR N N 372 119.667 119.667 123.465 -3.798 18990 8314 1 12 . 1 1 372 372 THR HA H 372 5.032 5.032 5.032 -0.000 18990 8315 1 12 . 1 1 372 372 THR C C 372 174.339 174.339 173.640 0.699 18990 8316 1 12 . 1 1 372 372 THR CA C 372 60.881 60.881 61.758 -0.877 18990 8317 1 12 . 1 1 372 372 THR CB C 372 70.471 70.471 72.072 -1.601 18990 8318 1 12 . 1 1 372 372 THR H H 372 8.087 8.087 8.046 0.041 18990 8319 1 12 . 1 1 373 373 CYS N N 373 132.554 132.554 126.471 6.083 18990 8320 1 12 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.556 0.246 18990 8321 1 12 . 1 1 373 373 CYS C C 373 176.791 176.791 175.389 1.402 18990 8322 1 12 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.421 -0.917 18990 8323 1 12 . 1 1 373 373 CYS CB C 373 28.311 28.311 25.283 3.028 18990 8324 1 12 . 1 1 373 373 CYS H H 373 9.322 9.322 9.249 0.073 18990 8325 1 12 . 1 1 374 374 GLN N N 374 125.890 125.890 124.291 1.599 18990 8326 1 12 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.376 -0.376 18990 8327 1 12 . 1 1 374 374 GLN C C 374 176.827 176.827 177.124 -0.297 18990 8328 1 12 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.608 0.692 18990 8329 1 12 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.833 0.831 18990 8330 1 12 . 1 1 374 374 GLN H H 374 7.856 7.856 8.554 -0.698 18990 8331 1 12 . 1 1 375 375 ASN N N 375 115.342 115.342 116.456 -1.114 18990 8332 1 12 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.806 0.081 18990 8333 1 12 . 1 1 375 375 ASN C C 375 174.049 174.049 175.735 -1.686 18990 8334 1 12 . 1 1 375 375 ASN CA C 375 53.047 53.047 53.811 -0.764 18990 8335 1 12 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.269 -0.353 18990 8336 1 12 . 1 1 375 375 ASN H H 375 8.913 8.913 8.575 0.338 18990 8337 1 12 . 1 1 376 376 GLY N N 376 109.098 109.098 109.047 0.051 18990 8338 1 12 . 1 1 376 376 GLY C C 376 174.110 174.110 174.387 -0.277 18990 8339 1 12 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.303 1.083 18990 8340 1 12 . 1 1 376 376 GLY H H 376 7.162 7.162 8.071 -0.909 18990 8341 1 12 . 1 1 377 377 CYS N N 377 132.546 132.546 119.190 13.356 18990 8342 1 12 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.980 -0.216 18990 8343 1 12 . 1 1 377 377 CYS C C 377 177.355 177.355 174.785 2.570 18990 8344 1 12 . 1 1 377 377 CYS CA C 377 59.988 59.988 57.350 2.638 18990 8345 1 12 . 1 1 377 377 CYS CB C 377 32.365 32.365 29.055 3.310 18990 8346 1 12 . 1 1 377 377 CYS H H 377 9.800 9.800 7.985 1.815 18990 8347 1 12 . 1 1 378 378 GLY N N 378 113.851 113.851 108.086 5.765 18990 8348 1 12 . 1 1 378 378 GLY C C 378 173.404 173.404 172.499 0.905 18990 8349 1 12 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.572 0.291 18990 8350 1 12 . 1 1 378 378 GLY H H 378 8.820 8.820 8.143 0.677 18990 8351 1 12 . 1 1 379 379 TYR N N 379 125.532 125.532 124.262 1.270 18990 8352 1 12 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.766 -0.288 18990 8353 1 12 . 1 1 379 379 TYR C C 379 173.661 173.661 173.909 -0.248 18990 8354 1 12 . 1 1 379 379 TYR CA C 379 59.180 59.180 57.482 1.698 18990 8355 1 12 . 1 1 379 379 TYR CB C 379 40.108 40.108 41.670 -1.562 18990 8356 1 12 . 1 1 379 379 TYR H H 379 9.054 9.054 8.158 0.896 18990 8357 1 12 . 1 1 380 380 VAL N N 380 124.461 124.461 123.550 0.911 18990 8358 1 12 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.984 -0.166 18990 8359 1 12 . 1 1 380 380 VAL C C 380 175.876 175.876 174.640 1.236 18990 8360 1 12 . 1 1 380 380 VAL CA C 380 60.797 60.797 60.573 0.224 18990 8361 1 12 . 1 1 380 380 VAL CB C 380 32.610 32.610 32.038 0.572 18990 8362 1 12 . 1 1 380 380 VAL H H 380 7.238 7.238 7.901 -0.663 18990 8363 1 12 . 1 1 381 381 PHE N N 381 124.588 124.588 123.348 1.240 18990 8364 1 12 . 1 1 381 381 PHE HA H 381 5.273 5.273 5.256 0.017 18990 8365 1 12 . 1 1 381 381 PHE C C 381 173.242 173.242 174.047 -0.805 18990 8366 1 12 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.758 -0.548 18990 8367 1 12 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.047 2.043 18990 8368 1 12 . 1 1 381 381 PHE H H 381 9.424 9.424 8.042 1.382 18990 8369 1 12 . 1 1 382 382 CYS N N 382 120.221 120.221 120.564 -0.343 18990 8370 1 12 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.393 0.509 18990 8371 1 12 . 1 1 382 382 CYS C C 382 177.165 177.165 175.559 1.606 18990 8372 1 12 . 1 1 382 382 CYS CA C 382 57.691 57.691 58.659 -0.968 18990 8373 1 12 . 1 1 382 382 CYS CB C 382 32.475 32.475 29.185 3.290 18990 8374 1 12 . 1 1 382 382 CYS H H 382 8.673 8.673 8.754 -0.081 18990 8375 1 12 . 1 1 383 383 ARG N N 383 129.347 129.347 118.595 10.752 18990 8376 1 12 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.302 -0.281 18990 8377 1 12 . 1 1 383 383 ARG C C 383 175.012 175.012 176.887 -1.875 18990 8378 1 12 . 1 1 383 383 ARG CA C 383 58.686 58.686 57.945 0.741 18990 8379 1 12 . 1 1 383 383 ARG CB C 383 30.900 30.900 30.490 0.410 18990 8380 1 12 . 1 1 383 383 ARG H H 383 9.534 9.534 8.548 0.986 18990 8381 1 12 . 1 1 384 384 ASN N N 384 117.772 117.772 116.521 1.251 18990 8382 1 12 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.893 -0.185 18990 8383 1 12 . 1 1 384 384 ASN C C 384 175.656 175.656 174.683 0.973 18990 8384 1 12 . 1 1 384 384 ASN CA C 384 55.778 55.778 53.485 2.293 18990 8385 1 12 . 1 1 384 384 ASN CB C 384 39.475 39.475 40.362 -0.887 18990 8386 1 12 . 1 1 384 384 ASN H H 384 8.840 8.840 7.927 0.913 18990 8387 1 12 . 1 1 385 385 CYS N N 385 115.876 115.876 113.339 2.537 18990 8388 1 12 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.749 0.279 18990 8389 1 12 . 1 1 385 385 CYS C C 385 175.703 175.703 173.715 1.988 18990 8390 1 12 . 1 1 385 385 CYS CA C 385 58.112 58.112 57.040 1.072 18990 8391 1 12 . 1 1 385 385 CYS CB C 385 32.359 32.359 29.324 3.035 18990 8392 1 12 . 1 1 385 385 CYS H H 385 7.868 7.868 7.761 0.107 18990 8393 1 12 . 1 1 386 386 LEU N N 386 120.082 120.082 119.215 0.867 18990 8394 1 12 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.748 -0.435 18990 8395 1 12 . 1 1 386 386 LEU C C 386 175.722 175.722 176.741 -1.019 18990 8396 1 12 . 1 1 386 386 LEU CA C 386 57.009 57.009 53.769 3.240 18990 8397 1 12 . 1 1 386 386 LEU CB C 386 38.412 38.412 40.222 -1.810 18990 8398 1 12 . 1 1 386 386 LEU H H 386 8.514 8.514 8.353 0.161 18990 8399 1 12 . 1 1 387 387 GLN N N 387 117.579 117.579 119.691 -2.112 18990 8400 1 12 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.335 0.441 18990 8401 1 12 . 1 1 387 387 GLN C C 387 175.299 175.299 176.420 -1.121 18990 8402 1 12 . 1 1 387 387 GLN CA C 387 54.017 54.017 56.253 -2.236 18990 8403 1 12 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.701 1.606 18990 8404 1 12 . 1 1 387 387 GLN H H 387 8.248 8.248 7.584 0.664 18990 8405 1 12 . 1 1 388 388 GLY N N 388 106.107 106.107 107.963 -1.856 18990 8406 1 12 . 1 1 388 388 GLY C C 388 173.693 173.693 174.134 -0.441 18990 8407 1 12 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.190 0.990 18990 8408 1 12 . 1 1 388 388 GLY H H 388 8.695 8.695 8.344 0.351 18990 8409 1 12 . 1 1 389 389 TYR N N 389 122.514 122.514 117.485 5.029 18990 8410 1 12 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.214 -0.556 18990 8411 1 12 . 1 1 389 389 TYR C C 389 172.860 172.860 174.517 -1.657 18990 8412 1 12 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.805 4.182 18990 8413 1 12 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.397 0.655 18990 8414 1 12 . 1 1 389 389 TYR H H 389 7.923 7.923 8.343 -0.420 18990 8415 1 12 . 1 1 390 390 HIS N N 390 120.080 120.080 121.630 -1.550 18990 8416 1 12 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.824 -0.116 18990 8417 1 12 . 1 1 390 390 HIS C C 390 173.235 173.235 173.991 -0.756 18990 8418 1 12 . 1 1 390 390 HIS CA C 390 51.431 51.431 53.630 -2.199 18990 8419 1 12 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.607 0.293 18990 8420 1 12 . 1 1 390 390 HIS H H 390 5.291 5.291 7.589 -2.298 18990 8421 1 12 . 1 1 391 391 ILE N N 391 117.810 117.810 120.924 -3.114 18990 8422 1 12 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.024 0.092 18990 8423 1 12 . 1 1 391 391 ILE C C 391 178.208 178.208 177.557 0.651 18990 8424 1 12 . 1 1 391 391 ILE CA C 391 60.877 60.877 60.764 0.113 18990 8425 1 12 . 1 1 391 391 ILE CB C 391 39.034 39.034 39.698 -0.664 18990 8426 1 12 . 1 1 391 391 ILE H H 391 8.418 8.418 8.538 -0.120 18990 8427 1 12 . 1 1 392 392 GLY N N 392 112.387 112.387 114.806 -2.419 18990 8428 1 12 . 1 1 392 392 GLY C C 392 173.565 173.565 173.164 0.401 18990 8429 1 12 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.905 0.353 18990 8430 1 12 . 1 1 392 392 GLY H H 392 8.654 8.654 8.517 0.137 18990 8431 1 12 . 1 1 393 393 GLU N N 393 119.098 119.098 120.096 -0.998 18990 8432 1 12 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.635 -0.346 18990 8433 1 12 . 1 1 393 393 GLU C C 393 176.899 176.899 174.665 2.234 18990 8434 1 12 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.638 0.795 18990 8435 1 12 . 1 1 393 393 GLU CB C 393 30.470 30.470 30.832 -0.362 18990 8436 1 12 . 1 1 393 393 GLU H H 393 8.391 8.391 7.847 0.544 18990 8437 1 12 . 1 1 394 394 CYS N N 394 122.845 122.845 121.213 1.632 18990 8438 1 12 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.727 -0.961 18990 8439 1 12 . 1 1 394 394 CYS C C 394 175.461 175.461 174.044 1.417 18990 8440 1 12 . 1 1 394 394 CYS CA C 394 59.835 59.835 59.085 0.750 18990 8441 1 12 . 1 1 394 394 CYS CB C 394 30.761 30.761 28.484 2.277 18990 8442 1 12 . 1 1 394 394 CYS H H 394 8.474 8.474 8.606 -0.132 18990 8443 1 12 . 1 1 395 395 LEU N N 395 124.403 124.403 122.995 1.408 18990 8444 1 12 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.828 -0.324 18990 8445 1 12 . 1 1 395 395 LEU C C 395 175.259 175.259 175.347 -0.088 18990 8446 1 12 . 1 1 395 395 LEU CA C 395 52.835 52.835 53.521 -0.686 18990 8447 1 12 . 1 1 395 395 LEU CB C 395 41.436 41.436 42.190 -0.754 18990 8448 1 12 . 1 1 395 395 LEU H H 395 8.418 8.418 7.911 0.507 18990 8449 1 12 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.508 -0.138 18990 8450 1 12 . 1 1 396 396 PRO C C 396 177.006 177.006 176.176 0.830 18990 8451 1 12 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.167 0.929 18990 8452 1 12 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.353 -0.281 18990 8453 1 12 . 1 1 397 397 GLU N N 397 121.574 121.574 119.123 2.451 18990 8454 1 12 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.409 -0.184 18990 8455 1 12 . 1 1 397 397 GLU C C 397 177.202 177.202 177.013 0.189 18990 8456 1 12 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.273 0.761 18990 8457 1 12 . 1 1 397 397 GLU CB C 397 30.263 30.263 30.074 0.189 18990 8458 1 12 . 1 1 397 397 GLU H H 397 8.568 8.568 8.473 0.095 18990 8459 1 12 . 1 1 398 398 GLY N N 398 110.495 110.495 111.372 -0.877 18990 8460 1 12 . 1 1 398 398 GLY C C 398 174.579 174.579 173.500 1.079 18990 8461 1 12 . 1 1 398 398 GLY CA C 398 45.462 45.462 44.725 0.737 18990 8462 1 12 . 1 1 398 398 GLY H H 398 8.515 8.515 8.312 0.203 18990 8463 1 12 . 1 1 399 399 THR N N 399 113.234 113.234 119.663 -6.429 18990 8464 1 12 . 1 1 399 399 THR HA H 399 4.398 4.398 4.629 -0.231 18990 8465 1 12 . 1 1 399 399 THR C C 399 175.333 175.333 174.355 0.978 18990 8466 1 12 . 1 1 399 399 THR CA C 399 62.233 62.233 62.089 0.144 18990 8467 1 12 . 1 1 399 399 THR CB C 399 69.833 69.833 69.848 -0.015 18990 8468 1 12 . 1 1 399 399 THR H H 399 8.090 8.090 8.330 -0.240 18990 8469 1 12 . 1 1 400 400 GLY N N 400 111.479 111.479 113.450 -1.971 18990 8470 1 12 . 1 1 400 400 GLY C C 400 174.048 174.048 172.650 1.398 18990 8471 1 12 . 1 1 400 400 GLY CA C 400 45.439 45.439 44.551 0.888 18990 8472 1 12 . 1 1 400 400 GLY H H 400 8.524 8.524 8.494 0.030 18990 8473 1 12 . 1 1 401 401 ALA N N 401 123.919 123.919 121.295 2.624 18990 8474 1 12 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.632 -0.381 18990 8475 1 12 . 1 1 401 401 ALA C C 401 177.942 177.942 176.071 1.871 18990 8476 1 12 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.612 1.118 18990 8477 1 12 . 1 1 401 401 ALA CB C 401 19.142 19.142 20.484 -1.342 18990 8478 1 12 . 1 1 401 401 ALA H H 401 8.179 8.179 7.869 0.310 18990 8479 1 12 . 1 1 402 402 SER N N 402 114.904 114.904 116.619 -1.715 18990 8480 1 12 . 1 1 402 402 SER HA H 402 4.448 4.448 4.553 -0.105 18990 8481 1 12 . 1 1 402 402 SER C C 402 174.426 174.426 175.151 -0.725 18990 8482 1 12 . 1 1 402 402 SER CA C 402 58.289 58.289 57.762 0.527 18990 8483 1 12 . 1 1 402 402 SER CB C 402 63.772 63.772 63.805 -0.033 18990 8484 1 12 . 1 1 402 402 SER H H 402 8.305 8.305 8.189 0.116 18990 8485 1 12 . 1 1 403 403 ALA N N 403 125.965 125.965 124.271 1.694 18990 8486 1 12 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.331 0.068 18990 8487 1 12 . 1 1 403 403 ALA C C 403 177.984 177.984 177.821 0.163 18990 8488 1 12 . 1 1 403 403 ALA CA C 403 52.655 52.655 51.741 0.914 18990 8489 1 12 . 1 1 403 403 ALA CB C 403 19.138 19.138 19.382 -0.244 18990 8490 1 12 . 1 1 403 403 ALA H H 403 8.345 8.345 8.262 0.083 18990 8491 1 12 . 1 1 404 404 THR N N 404 112.790 112.790 117.238 -4.448 18990 8492 1 12 . 1 1 404 404 THR C C 404 174.420 174.420 174.018 0.402 18990 8493 1 12 . 1 1 404 404 THR CA C 404 61.988 61.988 62.390 -0.402 18990 8494 1 12 . 1 1 404 404 THR CB C 404 69.688 69.688 68.408 1.280 18990 8495 1 12 . 1 1 404 404 THR H H 404 8.118 8.118 8.208 -0.090 18990 8496 1 12 . 1 1 405 405 ASN N N 405 121.050 121.050 125.188 -4.138 18990 8497 1 12 . 1 1 405 405 ASN H H 405 8.396 8.396 8.551 -0.155 18990 8498 1 12 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.796 -0.218 18990 8499 1 12 . 1 1 407 407 CYS C C 407 174.489 174.489 174.124 0.365 18990 8500 1 12 . 1 1 407 407 CYS CA C 407 58.713 58.713 56.879 1.834 18990 8501 1 12 . 1 1 407 407 CYS CB C 407 28.102 28.102 29.633 -1.531 18990 8502 1 12 . 1 1 408 408 GLU N N 408 123.021 123.021 124.722 -1.701 18990 8503 1 12 . 1 1 408 408 GLU C C 408 175.954 175.954 174.823 1.131 18990 8504 1 12 . 1 1 408 408 GLU CA C 408 56.802 56.802 55.944 0.858 18990 8505 1 12 . 1 1 408 408 GLU CB C 408 30.328 30.328 30.584 -0.256 18990 8506 1 12 . 1 1 408 408 GLU H H 408 8.415 8.415 8.350 0.065 18990 8507 1 12 . 1 1 409 409 TYR N N 409 121.015 121.015 117.829 3.186 18990 8508 1 12 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.858 -0.204 18990 8509 1 12 . 1 1 409 409 TYR C C 409 175.613 175.613 174.137 1.476 18990 8510 1 12 . 1 1 409 409 TYR CA C 409 57.669 57.669 56.645 1.024 18990 8511 1 12 . 1 1 409 409 TYR CB C 409 38.825 38.825 40.302 -1.477 18990 8512 1 12 . 1 1 409 409 TYR H H 409 8.135 8.135 7.853 0.282 18990 8513 1 12 . 1 1 410 410 THR N N 410 116.975 116.975 118.136 -1.161 18990 8514 1 12 . 1 1 410 410 THR HA H 410 4.306 4.306 4.550 -0.244 18990 8515 1 12 . 1 1 410 410 THR C C 410 173.846 173.846 173.313 0.533 18990 8516 1 12 . 1 1 410 410 THR CA C 410 61.730 61.730 62.179 -0.449 18990 8517 1 12 . 1 1 410 410 THR CB C 410 69.914 69.914 69.440 0.474 18990 8518 1 12 . 1 1 410 410 THR H H 410 8.060 8.060 8.442 -0.382 18990 8519 1 12 . 1 1 411 411 VAL N N 411 122.900 122.900 123.702 -0.802 18990 8520 1 12 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.366 -0.313 18990 8521 1 12 . 1 1 411 411 VAL C C 411 175.275 175.275 175.196 0.079 18990 8522 1 12 . 1 1 411 411 VAL CA C 411 61.853 61.853 61.822 0.031 18990 8523 1 12 . 1 1 411 411 VAL CB C 411 32.976 32.976 33.826 -0.850 18990 8524 1 12 . 1 1 411 411 VAL H H 411 8.089 8.089 8.410 -0.321 18990 8525 1 12 . 1 1 412 412 ASP N N 412 125.924 125.924 128.676 -2.752 18990 8526 1 12 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.844 0.006 18990 8527 1 12 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.908 -1.330 18990 8528 1 12 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.341 0.197 18990 8529 1 12 . 1 1 412 412 ASP H H 412 8.397 8.397 8.464 -0.067 18990 8530 1 12 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.394 -0.008 18990 8531 1 12 . 1 1 413 413 PRO C C 413 177.352 177.352 176.018 1.334 18990 8532 1 12 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.882 1.028 18990 8533 1 12 . 1 1 413 413 PRO CB C 413 32.268 32.268 31.939 0.329 18990 8534 1 12 . 1 1 414 414 ASN N N 414 117.035 117.035 122.348 -5.313 18990 8535 1 12 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.626 0.051 18990 8536 1 12 . 1 1 414 414 ASN C C 414 175.532 175.532 174.969 0.563 18990 8537 1 12 . 1 1 414 414 ASN CA C 414 53.824 53.824 53.111 0.713 18990 8538 1 12 . 1 1 414 414 ASN CB C 414 38.728 38.728 39.679 -0.951 18990 8539 1 12 . 1 1 414 414 ASN H H 414 8.496 8.496 8.538 -0.042 18990 8540 1 12 . 1 1 415 415 ARG N N 415 121.000 121.000 126.928 -5.928 18990 8541 1 12 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.460 -0.216 18990 8542 1 12 . 1 1 415 415 ARG C C 415 176.243 176.243 174.711 1.532 18990 8543 1 12 . 1 1 415 415 ARG CA C 415 56.404 56.404 55.942 0.462 18990 8544 1 12 . 1 1 415 415 ARG CB C 415 30.637 30.637 30.627 0.010 18990 8545 1 12 . 1 1 415 415 ARG H H 415 7.804 7.804 8.451 -0.647 18990 8546 1 12 . 1 1 416 416 ALA N N 416 124.880 124.880 127.522 -2.642 18990 8547 1 12 . 1 1 416 416 ALA C C 416 177.831 177.831 175.760 2.071 18990 8548 1 12 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.796 1.161 18990 8549 1 12 . 1 1 416 416 ALA CB C 416 19.059 19.059 21.017 -1.958 18990 8550 1 12 . 1 1 416 416 ALA H H 416 8.189 8.189 8.415 -0.226 18990 8551 1 12 . 1 1 417 417 ALA N N 417 122.614 122.614 124.907 -2.293 18990 8552 1 12 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.694 -0.447 18990 8553 1 12 . 1 1 417 417 ALA C C 417 178.024 178.024 176.896 1.128 18990 8554 1 12 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.625 1.164 18990 8555 1 12 . 1 1 417 417 ALA CB C 417 19.042 19.042 20.131 -1.089 18990 8556 1 12 . 1 1 417 417 ALA H H 417 8.169 8.169 8.302 -0.133 18990 8557 1 12 . 1 1 418 418 GLU N N 418 119.500 119.500 121.274 -1.774 18990 8558 1 12 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.609 -0.420 18990 8559 1 12 . 1 1 418 418 GLU C C 418 176.266 176.266 175.466 0.800 18990 8560 1 12 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.645 0.930 18990 8561 1 12 . 1 1 418 418 GLU CB C 418 30.307 30.307 30.466 -0.160 18990 8562 1 12 . 1 1 418 418 GLU H H 418 8.184 8.184 8.751 -0.567 18990 8563 1 12 . 1 1 419 419 ALA N N 419 124.643 124.643 122.874 1.769 18990 8564 1 12 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.614 -0.364 18990 8565 1 12 . 1 1 419 419 ALA C C 419 177.488 177.488 175.569 1.919 18990 8566 1 12 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.171 1.338 18990 8567 1 12 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.959 -1.798 18990 8568 1 12 . 1 1 419 419 ALA H H 419 8.135 8.135 8.522 -0.387 18990 8569 1 12 . 1 1 420 420 ARG N N 420 120.003 120.003 122.010 -2.007 18990 8570 1 12 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.352 -0.059 18990 8571 1 12 . 1 1 420 420 ARG C C 420 176.297 176.297 174.510 1.787 18990 8572 1 12 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.798 0.135 18990 8573 1 12 . 1 1 420 420 ARG CB C 420 30.850 30.850 31.701 -0.852 18990 8574 1 12 . 1 1 420 420 ARG H H 420 8.135 8.135 7.989 0.146 18990 8575 1 12 . 1 1 421 421 TRP N N 421 122.280 122.280 123.853 -1.573 18990 8576 1 12 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.733 -0.070 18990 8577 1 12 . 1 1 421 421 TRP C C 421 175.856 175.856 176.155 -0.299 18990 8578 1 12 . 1 1 421 421 TRP CA C 421 57.404 57.404 58.364 -0.960 18990 8579 1 12 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.448 -1.011 18990 8580 1 12 . 1 1 421 421 TRP H H 421 8.159 8.159 8.828 -0.669 18990 8581 1 12 . 1 1 422 422 ASP N N 422 121.980 121.980 118.898 3.082 18990 8582 1 12 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.712 -0.217 18990 8583 1 12 . 1 1 422 422 ASP C C 422 176.184 176.184 175.379 0.805 18990 8584 1 12 . 1 1 422 422 ASP CA C 422 53.899 53.899 53.326 0.573 18990 8585 1 12 . 1 1 422 422 ASP CB C 422 40.948 40.948 42.306 -1.358 18990 8586 1 12 . 1 1 422 422 ASP H H 422 8.135 8.135 7.825 0.310 18990 8587 1 12 . 1 1 423 423 GLU N N 423 121.990 121.990 120.151 1.839 18990 8588 1 12 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.432 -0.342 18990 8589 1 12 . 1 1 423 423 GLU C C 423 176.720 176.720 175.764 0.956 18990 8590 1 12 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.404 0.765 18990 8591 1 12 . 1 1 423 423 GLU CB C 423 30.156 30.156 30.422 -0.266 18990 8592 1 12 . 1 1 423 423 GLU H H 423 8.153 8.153 8.550 -0.397 18990 8593 1 12 . 1 1 424 424 ALA N N 424 123.900 123.900 120.764 3.136 18990 8594 1 12 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.433 -0.153 18990 8595 1 12 . 1 1 424 424 ALA C C 424 178.095 178.095 176.049 2.046 18990 8596 1 12 . 1 1 424 424 ALA CA C 424 53.017 53.017 51.818 1.199 18990 8597 1 12 . 1 1 424 424 ALA CB C 424 19.086 19.086 20.295 -1.209 18990 8598 1 12 . 1 1 424 424 ALA H H 424 8.243 8.243 7.824 0.419 18990 8599 1 12 . 1 1 425 425 SER N N 425 113.881 113.881 115.600 -1.719 18990 8600 1 12 . 1 1 425 425 SER HA H 425 4.387 4.387 4.947 -0.560 18990 8601 1 12 . 1 1 425 425 SER C C 425 174.338 174.338 173.258 1.080 18990 8602 1 12 . 1 1 425 425 SER CA C 425 58.546 58.546 57.647 0.899 18990 8603 1 12 . 1 1 425 425 SER CB C 425 63.784 63.784 64.339 -0.555 18990 8604 1 12 . 1 1 425 425 SER H H 425 8.063 8.063 8.714 -0.651 18990 8605 1 12 . 1 1 426 426 ASN N N 426 121.032 121.032 122.044 -1.012 18990 8606 1 12 . 1 1 426 426 ASN HA H 426 4.706 4.706 5.039 -0.333 18990 8607 1 12 . 1 1 426 426 ASN C C 426 175.046 175.046 174.001 1.045 18990 8608 1 12 . 1 1 426 426 ASN CA C 426 53.445 53.445 52.591 0.854 18990 8609 1 12 . 1 1 426 426 ASN CB C 426 38.847 38.847 39.175 -0.328 18990 8610 1 12 . 1 1 426 426 ASN H H 426 8.391 8.391 8.441 -0.050 18990 8611 1 12 . 1 1 427 427 VAL N N 427 119.463 119.463 117.900 1.563 18990 8612 1 12 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.247 -0.054 18990 8613 1 12 . 1 1 427 427 VAL C C 427 176.213 176.213 176.203 0.010 18990 8614 1 12 . 1 1 427 427 VAL CA C 427 62.449 62.449 62.691 -0.241 18990 8615 1 12 . 1 1 427 427 VAL CB C 427 32.865 32.865 32.349 0.516 18990 8616 1 12 . 1 1 427 427 VAL H H 427 7.954 7.954 8.252 -0.298 18990 8617 1 12 . 1 1 428 428 THR N N 428 118.226 118.226 113.155 5.071 18990 8618 1 12 . 1 1 428 428 THR HA H 428 4.353 4.353 4.461 -0.108 18990 8619 1 12 . 1 1 428 428 THR C C 428 174.361 174.361 172.929 1.432 18990 8620 1 12 . 1 1 428 428 THR CA C 428 62.065 62.065 61.516 0.549 18990 8621 1 12 . 1 1 428 428 THR CB C 428 69.729 69.729 69.595 0.134 18990 8622 1 12 . 1 1 428 428 THR H H 428 8.225 8.225 7.579 0.646 18990 8623 1 12 . 1 1 429 429 ILE N N 429 123.910 123.910 123.641 0.269 18990 8624 1 12 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.343 -0.155 18990 8625 1 12 . 1 1 429 429 ILE C C 429 175.774 175.774 175.304 0.470 18990 8626 1 12 . 1 1 429 429 ILE CA C 429 60.819 60.819 60.148 0.671 18990 8627 1 12 . 1 1 429 429 ILE CB C 429 38.719 38.719 39.174 -0.455 18990 8628 1 12 . 1 1 429 429 ILE H H 429 8.148 8.148 8.388 -0.240 18990 8629 1 12 . 1 1 430 430 LYS N N 430 126.453 126.453 128.318 -1.865 18990 8630 1 12 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.452 -0.018 18990 8631 1 12 . 1 1 430 430 LYS C C 430 176.241 176.241 176.069 0.172 18990 8632 1 12 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.178 0.758 18990 8633 1 12 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.209 -0.045 18990 8634 1 12 . 1 1 430 430 LYS H H 430 8.406 8.406 8.532 -0.126 18990 8635 1 12 . 1 1 431 431 VAL N N 431 122.496 122.496 125.003 -2.507 18990 8636 1 12 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.017 0.263 18990 8637 1 12 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.735 -0.432 18990 8638 1 12 . 1 1 431 431 VAL CB C 431 33.132 33.132 32.085 1.047 18990 8639 1 12 . 1 1 431 431 VAL H H 431 8.312 8.312 8.537 -0.225 18990 8640 1 12 . 1 1 432 432 SER HA H 432 4.486 4.486 4.677 -0.191 18990 8641 1 12 . 1 1 432 432 SER C C 432 173.834 173.834 173.983 -0.149 18990 8642 1 12 . 1 1 432 432 SER CA C 432 58.650 58.650 58.112 0.538 18990 8643 1 12 . 1 1 432 432 SER CB C 432 64.152 64.152 63.471 0.681 18990 8644 1 12 . 1 1 433 433 THR N N 433 114.706 114.706 112.721 1.985 18990 8645 1 12 . 1 1 433 433 THR HA H 433 5.446 5.446 4.819 0.627 18990 8646 1 12 . 1 1 433 433 THR C C 433 173.979 173.979 174.305 -0.326 18990 8647 1 12 . 1 1 433 433 THR CA C 433 60.412 60.412 60.663 -0.251 18990 8648 1 12 . 1 1 433 433 THR CB C 433 71.896 71.896 70.772 1.124 18990 8649 1 12 . 1 1 433 433 THR H H 433 7.833 7.833 7.518 0.315 18990 8650 1 12 . 1 1 434 434 LYS N N 434 122.492 122.492 121.368 1.124 18990 8651 1 12 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.979 -0.270 18990 8652 1 12 . 1 1 434 434 LYS C C 434 173.589 173.589 174.443 -0.854 18990 8653 1 12 . 1 1 434 434 LYS CA C 434 54.375 54.375 53.034 1.341 18990 8654 1 12 . 1 1 434 434 LYS CB C 434 36.925 36.925 34.199 2.727 18990 8655 1 12 . 1 1 434 434 LYS H H 434 8.937 8.937 9.075 -0.138 18990 8656 1 12 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.803 -0.536 18990 8657 1 12 . 1 1 435 435 PRO C C 435 175.238 175.238 176.986 -1.748 18990 8658 1 12 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.062 -1.139 18990 8659 1 12 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.678 -0.592 18990 8660 1 12 . 1 1 436 436 CYS N N 436 125.422 125.422 125.763 -0.341 18990 8661 1 12 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.392 -0.962 18990 8662 1 12 . 1 1 436 436 CYS C C 436 176.770 176.770 175.555 1.215 18990 8663 1 12 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.450 0.566 18990 8664 1 12 . 1 1 436 436 CYS CB C 436 31.698 31.698 27.525 4.173 18990 8665 1 12 . 1 1 436 436 CYS H H 436 7.768 7.768 8.482 -0.714 18990 8666 1 12 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.245 -0.387 18990 8667 1 12 . 1 1 437 437 PRO C C 437 173.608 173.608 176.482 -2.874 18990 8668 1 12 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.216 -0.003 18990 8669 1 12 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.380 1.069 18990 8670 1 12 . 1 1 438 438 LYS N N 438 118.600 118.600 117.513 1.087 18990 8671 1 12 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.311 -0.341 18990 8672 1 12 . 1 1 438 438 LYS C C 438 176.887 176.887 177.525 -0.638 18990 8673 1 12 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.585 0.102 18990 8674 1 12 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.358 -0.234 18990 8675 1 12 . 1 1 438 438 LYS H H 438 8.390 8.390 7.638 0.752 18990 8676 1 12 . 1 1 439 439 CYS N N 439 118.950 118.950 113.424 5.526 18990 8677 1 12 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.798 -0.052 18990 8678 1 12 . 1 1 439 439 CYS C C 439 176.650 176.650 175.169 1.481 18990 8679 1 12 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.369 1.979 18990 8680 1 12 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.273 2.923 18990 8681 1 12 . 1 1 439 439 CYS H H 439 8.357 8.357 7.744 0.613 18990 8682 1 12 . 1 1 440 440 ARG N N 440 117.200 117.200 118.467 -1.267 18990 8683 1 12 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.082 -0.114 18990 8684 1 12 . 1 1 440 440 ARG C C 440 175.253 175.253 175.556 -0.303 18990 8685 1 12 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.833 0.068 18990 8686 1 12 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.327 -1.286 18990 8687 1 12 . 1 1 440 440 ARG H H 440 8.065 8.065 8.088 -0.023 18990 8688 1 12 . 1 1 441 441 THR N N 441 122.400 122.400 111.682 10.718 18990 8689 1 12 . 1 1 441 441 THR HA H 441 4.371 4.371 4.641 -0.270 18990 8690 1 12 . 1 1 441 441 THR C C 441 173.702 173.702 173.200 0.502 18990 8691 1 12 . 1 1 441 441 THR CA C 441 63.194 63.194 58.961 4.233 18990 8692 1 12 . 1 1 441 441 THR CB C 441 68.933 68.933 69.439 -0.506 18990 8693 1 12 . 1 1 441 441 THR H H 441 8.643 8.643 7.600 1.043 18990 8694 1 12 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.742 -0.595 18990 8695 1 12 . 1 1 442 442 PRO C C 442 176.215 176.215 176.172 0.043 18990 8696 1 12 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.540 1.657 18990 8697 1 12 . 1 1 442 442 PRO CB C 442 32.044 32.044 30.952 1.092 18990 8698 1 12 . 1 1 443 443 THR N N 443 122.932 122.932 122.163 0.769 18990 8699 1 12 . 1 1 443 443 THR HA H 443 4.665 4.665 4.479 0.186 18990 8700 1 12 . 1 1 443 443 THR C C 443 172.133 172.133 174.733 -2.600 18990 8701 1 12 . 1 1 443 443 THR CA C 443 62.566 62.566 62.668 -0.102 18990 8702 1 12 . 1 1 443 443 THR CB C 443 71.562 71.562 69.916 1.646 18990 8703 1 12 . 1 1 443 443 THR H H 443 9.116 9.116 8.932 0.184 18990 8704 1 12 . 1 1 444 444 GLU N N 444 126.390 126.390 126.649 -0.259 18990 8705 1 12 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.315 0.627 18990 8706 1 12 . 1 1 444 444 GLU C C 444 175.292 175.292 176.166 -0.874 18990 8707 1 12 . 1 1 444 444 GLU CA C 444 55.049 55.049 56.916 -1.867 18990 8708 1 12 . 1 1 444 444 GLU CB C 444 31.861 31.861 30.447 1.414 18990 8709 1 12 . 1 1 444 444 GLU H H 444 8.720 8.720 8.820 -0.100 18990 8710 1 12 . 1 1 445 445 ARG N N 445 123.505 123.505 122.406 1.099 18990 8711 1 12 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.481 -0.770 18990 8712 1 12 . 1 1 445 445 ARG C C 445 175.289 175.289 175.231 0.058 18990 8713 1 12 . 1 1 445 445 ARG CA C 445 55.856 55.856 54.666 1.190 18990 8714 1 12 . 1 1 445 445 ARG CB C 445 30.675 30.675 33.211 -2.536 18990 8715 1 12 . 1 1 445 445 ARG H H 445 8.157 8.157 8.202 -0.045 18990 8716 1 12 . 1 1 446 446 ASP N N 446 126.800 126.800 119.237 7.563 18990 8717 1 12 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.581 0.060 18990 8718 1 12 . 1 1 446 446 ASP C C 446 176.020 176.020 176.745 -0.725 18990 8719 1 12 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.407 -0.455 18990 8720 1 12 . 1 1 446 446 ASP CB C 446 41.400 41.400 43.143 -1.743 18990 8721 1 12 . 1 1 446 446 ASP H H 446 8.476 8.476 8.395 0.081 18990 8722 1 12 . 1 1 447 447 GLY N N 447 111.262 111.262 108.811 2.451 18990 8723 1 12 . 1 1 447 447 GLY C C 447 174.073 174.073 173.537 0.536 18990 8724 1 12 . 1 1 447 447 GLY CA C 447 45.832 45.832 44.851 0.981 18990 8725 1 12 . 1 1 447 447 GLY H H 447 8.056 8.056 8.595 -0.539 18990 8726 1 12 . 1 1 448 448 GLY N N 448 108.655 108.655 110.095 -1.440 18990 8727 1 12 . 1 1 448 448 GLY C C 448 174.020 174.020 174.394 -0.374 18990 8728 1 12 . 1 1 448 448 GLY CA C 448 45.267 45.267 45.118 0.149 18990 8729 1 12 . 1 1 448 448 GLY H H 448 8.380 8.380 7.854 0.526 18990 8730 1 12 . 1 1 449 449 CYS N N 449 120.628 120.628 118.910 1.718 18990 8731 1 12 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.782 -0.785 18990 8732 1 12 . 1 1 449 449 CYS C C 449 174.855 174.855 174.686 0.169 18990 8733 1 12 . 1 1 449 449 CYS CA C 449 59.291 59.291 58.232 1.059 18990 8734 1 12 . 1 1 449 449 CYS CB C 449 28.000 28.000 30.179 -2.179 18990 8735 1 12 . 1 1 449 449 CYS H H 449 7.832 7.832 8.518 -0.686 18990 8736 1 12 . 1 1 450 450 MET N N 450 123.947 123.947 117.539 6.408 18990 8737 1 12 . 1 1 450 450 MET HA H 450 4.551 4.551 4.508 0.043 18990 8738 1 12 . 1 1 450 450 MET C C 450 174.658 174.658 174.870 -0.212 18990 8739 1 12 . 1 1 450 450 MET CA C 450 54.970 54.970 55.658 -0.688 18990 8740 1 12 . 1 1 450 450 MET CB C 450 34.100 34.100 34.115 -0.015 18990 8741 1 12 . 1 1 450 450 MET H H 450 8.916 8.916 8.123 0.793 18990 8742 1 12 . 1 1 451 451 HIS N N 451 120.490 120.490 121.432 -0.942 18990 8743 1 12 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.918 -1.239 18990 8744 1 12 . 1 1 451 451 HIS C C 451 172.443 172.443 174.188 -1.745 18990 8745 1 12 . 1 1 451 451 HIS CA C 451 53.812 53.812 56.015 -2.203 18990 8746 1 12 . 1 1 451 451 HIS CB C 451 28.900 28.900 30.252 -1.352 18990 8747 1 12 . 1 1 451 451 HIS H H 451 7.557 7.557 8.019 -0.462 18990 8748 1 12 . 1 1 452 452 MET N N 452 128.800 128.800 127.434 1.366 18990 8749 1 12 . 1 1 452 452 MET HA H 452 4.320 4.320 4.321 -0.001 18990 8750 1 12 . 1 1 452 452 MET C C 452 175.479 175.479 173.665 1.814 18990 8751 1 12 . 1 1 452 452 MET CA C 452 52.589 52.589 53.222 -0.633 18990 8752 1 12 . 1 1 452 452 MET CB C 452 28.074 28.074 31.822 -3.748 18990 8753 1 12 . 1 1 452 452 MET H H 452 9.087 9.087 7.810 1.277 18990 8754 1 12 . 1 1 453 453 VAL N N 453 122.200 122.200 117.340 4.860 18990 8755 1 12 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.492 0.302 18990 8756 1 12 . 1 1 453 453 VAL C C 453 175.476 175.476 174.448 1.028 18990 8757 1 12 . 1 1 453 453 VAL CA C 453 61.380 61.380 58.566 2.814 18990 8758 1 12 . 1 1 453 453 VAL CB C 453 33.089 33.089 33.876 -0.787 18990 8759 1 12 . 1 1 453 453 VAL H H 453 8.016 8.016 7.974 0.042 18990 8760 1 12 . 1 1 454 454 CYS N N 454 130.353 130.353 126.024 4.329 18990 8761 1 12 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.738 -0.143 18990 8762 1 12 . 1 1 454 454 CYS C C 454 177.833 177.833 175.058 2.775 18990 8763 1 12 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.397 3.174 18990 8764 1 12 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.621 5.424 18990 8765 1 12 . 1 1 454 454 CYS H H 454 8.989 8.989 8.944 0.045 18990 8766 1 12 . 1 1 455 455 THR N N 455 119.000 119.000 123.103 -4.103 18990 8767 1 12 . 1 1 455 455 THR HA H 455 4.393 4.393 4.396 -0.003 18990 8768 1 12 . 1 1 455 455 THR C C 455 175.264 175.264 173.780 1.484 18990 8769 1 12 . 1 1 455 455 THR CA C 455 61.644 61.644 61.659 -0.015 18990 8770 1 12 . 1 1 455 455 THR CB C 455 69.400 69.400 68.154 1.246 18990 8771 1 12 . 1 1 455 455 THR H H 455 8.533 8.533 8.472 0.061 18990 8772 1 12 . 1 1 456 456 ARG N N 456 128.900 128.900 127.317 1.583 18990 8773 1 12 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.574 -0.349 18990 8774 1 12 . 1 1 456 456 ARG C C 456 177.782 177.782 176.885 0.897 18990 8775 1 12 . 1 1 456 456 ARG CA C 456 56.950 56.950 55.054 1.896 18990 8776 1 12 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.127 -3.077 18990 8777 1 12 . 1 1 456 456 ARG H H 456 9.036 9.036 7.759 1.277 18990 8778 1 12 . 1 1 457 457 ALA N N 457 133.152 133.152 128.336 4.816 18990 8779 1 12 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.188 -0.042 18990 8780 1 12 . 1 1 457 457 ALA C C 457 178.757 178.757 177.197 1.560 18990 8781 1 12 . 1 1 457 457 ALA CA C 457 53.929 53.929 54.376 -0.447 18990 8782 1 12 . 1 1 457 457 ALA CB C 457 17.710 17.710 18.613 -0.903 18990 8783 1 12 . 1 1 457 457 ALA H H 457 9.042 9.042 8.750 0.292 18990 8784 1 12 . 1 1 458 458 GLY N N 458 111.200 111.200 103.292 7.908 18990 8785 1 12 . 1 1 458 458 GLY C C 458 173.558 173.558 173.952 -0.394 18990 8786 1 12 . 1 1 458 458 GLY CA C 458 45.436 45.436 43.874 1.562 18990 8787 1 12 . 1 1 458 458 GLY H H 458 8.830 8.830 7.941 0.889 18990 8788 1 12 . 1 1 459 459 CYS N N 459 123.040 123.040 119.049 3.991 18990 8789 1 12 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.936 -0.314 18990 8790 1 12 . 1 1 459 459 CYS C C 459 176.591 176.591 174.375 2.216 18990 8791 1 12 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.437 1.062 18990 8792 1 12 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.725 0.449 18990 8793 1 12 . 1 1 459 459 CYS H H 459 8.042 8.042 8.222 -0.180 18990 8794 1 12 . 1 1 460 460 GLY N N 460 104.500 104.500 112.004 -7.504 18990 8795 1 12 . 1 1 460 460 GLY C C 460 173.716 173.716 173.782 -0.066 18990 8796 1 12 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.887 0.121 18990 8797 1 12 . 1 1 460 460 GLY H H 460 7.705 7.705 8.089 -0.384 18990 8798 1 12 . 1 1 461 461 PHE N N 461 124.949 124.949 121.329 3.620 18990 8799 1 12 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.313 0.267 18990 8800 1 12 . 1 1 461 461 PHE C C 461 174.447 174.447 173.283 1.164 18990 8801 1 12 . 1 1 461 461 PHE CA C 461 59.946 59.946 56.138 3.808 18990 8802 1 12 . 1 1 461 461 PHE CB C 461 41.300 41.300 41.713 -0.413 18990 8803 1 12 . 1 1 461 461 PHE H H 461 8.947 8.947 7.639 1.308 18990 8804 1 12 . 1 1 462 462 GLU N N 462 125.272 125.272 126.464 -1.192 18990 8805 1 12 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.228 1.493 18990 8806 1 12 . 1 1 462 462 GLU C C 462 176.067 176.067 174.603 1.464 18990 8807 1 12 . 1 1 462 462 GLU CA C 462 54.624 54.624 55.559 -0.935 18990 8808 1 12 . 1 1 462 462 GLU CB C 462 31.255 31.255 31.776 -0.521 18990 8809 1 12 . 1 1 462 462 GLU H H 462 7.799 7.799 7.902 -0.103 18990 8810 1 12 . 1 1 463 463 TRP N N 463 121.524 121.524 116.103 5.421 18990 8811 1 12 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.027 0.479 18990 8812 1 12 . 1 1 463 463 TRP C C 463 172.844 172.844 174.074 -1.230 18990 8813 1 12 . 1 1 463 463 TRP CA C 463 53.771 53.771 55.491 -1.720 18990 8814 1 12 . 1 1 463 463 TRP CB C 463 31.736 31.736 30.381 1.355 18990 8815 1 12 . 1 1 463 463 TRP H H 463 9.300 9.300 8.018 1.282 18990 8816 1 12 . 1 1 464 464 CYS N N 464 120.868 120.868 121.182 -0.314 18990 8817 1 12 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.818 0.598 18990 8818 1 12 . 1 1 464 464 CYS C C 464 177.213 177.213 176.227 0.986 18990 8819 1 12 . 1 1 464 464 CYS CA C 464 57.776 57.776 59.569 -1.793 18990 8820 1 12 . 1 1 464 464 CYS CB C 464 32.930 32.930 28.970 3.960 18990 8821 1 12 . 1 1 464 464 CYS H H 464 8.752 8.752 8.717 0.035 18990 8822 1 12 . 1 1 465 465 TRP N N 465 131.209 131.209 128.999 2.210 18990 8823 1 12 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.424 0.003 18990 8824 1 12 . 1 1 465 465 TRP C C 465 176.051 176.051 175.869 0.182 18990 8825 1 12 . 1 1 465 465 TRP CA C 465 60.763 60.763 59.972 0.791 18990 8826 1 12 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.682 1.444 18990 8827 1 12 . 1 1 465 465 TRP H H 465 9.809 9.809 8.480 1.329 18990 8828 1 12 . 1 1 466 466 VAL N N 466 118.233 118.233 116.835 1.398 18990 8829 1 12 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.403 0.221 18990 8830 1 12 . 1 1 466 466 VAL C C 466 178.943 178.943 176.037 2.906 18990 8831 1 12 . 1 1 466 466 VAL CA C 466 65.602 65.602 64.759 0.843 18990 8832 1 12 . 1 1 466 466 VAL CB C 466 33.172 33.172 32.009 1.163 18990 8833 1 12 . 1 1 466 466 VAL H H 466 8.627 8.627 7.747 0.880 18990 8834 1 12 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.697 -1.266 18990 8835 1 12 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.735 0.264 18990 8836 1 12 . 1 1 467 467 CYS CB C 467 31.870 31.870 28.692 3.178 18990 8837 1 12 . 1 1 467 467 CYS H H 467 7.820 7.820 7.837 -0.017 18990 8838 1 12 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.471 -0.435 18990 8839 1 12 . 1 1 468 468 GLN CA C 468 58.051 58.051 56.691 1.360 18990 8840 1 12 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.408 -1.932 18990 8841 1 12 . 1 1 469 469 THR HA H 469 4.685 4.685 4.786 -0.101 18990 8842 1 12 . 1 1 469 469 THR C C 469 173.351 173.351 173.578 -0.227 18990 8843 1 12 . 1 1 469 469 THR CA C 469 59.176 59.176 60.021 -0.845 18990 8844 1 12 . 1 1 469 469 THR CB C 469 71.775 71.775 72.149 -0.374 18990 8845 1 12 . 1 1 470 470 GLU N N 470 120.940 120.940 122.340 -1.400 18990 8846 1 12 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.721 -0.428 18990 8847 1 12 . 1 1 470 470 GLU C C 470 175.539 175.539 176.222 -0.683 18990 8848 1 12 . 1 1 470 470 GLU CA C 470 57.015 57.015 55.936 1.079 18990 8849 1 12 . 1 1 470 470 GLU CB C 470 29.965 29.965 30.748 -0.783 18990 8850 1 12 . 1 1 470 470 GLU H H 470 8.912 8.912 8.680 0.232 18990 8851 1 12 . 1 1 471 471 TRP N N 471 126.998 126.998 125.013 1.985 18990 8852 1 12 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.134 0.159 18990 8853 1 12 . 1 1 471 471 TRP C C 471 175.408 175.408 176.183 -0.775 18990 8854 1 12 . 1 1 471 471 TRP CA C 471 58.220 58.220 58.088 0.132 18990 8855 1 12 . 1 1 471 471 TRP CB C 471 29.500 29.500 28.260 1.240 18990 8856 1 12 . 1 1 471 471 TRP H H 471 8.350 8.350 8.078 0.272 18990 8857 1 12 . 1 1 472 472 THR N N 472 117.480 117.480 114.842 2.638 18990 8858 1 12 . 1 1 472 472 THR HA H 472 4.444 4.444 4.501 -0.057 18990 8859 1 12 . 1 1 472 472 THR CA C 472 58.930 58.930 61.313 -2.383 18990 8860 1 12 . 1 1 472 472 THR H H 472 8.069 8.069 8.474 -0.405 18990 8861 1 12 . 1 1 473 473 ARG HA H 473 3.773 3.773 4.189 -0.416 18990 8862 1 12 . 1 1 473 473 ARG C C 473 178.053 178.053 177.402 0.651 18990 8863 1 12 . 1 1 473 473 ARG CA C 473 58.088 58.088 57.787 0.301 18990 8864 1 12 . 1 1 473 473 ARG CB C 473 29.426 29.426 30.285 -0.859 18990 8865 1 12 . 1 1 474 474 ASP N N 474 119.900 119.900 117.617 2.283 18990 8866 1 12 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.552 -0.337 18990 8867 1 12 . 1 1 474 474 ASP C C 474 178.197 178.197 177.168 1.029 18990 8868 1 12 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.191 0.612 18990 8869 1 12 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.397 -0.214 18990 8870 1 12 . 1 1 474 474 ASP H H 474 7.718 7.718 8.806 -1.088 18990 8871 1 12 . 1 1 475 475 CYS N N 475 121.000 121.000 118.032 2.968 18990 8872 1 12 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.784 -1.417 18990 8873 1 12 . 1 1 475 475 CYS CA C 475 64.533 64.533 58.910 5.623 18990 8874 1 12 . 1 1 475 475 CYS CB C 475 29.092 29.092 26.506 2.586 18990 8875 1 12 . 1 1 475 475 CYS H H 475 6.953 6.953 8.321 -1.368 18990 8876 1 12 . 1 1 476 476 MET HA H 476 4.021 4.021 3.913 0.108 18990 8877 1 12 . 1 1 476 476 MET CA C 476 58.010 58.010 58.490 -0.480 18990 8878 1 12 . 1 1 476 476 MET CB C 476 32.550 32.550 32.588 -0.038 18990 8879 1 12 . 1 1 477 477 GLY N N 477 111.938 111.938 103.199 8.739 18990 8880 1 12 . 1 1 477 477 GLY C C 477 174.406 174.406 174.037 0.369 18990 8881 1 12 . 1 1 477 477 GLY CA C 477 45.616 45.616 45.000 0.616 18990 8882 1 12 . 1 1 477 477 GLY H H 477 9.155 9.155 8.540 0.615 18990 8883 1 12 . 1 1 478 478 ALA N N 478 121.900 121.900 124.557 -2.657 18990 8884 1 12 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.417 -0.126 18990 8885 1 12 . 1 1 478 478 ALA C C 478 178.196 178.196 177.271 0.925 18990 8886 1 12 . 1 1 478 478 ALA CA C 478 53.440 53.440 53.682 -0.242 18990 8887 1 12 . 1 1 478 478 ALA CB C 478 20.390 20.390 19.673 0.717 18990 8888 1 12 . 1 1 478 478 ALA H H 478 7.347 7.347 7.672 -0.325 18990 8889 1 12 . 1 1 479 479 HIS N N 479 115.200 115.200 113.578 1.622 18990 8890 1 12 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.738 0.165 18990 8891 1 12 . 1 1 479 479 HIS C C 479 173.325 173.325 175.932 -2.607 18990 8892 1 12 . 1 1 479 479 HIS CA C 479 54.526 54.526 55.274 -0.748 18990 8893 1 12 . 1 1 479 479 HIS CB C 479 27.600 27.600 30.622 -3.022 18990 8894 1 12 . 1 1 479 479 HIS H H 479 8.297 8.297 7.689 0.608 18990 8895 1 12 . 1 1 480 480 TRP N N 480 121.780 121.780 120.973 0.807 18990 8896 1 12 . 1 1 480 480 TRP HA H 480 4.295 4.295 3.996 0.299 18990 8897 1 12 . 1 1 480 480 TRP C C 480 175.568 175.568 174.543 1.025 18990 8898 1 12 . 1 1 480 480 TRP CA C 480 58.358 58.358 57.502 0.856 18990 8899 1 12 . 1 1 480 480 TRP CB C 480 29.550 29.550 28.107 1.443 18990 8900 1 12 . 1 1 480 480 TRP H H 480 8.081 8.081 7.231 0.850 18990 8901 1 12 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.706 0.139 18990 8902 1 12 . 1 1 481 481 PHE C C 481 175.126 175.126 173.892 1.234 18990 8903 1 12 . 1 1 481 481 PHE CA C 481 56.471 56.471 57.790 -1.319 18990 8904 1 12 . 1 1 481 481 PHE CB C 481 41.006 41.006 41.967 -0.961 18990 8905 1 13 . 1 1 343 343 GLU N N 343 121.045 121.045 123.327 -2.282 18990 8906 1 13 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.689 -0.524 18990 8907 1 13 . 1 1 343 343 GLU C C 343 176.529 176.529 175.785 0.744 18990 8908 1 13 . 1 1 343 343 GLU CA C 343 57.162 57.162 55.856 1.306 18990 8909 1 13 . 1 1 343 343 GLU CB C 343 30.204 30.204 30.660 -0.456 18990 8910 1 13 . 1 1 343 343 GLU H H 343 8.293 8.293 8.580 -0.287 18990 8911 1 13 . 1 1 344 344 TYR N N 344 121.000 121.000 116.719 4.281 18990 8912 1 13 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.796 -0.258 18990 8913 1 13 . 1 1 344 344 TYR C C 344 175.897 175.897 174.658 1.239 18990 8914 1 13 . 1 1 344 344 TYR CA C 344 58.179 58.179 56.656 1.523 18990 8915 1 13 . 1 1 344 344 TYR CB C 344 38.600 38.600 38.365 0.235 18990 8916 1 13 . 1 1 344 344 TYR H H 344 8.040 8.040 8.058 -0.018 18990 8917 1 13 . 1 1 345 345 VAL N N 345 121.900 121.900 125.366 -3.466 18990 8918 1 13 . 1 1 345 345 VAL HA H 345 3.939 3.939 3.914 0.025 18990 8919 1 13 . 1 1 345 345 VAL C C 345 176.143 176.143 176.062 0.081 18990 8920 1 13 . 1 1 345 345 VAL CA C 345 62.867 62.867 62.993 -0.126 18990 8921 1 13 . 1 1 345 345 VAL CB C 345 32.799 32.799 31.702 1.097 18990 8922 1 13 . 1 1 345 345 VAL H H 345 7.856 7.856 8.364 -0.508 18990 8923 1 13 . 1 1 346 346 LEU N N 346 124.950 124.950 129.426 -4.476 18990 8924 1 13 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.832 -0.590 18990 8925 1 13 . 1 1 346 346 LEU C C 346 177.747 177.747 176.387 1.360 18990 8926 1 13 . 1 1 346 346 LEU CA C 346 55.500 55.500 53.985 1.515 18990 8927 1 13 . 1 1 346 346 LEU CB C 346 42.252 42.252 42.028 0.224 18990 8928 1 13 . 1 1 346 346 LEU H H 346 8.127 8.127 8.456 -0.329 18990 8929 1 13 . 1 1 347 347 GLN N N 347 121.452 121.452 124.466 -3.014 18990 8930 1 13 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.512 -0.226 18990 8931 1 13 . 1 1 347 347 GLN C C 347 175.833 175.833 174.371 1.462 18990 8932 1 13 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.756 0.232 18990 8933 1 13 . 1 1 347 347 GLN CB C 347 29.375 29.375 30.542 -1.167 18990 8934 1 13 . 1 1 347 347 GLN H H 347 8.270 8.270 8.496 -0.226 18990 8935 1 13 . 1 1 348 348 ALA N N 348 124.466 124.466 126.607 -2.141 18990 8936 1 13 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.603 -0.282 18990 8937 1 13 . 1 1 348 348 ALA C C 348 177.929 177.929 176.398 1.531 18990 8938 1 13 . 1 1 348 348 ALA CA C 348 52.703 52.703 51.588 1.115 18990 8939 1 13 . 1 1 348 348 ALA CB C 348 19.002 19.002 19.843 -0.841 18990 8940 1 13 . 1 1 348 348 ALA H H 348 8.227 8.227 8.626 -0.399 18990 8941 1 13 . 1 1 349 349 GLY N N 349 108.193 108.193 109.509 -1.316 18990 8942 1 13 . 1 1 349 349 GLY C C 349 174.269 174.269 174.262 0.007 18990 8943 1 13 . 1 1 349 349 GLY CA C 349 45.227 45.227 45.096 0.131 18990 8944 1 13 . 1 1 349 349 GLY H H 349 8.298 8.298 8.471 -0.173 18990 8945 1 13 . 1 1 350 350 GLY N N 350 108.073 108.073 109.192 -1.119 18990 8946 1 13 . 1 1 350 350 GLY C C 350 172.979 172.979 173.407 -0.428 18990 8947 1 13 . 1 1 350 350 GLY CA C 350 44.935 44.935 44.170 0.765 18990 8948 1 13 . 1 1 350 350 GLY H H 350 8.156 8.156 7.520 0.636 18990 8949 1 13 . 1 1 351 351 VAL N N 351 119.058 119.058 118.088 0.970 18990 8950 1 13 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.502 -0.086 18990 8951 1 13 . 1 1 351 351 VAL C C 351 173.412 173.412 175.018 -1.606 18990 8952 1 13 . 1 1 351 351 VAL CA C 351 60.663 60.663 61.002 -0.339 18990 8953 1 13 . 1 1 351 351 VAL CB C 351 34.866 34.866 34.712 0.154 18990 8954 1 13 . 1 1 351 351 VAL H H 351 8.541 8.541 8.524 0.017 18990 8955 1 13 . 1 1 352 352 LEU N N 352 125.800 125.800 120.236 5.564 18990 8956 1 13 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.615 0.150 18990 8957 1 13 . 1 1 352 352 LEU C C 352 176.218 176.218 175.489 0.729 18990 8958 1 13 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.783 -0.442 18990 8959 1 13 . 1 1 352 352 LEU CB C 352 42.706 42.706 44.706 -2.000 18990 8960 1 13 . 1 1 352 352 LEU H H 352 8.151 8.151 8.347 -0.196 18990 8961 1 13 . 1 1 353 353 CYS N N 353 126.825 126.825 123.294 3.531 18990 8962 1 13 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.229 -0.122 18990 8963 1 13 . 1 1 353 353 CYS C C 353 176.655 176.655 174.700 1.955 18990 8964 1 13 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.556 0.175 18990 8965 1 13 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.454 4.411 18990 8966 1 13 . 1 1 353 353 CYS H H 353 8.794 8.794 8.494 0.300 18990 8967 1 13 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.218 0.202 18990 8968 1 13 . 1 1 354 354 PRO C C 354 177.512 177.512 175.860 1.652 18990 8969 1 13 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.006 -0.014 18990 8970 1 13 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.023 1.544 18990 8971 1 13 . 1 1 355 355 GLN N N 355 126.800 126.800 119.026 7.774 18990 8972 1 13 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.523 -0.248 18990 8973 1 13 . 1 1 355 355 GLN C C 355 175.516 175.516 175.063 0.453 18990 8974 1 13 . 1 1 355 355 GLN CA C 355 54.793 54.793 52.848 1.945 18990 8975 1 13 . 1 1 355 355 GLN CB C 355 28.547 28.547 29.276 -0.729 18990 8976 1 13 . 1 1 355 355 GLN H H 355 9.033 9.033 7.294 1.739 18990 8977 1 13 . 1 1 357 357 GLY C C 357 173.229 173.229 174.869 -1.640 18990 8978 1 13 . 1 1 357 357 GLY CA C 357 45.254 45.254 45.230 0.024 18990 8979 1 13 . 1 1 358 358 CYS N N 358 123.500 123.500 117.065 6.435 18990 8980 1 13 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.718 -0.185 18990 8981 1 13 . 1 1 358 358 CYS C C 358 176.157 176.157 175.331 0.826 18990 8982 1 13 . 1 1 358 358 CYS CA C 358 60.268 60.268 58.109 2.159 18990 8983 1 13 . 1 1 358 358 CYS CB C 358 29.375 29.375 29.581 -0.206 18990 8984 1 13 . 1 1 358 358 CYS H H 358 7.720 7.720 7.142 0.578 18990 8985 1 13 . 1 1 359 359 GLY N N 359 104.400 104.400 107.222 -2.822 18990 8986 1 13 . 1 1 359 359 GLY C C 359 174.080 174.080 175.017 -0.937 18990 8987 1 13 . 1 1 359 359 GLY CA C 359 46.064 46.064 45.300 0.764 18990 8988 1 13 . 1 1 359 359 GLY H H 359 7.756 7.756 8.583 -0.827 18990 8989 1 13 . 1 1 360 360 MET N N 360 121.300 121.300 119.429 1.871 18990 8990 1 13 . 1 1 360 360 MET HA H 360 4.343 4.343 4.368 -0.025 18990 8991 1 13 . 1 1 360 360 MET C C 360 175.641 175.641 176.201 -0.560 18990 8992 1 13 . 1 1 360 360 MET CA C 360 55.923 55.923 56.123 -0.200 18990 8993 1 13 . 1 1 360 360 MET CB C 360 33.091 33.091 33.142 -0.051 18990 8994 1 13 . 1 1 360 360 MET H H 360 8.229 8.229 8.196 0.033 18990 8995 1 13 . 1 1 361 361 GLY N N 361 109.000 109.000 104.278 4.722 18990 8996 1 13 . 1 1 361 361 GLY C C 361 173.774 173.774 173.416 0.358 18990 8997 1 13 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.419 1.419 18990 8998 1 13 . 1 1 361 361 GLY H H 361 8.347 8.347 7.888 0.459 18990 8999 1 13 . 1 1 362 362 LEU N N 362 126.725 126.725 125.669 1.056 18990 9000 1 13 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.890 -0.215 18990 9001 1 13 . 1 1 362 362 LEU C C 362 175.865 175.865 175.225 0.640 18990 9002 1 13 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.273 0.916 18990 9003 1 13 . 1 1 362 362 LEU CB C 362 44.050 44.050 42.924 1.126 18990 9004 1 13 . 1 1 362 362 LEU H H 362 8.935 8.935 9.044 -0.109 18990 9005 1 13 . 1 1 363 363 LEU N N 363 123.742 123.742 127.046 -3.304 18990 9006 1 13 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.642 0.035 18990 9007 1 13 . 1 1 363 363 LEU C C 363 176.162 176.162 176.079 0.083 18990 9008 1 13 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.125 0.217 18990 9009 1 13 . 1 1 363 363 LEU CB C 363 42.210 42.210 42.203 0.007 18990 9010 1 13 . 1 1 363 363 LEU H H 363 8.481 8.481 8.782 -0.301 18990 9011 1 13 . 1 1 364 364 VAL N N 364 120.980 120.980 128.311 -7.331 18990 9012 1 13 . 1 1 364 364 VAL HA H 364 4.397 4.397 3.955 0.442 18990 9013 1 13 . 1 1 364 364 VAL C C 364 175.592 175.592 175.754 -0.162 18990 9014 1 13 . 1 1 364 364 VAL CA C 364 60.460 60.460 62.545 -2.085 18990 9015 1 13 . 1 1 364 364 VAL CB C 364 34.125 34.125 31.779 2.346 18990 9016 1 13 . 1 1 364 364 VAL H H 364 8.155 8.155 8.409 -0.254 18990 9017 1 13 . 1 1 365 365 GLU N N 365 126.950 126.950 128.921 -1.971 18990 9018 1 13 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.542 0.068 18990 9019 1 13 . 1 1 365 365 GLU C C 365 175.427 175.427 176.347 -0.920 18990 9020 1 13 . 1 1 365 365 GLU CA C 365 54.551 54.551 54.325 0.226 18990 9021 1 13 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.710 0.070 18990 9022 1 13 . 1 1 365 365 GLU H H 365 8.900 8.900 8.271 0.629 18990 9023 1 13 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.290 -0.028 18990 9024 1 13 . 1 1 366 366 PRO C C 366 177.013 177.013 176.473 0.540 18990 9025 1 13 . 1 1 366 366 PRO CA C 366 64.463 64.463 64.656 -0.193 18990 9026 1 13 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.888 0.160 18990 9027 1 13 . 1 1 367 367 ASP N N 367 115.459 115.459 115.357 0.102 18990 9028 1 13 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.614 -0.119 18990 9029 1 13 . 1 1 367 367 ASP C C 367 175.123 175.123 175.607 -0.484 18990 9030 1 13 . 1 1 367 367 ASP CA C 367 54.503 54.503 52.803 1.700 18990 9031 1 13 . 1 1 367 367 ASP CB C 367 40.123 40.123 39.444 0.679 18990 9032 1 13 . 1 1 367 367 ASP H H 367 8.439 8.439 8.221 0.218 18990 9033 1 13 . 1 1 368 368 CYS N N 368 118.700 118.700 122.076 -3.376 18990 9034 1 13 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.322 0.248 18990 9035 1 13 . 1 1 368 368 CYS C C 368 173.806 173.806 174.788 -0.982 18990 9036 1 13 . 1 1 368 368 CYS CA C 368 58.581 58.581 59.979 -1.398 18990 9037 1 13 . 1 1 368 368 CYS CB C 368 28.450 28.450 28.689 -0.238 18990 9038 1 13 . 1 1 368 368 CYS H H 368 7.515 7.515 7.907 -0.392 18990 9039 1 13 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.555 -0.290 18990 9040 1 13 . 1 1 369 369 ARG C C 369 174.908 174.908 175.544 -0.636 18990 9041 1 13 . 1 1 369 369 ARG CA C 369 57.669 57.669 55.429 2.240 18990 9042 1 13 . 1 1 369 369 ARG CB C 369 32.274 32.274 30.120 2.154 18990 9043 1 13 . 1 1 370 370 LYS N N 370 121.022 121.022 119.988 1.034 18990 9044 1 13 . 1 1 370 370 LYS HA H 370 4.170 4.170 3.682 0.488 18990 9045 1 13 . 1 1 370 370 LYS C C 370 174.868 174.868 173.788 1.080 18990 9046 1 13 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.687 0.867 18990 9047 1 13 . 1 1 370 370 LYS CB C 370 33.140 33.140 33.773 -0.633 18990 9048 1 13 . 1 1 370 370 LYS H H 370 7.740 7.740 7.283 0.457 18990 9049 1 13 . 1 1 371 371 VAL N N 371 128.362 128.362 126.408 1.954 18990 9050 1 13 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.109 0.024 18990 9051 1 13 . 1 1 371 371 VAL C C 371 173.402 173.402 174.025 -0.623 18990 9052 1 13 . 1 1 371 371 VAL CA C 371 60.777 60.777 60.944 -0.167 18990 9053 1 13 . 1 1 371 371 VAL CB C 371 33.000 33.000 33.214 -0.214 18990 9054 1 13 . 1 1 371 371 VAL H H 371 8.647 8.647 8.072 0.575 18990 9055 1 13 . 1 1 372 372 THR N N 372 119.667 119.667 122.819 -3.152 18990 9056 1 13 . 1 1 372 372 THR HA H 372 5.032 5.032 4.806 0.226 18990 9057 1 13 . 1 1 372 372 THR C C 372 174.339 174.339 173.379 0.960 18990 9058 1 13 . 1 1 372 372 THR CA C 372 60.881 60.881 60.810 0.071 18990 9059 1 13 . 1 1 372 372 THR CB C 372 70.471 70.471 71.649 -1.178 18990 9060 1 13 . 1 1 372 372 THR H H 372 8.087 8.087 8.048 0.039 18990 9061 1 13 . 1 1 373 373 CYS N N 373 132.554 132.554 126.149 6.405 18990 9062 1 13 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.492 0.310 18990 9063 1 13 . 1 1 373 373 CYS C C 373 176.791 176.791 175.843 0.948 18990 9064 1 13 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.060 -0.556 18990 9065 1 13 . 1 1 373 373 CYS CB C 373 28.311 28.311 25.220 3.091 18990 9066 1 13 . 1 1 373 373 CYS H H 373 9.322 9.322 9.038 0.284 18990 9067 1 13 . 1 1 374 374 GLN N N 374 125.890 125.890 124.887 1.003 18990 9068 1 13 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.312 -0.312 18990 9069 1 13 . 1 1 374 374 GLN C C 374 176.827 176.827 176.934 -0.107 18990 9070 1 13 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.689 0.611 18990 9071 1 13 . 1 1 374 374 GLN CB C 374 29.664 29.664 29.061 0.603 18990 9072 1 13 . 1 1 374 374 GLN H H 374 7.856 7.856 8.553 -0.697 18990 9073 1 13 . 1 1 375 375 ASN N N 375 115.342 115.342 116.386 -1.044 18990 9074 1 13 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.872 0.015 18990 9075 1 13 . 1 1 375 375 ASN C C 375 174.049 174.049 174.655 -0.606 18990 9076 1 13 . 1 1 375 375 ASN CA C 375 53.047 53.047 53.153 -0.106 18990 9077 1 13 . 1 1 375 375 ASN CB C 375 38.916 38.916 38.595 0.321 18990 9078 1 13 . 1 1 375 375 ASN H H 375 8.913 8.913 8.463 0.450 18990 9079 1 13 . 1 1 376 376 GLY N N 376 109.098 109.098 107.919 1.179 18990 9080 1 13 . 1 1 376 376 GLY C C 376 174.110 174.110 174.048 0.062 18990 9081 1 13 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.443 0.943 18990 9082 1 13 . 1 1 376 376 GLY H H 376 7.162 7.162 7.781 -0.619 18990 9083 1 13 . 1 1 377 377 CYS N N 377 132.546 132.546 119.712 12.834 18990 9084 1 13 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.990 -0.226 18990 9085 1 13 . 1 1 377 377 CYS C C 377 177.355 177.355 174.802 2.553 18990 9086 1 13 . 1 1 377 377 CYS CA C 377 59.988 59.988 57.316 2.672 18990 9087 1 13 . 1 1 377 377 CYS CB C 377 32.365 32.365 29.087 3.277 18990 9088 1 13 . 1 1 377 377 CYS H H 377 9.800 9.800 8.116 1.684 18990 9089 1 13 . 1 1 378 378 GLY N N 378 113.851 113.851 108.216 5.635 18990 9090 1 13 . 1 1 378 378 GLY C C 378 173.404 173.404 172.519 0.885 18990 9091 1 13 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.485 0.378 18990 9092 1 13 . 1 1 378 378 GLY H H 378 8.820 8.820 8.108 0.712 18990 9093 1 13 . 1 1 379 379 TYR N N 379 125.532 125.532 124.624 0.908 18990 9094 1 13 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.743 -0.265 18990 9095 1 13 . 1 1 379 379 TYR C C 379 173.661 173.661 173.648 0.013 18990 9096 1 13 . 1 1 379 379 TYR CA C 379 59.180 59.180 57.626 1.554 18990 9097 1 13 . 1 1 379 379 TYR CB C 379 40.108 40.108 41.563 -1.455 18990 9098 1 13 . 1 1 379 379 TYR H H 379 9.054 9.054 8.131 0.923 18990 9099 1 13 . 1 1 380 380 VAL N N 380 124.461 124.461 129.111 -4.650 18990 9100 1 13 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.921 -0.103 18990 9101 1 13 . 1 1 380 380 VAL C C 380 175.876 175.876 174.431 1.445 18990 9102 1 13 . 1 1 380 380 VAL CA C 380 60.797 60.797 60.682 0.115 18990 9103 1 13 . 1 1 380 380 VAL CB C 380 32.610 32.610 33.452 -0.842 18990 9104 1 13 . 1 1 380 380 VAL H H 380 7.238 7.238 8.126 -0.888 18990 9105 1 13 . 1 1 381 381 PHE N N 381 124.588 124.588 125.086 -0.498 18990 9106 1 13 . 1 1 381 381 PHE HA H 381 5.273 5.273 5.171 0.102 18990 9107 1 13 . 1 1 381 381 PHE C C 381 173.242 173.242 173.424 -0.182 18990 9108 1 13 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.495 -0.285 18990 9109 1 13 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.987 1.103 18990 9110 1 13 . 1 1 381 381 PHE H H 381 9.424 9.424 7.624 1.800 18990 9111 1 13 . 1 1 382 382 CYS N N 382 120.221 120.221 120.116 0.105 18990 9112 1 13 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.961 -0.059 18990 9113 1 13 . 1 1 382 382 CYS C C 382 177.165 177.165 176.029 1.136 18990 9114 1 13 . 1 1 382 382 CYS CA C 382 57.691 57.691 57.271 0.420 18990 9115 1 13 . 1 1 382 382 CYS CB C 382 32.475 32.475 29.609 2.866 18990 9116 1 13 . 1 1 382 382 CYS H H 382 8.673 8.673 8.618 0.055 18990 9117 1 13 . 1 1 383 383 ARG N N 383 129.347 129.347 121.412 7.935 18990 9118 1 13 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.476 -0.455 18990 9119 1 13 . 1 1 383 383 ARG C C 383 175.012 175.012 176.900 -1.888 18990 9120 1 13 . 1 1 383 383 ARG CA C 383 58.686 58.686 58.411 0.275 18990 9121 1 13 . 1 1 383 383 ARG CB C 383 30.900 30.900 30.449 0.451 18990 9122 1 13 . 1 1 383 383 ARG H H 383 9.534 9.534 8.869 0.665 18990 9123 1 13 . 1 1 384 384 ASN N N 384 117.772 117.772 116.550 1.222 18990 9124 1 13 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.777 -0.069 18990 9125 1 13 . 1 1 384 384 ASN C C 384 175.656 175.656 174.477 1.179 18990 9126 1 13 . 1 1 384 384 ASN CA C 384 55.778 55.778 53.868 1.910 18990 9127 1 13 . 1 1 384 384 ASN CB C 384 39.475 39.475 39.993 -0.518 18990 9128 1 13 . 1 1 384 384 ASN H H 384 8.840 8.840 8.181 0.659 18990 9129 1 13 . 1 1 385 385 CYS N N 385 115.876 115.876 115.899 -0.023 18990 9130 1 13 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.767 0.261 18990 9131 1 13 . 1 1 385 385 CYS C C 385 175.703 175.703 173.950 1.753 18990 9132 1 13 . 1 1 385 385 CYS CA C 385 58.112 58.112 57.947 0.165 18990 9133 1 13 . 1 1 385 385 CYS CB C 385 32.359 32.359 30.957 1.402 18990 9134 1 13 . 1 1 385 385 CYS H H 385 7.868 7.868 7.580 0.288 18990 9135 1 13 . 1 1 386 386 LEU N N 386 120.082 120.082 120.422 -0.340 18990 9136 1 13 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.720 -0.407 18990 9137 1 13 . 1 1 386 386 LEU C C 386 175.722 175.722 177.064 -1.342 18990 9138 1 13 . 1 1 386 386 LEU CA C 386 57.009 57.009 55.184 1.825 18990 9139 1 13 . 1 1 386 386 LEU CB C 386 38.412 38.412 42.211 -3.799 18990 9140 1 13 . 1 1 386 386 LEU H H 386 8.514 8.514 8.460 0.054 18990 9141 1 13 . 1 1 387 387 GLN N N 387 117.579 117.579 119.569 -1.990 18990 9142 1 13 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.301 0.475 18990 9143 1 13 . 1 1 387 387 GLN C C 387 175.299 175.299 175.594 -0.295 18990 9144 1 13 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.593 -1.575 18990 9145 1 13 . 1 1 387 387 GLN CB C 387 30.307 30.307 27.413 2.894 18990 9146 1 13 . 1 1 387 387 GLN H H 387 8.248 8.248 8.083 0.165 18990 9147 1 13 . 1 1 388 388 GLY N N 388 106.107 106.107 106.936 -0.829 18990 9148 1 13 . 1 1 388 388 GLY C C 388 173.693 173.693 174.283 -0.590 18990 9149 1 13 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.100 1.080 18990 9150 1 13 . 1 1 388 388 GLY H H 388 8.695 8.695 7.508 1.187 18990 9151 1 13 . 1 1 389 389 TYR N N 389 122.514 122.514 117.537 4.977 18990 9152 1 13 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.183 -0.525 18990 9153 1 13 . 1 1 389 389 TYR C C 389 172.860 172.860 174.178 -1.318 18990 9154 1 13 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.206 4.782 18990 9155 1 13 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.786 0.266 18990 9156 1 13 . 1 1 389 389 TYR H H 389 7.923 7.923 8.260 -0.337 18990 9157 1 13 . 1 1 390 390 HIS N N 390 120.080 120.080 118.181 1.899 18990 9158 1 13 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.570 0.138 18990 9159 1 13 . 1 1 390 390 HIS C C 390 173.235 173.235 174.909 -1.674 18990 9160 1 13 . 1 1 390 390 HIS CA C 390 51.431 51.431 54.552 -3.121 18990 9161 1 13 . 1 1 390 390 HIS CB C 390 31.900 31.900 30.337 1.563 18990 9162 1 13 . 1 1 390 390 HIS H H 390 5.291 5.291 7.958 -2.667 18990 9163 1 13 . 1 1 391 391 ILE N N 391 117.810 117.810 122.299 -4.489 18990 9164 1 13 . 1 1 391 391 ILE HA H 391 4.116 4.116 3.964 0.152 18990 9165 1 13 . 1 1 391 391 ILE C C 391 178.208 178.208 176.149 2.059 18990 9166 1 13 . 1 1 391 391 ILE CA C 391 60.877 60.877 61.750 -0.873 18990 9167 1 13 . 1 1 391 391 ILE CB C 391 39.034 39.034 38.147 0.887 18990 9168 1 13 . 1 1 391 391 ILE H H 391 8.418 8.418 8.408 0.010 18990 9169 1 13 . 1 1 392 392 GLY N N 392 112.387 112.387 114.979 -2.592 18990 9170 1 13 . 1 1 392 392 GLY C C 392 173.565 173.565 173.183 0.382 18990 9171 1 13 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.233 1.024 18990 9172 1 13 . 1 1 392 392 GLY H H 392 8.654 8.654 8.246 0.408 18990 9173 1 13 . 1 1 393 393 GLU N N 393 119.098 119.098 119.579 -0.481 18990 9174 1 13 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.444 -0.155 18990 9175 1 13 . 1 1 393 393 GLU C C 393 176.899 176.899 175.975 0.924 18990 9176 1 13 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.625 0.808 18990 9177 1 13 . 1 1 393 393 GLU CB C 393 30.470 30.470 30.431 0.039 18990 9178 1 13 . 1 1 393 393 GLU H H 393 8.391 8.391 8.278 0.113 18990 9179 1 13 . 1 1 394 394 CYS N N 394 122.845 122.845 120.115 2.730 18990 9180 1 13 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.367 -0.601 18990 9181 1 13 . 1 1 394 394 CYS C C 394 175.461 175.461 175.207 0.254 18990 9182 1 13 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.641 1.194 18990 9183 1 13 . 1 1 394 394 CYS CB C 394 30.761 30.761 27.674 3.087 18990 9184 1 13 . 1 1 394 394 CYS H H 394 8.474 8.474 8.343 0.131 18990 9185 1 13 . 1 1 395 395 LEU N N 395 124.403 124.403 122.278 2.125 18990 9186 1 13 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.609 -0.105 18990 9187 1 13 . 1 1 395 395 LEU C C 395 175.259 175.259 175.929 -0.670 18990 9188 1 13 . 1 1 395 395 LEU CA C 395 52.835 52.835 53.603 -0.768 18990 9189 1 13 . 1 1 395 395 LEU CB C 395 41.436 41.436 41.127 0.309 18990 9190 1 13 . 1 1 395 395 LEU H H 395 8.418 8.418 7.823 0.595 18990 9191 1 13 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.648 -0.278 18990 9192 1 13 . 1 1 396 396 PRO C C 396 177.006 177.006 176.250 0.756 18990 9193 1 13 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.470 0.626 18990 9194 1 13 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.950 -0.878 18990 9195 1 13 . 1 1 397 397 GLU N N 397 121.574 121.574 118.613 2.961 18990 9196 1 13 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.567 -0.342 18990 9197 1 13 . 1 1 397 397 GLU C C 397 177.202 177.202 176.166 1.036 18990 9198 1 13 . 1 1 397 397 GLU CA C 397 57.034 57.034 55.589 1.445 18990 9199 1 13 . 1 1 397 397 GLU CB C 397 30.263 30.263 31.188 -0.925 18990 9200 1 13 . 1 1 397 397 GLU H H 397 8.568 8.568 8.482 0.086 18990 9201 1 13 . 1 1 398 398 GLY N N 398 110.495 110.495 109.943 0.552 18990 9202 1 13 . 1 1 398 398 GLY C C 398 174.579 174.579 173.410 1.169 18990 9203 1 13 . 1 1 398 398 GLY CA C 398 45.462 45.462 45.518 -0.056 18990 9204 1 13 . 1 1 398 398 GLY H H 398 8.515 8.515 8.609 -0.094 18990 9205 1 13 . 1 1 399 399 THR N N 399 113.234 113.234 114.561 -1.327 18990 9206 1 13 . 1 1 399 399 THR HA H 399 4.398 4.398 4.606 -0.208 18990 9207 1 13 . 1 1 399 399 THR C C 399 175.333 175.333 173.473 1.860 18990 9208 1 13 . 1 1 399 399 THR CA C 399 62.233 62.233 61.578 0.655 18990 9209 1 13 . 1 1 399 399 THR CB C 399 69.833 69.833 69.796 0.037 18990 9210 1 13 . 1 1 399 399 THR H H 399 8.090 8.090 8.014 0.076 18990 9211 1 13 . 1 1 400 400 GLY N N 400 111.479 111.479 110.868 0.611 18990 9212 1 13 . 1 1 400 400 GLY C C 400 174.048 174.048 172.641 1.407 18990 9213 1 13 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.837 -0.398 18990 9214 1 13 . 1 1 400 400 GLY H H 400 8.524 8.524 8.346 0.178 18990 9215 1 13 . 1 1 401 401 ALA N N 401 123.919 123.919 124.750 -0.831 18990 9216 1 13 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.770 -0.519 18990 9217 1 13 . 1 1 401 401 ALA C C 401 177.942 177.942 176.479 1.463 18990 9218 1 13 . 1 1 401 401 ALA CA C 401 52.730 52.730 52.527 0.203 18990 9219 1 13 . 1 1 401 401 ALA CB C 401 19.142 19.142 19.461 -0.319 18990 9220 1 13 . 1 1 401 401 ALA H H 401 8.179 8.179 8.477 -0.298 18990 9221 1 13 . 1 1 402 402 SER N N 402 114.904 114.904 116.449 -1.545 18990 9222 1 13 . 1 1 402 402 SER HA H 402 4.448 4.448 4.737 -0.289 18990 9223 1 13 . 1 1 402 402 SER C C 402 174.426 174.426 173.245 1.181 18990 9224 1 13 . 1 1 402 402 SER CA C 402 58.289 58.289 58.467 -0.178 18990 9225 1 13 . 1 1 402 402 SER CB C 402 63.772 63.772 64.496 -0.724 18990 9226 1 13 . 1 1 402 402 SER H H 402 8.305 8.305 8.525 -0.220 18990 9227 1 13 . 1 1 403 403 ALA N N 403 125.965 125.965 126.435 -0.470 18990 9228 1 13 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.510 -0.111 18990 9229 1 13 . 1 1 403 403 ALA C C 403 177.984 177.984 176.351 1.633 18990 9230 1 13 . 1 1 403 403 ALA CA C 403 52.655 52.655 51.941 0.714 18990 9231 1 13 . 1 1 403 403 ALA CB C 403 19.138 19.138 19.985 -0.847 18990 9232 1 13 . 1 1 403 403 ALA H H 403 8.345 8.345 8.228 0.117 18990 9233 1 13 . 1 1 404 404 THR N N 404 112.790 112.790 117.966 -5.176 18990 9234 1 13 . 1 1 404 404 THR C C 404 174.420 174.420 174.390 0.030 18990 9235 1 13 . 1 1 404 404 THR CA C 404 61.988 61.988 62.264 -0.276 18990 9236 1 13 . 1 1 404 404 THR CB C 404 69.688 69.688 69.570 0.118 18990 9237 1 13 . 1 1 404 404 THR H H 404 8.118 8.118 8.258 -0.140 18990 9238 1 13 . 1 1 405 405 ASN N N 405 121.050 121.050 122.540 -1.490 18990 9239 1 13 . 1 1 405 405 ASN H H 405 8.396 8.396 8.568 -0.172 18990 9240 1 13 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.531 0.047 18990 9241 1 13 . 1 1 407 407 CYS C C 407 174.489 174.489 174.642 -0.153 18990 9242 1 13 . 1 1 407 407 CYS CA C 407 58.713 58.713 59.293 -0.580 18990 9243 1 13 . 1 1 407 407 CYS CB C 407 28.102 28.102 28.587 -0.485 18990 9244 1 13 . 1 1 408 408 GLU N N 408 123.021 123.021 126.513 -3.492 18990 9245 1 13 . 1 1 408 408 GLU C C 408 175.954 175.954 175.446 0.508 18990 9246 1 13 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.161 0.641 18990 9247 1 13 . 1 1 408 408 GLU CB C 408 30.328 30.328 30.038 0.290 18990 9248 1 13 . 1 1 408 408 GLU H H 408 8.415 8.415 8.776 -0.361 18990 9249 1 13 . 1 1 409 409 TYR N N 409 121.015 121.015 126.826 -5.811 18990 9250 1 13 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.752 -0.098 18990 9251 1 13 . 1 1 409 409 TYR C C 409 175.613 175.613 174.993 0.620 18990 9252 1 13 . 1 1 409 409 TYR CA C 409 57.669 57.669 57.681 -0.012 18990 9253 1 13 . 1 1 409 409 TYR CB C 409 38.825 38.825 39.361 -0.536 18990 9254 1 13 . 1 1 409 409 TYR H H 409 8.135 8.135 8.515 -0.380 18990 9255 1 13 . 1 1 410 410 THR N N 410 116.975 116.975 120.227 -3.252 18990 9256 1 13 . 1 1 410 410 THR HA H 410 4.306 4.306 4.427 -0.121 18990 9257 1 13 . 1 1 410 410 THR C C 410 173.846 173.846 174.558 -0.712 18990 9258 1 13 . 1 1 410 410 THR CA C 410 61.730 61.730 61.050 0.680 18990 9259 1 13 . 1 1 410 410 THR CB C 410 69.914 69.914 70.004 -0.090 18990 9260 1 13 . 1 1 410 410 THR H H 410 8.060 8.060 7.994 0.066 18990 9261 1 13 . 1 1 411 411 VAL N N 411 122.900 122.900 121.088 1.812 18990 9262 1 13 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.219 -0.166 18990 9263 1 13 . 1 1 411 411 VAL C C 411 175.275 175.275 175.706 -0.431 18990 9264 1 13 . 1 1 411 411 VAL CA C 411 61.853 61.853 61.415 0.438 18990 9265 1 13 . 1 1 411 411 VAL CB C 411 32.976 32.976 32.576 0.400 18990 9266 1 13 . 1 1 411 411 VAL H H 411 8.089 8.089 7.917 0.172 18990 9267 1 13 . 1 1 412 412 ASP N N 412 125.924 125.924 121.511 4.413 18990 9268 1 13 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.753 0.097 18990 9269 1 13 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.866 -1.288 18990 9270 1 13 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.107 0.431 18990 9271 1 13 . 1 1 412 412 ASP H H 412 8.397 8.397 8.368 0.029 18990 9272 1 13 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.351 0.035 18990 9273 1 13 . 1 1 413 413 PRO C C 413 177.352 177.352 175.619 1.733 18990 9274 1 13 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.564 1.346 18990 9275 1 13 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.166 0.102 18990 9276 1 13 . 1 1 414 414 ASN N N 414 117.035 117.035 118.557 -1.522 18990 9277 1 13 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.519 0.158 18990 9278 1 13 . 1 1 414 414 ASN C C 414 175.532 175.532 174.008 1.524 18990 9279 1 13 . 1 1 414 414 ASN CA C 414 53.824 53.824 53.447 0.377 18990 9280 1 13 . 1 1 414 414 ASN CB C 414 38.728 38.728 38.111 0.617 18990 9281 1 13 . 1 1 414 414 ASN H H 414 8.496 8.496 8.504 -0.008 18990 9282 1 13 . 1 1 415 415 ARG N N 415 121.000 121.000 124.840 -3.840 18990 9283 1 13 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.570 -0.326 18990 9284 1 13 . 1 1 415 415 ARG C C 415 176.243 176.243 174.413 1.830 18990 9285 1 13 . 1 1 415 415 ARG CA C 415 56.404 56.404 54.853 1.551 18990 9286 1 13 . 1 1 415 415 ARG CB C 415 30.637 30.637 31.586 -0.949 18990 9287 1 13 . 1 1 415 415 ARG H H 415 7.804 7.804 8.011 -0.207 18990 9288 1 13 . 1 1 416 416 ALA N N 416 124.880 124.880 126.644 -1.764 18990 9289 1 13 . 1 1 416 416 ALA C C 416 177.831 177.831 176.441 1.390 18990 9290 1 13 . 1 1 416 416 ALA CA C 416 52.957 52.957 52.044 0.913 18990 9291 1 13 . 1 1 416 416 ALA CB C 416 19.059 19.059 17.751 1.308 18990 9292 1 13 . 1 1 416 416 ALA H H 416 8.189 8.189 8.693 -0.504 18990 9293 1 13 . 1 1 417 417 ALA N N 417 122.614 122.614 126.768 -4.154 18990 9294 1 13 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.500 -0.253 18990 9295 1 13 . 1 1 417 417 ALA C C 417 178.024 178.024 175.682 2.342 18990 9296 1 13 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.733 1.056 18990 9297 1 13 . 1 1 417 417 ALA CB C 417 19.042 19.042 20.951 -1.909 18990 9298 1 13 . 1 1 417 417 ALA H H 417 8.169 8.169 8.423 -0.254 18990 9299 1 13 . 1 1 418 418 GLU N N 418 119.500 119.500 121.364 -1.864 18990 9300 1 13 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.700 -0.511 18990 9301 1 13 . 1 1 418 418 GLU C C 418 176.266 176.266 175.240 1.026 18990 9302 1 13 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.837 0.739 18990 9303 1 13 . 1 1 418 418 GLU CB C 418 30.307 30.307 30.021 0.286 18990 9304 1 13 . 1 1 418 418 GLU H H 418 8.184 8.184 8.606 -0.422 18990 9305 1 13 . 1 1 419 419 ALA N N 419 124.643 124.643 127.318 -2.675 18990 9306 1 13 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.580 -0.330 18990 9307 1 13 . 1 1 419 419 ALA C C 419 177.488 177.488 176.488 1.000 18990 9308 1 13 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.662 0.847 18990 9309 1 13 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.857 -1.696 18990 9310 1 13 . 1 1 419 419 ALA H H 419 8.135 8.135 8.732 -0.597 18990 9311 1 13 . 1 1 420 420 ARG N N 420 120.003 120.003 121.667 -1.664 18990 9312 1 13 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.706 -0.413 18990 9313 1 13 . 1 1 420 420 ARG C C 420 176.297 176.297 175.227 1.070 18990 9314 1 13 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.987 -0.054 18990 9315 1 13 . 1 1 420 420 ARG CB C 420 30.850 30.850 29.251 1.599 18990 9316 1 13 . 1 1 420 420 ARG H H 420 8.135 8.135 8.575 -0.440 18990 9317 1 13 . 1 1 421 421 TRP N N 421 122.280 122.280 124.653 -2.373 18990 9318 1 13 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.888 -0.225 18990 9319 1 13 . 1 1 421 421 TRP C C 421 175.856 175.856 174.238 1.618 18990 9320 1 13 . 1 1 421 421 TRP CA C 421 57.404 57.404 56.603 0.801 18990 9321 1 13 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.700 -1.263 18990 9322 1 13 . 1 1 421 421 TRP H H 421 8.159 8.159 8.254 -0.095 18990 9323 1 13 . 1 1 422 422 ASP N N 422 121.980 121.980 119.495 2.485 18990 9324 1 13 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.499 -0.004 18990 9325 1 13 . 1 1 422 422 ASP C C 422 176.184 176.184 174.834 1.350 18990 9326 1 13 . 1 1 422 422 ASP CA C 422 53.899 53.899 53.300 0.599 18990 9327 1 13 . 1 1 422 422 ASP CB C 422 40.948 40.948 44.396 -3.448 18990 9328 1 13 . 1 1 422 422 ASP H H 422 8.135 8.135 8.804 -0.669 18990 9329 1 13 . 1 1 423 423 GLU N N 423 121.990 121.990 120.325 1.665 18990 9330 1 13 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.397 -0.307 18990 9331 1 13 . 1 1 423 423 GLU C C 423 176.720 176.720 176.692 0.028 18990 9332 1 13 . 1 1 423 423 GLU CA C 423 57.169 57.169 57.217 -0.048 18990 9333 1 13 . 1 1 423 423 GLU CB C 423 30.156 30.156 30.176 -0.020 18990 9334 1 13 . 1 1 423 423 GLU H H 423 8.153 8.153 8.459 -0.306 18990 9335 1 13 . 1 1 424 424 ALA N N 424 123.900 123.900 121.445 2.455 18990 9336 1 13 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.124 0.156 18990 9337 1 13 . 1 1 424 424 ALA C C 424 178.095 178.095 176.470 1.625 18990 9338 1 13 . 1 1 424 424 ALA CA C 424 53.017 53.017 52.617 0.400 18990 9339 1 13 . 1 1 424 424 ALA CB C 424 19.086 19.086 17.617 1.469 18990 9340 1 13 . 1 1 424 424 ALA H H 424 8.243 8.243 8.171 0.072 18990 9341 1 13 . 1 1 425 425 SER N N 425 113.881 113.881 114.725 -0.844 18990 9342 1 13 . 1 1 425 425 SER HA H 425 4.387 4.387 4.608 -0.221 18990 9343 1 13 . 1 1 425 425 SER C C 425 174.338 174.338 173.916 0.422 18990 9344 1 13 . 1 1 425 425 SER CA C 425 58.546 58.546 57.895 0.651 18990 9345 1 13 . 1 1 425 425 SER CB C 425 63.784 63.784 63.877 -0.093 18990 9346 1 13 . 1 1 425 425 SER H H 425 8.063 8.063 8.048 0.015 18990 9347 1 13 . 1 1 426 426 ASN N N 426 121.032 121.032 124.315 -3.283 18990 9348 1 13 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.882 -0.176 18990 9349 1 13 . 1 1 426 426 ASN C C 426 175.046 175.046 174.704 0.342 18990 9350 1 13 . 1 1 426 426 ASN CA C 426 53.445 53.445 53.005 0.440 18990 9351 1 13 . 1 1 426 426 ASN CB C 426 38.847 38.847 39.033 -0.186 18990 9352 1 13 . 1 1 426 426 ASN H H 426 8.391 8.391 8.670 -0.279 18990 9353 1 13 . 1 1 427 427 VAL N N 427 119.463 119.463 121.305 -1.842 18990 9354 1 13 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.468 -0.275 18990 9355 1 13 . 1 1 427 427 VAL C C 427 176.213 176.213 175.969 0.244 18990 9356 1 13 . 1 1 427 427 VAL CA C 427 62.449 62.449 60.570 1.879 18990 9357 1 13 . 1 1 427 427 VAL CB C 427 32.865 32.865 33.072 -0.207 18990 9358 1 13 . 1 1 427 427 VAL H H 427 7.954 7.954 8.048 -0.094 18990 9359 1 13 . 1 1 428 428 THR N N 428 118.226 118.226 121.192 -2.966 18990 9360 1 13 . 1 1 428 428 THR HA H 428 4.353 4.353 4.522 -0.169 18990 9361 1 13 . 1 1 428 428 THR C C 428 174.361 174.361 173.355 1.006 18990 9362 1 13 . 1 1 428 428 THR CA C 428 62.065 62.065 61.971 0.094 18990 9363 1 13 . 1 1 428 428 THR CB C 428 69.729 69.729 68.559 1.170 18990 9364 1 13 . 1 1 428 428 THR H H 428 8.225 8.225 8.274 -0.049 18990 9365 1 13 . 1 1 429 429 ILE N N 429 123.910 123.910 125.337 -1.427 18990 9366 1 13 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.231 -0.043 18990 9367 1 13 . 1 1 429 429 ILE C C 429 175.774 175.774 175.498 0.276 18990 9368 1 13 . 1 1 429 429 ILE CA C 429 60.819 60.819 60.199 0.620 18990 9369 1 13 . 1 1 429 429 ILE CB C 429 38.719 38.719 38.497 0.222 18990 9370 1 13 . 1 1 429 429 ILE H H 429 8.148 8.148 8.180 -0.032 18990 9371 1 13 . 1 1 430 430 LYS N N 430 126.453 126.453 123.222 3.231 18990 9372 1 13 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.032 0.402 18990 9373 1 13 . 1 1 430 430 LYS C C 430 176.241 176.241 175.693 0.548 18990 9374 1 13 . 1 1 430 430 LYS CA C 430 55.937 55.937 56.608 -0.671 18990 9375 1 13 . 1 1 430 430 LYS CB C 430 33.164 33.164 31.505 1.659 18990 9376 1 13 . 1 1 430 430 LYS H H 430 8.406 8.406 8.710 -0.304 18990 9377 1 13 . 1 1 431 431 VAL N N 431 122.496 122.496 119.497 2.999 18990 9378 1 13 . 1 1 431 431 VAL HA H 431 4.280 4.280 3.957 0.323 18990 9379 1 13 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.846 -0.543 18990 9380 1 13 . 1 1 431 431 VAL CB C 431 33.132 33.132 32.025 1.107 18990 9381 1 13 . 1 1 431 431 VAL H H 431 8.312 8.312 8.023 0.289 18990 9382 1 13 . 1 1 432 432 SER HA H 432 4.486 4.486 4.573 -0.087 18990 9383 1 13 . 1 1 432 432 SER C C 432 173.834 173.834 173.954 -0.120 18990 9384 1 13 . 1 1 432 432 SER CA C 432 58.650 58.650 59.386 -0.736 18990 9385 1 13 . 1 1 432 432 SER CB C 432 64.152 64.152 63.739 0.413 18990 9386 1 13 . 1 1 433 433 THR N N 433 114.706 114.706 113.104 1.602 18990 9387 1 13 . 1 1 433 433 THR HA H 433 5.446 5.446 4.552 0.894 18990 9388 1 13 . 1 1 433 433 THR C C 433 173.979 173.979 174.482 -0.503 18990 9389 1 13 . 1 1 433 433 THR CA C 433 60.412 60.412 61.678 -1.266 18990 9390 1 13 . 1 1 433 433 THR CB C 433 71.896 71.896 69.925 1.971 18990 9391 1 13 . 1 1 433 433 THR H H 433 7.833 7.833 7.322 0.511 18990 9392 1 13 . 1 1 434 434 LYS N N 434 122.492 122.492 127.027 -4.535 18990 9393 1 13 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.914 -0.205 18990 9394 1 13 . 1 1 434 434 LYS C C 434 173.589 173.589 174.710 -1.121 18990 9395 1 13 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.723 1.652 18990 9396 1 13 . 1 1 434 434 LYS CB C 434 36.925 36.925 33.864 3.061 18990 9397 1 13 . 1 1 434 434 LYS H H 434 8.937 8.937 8.638 0.299 18990 9398 1 13 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.318 -0.051 18990 9399 1 13 . 1 1 435 435 PRO C C 435 175.238 175.238 176.408 -1.170 18990 9400 1 13 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.581 -1.659 18990 9401 1 13 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.395 -0.309 18990 9402 1 13 . 1 1 436 436 CYS N N 436 125.422 125.422 125.956 -0.534 18990 9403 1 13 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.214 -0.784 18990 9404 1 13 . 1 1 436 436 CYS C C 436 176.770 176.770 175.228 1.542 18990 9405 1 13 . 1 1 436 436 CYS CA C 436 57.016 57.016 57.287 -0.271 18990 9406 1 13 . 1 1 436 436 CYS CB C 436 31.698 31.698 28.107 3.591 18990 9407 1 13 . 1 1 436 436 CYS H H 436 7.768 7.768 8.749 -0.981 18990 9408 1 13 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.149 -0.291 18990 9409 1 13 . 1 1 437 437 PRO C C 437 173.608 173.608 175.932 -2.324 18990 9410 1 13 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.213 0.000 18990 9411 1 13 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.217 1.232 18990 9412 1 13 . 1 1 438 438 LYS N N 438 118.600 118.600 118.501 0.099 18990 9413 1 13 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.097 -0.127 18990 9414 1 13 . 1 1 438 438 LYS C C 438 176.887 176.887 177.386 -0.499 18990 9415 1 13 . 1 1 438 438 LYS CA C 438 57.687 57.687 56.838 0.849 18990 9416 1 13 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.288 -0.163 18990 9417 1 13 . 1 1 438 438 LYS H H 438 8.390 8.390 7.547 0.843 18990 9418 1 13 . 1 1 439 439 CYS N N 439 118.950 118.950 116.784 2.166 18990 9419 1 13 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.745 0.001 18990 9420 1 13 . 1 1 439 439 CYS C C 439 176.650 176.650 175.314 1.336 18990 9421 1 13 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.471 1.877 18990 9422 1 13 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.402 2.794 18990 9423 1 13 . 1 1 439 439 CYS H H 439 8.357 8.357 7.672 0.685 18990 9424 1 13 . 1 1 440 440 ARG N N 440 117.200 117.200 119.213 -2.013 18990 9425 1 13 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.106 -0.138 18990 9426 1 13 . 1 1 440 440 ARG C C 440 175.253 175.253 175.183 0.070 18990 9427 1 13 . 1 1 440 440 ARG CA C 440 56.900 56.900 57.172 -0.272 18990 9428 1 13 . 1 1 440 440 ARG CB C 440 26.041 26.041 28.516 -2.475 18990 9429 1 13 . 1 1 440 440 ARG H H 440 8.065 8.065 7.904 0.161 18990 9430 1 13 . 1 1 441 441 THR N N 441 122.400 122.400 112.420 9.980 18990 9431 1 13 . 1 1 441 441 THR HA H 441 4.371 4.371 4.632 -0.261 18990 9432 1 13 . 1 1 441 441 THR C C 441 173.702 173.702 173.299 0.403 18990 9433 1 13 . 1 1 441 441 THR CA C 441 63.194 63.194 59.361 3.833 18990 9434 1 13 . 1 1 441 441 THR CB C 441 68.933 68.933 69.390 -0.457 18990 9435 1 13 . 1 1 441 441 THR H H 441 8.643 8.643 7.539 1.104 18990 9436 1 13 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.363 -0.216 18990 9437 1 13 . 1 1 442 442 PRO C C 442 176.215 176.215 176.020 0.195 18990 9438 1 13 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.769 1.428 18990 9439 1 13 . 1 1 442 442 PRO CB C 442 32.044 32.044 30.971 1.073 18990 9440 1 13 . 1 1 443 443 THR N N 443 122.932 122.932 121.974 0.958 18990 9441 1 13 . 1 1 443 443 THR HA H 443 4.665 4.665 4.420 0.245 18990 9442 1 13 . 1 1 443 443 THR C C 443 172.133 172.133 174.684 -2.551 18990 9443 1 13 . 1 1 443 443 THR CA C 443 62.566 62.566 62.494 0.072 18990 9444 1 13 . 1 1 443 443 THR CB C 443 71.562 71.562 69.985 1.577 18990 9445 1 13 . 1 1 443 443 THR H H 443 9.116 9.116 8.611 0.505 18990 9446 1 13 . 1 1 444 444 GLU N N 444 126.390 126.390 126.356 0.034 18990 9447 1 13 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.251 0.691 18990 9448 1 13 . 1 1 444 444 GLU C C 444 175.292 175.292 175.451 -0.159 18990 9449 1 13 . 1 1 444 444 GLU CA C 444 55.049 55.049 56.711 -1.662 18990 9450 1 13 . 1 1 444 444 GLU CB C 444 31.861 31.861 29.855 2.006 18990 9451 1 13 . 1 1 444 444 GLU H H 444 8.720 8.720 8.840 -0.120 18990 9452 1 13 . 1 1 445 445 ARG N N 445 123.505 123.505 128.325 -4.820 18990 9453 1 13 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.347 -0.636 18990 9454 1 13 . 1 1 445 445 ARG C C 445 175.289 175.289 175.082 0.207 18990 9455 1 13 . 1 1 445 445 ARG CA C 445 55.856 55.856 55.800 0.056 18990 9456 1 13 . 1 1 445 445 ARG CB C 445 30.675 30.675 30.647 0.028 18990 9457 1 13 . 1 1 445 445 ARG H H 445 8.157 8.157 8.349 -0.192 18990 9458 1 13 . 1 1 446 446 ASP N N 446 126.800 126.800 127.571 -0.771 18990 9459 1 13 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.824 -0.183 18990 9460 1 13 . 1 1 446 446 ASP C C 446 176.020 176.020 176.136 -0.116 18990 9461 1 13 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.592 -0.640 18990 9462 1 13 . 1 1 446 446 ASP CB C 446 41.400 41.400 42.658 -1.258 18990 9463 1 13 . 1 1 446 446 ASP H H 446 8.476 8.476 8.335 0.141 18990 9464 1 13 . 1 1 447 447 GLY N N 447 111.262 111.262 113.929 -2.667 18990 9465 1 13 . 1 1 447 447 GLY C C 447 174.073 174.073 174.495 -0.422 18990 9466 1 13 . 1 1 447 447 GLY CA C 447 45.832 45.832 45.877 -0.045 18990 9467 1 13 . 1 1 447 447 GLY H H 447 8.056 8.056 8.725 -0.669 18990 9468 1 13 . 1 1 448 448 GLY N N 448 108.655 108.655 109.118 -0.463 18990 9469 1 13 . 1 1 448 448 GLY C C 448 174.020 174.020 173.766 0.254 18990 9470 1 13 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.634 0.633 18990 9471 1 13 . 1 1 448 448 GLY H H 448 8.380 8.380 8.037 0.343 18990 9472 1 13 . 1 1 449 449 CYS N N 449 120.628 120.628 121.819 -1.191 18990 9473 1 13 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.253 -0.257 18990 9474 1 13 . 1 1 449 449 CYS C C 449 174.855 174.855 174.737 0.118 18990 9475 1 13 . 1 1 449 449 CYS CA C 449 59.291 59.291 59.734 -0.443 18990 9476 1 13 . 1 1 449 449 CYS CB C 449 28.000 28.000 28.435 -0.435 18990 9477 1 13 . 1 1 449 449 CYS H H 449 7.832 7.832 7.616 0.216 18990 9478 1 13 . 1 1 450 450 MET N N 450 123.947 123.947 126.266 -2.319 18990 9479 1 13 . 1 1 450 450 MET HA H 450 4.551 4.551 4.257 0.294 18990 9480 1 13 . 1 1 450 450 MET C C 450 174.658 174.658 175.116 -0.458 18990 9481 1 13 . 1 1 450 450 MET CA C 450 54.970 54.970 56.385 -1.415 18990 9482 1 13 . 1 1 450 450 MET CB C 450 34.100 34.100 32.856 1.244 18990 9483 1 13 . 1 1 450 450 MET H H 450 8.916 8.916 8.339 0.577 18990 9484 1 13 . 1 1 451 451 HIS N N 451 120.490 120.490 119.540 0.950 18990 9485 1 13 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.464 -0.785 18990 9486 1 13 . 1 1 451 451 HIS C C 451 172.443 172.443 173.718 -1.275 18990 9487 1 13 . 1 1 451 451 HIS CA C 451 53.812 53.812 54.253 -0.441 18990 9488 1 13 . 1 1 451 451 HIS CB C 451 28.900 28.900 29.979 -1.079 18990 9489 1 13 . 1 1 451 451 HIS H H 451 7.557 7.557 7.363 0.194 18990 9490 1 13 . 1 1 452 452 MET N N 452 128.800 128.800 127.191 1.609 18990 9491 1 13 . 1 1 452 452 MET HA H 452 4.320 4.320 4.417 -0.097 18990 9492 1 13 . 1 1 452 452 MET C C 452 175.479 175.479 174.002 1.477 18990 9493 1 13 . 1 1 452 452 MET CA C 452 52.589 52.589 53.072 -0.483 18990 9494 1 13 . 1 1 452 452 MET CB C 452 28.074 28.074 31.829 -3.755 18990 9495 1 13 . 1 1 452 452 MET H H 452 9.087 9.087 8.003 1.084 18990 9496 1 13 . 1 1 453 453 VAL N N 453 122.200 122.200 124.422 -2.222 18990 9497 1 13 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.312 0.482 18990 9498 1 13 . 1 1 453 453 VAL C C 453 175.476 175.476 175.177 0.299 18990 9499 1 13 . 1 1 453 453 VAL CA C 453 61.380 61.380 61.300 0.080 18990 9500 1 13 . 1 1 453 453 VAL CB C 453 33.089 33.089 32.522 0.567 18990 9501 1 13 . 1 1 453 453 VAL H H 453 8.016 8.016 8.370 -0.354 18990 9502 1 13 . 1 1 454 454 CYS N N 454 130.353 130.353 128.946 1.407 18990 9503 1 13 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.712 -0.117 18990 9504 1 13 . 1 1 454 454 CYS C C 454 177.833 177.833 174.697 3.136 18990 9505 1 13 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.843 2.728 18990 9506 1 13 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.232 5.813 18990 9507 1 13 . 1 1 454 454 CYS H H 454 8.989 8.989 9.072 -0.083 18990 9508 1 13 . 1 1 455 455 THR N N 455 119.000 119.000 122.306 -3.306 18990 9509 1 13 . 1 1 455 455 THR HA H 455 4.393 4.393 4.373 0.020 18990 9510 1 13 . 1 1 455 455 THR C C 455 175.264 175.264 173.782 1.482 18990 9511 1 13 . 1 1 455 455 THR CA C 455 61.644 61.644 62.002 -0.358 18990 9512 1 13 . 1 1 455 455 THR CB C 455 69.400 69.400 68.552 0.848 18990 9513 1 13 . 1 1 455 455 THR H H 455 8.533 8.533 8.358 0.175 18990 9514 1 13 . 1 1 456 456 ARG N N 456 128.900 128.900 127.231 1.669 18990 9515 1 13 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.564 -0.339 18990 9516 1 13 . 1 1 456 456 ARG C C 456 177.782 177.782 174.937 2.845 18990 9517 1 13 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.482 2.468 18990 9518 1 13 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.752 -3.702 18990 9519 1 13 . 1 1 456 456 ARG H H 456 9.036 9.036 7.833 1.203 18990 9520 1 13 . 1 1 457 457 ALA N N 457 133.152 133.152 126.994 6.158 18990 9521 1 13 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.254 -0.108 18990 9522 1 13 . 1 1 457 457 ALA C C 457 178.757 178.757 177.628 1.129 18990 9523 1 13 . 1 1 457 457 ALA CA C 457 53.929 53.929 52.906 1.023 18990 9524 1 13 . 1 1 457 457 ALA CB C 457 17.710 17.710 17.766 -0.056 18990 9525 1 13 . 1 1 457 457 ALA H H 457 9.042 9.042 8.754 0.288 18990 9526 1 13 . 1 1 458 458 GLY N N 458 111.200 111.200 110.395 0.805 18990 9527 1 13 . 1 1 458 458 GLY C C 458 173.558 173.558 174.334 -0.776 18990 9528 1 13 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.730 0.706 18990 9529 1 13 . 1 1 458 458 GLY H H 458 8.830 8.830 8.395 0.435 18990 9530 1 13 . 1 1 459 459 CYS N N 459 123.040 123.040 120.075 2.965 18990 9531 1 13 . 1 1 459 459 CYS HA H 459 4.622 4.622 5.119 -0.497 18990 9532 1 13 . 1 1 459 459 CYS C C 459 176.591 176.591 174.938 1.653 18990 9533 1 13 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.213 1.286 18990 9534 1 13 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.221 0.953 18990 9535 1 13 . 1 1 459 459 CYS H H 459 8.042 8.042 8.395 -0.353 18990 9536 1 13 . 1 1 460 460 GLY N N 460 104.500 104.500 111.226 -6.726 18990 9537 1 13 . 1 1 460 460 GLY C C 460 173.716 173.716 174.024 -0.308 18990 9538 1 13 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.776 0.232 18990 9539 1 13 . 1 1 460 460 GLY H H 460 7.705 7.705 8.155 -0.450 18990 9540 1 13 . 1 1 461 461 PHE N N 461 124.949 124.949 121.137 3.812 18990 9541 1 13 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.585 -0.005 18990 9542 1 13 . 1 1 461 461 PHE C C 461 174.447 174.447 174.244 0.203 18990 9543 1 13 . 1 1 461 461 PHE CA C 461 59.946 59.946 58.068 1.878 18990 9544 1 13 . 1 1 461 461 PHE CB C 461 41.300 41.300 40.755 0.545 18990 9545 1 13 . 1 1 461 461 PHE H H 461 8.947 8.947 7.667 1.280 18990 9546 1 13 . 1 1 462 462 GLU N N 462 125.272 125.272 128.021 -2.749 18990 9547 1 13 . 1 1 462 462 GLU HA H 462 5.721 5.721 5.199 0.522 18990 9548 1 13 . 1 1 462 462 GLU C C 462 176.067 176.067 175.276 0.791 18990 9549 1 13 . 1 1 462 462 GLU CA C 462 54.624 54.624 55.127 -0.502 18990 9550 1 13 . 1 1 462 462 GLU CB C 462 31.255 31.255 31.710 -0.455 18990 9551 1 13 . 1 1 462 462 GLU H H 462 7.799 7.799 8.477 -0.678 18990 9552 1 13 . 1 1 463 463 TRP N N 463 121.524 121.524 120.753 0.771 18990 9553 1 13 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.524 -0.018 18990 9554 1 13 . 1 1 463 463 TRP C C 463 172.844 172.844 174.720 -1.876 18990 9555 1 13 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.841 -1.070 18990 9556 1 13 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.372 0.364 18990 9557 1 13 . 1 1 463 463 TRP H H 463 9.300 9.300 8.606 0.694 18990 9558 1 13 . 1 1 464 464 CYS N N 464 120.868 120.868 121.967 -1.099 18990 9559 1 13 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.834 0.582 18990 9560 1 13 . 1 1 464 464 CYS C C 464 177.213 177.213 176.409 0.804 18990 9561 1 13 . 1 1 464 464 CYS CA C 464 57.776 57.776 59.355 -1.579 18990 9562 1 13 . 1 1 464 464 CYS CB C 464 32.930 32.930 29.299 3.631 18990 9563 1 13 . 1 1 464 464 CYS H H 464 8.752 8.752 9.270 -0.518 18990 9564 1 13 . 1 1 465 465 TRP N N 465 131.209 131.209 128.125 3.084 18990 9565 1 13 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.444 -0.017 18990 9566 1 13 . 1 1 465 465 TRP C C 465 176.051 176.051 175.918 0.133 18990 9567 1 13 . 1 1 465 465 TRP CA C 465 60.763 60.763 60.087 0.676 18990 9568 1 13 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.698 1.428 18990 9569 1 13 . 1 1 465 465 TRP H H 465 9.809 9.809 8.277 1.532 18990 9570 1 13 . 1 1 466 466 VAL N N 466 118.233 118.233 115.835 2.398 18990 9571 1 13 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.503 0.121 18990 9572 1 13 . 1 1 466 466 VAL C C 466 178.943 178.943 176.293 2.650 18990 9573 1 13 . 1 1 466 466 VAL CA C 466 65.602 65.602 64.349 1.253 18990 9574 1 13 . 1 1 466 466 VAL CB C 466 33.172 33.172 32.311 0.861 18990 9575 1 13 . 1 1 466 466 VAL H H 466 8.627 8.627 7.580 1.047 18990 9576 1 13 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.819 -1.388 18990 9577 1 13 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.064 0.935 18990 9578 1 13 . 1 1 467 467 CYS CB C 467 31.870 31.870 26.485 5.385 18990 9579 1 13 . 1 1 467 467 CYS H H 467 7.820 7.820 8.018 -0.198 18990 9580 1 13 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.989 -0.953 18990 9581 1 13 . 1 1 468 468 GLN CA C 468 58.051 58.051 56.864 1.188 18990 9582 1 13 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.776 -2.300 18990 9583 1 13 . 1 1 469 469 THR HA H 469 4.685 4.685 4.651 0.034 18990 9584 1 13 . 1 1 469 469 THR C C 469 173.351 173.351 172.667 0.684 18990 9585 1 13 . 1 1 469 469 THR CA C 469 59.176 59.176 60.069 -0.893 18990 9586 1 13 . 1 1 469 469 THR CB C 469 71.775 71.775 71.325 0.450 18990 9587 1 13 . 1 1 470 470 GLU N N 470 120.940 120.940 120.993 -0.053 18990 9588 1 13 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.427 -0.134 18990 9589 1 13 . 1 1 470 470 GLU C C 470 175.539 175.539 176.575 -1.036 18990 9590 1 13 . 1 1 470 470 GLU CA C 470 57.015 57.015 56.139 0.876 18990 9591 1 13 . 1 1 470 470 GLU CB C 470 29.965 29.965 31.200 -1.235 18990 9592 1 13 . 1 1 470 470 GLU H H 470 8.912 8.912 8.643 0.269 18990 9593 1 13 . 1 1 471 471 TRP N N 471 126.998 126.998 129.849 -2.851 18990 9594 1 13 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.407 -0.114 18990 9595 1 13 . 1 1 471 471 TRP C C 471 175.408 175.408 175.043 0.365 18990 9596 1 13 . 1 1 471 471 TRP CA C 471 58.220 58.220 59.277 -1.057 18990 9597 1 13 . 1 1 471 471 TRP CB C 471 29.500 29.500 29.349 0.151 18990 9598 1 13 . 1 1 471 471 TRP H H 471 8.350 8.350 8.225 0.125 18990 9599 1 13 . 1 1 472 472 THR N N 472 117.480 117.480 118.104 -0.624 18990 9600 1 13 . 1 1 472 472 THR HA H 472 4.444 4.444 4.242 0.202 18990 9601 1 13 . 1 1 472 472 THR CA C 472 58.930 58.930 59.902 -0.972 18990 9602 1 13 . 1 1 472 472 THR H H 472 8.069 8.069 7.128 0.941 18990 9603 1 13 . 1 1 473 473 ARG HA H 473 3.773 3.773 3.886 -0.113 18990 9604 1 13 . 1 1 473 473 ARG C C 473 178.053 178.053 178.365 -0.312 18990 9605 1 13 . 1 1 473 473 ARG CA C 473 58.088 58.088 58.311 -0.223 18990 9606 1 13 . 1 1 473 473 ARG CB C 473 29.426 29.426 30.014 -0.588 18990 9607 1 13 . 1 1 474 474 ASP N N 474 119.900 119.900 121.338 -1.438 18990 9608 1 13 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.363 -0.148 18990 9609 1 13 . 1 1 474 474 ASP C C 474 178.197 178.197 176.548 1.649 18990 9610 1 13 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.964 -0.162 18990 9611 1 13 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.835 -0.653 18990 9612 1 13 . 1 1 474 474 ASP H H 474 7.718 7.718 7.962 -0.244 18990 9613 1 13 . 1 1 475 475 CYS N N 475 121.000 121.000 117.837 3.163 18990 9614 1 13 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.534 -1.167 18990 9615 1 13 . 1 1 475 475 CYS CA C 475 64.533 64.533 57.331 7.202 18990 9616 1 13 . 1 1 475 475 CYS CB C 475 29.092 29.092 25.936 3.155 18990 9617 1 13 . 1 1 475 475 CYS H H 475 6.953 6.953 8.330 -1.377 18990 9618 1 13 . 1 1 476 476 MET HA H 476 4.021 4.021 3.983 0.038 18990 9619 1 13 . 1 1 476 476 MET CA C 476 58.010 58.010 56.959 1.051 18990 9620 1 13 . 1 1 476 476 MET CB C 476 32.550 32.550 33.103 -0.554 18990 9621 1 13 . 1 1 477 477 GLY N N 477 111.938 111.938 104.216 7.722 18990 9622 1 13 . 1 1 477 477 GLY C C 477 174.406 174.406 173.736 0.670 18990 9623 1 13 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.684 0.933 18990 9624 1 13 . 1 1 477 477 GLY H H 477 9.155 9.155 7.890 1.265 18990 9625 1 13 . 1 1 478 478 ALA N N 478 121.900 121.900 123.946 -2.046 18990 9626 1 13 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.276 0.015 18990 9627 1 13 . 1 1 478 478 ALA C C 478 178.196 178.196 178.157 0.039 18990 9628 1 13 . 1 1 478 478 ALA CA C 478 53.440 53.440 54.002 -0.562 18990 9629 1 13 . 1 1 478 478 ALA CB C 478 20.390 20.390 19.347 1.043 18990 9630 1 13 . 1 1 478 478 ALA H H 478 7.347 7.347 8.251 -0.904 18990 9631 1 13 . 1 1 479 479 HIS N N 479 115.200 115.200 111.615 3.585 18990 9632 1 13 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.842 0.061 18990 9633 1 13 . 1 1 479 479 HIS C C 479 173.325 173.325 175.426 -2.101 18990 9634 1 13 . 1 1 479 479 HIS CA C 479 54.526 54.526 54.767 -0.241 18990 9635 1 13 . 1 1 479 479 HIS CB C 479 27.600 27.600 30.203 -2.603 18990 9636 1 13 . 1 1 479 479 HIS H H 479 8.297 8.297 7.515 0.782 18990 9637 1 13 . 1 1 480 480 TRP N N 480 121.780 121.780 121.934 -0.154 18990 9638 1 13 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.498 -0.203 18990 9639 1 13 . 1 1 480 480 TRP C C 480 175.568 175.568 176.049 -0.481 18990 9640 1 13 . 1 1 480 480 TRP CA C 480 58.358 58.358 58.788 -0.430 18990 9641 1 13 . 1 1 480 480 TRP CB C 480 29.550 29.550 29.642 -0.092 18990 9642 1 13 . 1 1 480 480 TRP H H 480 8.081 8.081 7.881 0.200 18990 9643 1 13 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.548 0.297 18990 9644 1 13 . 1 1 481 481 PHE C C 481 175.126 175.126 175.126 0.000 18990 9645 1 13 . 1 1 481 481 PHE CA C 481 56.471 56.471 58.491 -2.020 18990 9646 1 13 . 1 1 481 481 PHE CB C 481 41.006 41.006 39.126 1.880 18990 9647 1 14 . 1 1 343 343 GLU N N 343 121.045 121.045 122.830 -1.785 18990 9648 1 14 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.675 -0.510 18990 9649 1 14 . 1 1 343 343 GLU C C 343 176.529 176.529 175.698 0.831 18990 9650 1 14 . 1 1 343 343 GLU CA C 343 57.162 57.162 55.554 1.608 18990 9651 1 14 . 1 1 343 343 GLU CB C 343 30.204 30.204 31.460 -1.256 18990 9652 1 14 . 1 1 343 343 GLU H H 343 8.293 8.293 8.449 -0.156 18990 9653 1 14 . 1 1 344 344 TYR N N 344 121.000 121.000 121.941 -0.941 18990 9654 1 14 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.512 0.026 18990 9655 1 14 . 1 1 344 344 TYR C C 344 175.897 175.897 175.750 0.147 18990 9656 1 14 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.534 0.645 18990 9657 1 14 . 1 1 344 344 TYR CB C 344 38.600 38.600 37.616 0.984 18990 9658 1 14 . 1 1 344 344 TYR H H 344 8.040 8.040 8.731 -0.691 18990 9659 1 14 . 1 1 345 345 VAL N N 345 121.900 121.900 123.771 -1.871 18990 9660 1 14 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.067 -0.128 18990 9661 1 14 . 1 1 345 345 VAL C C 345 176.143 176.143 176.132 0.011 18990 9662 1 14 . 1 1 345 345 VAL CA C 345 62.867 62.867 62.761 0.106 18990 9663 1 14 . 1 1 345 345 VAL CB C 345 32.799 32.799 31.591 1.208 18990 9664 1 14 . 1 1 345 345 VAL H H 345 7.856 7.856 8.083 -0.227 18990 9665 1 14 . 1 1 346 346 LEU N N 346 124.950 124.950 125.982 -1.032 18990 9666 1 14 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.976 -0.733 18990 9667 1 14 . 1 1 346 346 LEU C C 346 177.747 177.747 174.892 2.855 18990 9668 1 14 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.230 1.270 18990 9669 1 14 . 1 1 346 346 LEU CB C 346 42.252 42.252 44.843 -2.591 18990 9670 1 14 . 1 1 346 346 LEU H H 346 8.127 8.127 8.373 -0.246 18990 9671 1 14 . 1 1 347 347 GLN N N 347 121.452 121.452 121.142 0.310 18990 9672 1 14 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.977 -0.691 18990 9673 1 14 . 1 1 347 347 GLN C C 347 175.833 175.833 173.983 1.850 18990 9674 1 14 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.407 0.581 18990 9675 1 14 . 1 1 347 347 GLN CB C 347 29.375 29.375 31.535 -2.160 18990 9676 1 14 . 1 1 347 347 GLN H H 347 8.270 8.270 9.181 -0.911 18990 9677 1 14 . 1 1 348 348 ALA N N 348 124.466 124.466 126.661 -2.195 18990 9678 1 14 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.620 -0.299 18990 9679 1 14 . 1 1 348 348 ALA C C 348 177.929 177.929 177.049 0.880 18990 9680 1 14 . 1 1 348 348 ALA CA C 348 52.703 52.703 51.815 0.888 18990 9681 1 14 . 1 1 348 348 ALA CB C 348 19.002 19.002 19.501 -0.499 18990 9682 1 14 . 1 1 348 348 ALA H H 348 8.227 8.227 8.603 -0.376 18990 9683 1 14 . 1 1 349 349 GLY N N 349 108.193 108.193 106.771 1.422 18990 9684 1 14 . 1 1 349 349 GLY C C 349 174.269 174.269 173.910 0.359 18990 9685 1 14 . 1 1 349 349 GLY CA C 349 45.227 45.227 44.825 0.402 18990 9686 1 14 . 1 1 349 349 GLY H H 349 8.298 8.298 8.262 0.036 18990 9687 1 14 . 1 1 350 350 GLY N N 350 108.073 108.073 107.473 0.600 18990 9688 1 14 . 1 1 350 350 GLY C C 350 172.979 172.979 172.924 0.055 18990 9689 1 14 . 1 1 350 350 GLY CA C 350 44.935 44.935 45.328 -0.393 18990 9690 1 14 . 1 1 350 350 GLY H H 350 8.156 8.156 7.964 0.192 18990 9691 1 14 . 1 1 351 351 VAL N N 351 119.058 119.058 119.117 -0.059 18990 9692 1 14 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.581 -0.165 18990 9693 1 14 . 1 1 351 351 VAL C C 351 173.412 173.412 174.982 -1.570 18990 9694 1 14 . 1 1 351 351 VAL CA C 351 60.663 60.663 60.556 0.107 18990 9695 1 14 . 1 1 351 351 VAL CB C 351 34.866 34.866 35.556 -0.690 18990 9696 1 14 . 1 1 351 351 VAL H H 351 8.541 8.541 8.611 -0.070 18990 9697 1 14 . 1 1 352 352 LEU N N 352 125.800 125.800 120.237 5.563 18990 9698 1 14 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.701 0.064 18990 9699 1 14 . 1 1 352 352 LEU C C 352 176.218 176.218 175.874 0.344 18990 9700 1 14 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.253 0.088 18990 9701 1 14 . 1 1 352 352 LEU CB C 352 42.706 42.706 44.534 -1.828 18990 9702 1 14 . 1 1 352 352 LEU H H 352 8.151 8.151 8.211 -0.060 18990 9703 1 14 . 1 1 353 353 CYS N N 353 126.825 126.825 122.384 4.441 18990 9704 1 14 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.155 -0.048 18990 9705 1 14 . 1 1 353 353 CYS C C 353 176.655 176.655 174.802 1.853 18990 9706 1 14 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.774 -0.043 18990 9707 1 14 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.425 4.440 18990 9708 1 14 . 1 1 353 353 CYS H H 353 8.794 8.794 8.527 0.267 18990 9709 1 14 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.205 0.215 18990 9710 1 14 . 1 1 354 354 PRO C C 354 177.512 177.512 176.071 1.441 18990 9711 1 14 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.408 -0.416 18990 9712 1 14 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.442 1.125 18990 9713 1 14 . 1 1 355 355 GLN N N 355 126.800 126.800 118.910 7.890 18990 9714 1 14 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.502 -0.227 18990 9715 1 14 . 1 1 355 355 GLN C C 355 175.516 175.516 175.051 0.465 18990 9716 1 14 . 1 1 355 355 GLN CA C 355 54.793 54.793 52.892 1.901 18990 9717 1 14 . 1 1 355 355 GLN CB C 355 28.547 28.547 29.256 -0.709 18990 9718 1 14 . 1 1 355 355 GLN H H 355 9.033 9.033 7.330 1.703 18990 9719 1 14 . 1 1 357 357 GLY C C 357 173.229 173.229 174.155 -0.926 18990 9720 1 14 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.621 0.633 18990 9721 1 14 . 1 1 358 358 CYS N N 358 123.500 123.500 118.713 4.787 18990 9722 1 14 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.934 -0.401 18990 9723 1 14 . 1 1 358 358 CYS C C 358 176.157 176.157 175.472 0.685 18990 9724 1 14 . 1 1 358 358 CYS CA C 358 60.268 60.268 58.922 1.346 18990 9725 1 14 . 1 1 358 358 CYS CB C 358 29.375 29.375 29.338 0.037 18990 9726 1 14 . 1 1 358 358 CYS H H 358 7.720 7.720 7.577 0.143 18990 9727 1 14 . 1 1 359 359 GLY N N 359 104.400 104.400 110.161 -5.761 18990 9728 1 14 . 1 1 359 359 GLY C C 359 174.080 174.080 175.113 -1.033 18990 9729 1 14 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.445 -0.381 18990 9730 1 14 . 1 1 359 359 GLY H H 359 7.756 7.756 8.359 -0.603 18990 9731 1 14 . 1 1 360 360 MET N N 360 121.300 121.300 119.030 2.270 18990 9732 1 14 . 1 1 360 360 MET HA H 360 4.343 4.343 4.276 0.067 18990 9733 1 14 . 1 1 360 360 MET C C 360 175.641 175.641 177.128 -1.487 18990 9734 1 14 . 1 1 360 360 MET CA C 360 55.923 55.923 57.242 -1.319 18990 9735 1 14 . 1 1 360 360 MET CB C 360 33.091 33.091 33.788 -0.697 18990 9736 1 14 . 1 1 360 360 MET H H 360 8.229 8.229 7.516 0.713 18990 9737 1 14 . 1 1 361 361 GLY N N 361 109.000 109.000 104.345 4.655 18990 9738 1 14 . 1 1 361 361 GLY C C 361 173.774 173.774 172.894 0.880 18990 9739 1 14 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.766 1.072 18990 9740 1 14 . 1 1 361 361 GLY H H 361 8.347 8.347 7.885 0.462 18990 9741 1 14 . 1 1 362 362 LEU N N 362 126.725 126.725 125.254 1.471 18990 9742 1 14 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.891 -0.216 18990 9743 1 14 . 1 1 362 362 LEU C C 362 175.865 175.865 175.648 0.217 18990 9744 1 14 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.115 1.075 18990 9745 1 14 . 1 1 362 362 LEU CB C 362 44.050 44.050 44.480 -0.430 18990 9746 1 14 . 1 1 362 362 LEU H H 362 8.935 8.935 9.009 -0.074 18990 9747 1 14 . 1 1 363 363 LEU N N 363 123.742 123.742 126.893 -3.151 18990 9748 1 14 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.554 0.123 18990 9749 1 14 . 1 1 363 363 LEU C C 363 176.162 176.162 175.556 0.606 18990 9750 1 14 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.550 -0.208 18990 9751 1 14 . 1 1 363 363 LEU CB C 363 42.210 42.210 41.695 0.515 18990 9752 1 14 . 1 1 363 363 LEU H H 363 8.481 8.481 8.795 -0.314 18990 9753 1 14 . 1 1 364 364 VAL N N 364 120.980 120.980 127.932 -6.952 18990 9754 1 14 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.306 0.091 18990 9755 1 14 . 1 1 364 364 VAL C C 364 175.592 175.592 175.394 0.198 18990 9756 1 14 . 1 1 364 364 VAL CA C 364 60.460 60.460 61.190 -0.730 18990 9757 1 14 . 1 1 364 364 VAL CB C 364 34.125 34.125 32.733 1.392 18990 9758 1 14 . 1 1 364 364 VAL H H 364 8.155 8.155 8.120 0.035 18990 9759 1 14 . 1 1 365 365 GLU N N 365 126.950 126.950 127.931 -0.981 18990 9760 1 14 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.471 0.139 18990 9761 1 14 . 1 1 365 365 GLU C C 365 175.427 175.427 176.464 -1.037 18990 9762 1 14 . 1 1 365 365 GLU CA C 365 54.551 54.551 54.883 -0.332 18990 9763 1 14 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.128 0.652 18990 9764 1 14 . 1 1 365 365 GLU H H 365 8.900 8.900 8.684 0.216 18990 9765 1 14 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.109 0.153 18990 9766 1 14 . 1 1 366 366 PRO C C 366 177.013 177.013 177.756 -0.743 18990 9767 1 14 . 1 1 366 366 PRO CA C 366 64.463 64.463 65.605 -1.142 18990 9768 1 14 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.763 0.285 18990 9769 1 14 . 1 1 367 367 ASP N N 367 115.459 115.459 114.666 0.793 18990 9770 1 14 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.575 -0.080 18990 9771 1 14 . 1 1 367 367 ASP C C 367 175.123 175.123 175.691 -0.568 18990 9772 1 14 . 1 1 367 367 ASP CA C 367 54.503 54.503 53.821 0.682 18990 9773 1 14 . 1 1 367 367 ASP CB C 367 40.123 40.123 40.158 -0.035 18990 9774 1 14 . 1 1 367 367 ASP H H 367 8.439 8.439 8.905 -0.466 18990 9775 1 14 . 1 1 368 368 CYS N N 368 118.700 118.700 120.759 -2.059 18990 9776 1 14 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.462 0.108 18990 9777 1 14 . 1 1 368 368 CYS C C 368 173.806 173.806 174.652 -0.846 18990 9778 1 14 . 1 1 368 368 CYS CA C 368 58.581 58.581 59.349 -0.768 18990 9779 1 14 . 1 1 368 368 CYS CB C 368 28.450 28.450 29.584 -1.134 18990 9780 1 14 . 1 1 368 368 CYS H H 368 7.515 7.515 7.741 -0.226 18990 9781 1 14 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.430 -0.165 18990 9782 1 14 . 1 1 369 369 ARG C C 369 174.908 174.908 174.878 0.030 18990 9783 1 14 . 1 1 369 369 ARG CA C 369 57.669 57.669 53.946 3.723 18990 9784 1 14 . 1 1 369 369 ARG CB C 369 32.274 32.274 29.277 2.997 18990 9785 1 14 . 1 1 370 370 LYS N N 370 121.022 121.022 121.148 -0.126 18990 9786 1 14 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.699 -0.529 18990 9787 1 14 . 1 1 370 370 LYS C C 370 174.868 174.868 174.831 0.037 18990 9788 1 14 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.507 1.047 18990 9789 1 14 . 1 1 370 370 LYS CB C 370 33.140 33.140 34.796 -1.656 18990 9790 1 14 . 1 1 370 370 LYS H H 370 7.740 7.740 7.428 0.312 18990 9791 1 14 . 1 1 371 371 VAL N N 371 128.362 128.362 121.481 6.881 18990 9792 1 14 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.456 -0.323 18990 9793 1 14 . 1 1 371 371 VAL C C 371 173.402 173.402 174.557 -1.155 18990 9794 1 14 . 1 1 371 371 VAL CA C 371 60.777 60.777 61.340 -0.563 18990 9795 1 14 . 1 1 371 371 VAL CB C 371 33.000 33.000 33.892 -0.892 18990 9796 1 14 . 1 1 371 371 VAL H H 371 8.647 8.647 8.377 0.270 18990 9797 1 14 . 1 1 372 372 THR N N 372 119.667 119.667 117.947 1.720 18990 9798 1 14 . 1 1 372 372 THR HA H 372 5.032 5.032 4.654 0.378 18990 9799 1 14 . 1 1 372 372 THR C C 372 174.339 174.339 173.857 0.482 18990 9800 1 14 . 1 1 372 372 THR CA C 372 60.881 60.881 61.763 -0.882 18990 9801 1 14 . 1 1 372 372 THR CB C 372 70.471 70.471 71.159 -0.688 18990 9802 1 14 . 1 1 372 372 THR H H 372 8.087 8.087 8.152 -0.065 18990 9803 1 14 . 1 1 373 373 CYS N N 373 132.554 132.554 127.124 5.430 18990 9804 1 14 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.604 0.198 18990 9805 1 14 . 1 1 373 373 CYS C C 373 176.791 176.791 175.939 0.852 18990 9806 1 14 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.060 -0.556 18990 9807 1 14 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.981 3.330 18990 9808 1 14 . 1 1 373 373 CYS H H 373 9.322 9.322 9.391 -0.069 18990 9809 1 14 . 1 1 374 374 GLN N N 374 125.890 125.890 124.639 1.251 18990 9810 1 14 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.340 -0.340 18990 9811 1 14 . 1 1 374 374 GLN C C 374 176.827 176.827 176.822 0.005 18990 9812 1 14 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.309 0.990 18990 9813 1 14 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.533 1.131 18990 9814 1 14 . 1 1 374 374 GLN H H 374 7.856 7.856 8.316 -0.460 18990 9815 1 14 . 1 1 375 375 ASN N N 375 115.342 115.342 116.154 -0.812 18990 9816 1 14 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.758 0.129 18990 9817 1 14 . 1 1 375 375 ASN C C 375 174.049 174.049 174.976 -0.927 18990 9818 1 14 . 1 1 375 375 ASN CA C 375 53.047 53.047 53.230 -0.182 18990 9819 1 14 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.246 -0.330 18990 9820 1 14 . 1 1 375 375 ASN H H 375 8.913 8.913 8.303 0.610 18990 9821 1 14 . 1 1 376 376 GLY N N 376 109.098 109.098 107.265 1.833 18990 9822 1 14 . 1 1 376 376 GLY C C 376 174.110 174.110 172.849 1.261 18990 9823 1 14 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.331 1.055 18990 9824 1 14 . 1 1 376 376 GLY H H 376 7.162 7.162 7.306 -0.144 18990 9825 1 14 . 1 1 377 377 CYS N N 377 132.546 132.546 121.856 10.690 18990 9826 1 14 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.838 -0.074 18990 9827 1 14 . 1 1 377 377 CYS C C 377 177.355 177.355 175.912 1.443 18990 9828 1 14 . 1 1 377 377 CYS CA C 377 59.988 59.988 56.649 3.339 18990 9829 1 14 . 1 1 377 377 CYS CB C 377 32.365 32.365 26.086 6.279 18990 9830 1 14 . 1 1 377 377 CYS H H 377 9.800 9.800 8.271 1.529 18990 9831 1 14 . 1 1 378 378 GLY N N 378 113.851 113.851 112.808 1.043 18990 9832 1 14 . 1 1 378 378 GLY C C 378 173.404 173.404 173.048 0.356 18990 9833 1 14 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.459 0.404 18990 9834 1 14 . 1 1 378 378 GLY H H 378 8.820 8.820 8.532 0.288 18990 9835 1 14 . 1 1 379 379 TYR N N 379 125.532 125.532 126.500 -0.968 18990 9836 1 14 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.803 -0.325 18990 9837 1 14 . 1 1 379 379 TYR C C 379 173.661 173.661 174.484 -0.823 18990 9838 1 14 . 1 1 379 379 TYR CA C 379 59.180 59.180 57.233 1.947 18990 9839 1 14 . 1 1 379 379 TYR CB C 379 40.108 40.108 42.186 -2.078 18990 9840 1 14 . 1 1 379 379 TYR H H 379 9.054 9.054 7.915 1.139 18990 9841 1 14 . 1 1 380 380 VAL N N 380 124.461 124.461 127.293 -2.832 18990 9842 1 14 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.004 0.814 18990 9843 1 14 . 1 1 380 380 VAL C C 380 175.876 175.876 174.935 0.941 18990 9844 1 14 . 1 1 380 380 VAL CA C 380 60.797 60.797 62.383 -1.586 18990 9845 1 14 . 1 1 380 380 VAL CB C 380 32.610 32.610 29.998 2.612 18990 9846 1 14 . 1 1 380 380 VAL H H 380 7.238 7.238 7.965 -0.727 18990 9847 1 14 . 1 1 381 381 PHE N N 381 124.588 124.588 124.182 0.406 18990 9848 1 14 . 1 1 381 381 PHE HA H 381 5.273 5.273 4.966 0.307 18990 9849 1 14 . 1 1 381 381 PHE C C 381 173.242 173.242 174.067 -0.825 18990 9850 1 14 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.100 0.110 18990 9851 1 14 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.067 2.023 18990 9852 1 14 . 1 1 381 381 PHE H H 381 9.424 9.424 7.852 1.572 18990 9853 1 14 . 1 1 382 382 CYS N N 382 120.221 120.221 119.886 0.335 18990 9854 1 14 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.537 0.365 18990 9855 1 14 . 1 1 382 382 CYS C C 382 177.165 177.165 175.671 1.494 18990 9856 1 14 . 1 1 382 382 CYS CA C 382 57.691 57.691 58.017 -0.326 18990 9857 1 14 . 1 1 382 382 CYS CB C 382 32.475 32.475 29.506 2.969 18990 9858 1 14 . 1 1 382 382 CYS H H 382 8.673 8.673 8.587 0.086 18990 9859 1 14 . 1 1 383 383 ARG N N 383 129.347 129.347 121.355 7.992 18990 9860 1 14 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.259 -0.238 18990 9861 1 14 . 1 1 383 383 ARG C C 383 175.012 175.012 176.531 -1.519 18990 9862 1 14 . 1 1 383 383 ARG CA C 383 58.686 58.686 58.407 0.279 18990 9863 1 14 . 1 1 383 383 ARG CB C 383 30.900 30.900 30.601 0.299 18990 9864 1 14 . 1 1 383 383 ARG H H 383 9.534 9.534 8.750 0.784 18990 9865 1 14 . 1 1 384 384 ASN N N 384 117.772 117.772 117.148 0.624 18990 9866 1 14 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.698 0.010 18990 9867 1 14 . 1 1 384 384 ASN C C 384 175.656 175.656 175.090 0.566 18990 9868 1 14 . 1 1 384 384 ASN CA C 384 55.778 55.778 53.648 2.130 18990 9869 1 14 . 1 1 384 384 ASN CB C 384 39.475 39.475 39.025 0.450 18990 9870 1 14 . 1 1 384 384 ASN H H 384 8.840 8.840 8.773 0.067 18990 9871 1 14 . 1 1 385 385 CYS N N 385 115.876 115.876 115.482 0.394 18990 9872 1 14 . 1 1 385 385 CYS HA H 385 5.028 5.028 5.018 0.010 18990 9873 1 14 . 1 1 385 385 CYS C C 385 175.703 175.703 173.819 1.884 18990 9874 1 14 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.787 1.325 18990 9875 1 14 . 1 1 385 385 CYS CB C 385 32.359 32.359 30.834 1.525 18990 9876 1 14 . 1 1 385 385 CYS H H 385 7.868 7.868 7.814 0.054 18990 9877 1 14 . 1 1 386 386 LEU N N 386 120.082 120.082 119.570 0.512 18990 9878 1 14 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.724 -0.411 18990 9879 1 14 . 1 1 386 386 LEU C C 386 175.722 175.722 177.101 -1.379 18990 9880 1 14 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.400 2.609 18990 9881 1 14 . 1 1 386 386 LEU CB C 386 38.412 38.412 41.705 -3.293 18990 9882 1 14 . 1 1 386 386 LEU H H 386 8.514 8.514 8.399 0.115 18990 9883 1 14 . 1 1 387 387 GLN N N 387 117.579 117.579 120.508 -2.929 18990 9884 1 14 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.312 0.464 18990 9885 1 14 . 1 1 387 387 GLN C C 387 175.299 175.299 176.605 -1.306 18990 9886 1 14 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.319 -1.302 18990 9887 1 14 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.581 1.726 18990 9888 1 14 . 1 1 387 387 GLN H H 387 8.248 8.248 7.872 0.376 18990 9889 1 14 . 1 1 388 388 GLY N N 388 106.107 106.107 108.219 -2.112 18990 9890 1 14 . 1 1 388 388 GLY C C 388 173.693 173.693 173.571 0.122 18990 9891 1 14 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.321 0.859 18990 9892 1 14 . 1 1 388 388 GLY H H 388 8.695 8.695 8.273 0.422 18990 9893 1 14 . 1 1 389 389 TYR N N 389 122.514 122.514 116.832 5.682 18990 9894 1 14 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.132 -0.474 18990 9895 1 14 . 1 1 389 389 TYR C C 389 172.860 172.860 174.402 -1.542 18990 9896 1 14 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.960 4.027 18990 9897 1 14 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.655 0.397 18990 9898 1 14 . 1 1 389 389 TYR H H 389 7.923 7.923 8.154 -0.231 18990 9899 1 14 . 1 1 390 390 HIS N N 390 120.080 120.080 122.811 -2.731 18990 9900 1 14 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.681 0.027 18990 9901 1 14 . 1 1 390 390 HIS C C 390 173.235 173.235 173.919 -0.684 18990 9902 1 14 . 1 1 390 390 HIS CA C 390 51.431 51.431 55.966 -4.535 18990 9903 1 14 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.541 0.359 18990 9904 1 14 . 1 1 390 390 HIS H H 390 5.291 5.291 8.390 -3.099 18990 9905 1 14 . 1 1 391 391 ILE N N 391 117.810 117.810 120.031 -2.221 18990 9906 1 14 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.165 -0.049 18990 9907 1 14 . 1 1 391 391 ILE C C 391 178.208 178.208 174.908 3.300 18990 9908 1 14 . 1 1 391 391 ILE CA C 391 60.877 60.877 59.283 1.593 18990 9909 1 14 . 1 1 391 391 ILE CB C 391 39.034 39.034 40.541 -1.507 18990 9910 1 14 . 1 1 391 391 ILE H H 391 8.418 8.418 6.743 1.675 18990 9911 1 14 . 1 1 392 392 GLY N N 392 112.387 112.387 111.271 1.116 18990 9912 1 14 . 1 1 392 392 GLY C C 392 173.565 173.565 174.128 -0.563 18990 9913 1 14 . 1 1 392 392 GLY CA C 392 45.258 45.258 45.957 -0.699 18990 9914 1 14 . 1 1 392 392 GLY H H 392 8.654 8.654 8.246 0.408 18990 9915 1 14 . 1 1 393 393 GLU N N 393 119.098 119.098 120.545 -1.447 18990 9916 1 14 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.568 -0.279 18990 9917 1 14 . 1 1 393 393 GLU C C 393 176.899 176.899 174.942 1.957 18990 9918 1 14 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.228 1.204 18990 9919 1 14 . 1 1 393 393 GLU CB C 393 30.470 30.470 30.355 0.115 18990 9920 1 14 . 1 1 393 393 GLU H H 393 8.391 8.391 8.277 0.114 18990 9921 1 14 . 1 1 394 394 CYS N N 394 122.845 122.845 123.523 -0.678 18990 9922 1 14 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.713 -0.947 18990 9923 1 14 . 1 1 394 394 CYS C C 394 175.461 175.461 174.346 1.115 18990 9924 1 14 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.470 1.365 18990 9925 1 14 . 1 1 394 394 CYS CB C 394 30.761 30.761 28.202 2.559 18990 9926 1 14 . 1 1 394 394 CYS H H 394 8.474 8.474 8.761 -0.287 18990 9927 1 14 . 1 1 395 395 LEU N N 395 124.403 124.403 126.244 -1.841 18990 9928 1 14 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.936 -0.432 18990 9929 1 14 . 1 1 395 395 LEU C C 395 175.259 175.259 175.499 -0.240 18990 9930 1 14 . 1 1 395 395 LEU CA C 395 52.835 52.835 53.139 -0.304 18990 9931 1 14 . 1 1 395 395 LEU CB C 395 41.436 41.436 42.596 -1.160 18990 9932 1 14 . 1 1 395 395 LEU H H 395 8.418 8.418 8.509 -0.091 18990 9933 1 14 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.843 -0.473 18990 9934 1 14 . 1 1 396 396 PRO C C 396 177.006 177.006 175.431 1.575 18990 9935 1 14 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.671 0.425 18990 9936 1 14 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.812 -0.740 18990 9937 1 14 . 1 1 397 397 GLU N N 397 121.574 121.574 117.220 4.354 18990 9938 1 14 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.923 -0.698 18990 9939 1 14 . 1 1 397 397 GLU C C 397 177.202 177.202 175.095 2.107 18990 9940 1 14 . 1 1 397 397 GLU CA C 397 57.034 57.034 54.925 2.109 18990 9941 1 14 . 1 1 397 397 GLU CB C 397 30.263 30.263 32.072 -1.809 18990 9942 1 14 . 1 1 397 397 GLU H H 397 8.568 8.568 8.837 -0.269 18990 9943 1 14 . 1 1 398 398 GLY N N 398 110.495 110.495 109.001 1.494 18990 9944 1 14 . 1 1 398 398 GLY C C 398 174.579 174.579 173.090 1.489 18990 9945 1 14 . 1 1 398 398 GLY CA C 398 45.462 45.462 44.724 0.738 18990 9946 1 14 . 1 1 398 398 GLY H H 398 8.515 8.515 8.366 0.149 18990 9947 1 14 . 1 1 399 399 THR N N 399 113.234 113.234 113.839 -0.605 18990 9948 1 14 . 1 1 399 399 THR HA H 399 4.398 4.398 4.767 -0.369 18990 9949 1 14 . 1 1 399 399 THR C C 399 175.333 175.333 174.146 1.187 18990 9950 1 14 . 1 1 399 399 THR CA C 399 62.233 62.233 61.757 0.476 18990 9951 1 14 . 1 1 399 399 THR CB C 399 69.833 69.833 69.868 -0.035 18990 9952 1 14 . 1 1 399 399 THR H H 399 8.090 8.090 7.802 0.288 18990 9953 1 14 . 1 1 400 400 GLY N N 400 111.479 111.479 111.772 -0.293 18990 9954 1 14 . 1 1 400 400 GLY C C 400 174.048 174.048 172.737 1.311 18990 9955 1 14 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.521 -0.082 18990 9956 1 14 . 1 1 400 400 GLY H H 400 8.524 8.524 8.252 0.272 18990 9957 1 14 . 1 1 401 401 ALA N N 401 123.919 123.919 123.220 0.699 18990 9958 1 14 . 1 1 401 401 ALA HA H 401 4.251 4.251 5.322 -1.071 18990 9959 1 14 . 1 1 401 401 ALA C C 401 177.942 177.942 176.139 1.803 18990 9960 1 14 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.384 1.346 18990 9961 1 14 . 1 1 401 401 ALA CB C 401 19.142 19.142 21.349 -2.208 18990 9962 1 14 . 1 1 401 401 ALA H H 401 8.179 8.179 8.700 -0.521 18990 9963 1 14 . 1 1 402 402 SER N N 402 114.904 114.904 114.989 -0.085 18990 9964 1 14 . 1 1 402 402 SER HA H 402 4.448 4.448 4.833 -0.385 18990 9965 1 14 . 1 1 402 402 SER C C 402 174.426 174.426 173.344 1.082 18990 9966 1 14 . 1 1 402 402 SER CA C 402 58.289 58.289 58.054 0.235 18990 9967 1 14 . 1 1 402 402 SER CB C 402 63.772 63.772 65.033 -1.261 18990 9968 1 14 . 1 1 402 402 SER H H 402 8.305 8.305 8.451 -0.146 18990 9969 1 14 . 1 1 403 403 ALA N N 403 125.965 125.965 124.554 1.411 18990 9970 1 14 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.725 -0.326 18990 9971 1 14 . 1 1 403 403 ALA C C 403 177.984 177.984 176.210 1.774 18990 9972 1 14 . 1 1 403 403 ALA CA C 403 52.655 52.655 52.310 0.345 18990 9973 1 14 . 1 1 403 403 ALA CB C 403 19.138 19.138 20.627 -1.489 18990 9974 1 14 . 1 1 403 403 ALA H H 403 8.345 8.345 8.337 0.008 18990 9975 1 14 . 1 1 404 404 THR N N 404 112.790 112.790 114.324 -1.534 18990 9976 1 14 . 1 1 404 404 THR C C 404 174.420 174.420 173.734 0.686 18990 9977 1 14 . 1 1 404 404 THR CA C 404 61.988 61.988 61.645 0.343 18990 9978 1 14 . 1 1 404 404 THR CB C 404 69.688 69.688 70.021 -0.333 18990 9979 1 14 . 1 1 404 404 THR H H 404 8.118 8.118 8.251 -0.133 18990 9980 1 14 . 1 1 405 405 ASN N N 405 121.050 121.050 121.131 -0.081 18990 9981 1 14 . 1 1 405 405 ASN H H 405 8.396 8.396 8.518 -0.122 18990 9982 1 14 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.818 -0.240 18990 9983 1 14 . 1 1 407 407 CYS C C 407 174.489 174.489 173.968 0.521 18990 9984 1 14 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.797 -0.084 18990 9985 1 14 . 1 1 407 407 CYS CB C 407 28.102 28.102 30.262 -2.160 18990 9986 1 14 . 1 1 408 408 GLU N N 408 123.021 123.021 123.043 -0.022 18990 9987 1 14 . 1 1 408 408 GLU C C 408 175.954 175.954 174.771 1.183 18990 9988 1 14 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.824 -0.022 18990 9989 1 14 . 1 1 408 408 GLU CB C 408 30.328 30.328 31.008 -0.680 18990 9990 1 14 . 1 1 408 408 GLU H H 408 8.415 8.415 8.590 -0.175 18990 9991 1 14 . 1 1 409 409 TYR N N 409 121.015 121.015 121.490 -0.475 18990 9992 1 14 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.870 -0.216 18990 9993 1 14 . 1 1 409 409 TYR C C 409 175.613 175.613 174.325 1.288 18990 9994 1 14 . 1 1 409 409 TYR CA C 409 57.669 57.669 57.518 0.151 18990 9995 1 14 . 1 1 409 409 TYR CB C 409 38.825 38.825 39.746 -0.921 18990 9996 1 14 . 1 1 409 409 TYR H H 409 8.135 8.135 7.972 0.163 18990 9997 1 14 . 1 1 410 410 THR N N 410 116.975 116.975 116.305 0.670 18990 9998 1 14 . 1 1 410 410 THR HA H 410 4.306 4.306 4.444 -0.138 18990 9999 1 14 . 1 1 410 410 THR C C 410 173.846 173.846 174.284 -0.438 18990 10000 1 14 . 1 1 410 410 THR CA C 410 61.730 61.730 61.264 0.466 18990 10001 1 14 . 1 1 410 410 THR CB C 410 69.914 69.914 70.525 -0.611 18990 10002 1 14 . 1 1 410 410 THR H H 410 8.060 8.060 8.067 -0.007 18990 10003 1 14 . 1 1 411 411 VAL N N 411 122.900 122.900 118.714 4.186 18990 10004 1 14 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.453 -0.400 18990 10005 1 14 . 1 1 411 411 VAL C C 411 175.275 175.275 175.161 0.114 18990 10006 1 14 . 1 1 411 411 VAL CA C 411 61.853 61.853 61.417 0.436 18990 10007 1 14 . 1 1 411 411 VAL CB C 411 32.976 32.976 33.392 -0.415 18990 10008 1 14 . 1 1 411 411 VAL H H 411 8.089 8.089 8.241 -0.152 18990 10009 1 14 . 1 1 412 412 ASP N N 412 125.924 125.924 123.610 2.314 18990 10010 1 14 . 1 1 412 412 ASP HA H 412 4.850 4.850 5.042 -0.192 18990 10011 1 14 . 1 1 412 412 ASP CA C 412 51.578 51.578 53.129 -1.551 18990 10012 1 14 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.855 -0.317 18990 10013 1 14 . 1 1 412 412 ASP H H 412 8.397 8.397 8.516 -0.119 18990 10014 1 14 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.696 -0.310 18990 10015 1 14 . 1 1 413 413 PRO C C 413 177.352 177.352 175.590 1.762 18990 10016 1 14 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.727 1.183 18990 10017 1 14 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.661 -0.393 18990 10018 1 14 . 1 1 414 414 ASN N N 414 117.035 117.035 117.016 0.019 18990 10019 1 14 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.782 -0.105 18990 10020 1 14 . 1 1 414 414 ASN C C 414 175.532 175.532 173.651 1.881 18990 10021 1 14 . 1 1 414 414 ASN CA C 414 53.824 53.824 52.392 1.433 18990 10022 1 14 . 1 1 414 414 ASN CB C 414 38.728 38.728 40.197 -1.469 18990 10023 1 14 . 1 1 414 414 ASN H H 414 8.496 8.496 8.360 0.136 18990 10024 1 14 . 1 1 415 415 ARG N N 415 121.000 121.000 121.176 -0.176 18990 10025 1 14 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.764 -0.520 18990 10026 1 14 . 1 1 415 415 ARG C C 415 176.243 176.243 174.565 1.678 18990 10027 1 14 . 1 1 415 415 ARG CA C 415 56.404 56.404 56.033 0.371 18990 10028 1 14 . 1 1 415 415 ARG CB C 415 30.637 30.637 31.093 -0.456 18990 10029 1 14 . 1 1 415 415 ARG H H 415 7.804 7.804 8.671 -0.867 18990 10030 1 14 . 1 1 416 416 ALA N N 416 124.880 124.880 126.630 -1.750 18990 10031 1 14 . 1 1 416 416 ALA C C 416 177.831 177.831 175.726 2.105 18990 10032 1 14 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.819 1.139 18990 10033 1 14 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.653 -1.594 18990 10034 1 14 . 1 1 416 416 ALA H H 416 8.189 8.189 8.492 -0.303 18990 10035 1 14 . 1 1 417 417 ALA N N 417 122.614 122.614 122.983 -0.369 18990 10036 1 14 . 1 1 417 417 ALA HA H 417 4.247 4.247 5.193 -0.946 18990 10037 1 14 . 1 1 417 417 ALA C C 417 178.024 178.024 175.894 2.130 18990 10038 1 14 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.700 1.089 18990 10039 1 14 . 1 1 417 417 ALA CB C 417 19.042 19.042 21.077 -2.035 18990 10040 1 14 . 1 1 417 417 ALA H H 417 8.169 8.169 8.643 -0.474 18990 10041 1 14 . 1 1 418 418 GLU N N 418 119.500 119.500 120.029 -0.529 18990 10042 1 14 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.663 -0.474 18990 10043 1 14 . 1 1 418 418 GLU C C 418 176.266 176.266 174.948 1.318 18990 10044 1 14 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.694 0.882 18990 10045 1 14 . 1 1 418 418 GLU CB C 418 30.307 30.307 32.133 -1.827 18990 10046 1 14 . 1 1 418 418 GLU H H 418 8.184 8.184 8.709 -0.525 18990 10047 1 14 . 1 1 419 419 ALA N N 419 124.643 124.643 126.518 -1.875 18990 10048 1 14 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.798 -0.548 18990 10049 1 14 . 1 1 419 419 ALA C C 419 177.488 177.488 176.269 1.219 18990 10050 1 14 . 1 1 419 419 ALA CA C 419 52.509 52.509 52.272 0.237 18990 10051 1 14 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.477 -1.316 18990 10052 1 14 . 1 1 419 419 ALA H H 419 8.135 8.135 8.676 -0.541 18990 10053 1 14 . 1 1 420 420 ARG N N 420 120.003 120.003 121.081 -1.078 18990 10054 1 14 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.555 -0.262 18990 10055 1 14 . 1 1 420 420 ARG C C 420 176.297 176.297 174.710 1.587 18990 10056 1 14 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.445 0.488 18990 10057 1 14 . 1 1 420 420 ARG CB C 420 30.850 30.850 32.849 -1.999 18990 10058 1 14 . 1 1 420 420 ARG H H 420 8.135 8.135 8.431 -0.296 18990 10059 1 14 . 1 1 421 421 TRP N N 421 122.280 122.280 121.345 0.935 18990 10060 1 14 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.980 -0.317 18990 10061 1 14 . 1 1 421 421 TRP C C 421 175.856 175.856 174.368 1.488 18990 10062 1 14 . 1 1 421 421 TRP CA C 421 57.404 57.404 56.386 1.018 18990 10063 1 14 . 1 1 421 421 TRP CB C 421 29.437 29.437 29.883 -0.446 18990 10064 1 14 . 1 1 421 421 TRP H H 421 8.159 8.159 7.774 0.385 18990 10065 1 14 . 1 1 422 422 ASP N N 422 121.980 121.980 122.629 -0.649 18990 10066 1 14 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.651 -0.156 18990 10067 1 14 . 1 1 422 422 ASP C C 422 176.184 176.184 176.121 0.063 18990 10068 1 14 . 1 1 422 422 ASP CA C 422 53.899 53.899 53.781 0.118 18990 10069 1 14 . 1 1 422 422 ASP CB C 422 40.948 40.948 42.207 -1.259 18990 10070 1 14 . 1 1 422 422 ASP H H 422 8.135 8.135 8.519 -0.384 18990 10071 1 14 . 1 1 423 423 GLU N N 423 121.990 121.990 122.569 -0.579 18990 10072 1 14 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.381 -0.291 18990 10073 1 14 . 1 1 423 423 GLU C C 423 176.720 176.720 175.765 0.955 18990 10074 1 14 . 1 1 423 423 GLU CA C 423 57.169 57.169 58.023 -0.854 18990 10075 1 14 . 1 1 423 423 GLU CB C 423 30.156 30.156 30.366 -0.209 18990 10076 1 14 . 1 1 423 423 GLU H H 423 8.153 8.153 8.836 -0.683 18990 10077 1 14 . 1 1 424 424 ALA N N 424 123.900 123.900 120.282 3.618 18990 10078 1 14 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.346 -0.066 18990 10079 1 14 . 1 1 424 424 ALA C C 424 178.095 178.095 175.636 2.459 18990 10080 1 14 . 1 1 424 424 ALA CA C 424 53.017 53.017 51.706 1.311 18990 10081 1 14 . 1 1 424 424 ALA CB C 424 19.086 19.086 18.877 0.209 18990 10082 1 14 . 1 1 424 424 ALA H H 424 8.243 8.243 7.702 0.541 18990 10083 1 14 . 1 1 425 425 SER N N 425 113.881 113.881 114.260 -0.379 18990 10084 1 14 . 1 1 425 425 SER HA H 425 4.387 4.387 5.193 -0.806 18990 10085 1 14 . 1 1 425 425 SER C C 425 174.338 174.338 173.259 1.079 18990 10086 1 14 . 1 1 425 425 SER CA C 425 58.546 58.546 57.569 0.977 18990 10087 1 14 . 1 1 425 425 SER CB C 425 63.784 63.784 64.947 -1.163 18990 10088 1 14 . 1 1 425 425 SER H H 425 8.063 8.063 9.020 -0.957 18990 10089 1 14 . 1 1 426 426 ASN N N 426 121.032 121.032 117.627 3.405 18990 10090 1 14 . 1 1 426 426 ASN HA H 426 4.706 4.706 5.455 -0.749 18990 10091 1 14 . 1 1 426 426 ASN C C 426 175.046 175.046 173.118 1.928 18990 10092 1 14 . 1 1 426 426 ASN CA C 426 53.445 53.445 52.316 1.129 18990 10093 1 14 . 1 1 426 426 ASN CB C 426 38.847 38.847 40.804 -1.957 18990 10094 1 14 . 1 1 426 426 ASN H H 426 8.391 8.391 8.903 -0.512 18990 10095 1 14 . 1 1 427 427 VAL N N 427 119.463 119.463 120.159 -0.696 18990 10096 1 14 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.728 -0.535 18990 10097 1 14 . 1 1 427 427 VAL C C 427 176.213 176.213 173.960 2.253 18990 10098 1 14 . 1 1 427 427 VAL CA C 427 62.449 62.449 62.227 0.222 18990 10099 1 14 . 1 1 427 427 VAL CB C 427 32.865 32.865 34.609 -1.744 18990 10100 1 14 . 1 1 427 427 VAL H H 427 7.954 7.954 9.027 -1.073 18990 10101 1 14 . 1 1 428 428 THR N N 428 118.226 118.226 121.289 -3.063 18990 10102 1 14 . 1 1 428 428 THR HA H 428 4.353 4.353 4.938 -0.585 18990 10103 1 14 . 1 1 428 428 THR C C 428 174.361 174.361 172.817 1.544 18990 10104 1 14 . 1 1 428 428 THR CA C 428 62.065 62.065 61.761 0.304 18990 10105 1 14 . 1 1 428 428 THR CB C 428 69.729 69.729 70.278 -0.550 18990 10106 1 14 . 1 1 428 428 THR H H 428 8.225 8.225 8.426 -0.201 18990 10107 1 14 . 1 1 429 429 ILE N N 429 123.910 123.910 121.483 2.427 18990 10108 1 14 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.857 -0.669 18990 10109 1 14 . 1 1 429 429 ILE C C 429 175.774 175.774 174.675 1.099 18990 10110 1 14 . 1 1 429 429 ILE CA C 429 60.819 60.819 60.386 0.433 18990 10111 1 14 . 1 1 429 429 ILE CB C 429 38.719 38.719 39.790 -1.071 18990 10112 1 14 . 1 1 429 429 ILE H H 429 8.148 8.148 8.294 -0.146 18990 10113 1 14 . 1 1 430 430 LYS N N 430 126.453 126.453 120.874 5.579 18990 10114 1 14 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.664 -0.230 18990 10115 1 14 . 1 1 430 430 LYS C C 430 176.241 176.241 175.350 0.891 18990 10116 1 14 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.222 0.715 18990 10117 1 14 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.594 -0.430 18990 10118 1 14 . 1 1 430 430 LYS H H 430 8.406 8.406 8.223 0.183 18990 10119 1 14 . 1 1 431 431 VAL N N 431 122.496 122.496 121.143 1.353 18990 10120 1 14 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.404 -0.124 18990 10121 1 14 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.278 0.025 18990 10122 1 14 . 1 1 431 431 VAL CB C 431 33.132 33.132 33.147 -0.015 18990 10123 1 14 . 1 1 431 431 VAL H H 431 8.312 8.312 8.355 -0.043 18990 10124 1 14 . 1 1 432 432 SER HA H 432 4.486 4.486 4.790 -0.304 18990 10125 1 14 . 1 1 432 432 SER C C 432 173.834 173.834 173.691 0.143 18990 10126 1 14 . 1 1 432 432 SER CA C 432 58.650 58.650 58.116 0.534 18990 10127 1 14 . 1 1 432 432 SER CB C 432 64.152 64.152 64.698 -0.546 18990 10128 1 14 . 1 1 433 433 THR N N 433 114.706 114.706 114.203 0.503 18990 10129 1 14 . 1 1 433 433 THR HA H 433 5.446 5.446 4.504 0.942 18990 10130 1 14 . 1 1 433 433 THR C C 433 173.979 173.979 174.536 -0.557 18990 10131 1 14 . 1 1 433 433 THR CA C 433 60.412 60.412 61.652 -1.240 18990 10132 1 14 . 1 1 433 433 THR CB C 433 71.896 71.896 69.710 2.186 18990 10133 1 14 . 1 1 433 433 THR H H 433 7.833 7.833 7.710 0.123 18990 10134 1 14 . 1 1 434 434 LYS N N 434 122.492 122.492 123.583 -1.091 18990 10135 1 14 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.934 -0.225 18990 10136 1 14 . 1 1 434 434 LYS C C 434 173.589 173.589 174.870 -1.281 18990 10137 1 14 . 1 1 434 434 LYS CA C 434 54.375 54.375 53.038 1.337 18990 10138 1 14 . 1 1 434 434 LYS CB C 434 36.925 36.925 33.176 3.749 18990 10139 1 14 . 1 1 434 434 LYS H H 434 8.937 8.937 8.970 -0.033 18990 10140 1 14 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.694 -0.427 18990 10141 1 14 . 1 1 435 435 PRO C C 435 175.238 175.238 176.621 -1.383 18990 10142 1 14 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.414 -1.492 18990 10143 1 14 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.507 -0.421 18990 10144 1 14 . 1 1 436 436 CYS N N 436 125.422 125.422 125.047 0.375 18990 10145 1 14 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.112 -0.682 18990 10146 1 14 . 1 1 436 436 CYS C C 436 176.770 176.770 174.656 2.114 18990 10147 1 14 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.741 0.275 18990 10148 1 14 . 1 1 436 436 CYS CB C 436 31.698 31.698 27.730 3.968 18990 10149 1 14 . 1 1 436 436 CYS H H 436 7.768 7.768 8.401 -0.633 18990 10150 1 14 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.027 -0.169 18990 10151 1 14 . 1 1 437 437 PRO C C 437 173.608 173.608 176.582 -2.974 18990 10152 1 14 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.182 0.031 18990 10153 1 14 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.318 1.131 18990 10154 1 14 . 1 1 438 438 LYS N N 438 118.600 118.600 117.072 1.528 18990 10155 1 14 . 1 1 438 438 LYS HA H 438 3.970 3.970 3.948 0.022 18990 10156 1 14 . 1 1 438 438 LYS C C 438 176.887 176.887 177.163 -0.276 18990 10157 1 14 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.489 0.198 18990 10158 1 14 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.009 0.115 18990 10159 1 14 . 1 1 438 438 LYS H H 438 8.390 8.390 7.492 0.898 18990 10160 1 14 . 1 1 439 439 CYS N N 439 118.950 118.950 114.676 4.274 18990 10161 1 14 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.901 -0.155 18990 10162 1 14 . 1 1 439 439 CYS C C 439 176.650 176.650 174.612 2.038 18990 10163 1 14 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.190 2.158 18990 10164 1 14 . 1 1 439 439 CYS CB C 439 31.196 31.196 29.238 1.958 18990 10165 1 14 . 1 1 439 439 CYS H H 439 8.357 8.357 7.623 0.734 18990 10166 1 14 . 1 1 440 440 ARG N N 440 117.200 117.200 119.449 -2.249 18990 10167 1 14 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.049 -0.081 18990 10168 1 14 . 1 1 440 440 ARG C C 440 175.253 175.253 175.505 -0.252 18990 10169 1 14 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.705 0.195 18990 10170 1 14 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.822 -1.781 18990 10171 1 14 . 1 1 440 440 ARG H H 440 8.065 8.065 7.865 0.200 18990 10172 1 14 . 1 1 441 441 THR N N 441 122.400 122.400 112.155 10.245 18990 10173 1 14 . 1 1 441 441 THR HA H 441 4.371 4.371 4.559 -0.188 18990 10174 1 14 . 1 1 441 441 THR C C 441 173.702 173.702 173.313 0.389 18990 10175 1 14 . 1 1 441 441 THR CA C 441 63.194 63.194 59.942 3.252 18990 10176 1 14 . 1 1 441 441 THR CB C 441 68.933 68.933 69.083 -0.150 18990 10177 1 14 . 1 1 441 441 THR H H 441 8.643 8.643 7.599 1.044 18990 10178 1 14 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.537 -0.390 18990 10179 1 14 . 1 1 442 442 PRO C C 442 176.215 176.215 175.995 0.220 18990 10180 1 14 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.640 1.557 18990 10181 1 14 . 1 1 442 442 PRO CB C 442 32.044 32.044 30.890 1.154 18990 10182 1 14 . 1 1 443 443 THR N N 443 122.932 122.932 122.044 0.888 18990 10183 1 14 . 1 1 443 443 THR HA H 443 4.665 4.665 4.520 0.145 18990 10184 1 14 . 1 1 443 443 THR C C 443 172.133 172.133 173.807 -1.674 18990 10185 1 14 . 1 1 443 443 THR CA C 443 62.566 62.566 62.049 0.517 18990 10186 1 14 . 1 1 443 443 THR CB C 443 71.562 71.562 69.735 1.827 18990 10187 1 14 . 1 1 443 443 THR H H 443 9.116 9.116 8.858 0.258 18990 10188 1 14 . 1 1 444 444 GLU N N 444 126.390 126.390 128.090 -1.700 18990 10189 1 14 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.669 0.273 18990 10190 1 14 . 1 1 444 444 GLU C C 444 175.292 175.292 175.920 -0.628 18990 10191 1 14 . 1 1 444 444 GLU CA C 444 55.049 55.049 54.760 0.289 18990 10192 1 14 . 1 1 444 444 GLU CB C 444 31.861 31.861 31.330 0.531 18990 10193 1 14 . 1 1 444 444 GLU H H 444 8.720 8.720 8.783 -0.063 18990 10194 1 14 . 1 1 445 445 ARG N N 445 123.505 123.505 128.062 -4.557 18990 10195 1 14 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.283 -0.572 18990 10196 1 14 . 1 1 445 445 ARG C C 445 175.289 175.289 175.196 0.093 18990 10197 1 14 . 1 1 445 445 ARG CA C 445 55.856 55.856 55.461 0.395 18990 10198 1 14 . 1 1 445 445 ARG CB C 445 30.675 30.675 29.809 0.866 18990 10199 1 14 . 1 1 445 445 ARG H H 445 8.157 8.157 8.688 -0.531 18990 10200 1 14 . 1 1 446 446 ASP N N 446 126.800 126.800 127.520 -0.720 18990 10201 1 14 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.530 0.111 18990 10202 1 14 . 1 1 446 446 ASP C C 446 176.020 176.020 175.912 0.108 18990 10203 1 14 . 1 1 446 446 ASP CA C 446 52.952 52.952 54.330 -1.378 18990 10204 1 14 . 1 1 446 446 ASP CB C 446 41.400 41.400 40.930 0.470 18990 10205 1 14 . 1 1 446 446 ASP H H 446 8.476 8.476 8.186 0.290 18990 10206 1 14 . 1 1 447 447 GLY N N 447 111.262 111.262 112.012 -0.750 18990 10207 1 14 . 1 1 447 447 GLY C C 447 174.073 174.073 173.808 0.265 18990 10208 1 14 . 1 1 447 447 GLY CA C 447 45.832 45.832 44.301 1.531 18990 10209 1 14 . 1 1 447 447 GLY H H 447 8.056 8.056 7.926 0.130 18990 10210 1 14 . 1 1 448 448 GLY N N 448 108.655 108.655 109.582 -0.927 18990 10211 1 14 . 1 1 448 448 GLY C C 448 174.020 174.020 173.999 0.021 18990 10212 1 14 . 1 1 448 448 GLY CA C 448 45.267 45.267 45.623 -0.356 18990 10213 1 14 . 1 1 448 448 GLY H H 448 8.380 8.380 8.381 -0.001 18990 10214 1 14 . 1 1 449 449 CYS N N 449 120.628 120.628 123.197 -2.569 18990 10215 1 14 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.694 -0.697 18990 10216 1 14 . 1 1 449 449 CYS C C 449 174.855 174.855 174.318 0.537 18990 10217 1 14 . 1 1 449 449 CYS CA C 449 59.291 59.291 58.667 0.624 18990 10218 1 14 . 1 1 449 449 CYS CB C 449 28.000 28.000 31.586 -3.586 18990 10219 1 14 . 1 1 449 449 CYS H H 449 7.832 7.832 7.665 0.167 18990 10220 1 14 . 1 1 450 450 MET N N 450 123.947 123.947 122.721 1.226 18990 10221 1 14 . 1 1 450 450 MET HA H 450 4.551 4.551 4.483 0.068 18990 10222 1 14 . 1 1 450 450 MET C C 450 174.658 174.658 175.113 -0.455 18990 10223 1 14 . 1 1 450 450 MET CA C 450 54.970 54.970 56.564 -1.594 18990 10224 1 14 . 1 1 450 450 MET CB C 450 34.100 34.100 33.632 0.468 18990 10225 1 14 . 1 1 450 450 MET H H 450 8.916 8.916 9.084 -0.168 18990 10226 1 14 . 1 1 451 451 HIS N N 451 120.490 120.490 119.878 0.612 18990 10227 1 14 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.772 -1.093 18990 10228 1 14 . 1 1 451 451 HIS C C 451 172.443 172.443 173.917 -1.474 18990 10229 1 14 . 1 1 451 451 HIS CA C 451 53.812 53.812 55.541 -1.729 18990 10230 1 14 . 1 1 451 451 HIS CB C 451 28.900 28.900 29.425 -0.525 18990 10231 1 14 . 1 1 451 451 HIS H H 451 7.557 7.557 8.378 -0.821 18990 10232 1 14 . 1 1 452 452 MET N N 452 128.800 128.800 124.334 4.466 18990 10233 1 14 . 1 1 452 452 MET HA H 452 4.320 4.320 4.526 -0.206 18990 10234 1 14 . 1 1 452 452 MET C C 452 175.479 175.479 173.830 1.649 18990 10235 1 14 . 1 1 452 452 MET CA C 452 52.589 52.589 53.690 -1.101 18990 10236 1 14 . 1 1 452 452 MET CB C 452 28.074 28.074 35.008 -6.934 18990 10237 1 14 . 1 1 452 452 MET H H 452 9.087 9.087 7.637 1.450 18990 10238 1 14 . 1 1 453 453 VAL N N 453 122.200 122.200 117.289 4.911 18990 10239 1 14 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.317 0.477 18990 10240 1 14 . 1 1 453 453 VAL C C 453 175.476 175.476 174.363 1.113 18990 10241 1 14 . 1 1 453 453 VAL CA C 453 61.380 61.380 58.862 2.518 18990 10242 1 14 . 1 1 453 453 VAL CB C 453 33.089 33.089 33.984 -0.895 18990 10243 1 14 . 1 1 453 453 VAL H H 453 8.016 8.016 7.875 0.141 18990 10244 1 14 . 1 1 454 454 CYS N N 454 130.353 130.353 124.290 6.063 18990 10245 1 14 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.747 -0.152 18990 10246 1 14 . 1 1 454 454 CYS C C 454 177.833 177.833 174.579 3.254 18990 10247 1 14 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.773 2.799 18990 10248 1 14 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.737 5.308 18990 10249 1 14 . 1 1 454 454 CYS H H 454 8.989 8.989 8.795 0.194 18990 10250 1 14 . 1 1 455 455 THR N N 455 119.000 119.000 124.345 -5.345 18990 10251 1 14 . 1 1 455 455 THR HA H 455 4.393 4.393 4.484 -0.091 18990 10252 1 14 . 1 1 455 455 THR C C 455 175.264 175.264 173.722 1.542 18990 10253 1 14 . 1 1 455 455 THR CA C 455 61.644 61.644 62.034 -0.390 18990 10254 1 14 . 1 1 455 455 THR CB C 455 69.400 69.400 68.258 1.142 18990 10255 1 14 . 1 1 455 455 THR H H 455 8.533 8.533 8.624 -0.091 18990 10256 1 14 . 1 1 456 456 ARG N N 456 128.900 128.900 128.462 0.438 18990 10257 1 14 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.591 -0.366 18990 10258 1 14 . 1 1 456 456 ARG C C 456 177.782 177.782 175.072 2.710 18990 10259 1 14 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.103 2.847 18990 10260 1 14 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.827 -3.777 18990 10261 1 14 . 1 1 456 456 ARG H H 456 9.036 9.036 7.826 1.210 18990 10262 1 14 . 1 1 457 457 ALA N N 457 133.152 133.152 128.522 4.630 18990 10263 1 14 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.208 -0.062 18990 10264 1 14 . 1 1 457 457 ALA C C 457 178.757 178.757 177.343 1.414 18990 10265 1 14 . 1 1 457 457 ALA CA C 457 53.929 53.929 53.432 0.497 18990 10266 1 14 . 1 1 457 457 ALA CB C 457 17.710 17.710 17.799 -0.089 18990 10267 1 14 . 1 1 457 457 ALA H H 457 9.042 9.042 8.806 0.236 18990 10268 1 14 . 1 1 458 458 GLY N N 458 111.200 111.200 111.074 0.126 18990 10269 1 14 . 1 1 458 458 GLY C C 458 173.558 173.558 174.011 -0.453 18990 10270 1 14 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.615 0.821 18990 10271 1 14 . 1 1 458 458 GLY H H 458 8.830 8.830 8.401 0.429 18990 10272 1 14 . 1 1 459 459 CYS N N 459 123.040 123.040 120.454 2.586 18990 10273 1 14 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.920 -0.298 18990 10274 1 14 . 1 1 459 459 CYS C C 459 176.591 176.591 175.000 1.591 18990 10275 1 14 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.251 1.248 18990 10276 1 14 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.291 0.883 18990 10277 1 14 . 1 1 459 459 CYS H H 459 8.042 8.042 8.296 -0.254 18990 10278 1 14 . 1 1 460 460 GLY N N 460 104.500 104.500 111.863 -7.363 18990 10279 1 14 . 1 1 460 460 GLY C C 460 173.716 173.716 173.918 -0.202 18990 10280 1 14 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.693 0.315 18990 10281 1 14 . 1 1 460 460 GLY H H 460 7.705 7.705 8.223 -0.518 18990 10282 1 14 . 1 1 461 461 PHE N N 461 124.949 124.949 120.721 4.228 18990 10283 1 14 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.722 -0.142 18990 10284 1 14 . 1 1 461 461 PHE C C 461 174.447 174.447 173.864 0.583 18990 10285 1 14 . 1 1 461 461 PHE CA C 461 59.946 59.946 57.024 2.922 18990 10286 1 14 . 1 1 461 461 PHE CB C 461 41.300 41.300 41.783 -0.483 18990 10287 1 14 . 1 1 461 461 PHE H H 461 8.947 8.947 7.706 1.241 18990 10288 1 14 . 1 1 462 462 GLU N N 462 125.272 125.272 126.459 -1.187 18990 10289 1 14 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.462 1.259 18990 10290 1 14 . 1 1 462 462 GLU C C 462 176.067 176.067 174.809 1.258 18990 10291 1 14 . 1 1 462 462 GLU CA C 462 54.624 54.624 56.012 -1.388 18990 10292 1 14 . 1 1 462 462 GLU CB C 462 31.255 31.255 30.848 0.407 18990 10293 1 14 . 1 1 462 462 GLU H H 462 7.799 7.799 8.376 -0.577 18990 10294 1 14 . 1 1 463 463 TRP N N 463 121.524 121.524 119.012 2.512 18990 10295 1 14 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.233 0.273 18990 10296 1 14 . 1 1 463 463 TRP C C 463 172.844 172.844 173.776 -0.932 18990 10297 1 14 . 1 1 463 463 TRP CA C 463 53.771 53.771 55.881 -2.110 18990 10298 1 14 . 1 1 463 463 TRP CB C 463 31.736 31.736 30.474 1.262 18990 10299 1 14 . 1 1 463 463 TRP H H 463 9.300 9.300 7.834 1.466 18990 10300 1 14 . 1 1 464 464 CYS N N 464 120.868 120.868 119.170 1.698 18990 10301 1 14 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.965 0.451 18990 10302 1 14 . 1 1 464 464 CYS C C 464 177.213 177.213 176.166 1.047 18990 10303 1 14 . 1 1 464 464 CYS CA C 464 57.776 57.776 59.198 -1.422 18990 10304 1 14 . 1 1 464 464 CYS CB C 464 32.930 32.930 29.056 3.874 18990 10305 1 14 . 1 1 464 464 CYS H H 464 8.752 8.752 9.280 -0.528 18990 10306 1 14 . 1 1 465 465 TRP N N 465 131.209 131.209 126.017 5.192 18990 10307 1 14 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.189 0.238 18990 10308 1 14 . 1 1 465 465 TRP C C 465 176.051 176.051 176.198 -0.147 18990 10309 1 14 . 1 1 465 465 TRP CA C 465 60.763 60.763 60.141 0.622 18990 10310 1 14 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.559 1.567 18990 10311 1 14 . 1 1 465 465 TRP H H 465 9.809 9.809 8.357 1.452 18990 10312 1 14 . 1 1 466 466 VAL N N 466 118.233 118.233 117.535 0.698 18990 10313 1 14 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.532 0.092 18990 10314 1 14 . 1 1 466 466 VAL C C 466 178.943 178.943 175.870 3.073 18990 10315 1 14 . 1 1 466 466 VAL CA C 466 65.602 65.602 64.289 1.313 18990 10316 1 14 . 1 1 466 466 VAL CB C 466 33.172 33.172 31.688 1.484 18990 10317 1 14 . 1 1 466 466 VAL H H 466 8.627 8.627 7.963 0.664 18990 10318 1 14 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.655 -1.224 18990 10319 1 14 . 1 1 467 467 CYS CA C 467 56.999 56.999 57.038 -0.039 18990 10320 1 14 . 1 1 467 467 CYS CB C 467 31.870 31.870 28.020 3.850 18990 10321 1 14 . 1 1 467 467 CYS H H 467 7.820 7.820 7.736 0.084 18990 10322 1 14 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.537 -0.501 18990 10323 1 14 . 1 1 468 468 GLN CA C 468 58.051 58.051 56.363 1.688 18990 10324 1 14 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.051 -1.575 18990 10325 1 14 . 1 1 469 469 THR HA H 469 4.685 4.685 4.664 0.021 18990 10326 1 14 . 1 1 469 469 THR C C 469 173.351 173.351 173.237 0.114 18990 10327 1 14 . 1 1 469 469 THR CA C 469 59.176 59.176 59.848 -0.672 18990 10328 1 14 . 1 1 469 469 THR CB C 469 71.775 71.775 71.544 0.231 18990 10329 1 14 . 1 1 470 470 GLU N N 470 120.940 120.940 120.197 0.743 18990 10330 1 14 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.858 -0.565 18990 10331 1 14 . 1 1 470 470 GLU C C 470 175.539 175.539 175.833 -0.294 18990 10332 1 14 . 1 1 470 470 GLU CA C 470 57.015 57.015 55.417 1.598 18990 10333 1 14 . 1 1 470 470 GLU CB C 470 29.965 29.965 31.558 -1.593 18990 10334 1 14 . 1 1 470 470 GLU H H 470 8.912 8.912 8.500 0.412 18990 10335 1 14 . 1 1 471 471 TRP N N 471 126.998 126.998 126.715 0.283 18990 10336 1 14 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.681 -0.388 18990 10337 1 14 . 1 1 471 471 TRP C C 471 175.408 175.408 175.758 -0.350 18990 10338 1 14 . 1 1 471 471 TRP CA C 471 58.220 58.220 59.027 -0.807 18990 10339 1 14 . 1 1 471 471 TRP CB C 471 29.500 29.500 28.555 0.945 18990 10340 1 14 . 1 1 471 471 TRP H H 471 8.350 8.350 8.164 0.186 18990 10341 1 14 . 1 1 472 472 THR N N 472 117.480 117.480 120.240 -2.760 18990 10342 1 14 . 1 1 472 472 THR HA H 472 4.444 4.444 4.520 -0.076 18990 10343 1 14 . 1 1 472 472 THR CA C 472 58.930 58.930 59.573 -0.643 18990 10344 1 14 . 1 1 472 472 THR H H 472 8.069 8.069 7.618 0.451 18990 10345 1 14 . 1 1 473 473 ARG HA H 473 3.773 3.773 4.053 -0.280 18990 10346 1 14 . 1 1 473 473 ARG C C 473 178.053 178.053 177.061 0.992 18990 10347 1 14 . 1 1 473 473 ARG CA C 473 58.088 58.088 57.947 0.141 18990 10348 1 14 . 1 1 473 473 ARG CB C 473 29.426 29.426 30.162 -0.736 18990 10349 1 14 . 1 1 474 474 ASP N N 474 119.900 119.900 120.340 -0.440 18990 10350 1 14 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.492 -0.277 18990 10351 1 14 . 1 1 474 474 ASP C C 474 178.197 178.197 177.337 0.860 18990 10352 1 14 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.602 0.200 18990 10353 1 14 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.792 -0.610 18990 10354 1 14 . 1 1 474 474 ASP H H 474 7.718 7.718 8.093 -0.375 18990 10355 1 14 . 1 1 475 475 CYS N N 475 121.000 121.000 117.965 3.035 18990 10356 1 14 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.407 -1.040 18990 10357 1 14 . 1 1 475 475 CYS CA C 475 64.533 64.533 57.565 6.968 18990 10358 1 14 . 1 1 475 475 CYS CB C 475 29.092 29.092 25.070 4.022 18990 10359 1 14 . 1 1 475 475 CYS H H 475 6.953 6.953 8.372 -1.419 18990 10360 1 14 . 1 1 476 476 MET HA H 476 4.021 4.021 4.433 -0.412 18990 10361 1 14 . 1 1 476 476 MET CA C 476 58.010 58.010 58.579 -0.569 18990 10362 1 14 . 1 1 476 476 MET CB C 476 32.550 32.550 32.455 0.095 18990 10363 1 14 . 1 1 477 477 GLY N N 477 111.938 111.938 104.392 7.546 18990 10364 1 14 . 1 1 477 477 GLY C C 477 174.406 174.406 173.353 1.053 18990 10365 1 14 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.964 0.652 18990 10366 1 14 . 1 1 477 477 GLY H H 477 9.155 9.155 7.939 1.216 18990 10367 1 14 . 1 1 478 478 ALA N N 478 121.900 121.900 125.109 -3.209 18990 10368 1 14 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.175 0.116 18990 10369 1 14 . 1 1 478 478 ALA C C 478 178.196 178.196 176.898 1.298 18990 10370 1 14 . 1 1 478 478 ALA CA C 478 53.440 53.440 52.827 0.613 18990 10371 1 14 . 1 1 478 478 ALA CB C 478 20.390 20.390 19.583 0.807 18990 10372 1 14 . 1 1 478 478 ALA H H 478 7.347 7.347 7.270 0.077 18990 10373 1 14 . 1 1 479 479 HIS N N 479 115.200 115.200 112.444 2.756 18990 10374 1 14 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.778 0.125 18990 10375 1 14 . 1 1 479 479 HIS C C 479 173.325 173.325 174.050 -0.725 18990 10376 1 14 . 1 1 479 479 HIS CA C 479 54.526 54.526 54.082 0.444 18990 10377 1 14 . 1 1 479 479 HIS CB C 479 27.600 27.600 28.982 -1.382 18990 10378 1 14 . 1 1 479 479 HIS H H 479 8.297 8.297 7.808 0.489 18990 10379 1 14 . 1 1 480 480 TRP N N 480 121.780 121.780 120.037 1.743 18990 10380 1 14 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.752 -0.457 18990 10381 1 14 . 1 1 480 480 TRP C C 480 175.568 175.568 175.009 0.559 18990 10382 1 14 . 1 1 480 480 TRP CA C 480 58.358 58.358 57.150 1.208 18990 10383 1 14 . 1 1 480 480 TRP CB C 480 29.550 29.550 29.959 -0.409 18990 10384 1 14 . 1 1 480 480 TRP H H 480 8.081 8.081 7.865 0.216 18990 10385 1 14 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.705 0.140 18990 10386 1 14 . 1 1 481 481 PHE C C 481 175.126 175.126 173.878 1.248 18990 10387 1 14 . 1 1 481 481 PHE CA C 481 56.471 56.471 57.406 -0.935 18990 10388 1 14 . 1 1 481 481 PHE CB C 481 41.006 41.006 42.362 -1.356 18990 10389 1 15 . 1 1 343 343 GLU N N 343 121.045 121.045 119.999 1.046 18990 10390 1 15 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.320 -0.155 18990 10391 1 15 . 1 1 343 343 GLU C C 343 176.529 176.529 176.428 0.101 18990 10392 1 15 . 1 1 343 343 GLU CA C 343 57.162 57.162 56.221 0.941 18990 10393 1 15 . 1 1 343 343 GLU CB C 343 30.204 30.204 29.924 0.280 18990 10394 1 15 . 1 1 343 343 GLU H H 343 8.293 8.293 8.642 -0.349 18990 10395 1 15 . 1 1 344 344 TYR N N 344 121.000 121.000 122.492 -1.492 18990 10396 1 15 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.497 0.041 18990 10397 1 15 . 1 1 344 344 TYR C C 344 175.897 175.897 174.930 0.967 18990 10398 1 15 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.715 0.464 18990 10399 1 15 . 1 1 344 344 TYR CB C 344 38.600 38.600 38.410 0.190 18990 10400 1 15 . 1 1 344 344 TYR H H 344 8.040 8.040 7.744 0.296 18990 10401 1 15 . 1 1 345 345 VAL N N 345 121.900 121.900 128.265 -6.365 18990 10402 1 15 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.281 -0.342 18990 10403 1 15 . 1 1 345 345 VAL C C 345 176.143 176.143 174.430 1.713 18990 10404 1 15 . 1 1 345 345 VAL CA C 345 62.867 62.867 61.734 1.133 18990 10405 1 15 . 1 1 345 345 VAL CB C 345 32.799 32.799 32.638 0.161 18990 10406 1 15 . 1 1 345 345 VAL H H 345 7.856 7.856 8.131 -0.275 18990 10407 1 15 . 1 1 346 346 LEU N N 346 124.950 124.950 128.079 -3.129 18990 10408 1 15 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.584 -0.341 18990 10409 1 15 . 1 1 346 346 LEU C C 346 177.747 177.747 176.361 1.386 18990 10410 1 15 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.573 0.927 18990 10411 1 15 . 1 1 346 346 LEU CB C 346 42.252 42.252 44.266 -2.014 18990 10412 1 15 . 1 1 346 346 LEU H H 346 8.127 8.127 8.361 -0.234 18990 10413 1 15 . 1 1 347 347 GLN N N 347 121.452 121.452 122.851 -1.399 18990 10414 1 15 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.392 -0.106 18990 10415 1 15 . 1 1 347 347 GLN C C 347 175.833 175.833 175.175 0.658 18990 10416 1 15 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.341 0.647 18990 10417 1 15 . 1 1 347 347 GLN CB C 347 29.375 29.375 29.463 -0.088 18990 10418 1 15 . 1 1 347 347 GLN H H 347 8.270 8.270 8.443 -0.173 18990 10419 1 15 . 1 1 348 348 ALA N N 348 124.466 124.466 121.932 2.534 18990 10420 1 15 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.497 -0.176 18990 10421 1 15 . 1 1 348 348 ALA C C 348 177.929 177.929 177.764 0.165 18990 10422 1 15 . 1 1 348 348 ALA CA C 348 52.703 52.703 51.710 0.993 18990 10423 1 15 . 1 1 348 348 ALA CB C 348 19.002 19.002 19.940 -0.938 18990 10424 1 15 . 1 1 348 348 ALA H H 348 8.227 8.227 8.882 -0.655 18990 10425 1 15 . 1 1 349 349 GLY N N 349 108.193 108.193 107.271 0.922 18990 10426 1 15 . 1 1 349 349 GLY C C 349 174.269 174.269 174.993 -0.724 18990 10427 1 15 . 1 1 349 349 GLY CA C 349 45.227 45.227 45.086 0.141 18990 10428 1 15 . 1 1 349 349 GLY H H 349 8.298 8.298 8.383 -0.085 18990 10429 1 15 . 1 1 350 350 GLY N N 350 108.073 108.073 111.587 -3.514 18990 10430 1 15 . 1 1 350 350 GLY C C 350 172.979 172.979 174.688 -1.709 18990 10431 1 15 . 1 1 350 350 GLY CA C 350 44.935 44.935 44.782 0.153 18990 10432 1 15 . 1 1 350 350 GLY H H 350 8.156 8.156 7.854 0.302 18990 10433 1 15 . 1 1 351 351 VAL N N 351 119.058 119.058 122.464 -3.406 18990 10434 1 15 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.118 0.298 18990 10435 1 15 . 1 1 351 351 VAL C C 351 173.412 173.412 175.016 -1.604 18990 10436 1 15 . 1 1 351 351 VAL CA C 351 60.663 60.663 62.835 -2.172 18990 10437 1 15 . 1 1 351 351 VAL CB C 351 34.866 34.866 33.783 1.083 18990 10438 1 15 . 1 1 351 351 VAL H H 351 8.541 8.541 8.232 0.309 18990 10439 1 15 . 1 1 352 352 LEU N N 352 125.800 125.800 120.312 5.488 18990 10440 1 15 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.892 -0.127 18990 10441 1 15 . 1 1 352 352 LEU C C 352 176.218 176.218 175.288 0.930 18990 10442 1 15 . 1 1 352 352 LEU CA C 352 53.341 53.341 52.705 0.636 18990 10443 1 15 . 1 1 352 352 LEU CB C 352 42.706 42.706 44.361 -1.655 18990 10444 1 15 . 1 1 352 352 LEU H H 352 8.151 8.151 8.167 -0.016 18990 10445 1 15 . 1 1 353 353 CYS N N 353 126.825 126.825 121.622 5.203 18990 10446 1 15 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.020 0.087 18990 10447 1 15 . 1 1 353 353 CYS C C 353 176.655 176.655 174.945 1.710 18990 10448 1 15 . 1 1 353 353 CYS CA C 353 57.731 57.731 58.469 -0.738 18990 10449 1 15 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.343 4.522 18990 10450 1 15 . 1 1 353 353 CYS H H 353 8.794 8.794 8.753 0.041 18990 10451 1 15 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.267 0.153 18990 10452 1 15 . 1 1 354 354 PRO C C 354 177.512 177.512 175.713 1.799 18990 10453 1 15 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.359 -0.367 18990 10454 1 15 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.312 1.255 18990 10455 1 15 . 1 1 355 355 GLN N N 355 126.800 126.800 119.045 7.755 18990 10456 1 15 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.564 -0.289 18990 10457 1 15 . 1 1 355 355 GLN C C 355 175.516 175.516 174.983 0.533 18990 10458 1 15 . 1 1 355 355 GLN CA C 355 54.793 54.793 52.505 2.288 18990 10459 1 15 . 1 1 355 355 GLN CB C 355 28.547 28.547 29.317 -0.770 18990 10460 1 15 . 1 1 355 355 GLN H H 355 9.033 9.033 7.414 1.619 18990 10461 1 15 . 1 1 357 357 GLY C C 357 173.229 173.229 174.789 -1.560 18990 10462 1 15 . 1 1 357 357 GLY CA C 357 45.254 45.254 45.183 0.071 18990 10463 1 15 . 1 1 358 358 CYS N N 358 123.500 123.500 120.129 3.371 18990 10464 1 15 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.444 0.089 18990 10465 1 15 . 1 1 358 358 CYS C C 358 176.157 176.157 176.139 0.018 18990 10466 1 15 . 1 1 358 358 CYS CA C 358 60.268 60.268 59.981 0.287 18990 10467 1 15 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.760 0.615 18990 10468 1 15 . 1 1 358 358 CYS H H 358 7.720 7.720 7.640 0.080 18990 10469 1 15 . 1 1 359 359 GLY N N 359 104.400 104.400 109.801 -5.401 18990 10470 1 15 . 1 1 359 359 GLY C C 359 174.080 174.080 175.302 -1.222 18990 10471 1 15 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.373 -0.309 18990 10472 1 15 . 1 1 359 359 GLY H H 359 7.756 7.756 8.160 -0.404 18990 10473 1 15 . 1 1 360 360 MET N N 360 121.300 121.300 119.630 1.670 18990 10474 1 15 . 1 1 360 360 MET HA H 360 4.343 4.343 4.296 0.047 18990 10475 1 15 . 1 1 360 360 MET C C 360 175.641 175.641 177.612 -1.971 18990 10476 1 15 . 1 1 360 360 MET CA C 360 55.923 55.923 56.689 -0.766 18990 10477 1 15 . 1 1 360 360 MET CB C 360 33.091 33.091 33.675 -0.584 18990 10478 1 15 . 1 1 360 360 MET H H 360 8.229 8.229 7.570 0.659 18990 10479 1 15 . 1 1 361 361 GLY N N 361 109.000 109.000 105.660 3.340 18990 10480 1 15 . 1 1 361 361 GLY C C 361 173.774 173.774 173.018 0.756 18990 10481 1 15 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.504 1.334 18990 10482 1 15 . 1 1 361 361 GLY H H 361 8.347 8.347 7.726 0.621 18990 10483 1 15 . 1 1 362 362 LEU N N 362 126.725 126.725 123.793 2.932 18990 10484 1 15 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.921 -0.246 18990 10485 1 15 . 1 1 362 362 LEU C C 362 175.865 175.865 175.715 0.150 18990 10486 1 15 . 1 1 362 362 LEU CA C 362 54.190 54.190 52.765 1.425 18990 10487 1 15 . 1 1 362 362 LEU CB C 362 44.050 44.050 45.443 -1.393 18990 10488 1 15 . 1 1 362 362 LEU H H 362 8.935 8.935 8.861 0.074 18990 10489 1 15 . 1 1 363 363 LEU N N 363 123.742 123.742 119.555 4.187 18990 10490 1 15 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.497 0.180 18990 10491 1 15 . 1 1 363 363 LEU C C 363 176.162 176.162 175.994 0.168 18990 10492 1 15 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.833 -0.491 18990 10493 1 15 . 1 1 363 363 LEU CB C 363 42.210 42.210 43.658 -1.448 18990 10494 1 15 . 1 1 363 363 LEU H H 363 8.481 8.481 8.523 -0.042 18990 10495 1 15 . 1 1 364 364 VAL N N 364 120.980 120.980 121.106 -0.126 18990 10496 1 15 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.247 0.150 18990 10497 1 15 . 1 1 364 364 VAL C C 364 175.592 175.592 175.018 0.574 18990 10498 1 15 . 1 1 364 364 VAL CA C 364 60.460 60.460 61.351 -0.891 18990 10499 1 15 . 1 1 364 364 VAL CB C 364 34.125 34.125 33.014 1.111 18990 10500 1 15 . 1 1 364 364 VAL H H 364 8.155 8.155 8.328 -0.173 18990 10501 1 15 . 1 1 365 365 GLU N N 365 126.950 126.950 121.830 5.120 18990 10502 1 15 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.370 0.240 18990 10503 1 15 . 1 1 365 365 GLU C C 365 175.427 175.427 175.969 -0.542 18990 10504 1 15 . 1 1 365 365 GLU CA C 365 54.551 54.551 56.041 -1.490 18990 10505 1 15 . 1 1 365 365 GLU CB C 365 29.780 29.780 28.828 0.952 18990 10506 1 15 . 1 1 365 365 GLU H H 365 8.900 8.900 8.248 0.652 18990 10507 1 15 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.227 0.035 18990 10508 1 15 . 1 1 366 366 PRO C C 366 177.013 177.013 176.584 0.429 18990 10509 1 15 . 1 1 366 366 PRO CA C 366 64.463 64.463 65.156 -0.693 18990 10510 1 15 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.867 0.181 18990 10511 1 15 . 1 1 367 367 ASP N N 367 115.459 115.459 115.151 0.308 18990 10512 1 15 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.475 0.020 18990 10513 1 15 . 1 1 367 367 ASP C C 367 175.123 175.123 176.067 -0.944 18990 10514 1 15 . 1 1 367 367 ASP CA C 367 54.503 54.503 53.812 0.691 18990 10515 1 15 . 1 1 367 367 ASP CB C 367 40.123 40.123 39.717 0.406 18990 10516 1 15 . 1 1 367 367 ASP H H 367 8.439 8.439 8.317 0.122 18990 10517 1 15 . 1 1 368 368 CYS N N 368 118.700 118.700 120.996 -2.296 18990 10518 1 15 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.253 0.317 18990 10519 1 15 . 1 1 368 368 CYS C C 368 173.806 173.806 175.603 -1.797 18990 10520 1 15 . 1 1 368 368 CYS CA C 368 58.581 58.581 60.259 -1.678 18990 10521 1 15 . 1 1 368 368 CYS CB C 368 28.450 28.450 28.381 0.069 18990 10522 1 15 . 1 1 368 368 CYS H H 368 7.515 7.515 8.011 -0.496 18990 10523 1 15 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.149 0.116 18990 10524 1 15 . 1 1 369 369 ARG C C 369 174.908 174.908 176.121 -1.213 18990 10525 1 15 . 1 1 369 369 ARG CA C 369 57.669 57.669 57.727 -0.058 18990 10526 1 15 . 1 1 369 369 ARG CB C 369 32.274 32.274 30.649 1.625 18990 10527 1 15 . 1 1 370 370 LYS N N 370 121.022 121.022 117.626 3.396 18990 10528 1 15 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.345 -0.175 18990 10529 1 15 . 1 1 370 370 LYS C C 370 174.868 174.868 174.246 0.622 18990 10530 1 15 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.834 0.720 18990 10531 1 15 . 1 1 370 370 LYS CB C 370 33.140 33.140 34.045 -0.905 18990 10532 1 15 . 1 1 370 370 LYS H H 370 7.740 7.740 7.540 0.200 18990 10533 1 15 . 1 1 371 371 VAL N N 371 128.362 128.362 127.247 1.115 18990 10534 1 15 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.122 0.011 18990 10535 1 15 . 1 1 371 371 VAL C C 371 173.402 173.402 174.161 -0.759 18990 10536 1 15 . 1 1 371 371 VAL CA C 371 60.777 60.777 61.682 -0.905 18990 10537 1 15 . 1 1 371 371 VAL CB C 371 33.000 33.000 32.751 0.249 18990 10538 1 15 . 1 1 371 371 VAL H H 371 8.647 8.647 8.706 -0.059 18990 10539 1 15 . 1 1 372 372 THR N N 372 119.667 119.667 123.711 -4.044 18990 10540 1 15 . 1 1 372 372 THR HA H 372 5.032 5.032 4.955 0.077 18990 10541 1 15 . 1 1 372 372 THR C C 372 174.339 174.339 173.741 0.598 18990 10542 1 15 . 1 1 372 372 THR CA C 372 60.881 60.881 61.543 -0.662 18990 10543 1 15 . 1 1 372 372 THR CB C 372 70.471 70.471 71.682 -1.211 18990 10544 1 15 . 1 1 372 372 THR H H 372 8.087 8.087 8.074 0.013 18990 10545 1 15 . 1 1 373 373 CYS N N 373 132.554 132.554 126.501 6.053 18990 10546 1 15 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.529 0.273 18990 10547 1 15 . 1 1 373 373 CYS C C 373 176.791 176.791 175.404 1.387 18990 10548 1 15 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.293 -0.789 18990 10549 1 15 . 1 1 373 373 CYS CB C 373 28.311 28.311 25.182 3.129 18990 10550 1 15 . 1 1 373 373 CYS H H 373 9.322 9.322 9.154 0.168 18990 10551 1 15 . 1 1 374 374 GLN N N 374 125.890 125.890 123.929 1.961 18990 10552 1 15 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.376 -0.376 18990 10553 1 15 . 1 1 374 374 GLN C C 374 176.827 176.827 177.043 -0.216 18990 10554 1 15 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.256 1.044 18990 10555 1 15 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.495 1.169 18990 10556 1 15 . 1 1 374 374 GLN H H 374 7.856 7.856 8.430 -0.574 18990 10557 1 15 . 1 1 375 375 ASN N N 375 115.342 115.342 116.042 -0.700 18990 10558 1 15 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.779 0.108 18990 10559 1 15 . 1 1 375 375 ASN C C 375 174.049 174.049 175.001 -0.952 18990 10560 1 15 . 1 1 375 375 ASN CA C 375 53.047 53.047 52.970 0.077 18990 10561 1 15 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.099 -0.183 18990 10562 1 15 . 1 1 375 375 ASN H H 375 8.913 8.913 8.144 0.769 18990 10563 1 15 . 1 1 376 376 GLY N N 376 109.098 109.098 106.115 2.983 18990 10564 1 15 . 1 1 376 376 GLY C C 376 174.110 174.110 174.166 -0.056 18990 10565 1 15 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.505 0.881 18990 10566 1 15 . 1 1 376 376 GLY H H 376 7.162 7.162 7.792 -0.630 18990 10567 1 15 . 1 1 377 377 CYS N N 377 132.546 132.546 120.046 12.500 18990 10568 1 15 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.980 -0.216 18990 10569 1 15 . 1 1 377 377 CYS C C 377 177.355 177.355 174.162 3.193 18990 10570 1 15 . 1 1 377 377 CYS CA C 377 59.988 59.988 57.748 2.240 18990 10571 1 15 . 1 1 377 377 CYS CB C 377 32.365 32.365 29.354 3.011 18990 10572 1 15 . 1 1 377 377 CYS H H 377 9.800 9.800 8.111 1.689 18990 10573 1 15 . 1 1 378 378 GLY N N 378 113.851 113.851 107.574 6.277 18990 10574 1 15 . 1 1 378 378 GLY C C 378 173.404 173.404 172.645 0.759 18990 10575 1 15 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.664 0.199 18990 10576 1 15 . 1 1 378 378 GLY H H 378 8.820 8.820 8.260 0.560 18990 10577 1 15 . 1 1 379 379 TYR N N 379 125.532 125.532 124.818 0.714 18990 10578 1 15 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.820 -0.342 18990 10579 1 15 . 1 1 379 379 TYR C C 379 173.661 173.661 173.099 0.562 18990 10580 1 15 . 1 1 379 379 TYR CA C 379 59.180 59.180 57.968 1.212 18990 10581 1 15 . 1 1 379 379 TYR CB C 379 40.108 40.108 41.967 -1.859 18990 10582 1 15 . 1 1 379 379 TYR H H 379 9.054 9.054 8.337 0.717 18990 10583 1 15 . 1 1 380 380 VAL N N 380 124.461 124.461 127.257 -2.796 18990 10584 1 15 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.581 0.237 18990 10585 1 15 . 1 1 380 380 VAL C C 380 175.876 175.876 174.683 1.193 18990 10586 1 15 . 1 1 380 380 VAL CA C 380 60.797 60.797 61.810 -1.013 18990 10587 1 15 . 1 1 380 380 VAL CB C 380 32.610 32.610 32.045 0.564 18990 10588 1 15 . 1 1 380 380 VAL H H 380 7.238 7.238 7.982 -0.744 18990 10589 1 15 . 1 1 381 381 PHE N N 381 124.588 124.588 123.956 0.632 18990 10590 1 15 . 1 1 381 381 PHE HA H 381 5.273 5.273 4.927 0.346 18990 10591 1 15 . 1 1 381 381 PHE C C 381 173.242 173.242 174.164 -0.922 18990 10592 1 15 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.103 0.107 18990 10593 1 15 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.080 2.010 18990 10594 1 15 . 1 1 381 381 PHE H H 381 9.424 9.424 7.821 1.603 18990 10595 1 15 . 1 1 382 382 CYS N N 382 120.221 120.221 120.550 -0.329 18990 10596 1 15 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.588 0.314 18990 10597 1 15 . 1 1 382 382 CYS C C 382 177.165 177.165 175.783 1.382 18990 10598 1 15 . 1 1 382 382 CYS CA C 382 57.691 57.691 58.016 -0.324 18990 10599 1 15 . 1 1 382 382 CYS CB C 382 32.475 32.475 29.972 2.503 18990 10600 1 15 . 1 1 382 382 CYS H H 382 8.673 8.673 8.751 -0.078 18990 10601 1 15 . 1 1 383 383 ARG N N 383 129.347 129.347 121.193 8.154 18990 10602 1 15 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.353 -0.332 18990 10603 1 15 . 1 1 383 383 ARG C C 383 175.012 175.012 176.093 -1.081 18990 10604 1 15 . 1 1 383 383 ARG CA C 383 58.686 58.686 57.691 0.995 18990 10605 1 15 . 1 1 383 383 ARG CB C 383 30.900 30.900 30.188 0.712 18990 10606 1 15 . 1 1 383 383 ARG H H 383 9.534 9.534 8.601 0.933 18990 10607 1 15 . 1 1 384 384 ASN N N 384 117.772 117.772 117.439 0.333 18990 10608 1 15 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.801 -0.093 18990 10609 1 15 . 1 1 384 384 ASN C C 384 175.656 175.656 175.122 0.534 18990 10610 1 15 . 1 1 384 384 ASN CA C 384 55.778 55.778 54.010 1.768 18990 10611 1 15 . 1 1 384 384 ASN CB C 384 39.475 39.475 40.992 -1.517 18990 10612 1 15 . 1 1 384 384 ASN H H 384 8.840 8.840 7.935 0.905 18990 10613 1 15 . 1 1 385 385 CYS N N 385 115.876 115.876 114.802 1.074 18990 10614 1 15 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.854 0.174 18990 10615 1 15 . 1 1 385 385 CYS C C 385 175.703 175.703 173.926 1.777 18990 10616 1 15 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.856 1.256 18990 10617 1 15 . 1 1 385 385 CYS CB C 385 32.359 32.359 29.836 2.523 18990 10618 1 15 . 1 1 385 385 CYS H H 385 7.868 7.868 7.875 -0.007 18990 10619 1 15 . 1 1 386 386 LEU N N 386 120.082 120.082 118.954 1.128 18990 10620 1 15 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.852 -0.539 18990 10621 1 15 . 1 1 386 386 LEU C C 386 175.722 175.722 177.218 -1.496 18990 10622 1 15 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.045 2.964 18990 10623 1 15 . 1 1 386 386 LEU CB C 386 38.412 38.412 40.908 -2.497 18990 10624 1 15 . 1 1 386 386 LEU H H 386 8.514 8.514 8.407 0.107 18990 10625 1 15 . 1 1 387 387 GLN N N 387 117.579 117.579 119.514 -1.935 18990 10626 1 15 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.459 0.317 18990 10627 1 15 . 1 1 387 387 GLN C C 387 175.299 175.299 176.932 -1.633 18990 10628 1 15 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.627 -1.610 18990 10629 1 15 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.739 1.568 18990 10630 1 15 . 1 1 387 387 GLN H H 387 8.248 8.248 7.547 0.701 18990 10631 1 15 . 1 1 388 388 GLY N N 388 106.107 106.107 107.934 -1.827 18990 10632 1 15 . 1 1 388 388 GLY C C 388 173.693 173.693 173.819 -0.126 18990 10633 1 15 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.099 1.081 18990 10634 1 15 . 1 1 388 388 GLY H H 388 8.695 8.695 8.310 0.385 18990 10635 1 15 . 1 1 389 389 TYR N N 389 122.514 122.514 116.990 5.524 18990 10636 1 15 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.205 -0.547 18990 10637 1 15 . 1 1 389 389 TYR C C 389 172.860 172.860 173.941 -1.081 18990 10638 1 15 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.871 4.115 18990 10639 1 15 . 1 1 389 389 TYR CB C 389 38.052 38.052 38.490 -0.438 18990 10640 1 15 . 1 1 389 389 TYR H H 389 7.923 7.923 8.140 -0.217 18990 10641 1 15 . 1 1 390 390 HIS N N 390 120.080 120.080 123.523 -3.443 18990 10642 1 15 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.633 0.075 18990 10643 1 15 . 1 1 390 390 HIS C C 390 173.235 173.235 172.723 0.512 18990 10644 1 15 . 1 1 390 390 HIS CA C 390 51.431 51.431 54.503 -3.072 18990 10645 1 15 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.103 0.797 18990 10646 1 15 . 1 1 390 390 HIS H H 390 5.291 5.291 7.272 -1.981 18990 10647 1 15 . 1 1 391 391 ILE N N 391 117.810 117.810 121.696 -3.886 18990 10648 1 15 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.078 0.038 18990 10649 1 15 . 1 1 391 391 ILE C C 391 178.208 178.208 175.587 2.621 18990 10650 1 15 . 1 1 391 391 ILE CA C 391 60.877 60.877 61.182 -0.305 18990 10651 1 15 . 1 1 391 391 ILE CB C 391 39.034 39.034 38.677 0.357 18990 10652 1 15 . 1 1 391 391 ILE H H 391 8.418 8.418 8.295 0.123 18990 10653 1 15 . 1 1 392 392 GLY N N 392 112.387 112.387 113.822 -1.435 18990 10654 1 15 . 1 1 392 392 GLY C C 392 173.565 173.565 173.358 0.207 18990 10655 1 15 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.366 0.892 18990 10656 1 15 . 1 1 392 392 GLY H H 392 8.654 8.654 8.364 0.290 18990 10657 1 15 . 1 1 393 393 GLU N N 393 119.098 119.098 120.019 -0.921 18990 10658 1 15 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.594 -0.305 18990 10659 1 15 . 1 1 393 393 GLU C C 393 176.899 176.899 175.333 1.566 18990 10660 1 15 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.464 0.969 18990 10661 1 15 . 1 1 393 393 GLU CB C 393 30.470 30.470 31.352 -0.882 18990 10662 1 15 . 1 1 393 393 GLU H H 393 8.391 8.391 8.274 0.117 18990 10663 1 15 . 1 1 394 394 CYS N N 394 122.845 122.845 119.060 3.785 18990 10664 1 15 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.669 -0.903 18990 10665 1 15 . 1 1 394 394 CYS C C 394 175.461 175.461 174.273 1.188 18990 10666 1 15 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.537 1.298 18990 10667 1 15 . 1 1 394 394 CYS CB C 394 30.761 30.761 27.046 3.716 18990 10668 1 15 . 1 1 394 394 CYS H H 394 8.474 8.474 8.653 -0.179 18990 10669 1 15 . 1 1 395 395 LEU N N 395 124.403 124.403 125.724 -1.321 18990 10670 1 15 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.686 -0.182 18990 10671 1 15 . 1 1 395 395 LEU C C 395 175.259 175.259 174.741 0.518 18990 10672 1 15 . 1 1 395 395 LEU CA C 395 52.835 52.835 53.171 -0.336 18990 10673 1 15 . 1 1 395 395 LEU CB C 395 41.436 41.436 43.032 -1.596 18990 10674 1 15 . 1 1 395 395 LEU H H 395 8.418 8.418 8.429 -0.011 18990 10675 1 15 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.422 -0.052 18990 10676 1 15 . 1 1 396 396 PRO C C 396 177.006 177.006 175.850 1.156 18990 10677 1 15 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.518 0.578 18990 10678 1 15 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.505 -0.433 18990 10679 1 15 . 1 1 397 397 GLU N N 397 121.574 121.574 121.639 -0.065 18990 10680 1 15 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.424 -0.199 18990 10681 1 15 . 1 1 397 397 GLU C C 397 177.202 177.202 177.452 -0.250 18990 10682 1 15 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.169 0.865 18990 10683 1 15 . 1 1 397 397 GLU CB C 397 30.263 30.263 30.418 -0.155 18990 10684 1 15 . 1 1 397 397 GLU H H 397 8.568 8.568 8.471 0.097 18990 10685 1 15 . 1 1 398 398 GLY N N 398 110.495 110.495 111.477 -0.982 18990 10686 1 15 . 1 1 398 398 GLY C C 398 174.579 174.579 173.550 1.029 18990 10687 1 15 . 1 1 398 398 GLY CA C 398 45.462 45.462 44.709 0.753 18990 10688 1 15 . 1 1 398 398 GLY H H 398 8.515 8.515 8.301 0.214 18990 10689 1 15 . 1 1 399 399 THR N N 399 113.234 113.234 111.780 1.454 18990 10690 1 15 . 1 1 399 399 THR HA H 399 4.398 4.398 5.048 -0.650 18990 10691 1 15 . 1 1 399 399 THR C C 399 175.333 175.333 174.473 0.860 18990 10692 1 15 . 1 1 399 399 THR CA C 399 62.233 62.233 61.031 1.202 18990 10693 1 15 . 1 1 399 399 THR CB C 399 69.833 69.833 71.804 -1.971 18990 10694 1 15 . 1 1 399 399 THR H H 399 8.090 8.090 9.022 -0.932 18990 10695 1 15 . 1 1 400 400 GLY N N 400 111.479 111.479 108.057 3.422 18990 10696 1 15 . 1 1 400 400 GLY C C 400 174.048 174.048 172.380 1.668 18990 10697 1 15 . 1 1 400 400 GLY CA C 400 45.439 45.439 44.392 1.047 18990 10698 1 15 . 1 1 400 400 GLY H H 400 8.524 8.524 8.958 -0.434 18990 10699 1 15 . 1 1 401 401 ALA N N 401 123.919 123.919 122.633 1.286 18990 10700 1 15 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.675 -0.424 18990 10701 1 15 . 1 1 401 401 ALA C C 401 177.942 177.942 176.325 1.617 18990 10702 1 15 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.990 0.740 18990 10703 1 15 . 1 1 401 401 ALA CB C 401 19.142 19.142 20.724 -1.582 18990 10704 1 15 . 1 1 401 401 ALA H H 401 8.179 8.179 8.106 0.073 18990 10705 1 15 . 1 1 402 402 SER N N 402 114.904 114.904 117.318 -2.414 18990 10706 1 15 . 1 1 402 402 SER HA H 402 4.448 4.448 4.671 -0.223 18990 10707 1 15 . 1 1 402 402 SER C C 402 174.426 174.426 173.532 0.894 18990 10708 1 15 . 1 1 402 402 SER CA C 402 58.289 58.289 58.733 -0.444 18990 10709 1 15 . 1 1 402 402 SER CB C 402 63.772 63.772 63.745 0.027 18990 10710 1 15 . 1 1 402 402 SER H H 402 8.305 8.305 8.438 -0.133 18990 10711 1 15 . 1 1 403 403 ALA N N 403 125.965 125.965 129.006 -3.041 18990 10712 1 15 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.636 -0.237 18990 10713 1 15 . 1 1 403 403 ALA C C 403 177.984 177.984 176.321 1.663 18990 10714 1 15 . 1 1 403 403 ALA CA C 403 52.655 52.655 52.165 0.490 18990 10715 1 15 . 1 1 403 403 ALA CB C 403 19.138 19.138 19.463 -0.325 18990 10716 1 15 . 1 1 403 403 ALA H H 403 8.345 8.345 8.202 0.143 18990 10717 1 15 . 1 1 404 404 THR N N 404 112.790 112.790 115.509 -2.719 18990 10718 1 15 . 1 1 404 404 THR C C 404 174.420 174.420 174.019 0.401 18990 10719 1 15 . 1 1 404 404 THR CA C 404 61.988 61.988 61.491 0.497 18990 10720 1 15 . 1 1 404 404 THR CB C 404 69.688 69.688 70.188 -0.500 18990 10721 1 15 . 1 1 404 404 THR H H 404 8.118 8.118 8.195 -0.077 18990 10722 1 15 . 1 1 405 405 ASN N N 405 121.050 121.050 123.693 -2.643 18990 10723 1 15 . 1 1 405 405 ASN H H 405 8.396 8.396 8.870 -0.474 18990 10724 1 15 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.697 -0.119 18990 10725 1 15 . 1 1 407 407 CYS C C 407 174.489 174.489 174.854 -0.365 18990 10726 1 15 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.666 0.047 18990 10727 1 15 . 1 1 407 407 CYS CB C 407 28.102 28.102 28.419 -0.317 18990 10728 1 15 . 1 1 408 408 GLU N N 408 123.021 123.021 121.411 1.610 18990 10729 1 15 . 1 1 408 408 GLU C C 408 175.954 175.954 175.577 0.377 18990 10730 1 15 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.592 0.210 18990 10731 1 15 . 1 1 408 408 GLU CB C 408 30.328 30.328 30.199 0.129 18990 10732 1 15 . 1 1 408 408 GLU H H 408 8.415 8.415 8.327 0.088 18990 10733 1 15 . 1 1 409 409 TYR N N 409 121.015 121.015 123.767 -2.752 18990 10734 1 15 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.568 0.086 18990 10735 1 15 . 1 1 409 409 TYR C C 409 175.613 175.613 175.368 0.245 18990 10736 1 15 . 1 1 409 409 TYR CA C 409 57.669 57.669 58.314 -0.645 18990 10737 1 15 . 1 1 409 409 TYR CB C 409 38.825 38.825 39.264 -0.439 18990 10738 1 15 . 1 1 409 409 TYR H H 409 8.135 8.135 8.371 -0.236 18990 10739 1 15 . 1 1 410 410 THR N N 410 116.975 116.975 113.672 3.303 18990 10740 1 15 . 1 1 410 410 THR HA H 410 4.306 4.306 4.133 0.173 18990 10741 1 15 . 1 1 410 410 THR C C 410 173.846 173.846 173.479 0.367 18990 10742 1 15 . 1 1 410 410 THR CA C 410 61.730 61.730 62.873 -1.143 18990 10743 1 15 . 1 1 410 410 THR CB C 410 69.914 69.914 69.336 0.578 18990 10744 1 15 . 1 1 410 410 THR H H 410 8.060 8.060 7.685 0.375 18990 10745 1 15 . 1 1 411 411 VAL N N 411 122.900 122.900 118.707 4.193 18990 10746 1 15 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.462 -0.409 18990 10747 1 15 . 1 1 411 411 VAL C C 411 175.275 175.275 174.083 1.192 18990 10748 1 15 . 1 1 411 411 VAL CA C 411 61.853 61.853 61.447 0.407 18990 10749 1 15 . 1 1 411 411 VAL CB C 411 32.976 32.976 34.049 -1.073 18990 10750 1 15 . 1 1 411 411 VAL H H 411 8.089 8.089 7.979 0.111 18990 10751 1 15 . 1 1 412 412 ASP N N 412 125.924 125.924 120.155 5.769 18990 10752 1 15 . 1 1 412 412 ASP HA H 412 4.850 4.850 5.112 -0.262 18990 10753 1 15 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.338 -0.760 18990 10754 1 15 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.751 -0.213 18990 10755 1 15 . 1 1 412 412 ASP H H 412 8.397 8.397 8.674 -0.277 18990 10756 1 15 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.705 -0.319 18990 10757 1 15 . 1 1 413 413 PRO C C 413 177.352 177.352 175.845 1.507 18990 10758 1 15 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.621 1.289 18990 10759 1 15 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.311 -0.043 18990 10760 1 15 . 1 1 414 414 ASN N N 414 117.035 117.035 118.775 -1.740 18990 10761 1 15 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.904 -0.227 18990 10762 1 15 . 1 1 414 414 ASN C C 414 175.532 175.532 175.255 0.277 18990 10763 1 15 . 1 1 414 414 ASN CA C 414 53.824 53.824 52.344 1.480 18990 10764 1 15 . 1 1 414 414 ASN CB C 414 38.728 38.728 39.480 -0.752 18990 10765 1 15 . 1 1 414 414 ASN H H 414 8.496 8.496 8.273 0.223 18990 10766 1 15 . 1 1 415 415 ARG N N 415 121.000 121.000 119.224 1.776 18990 10767 1 15 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.643 -0.399 18990 10768 1 15 . 1 1 415 415 ARG C C 415 176.243 176.243 174.503 1.740 18990 10769 1 15 . 1 1 415 415 ARG CA C 415 56.404 56.404 55.000 1.404 18990 10770 1 15 . 1 1 415 415 ARG CB C 415 30.637 30.637 31.557 -0.920 18990 10771 1 15 . 1 1 415 415 ARG H H 415 7.804 7.804 8.588 -0.784 18990 10772 1 15 . 1 1 416 416 ALA N N 416 124.880 124.880 124.653 0.227 18990 10773 1 15 . 1 1 416 416 ALA C C 416 177.831 177.831 176.225 1.606 18990 10774 1 15 . 1 1 416 416 ALA CA C 416 52.957 52.957 52.313 0.644 18990 10775 1 15 . 1 1 416 416 ALA CB C 416 19.059 19.059 18.817 0.242 18990 10776 1 15 . 1 1 416 416 ALA H H 416 8.189 8.189 8.718 -0.529 18990 10777 1 15 . 1 1 417 417 ALA N N 417 122.614 122.614 124.801 -2.187 18990 10778 1 15 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.754 -0.507 18990 10779 1 15 . 1 1 417 417 ALA C C 417 178.024 178.024 175.021 3.003 18990 10780 1 15 . 1 1 417 417 ALA CA C 417 52.789 52.789 52.349 0.440 18990 10781 1 15 . 1 1 417 417 ALA CB C 417 19.042 19.042 21.043 -2.001 18990 10782 1 15 . 1 1 417 417 ALA H H 417 8.169 8.169 8.207 -0.038 18990 10783 1 15 . 1 1 418 418 GLU N N 418 119.500 119.500 121.075 -1.575 18990 10784 1 15 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.531 -0.342 18990 10785 1 15 . 1 1 418 418 GLU C C 418 176.266 176.266 174.677 1.589 18990 10786 1 15 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.157 1.419 18990 10787 1 15 . 1 1 418 418 GLU CB C 418 30.307 30.307 32.553 -2.246 18990 10788 1 15 . 1 1 418 418 GLU H H 418 8.184 8.184 8.782 -0.598 18990 10789 1 15 . 1 1 419 419 ALA N N 419 124.643 124.643 122.334 2.309 18990 10790 1 15 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.454 -0.204 18990 10791 1 15 . 1 1 419 419 ALA C C 419 177.488 177.488 176.819 0.669 18990 10792 1 15 . 1 1 419 419 ALA CA C 419 52.509 52.509 52.485 0.024 18990 10793 1 15 . 1 1 419 419 ALA CB C 419 19.161 19.161 19.311 -0.150 18990 10794 1 15 . 1 1 419 419 ALA H H 419 8.135 8.135 8.378 -0.243 18990 10795 1 15 . 1 1 420 420 ARG N N 420 120.003 120.003 119.950 0.053 18990 10796 1 15 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.074 0.219 18990 10797 1 15 . 1 1 420 420 ARG C C 420 176.297 176.297 174.953 1.344 18990 10798 1 15 . 1 1 420 420 ARG CA C 420 55.933 55.933 56.456 -0.523 18990 10799 1 15 . 1 1 420 420 ARG CB C 420 30.850 30.850 29.213 1.637 18990 10800 1 15 . 1 1 420 420 ARG H H 420 8.135 8.135 8.444 -0.309 18990 10801 1 15 . 1 1 421 421 TRP N N 421 122.280 122.280 122.160 0.120 18990 10802 1 15 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.787 -0.124 18990 10803 1 15 . 1 1 421 421 TRP C C 421 175.856 175.856 176.148 -0.292 18990 10804 1 15 . 1 1 421 421 TRP CA C 421 57.404 57.404 57.652 -0.248 18990 10805 1 15 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.228 -0.791 18990 10806 1 15 . 1 1 421 421 TRP H H 421 8.159 8.159 8.403 -0.244 18990 10807 1 15 . 1 1 422 422 ASP N N 422 121.980 121.980 118.696 3.284 18990 10808 1 15 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.784 -0.289 18990 10809 1 15 . 1 1 422 422 ASP C C 422 176.184 176.184 176.453 -0.269 18990 10810 1 15 . 1 1 422 422 ASP CA C 422 53.899 53.899 53.130 0.769 18990 10811 1 15 . 1 1 422 422 ASP CB C 422 40.948 40.948 42.333 -1.385 18990 10812 1 15 . 1 1 422 422 ASP H H 422 8.135 8.135 7.858 0.277 18990 10813 1 15 . 1 1 423 423 GLU N N 423 121.990 121.990 118.720 3.270 18990 10814 1 15 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.254 -0.164 18990 10815 1 15 . 1 1 423 423 GLU C C 423 176.720 176.720 176.431 0.289 18990 10816 1 15 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.391 0.778 18990 10817 1 15 . 1 1 423 423 GLU CB C 423 30.156 30.156 29.560 0.596 18990 10818 1 15 . 1 1 423 423 GLU H H 423 8.153 8.153 8.674 -0.521 18990 10819 1 15 . 1 1 424 424 ALA N N 424 123.900 123.900 123.817 0.083 18990 10820 1 15 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.162 0.118 18990 10821 1 15 . 1 1 424 424 ALA C C 424 178.095 178.095 176.210 1.885 18990 10822 1 15 . 1 1 424 424 ALA CA C 424 53.017 53.017 52.361 0.656 18990 10823 1 15 . 1 1 424 424 ALA CB C 424 19.086 19.086 18.089 0.997 18990 10824 1 15 . 1 1 424 424 ALA H H 424 8.243 8.243 8.130 0.113 18990 10825 1 15 . 1 1 425 425 SER N N 425 113.881 113.881 116.215 -2.334 18990 10826 1 15 . 1 1 425 425 SER HA H 425 4.387 4.387 4.557 -0.170 18990 10827 1 15 . 1 1 425 425 SER C C 425 174.338 174.338 173.223 1.115 18990 10828 1 15 . 1 1 425 425 SER CA C 425 58.546 58.546 57.848 0.698 18990 10829 1 15 . 1 1 425 425 SER CB C 425 63.784 63.784 64.487 -0.703 18990 10830 1 15 . 1 1 425 425 SER H H 425 8.063 8.063 8.205 -0.142 18990 10831 1 15 . 1 1 426 426 ASN N N 426 121.032 121.032 123.548 -2.516 18990 10832 1 15 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.804 -0.098 18990 10833 1 15 . 1 1 426 426 ASN C C 426 175.046 175.046 175.032 0.014 18990 10834 1 15 . 1 1 426 426 ASN CA C 426 53.445 53.445 52.891 0.554 18990 10835 1 15 . 1 1 426 426 ASN CB C 426 38.847 38.847 39.493 -0.646 18990 10836 1 15 . 1 1 426 426 ASN H H 426 8.391 8.391 8.379 0.012 18990 10837 1 15 . 1 1 427 427 VAL N N 427 119.463 119.463 121.390 -1.927 18990 10838 1 15 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.331 -0.138 18990 10839 1 15 . 1 1 427 427 VAL C C 427 176.213 176.213 175.652 0.561 18990 10840 1 15 . 1 1 427 427 VAL CA C 427 62.449 62.449 62.769 -0.320 18990 10841 1 15 . 1 1 427 427 VAL CB C 427 32.865 32.865 32.442 0.423 18990 10842 1 15 . 1 1 427 427 VAL H H 427 7.954 7.954 8.488 -0.534 18990 10843 1 15 . 1 1 428 428 THR N N 428 118.226 118.226 122.245 -4.019 18990 10844 1 15 . 1 1 428 428 THR HA H 428 4.353 4.353 4.570 -0.217 18990 10845 1 15 . 1 1 428 428 THR C C 428 174.361 174.361 173.578 0.783 18990 10846 1 15 . 1 1 428 428 THR CA C 428 62.065 62.065 62.102 -0.038 18990 10847 1 15 . 1 1 428 428 THR CB C 428 69.729 69.729 70.084 -0.355 18990 10848 1 15 . 1 1 428 428 THR H H 428 8.225 8.225 8.468 -0.243 18990 10849 1 15 . 1 1 429 429 ILE N N 429 123.910 123.910 125.586 -1.676 18990 10850 1 15 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.482 -0.294 18990 10851 1 15 . 1 1 429 429 ILE C C 429 175.774 175.774 174.931 0.843 18990 10852 1 15 . 1 1 429 429 ILE CA C 429 60.819 60.819 60.637 0.182 18990 10853 1 15 . 1 1 429 429 ILE CB C 429 38.719 38.719 39.505 -0.786 18990 10854 1 15 . 1 1 429 429 ILE H H 429 8.148 8.148 8.343 -0.195 18990 10855 1 15 . 1 1 430 430 LYS N N 430 126.453 126.453 128.731 -2.278 18990 10856 1 15 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.599 -0.165 18990 10857 1 15 . 1 1 430 430 LYS C C 430 176.241 176.241 175.873 0.368 18990 10858 1 15 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.305 0.632 18990 10859 1 15 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.869 -0.705 18990 10860 1 15 . 1 1 430 430 LYS H H 430 8.406 8.406 8.475 -0.069 18990 10861 1 15 . 1 1 431 431 VAL N N 431 122.496 122.496 126.264 -3.768 18990 10862 1 15 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.179 0.101 18990 10863 1 15 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.911 -0.608 18990 10864 1 15 . 1 1 431 431 VAL CB C 431 33.132 33.132 32.631 0.501 18990 10865 1 15 . 1 1 431 431 VAL H H 431 8.312 8.312 8.784 -0.472 18990 10866 1 15 . 1 1 432 432 SER HA H 432 4.486 4.486 4.758 -0.272 18990 10867 1 15 . 1 1 432 432 SER C C 432 173.834 173.834 173.054 0.780 18990 10868 1 15 . 1 1 432 432 SER CA C 432 58.650 58.650 58.366 0.284 18990 10869 1 15 . 1 1 432 432 SER CB C 432 64.152 64.152 63.919 0.233 18990 10870 1 15 . 1 1 433 433 THR N N 433 114.706 114.706 112.356 2.350 18990 10871 1 15 . 1 1 433 433 THR HA H 433 5.446 5.446 5.322 0.124 18990 10872 1 15 . 1 1 433 433 THR C C 433 173.979 173.979 173.923 0.056 18990 10873 1 15 . 1 1 433 433 THR CA C 433 60.412 60.412 60.023 0.389 18990 10874 1 15 . 1 1 433 433 THR CB C 433 71.896 71.896 71.767 0.129 18990 10875 1 15 . 1 1 433 433 THR H H 433 7.833 7.833 7.536 0.297 18990 10876 1 15 . 1 1 434 434 LYS N N 434 122.492 122.492 122.202 0.290 18990 10877 1 15 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.950 -0.241 18990 10878 1 15 . 1 1 434 434 LYS C C 434 173.589 173.589 174.745 -1.156 18990 10879 1 15 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.661 1.714 18990 10880 1 15 . 1 1 434 434 LYS CB C 434 36.925 36.925 33.387 3.538 18990 10881 1 15 . 1 1 434 434 LYS H H 434 8.937 8.937 9.115 -0.178 18990 10882 1 15 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.707 -0.440 18990 10883 1 15 . 1 1 435 435 PRO C C 435 175.238 175.238 176.517 -1.279 18990 10884 1 15 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.526 -1.603 18990 10885 1 15 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.072 0.014 18990 10886 1 15 . 1 1 436 436 CYS N N 436 125.422 125.422 125.960 -0.538 18990 10887 1 15 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.371 -0.941 18990 10888 1 15 . 1 1 436 436 CYS C C 436 176.770 176.770 175.806 0.964 18990 10889 1 15 . 1 1 436 436 CYS CA C 436 57.016 57.016 57.016 0.000 18990 10890 1 15 . 1 1 436 436 CYS CB C 436 31.698 31.698 28.016 3.682 18990 10891 1 15 . 1 1 436 436 CYS H H 436 7.768 7.768 8.758 -0.990 18990 10892 1 15 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.163 -0.305 18990 10893 1 15 . 1 1 437 437 PRO C C 437 173.608 173.608 176.291 -2.683 18990 10894 1 15 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.154 0.059 18990 10895 1 15 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.441 1.008 18990 10896 1 15 . 1 1 438 438 LYS N N 438 118.600 118.600 117.785 0.815 18990 10897 1 15 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.035 -0.065 18990 10898 1 15 . 1 1 438 438 LYS C C 438 176.887 176.887 177.493 -0.606 18990 10899 1 15 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.161 0.526 18990 10900 1 15 . 1 1 438 438 LYS CB C 438 33.124 33.124 32.974 0.150 18990 10901 1 15 . 1 1 438 438 LYS H H 438 8.390 8.390 7.525 0.865 18990 10902 1 15 . 1 1 439 439 CYS N N 439 118.950 118.950 116.029 2.921 18990 10903 1 15 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.608 0.138 18990 10904 1 15 . 1 1 439 439 CYS C C 439 176.650 176.650 175.612 1.038 18990 10905 1 15 . 1 1 439 439 CYS CA C 439 59.348 59.348 58.135 1.214 18990 10906 1 15 . 1 1 439 439 CYS CB C 439 31.196 31.196 27.733 3.463 18990 10907 1 15 . 1 1 439 439 CYS H H 439 8.357 8.357 7.775 0.582 18990 10908 1 15 . 1 1 440 440 ARG N N 440 117.200 117.200 119.649 -2.449 18990 10909 1 15 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.112 -0.144 18990 10910 1 15 . 1 1 440 440 ARG C C 440 175.253 175.253 175.253 0.000 18990 10911 1 15 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.571 0.329 18990 10912 1 15 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.557 -1.516 18990 10913 1 15 . 1 1 440 440 ARG H H 440 8.065 8.065 8.140 -0.075 18990 10914 1 15 . 1 1 441 441 THR N N 441 122.400 122.400 111.478 10.922 18990 10915 1 15 . 1 1 441 441 THR HA H 441 4.371 4.371 4.740 -0.369 18990 10916 1 15 . 1 1 441 441 THR C C 441 173.702 173.702 172.908 0.794 18990 10917 1 15 . 1 1 441 441 THR CA C 441 63.194 63.194 58.788 4.406 18990 10918 1 15 . 1 1 441 441 THR CB C 441 68.933 68.933 69.746 -0.813 18990 10919 1 15 . 1 1 441 441 THR H H 441 8.643 8.643 7.697 0.946 18990 10920 1 15 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.777 -0.630 18990 10921 1 15 . 1 1 442 442 PRO C C 442 176.215 176.215 175.977 0.238 18990 10922 1 15 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.490 1.707 18990 10923 1 15 . 1 1 442 442 PRO CB C 442 32.044 32.044 31.199 0.845 18990 10924 1 15 . 1 1 443 443 THR N N 443 122.932 122.932 122.428 0.504 18990 10925 1 15 . 1 1 443 443 THR HA H 443 4.665 4.665 4.452 0.213 18990 10926 1 15 . 1 1 443 443 THR C C 443 172.133 172.133 174.305 -2.172 18990 10927 1 15 . 1 1 443 443 THR CA C 443 62.566 62.566 62.312 0.255 18990 10928 1 15 . 1 1 443 443 THR CB C 443 71.562 71.562 69.958 1.604 18990 10929 1 15 . 1 1 443 443 THR H H 443 9.116 9.116 9.035 0.081 18990 10930 1 15 . 1 1 444 444 GLU N N 444 126.390 126.390 128.846 -2.456 18990 10931 1 15 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.443 0.499 18990 10932 1 15 . 1 1 444 444 GLU C C 444 175.292 175.292 176.307 -1.015 18990 10933 1 15 . 1 1 444 444 GLU CA C 444 55.049 55.049 56.769 -1.720 18990 10934 1 15 . 1 1 444 444 GLU CB C 444 31.861 31.861 30.367 1.494 18990 10935 1 15 . 1 1 444 444 GLU H H 444 8.720 8.720 8.913 -0.193 18990 10936 1 15 . 1 1 445 445 ARG N N 445 123.505 123.505 127.483 -3.978 18990 10937 1 15 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.578 -0.867 18990 10938 1 15 . 1 1 445 445 ARG C C 445 175.289 175.289 175.666 -0.377 18990 10939 1 15 . 1 1 445 445 ARG CA C 445 55.856 55.856 55.126 0.730 18990 10940 1 15 . 1 1 445 445 ARG CB C 445 30.675 30.675 32.255 -1.580 18990 10941 1 15 . 1 1 445 445 ARG H H 445 8.157 8.157 8.580 -0.423 18990 10942 1 15 . 1 1 446 446 ASP N N 446 126.800 126.800 122.739 4.061 18990 10943 1 15 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.733 -0.092 18990 10944 1 15 . 1 1 446 446 ASP C C 446 176.020 176.020 176.006 0.014 18990 10945 1 15 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.654 -0.702 18990 10946 1 15 . 1 1 446 446 ASP CB C 446 41.400 41.400 43.710 -2.310 18990 10947 1 15 . 1 1 446 446 ASP H H 446 8.476 8.476 8.481 -0.005 18990 10948 1 15 . 1 1 447 447 GLY N N 447 111.262 111.262 109.852 1.410 18990 10949 1 15 . 1 1 447 447 GLY C C 447 174.073 174.073 174.698 -0.625 18990 10950 1 15 . 1 1 447 447 GLY CA C 447 45.832 45.832 45.874 -0.042 18990 10951 1 15 . 1 1 447 447 GLY H H 447 8.056 8.056 8.737 -0.681 18990 10952 1 15 . 1 1 448 448 GLY N N 448 108.655 108.655 113.952 -5.297 18990 10953 1 15 . 1 1 448 448 GLY C C 448 174.020 174.020 174.538 -0.518 18990 10954 1 15 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.716 0.551 18990 10955 1 15 . 1 1 448 448 GLY H H 448 8.380 8.380 8.528 -0.148 18990 10956 1 15 . 1 1 449 449 CYS N N 449 120.628 120.628 120.594 0.034 18990 10957 1 15 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.401 -0.404 18990 10958 1 15 . 1 1 449 449 CYS C C 449 174.855 174.855 175.174 -0.319 18990 10959 1 15 . 1 1 449 449 CYS CA C 449 59.291 59.291 58.178 1.113 18990 10960 1 15 . 1 1 449 449 CYS CB C 449 28.000 28.000 28.670 -0.670 18990 10961 1 15 . 1 1 449 449 CYS H H 449 7.832 7.832 7.611 0.221 18990 10962 1 15 . 1 1 450 450 MET N N 450 123.947 123.947 119.765 4.182 18990 10963 1 15 . 1 1 450 450 MET HA H 450 4.551 4.551 4.373 0.178 18990 10964 1 15 . 1 1 450 450 MET C C 450 174.658 174.658 175.599 -0.941 18990 10965 1 15 . 1 1 450 450 MET CA C 450 54.970 54.970 56.287 -1.317 18990 10966 1 15 . 1 1 450 450 MET CB C 450 34.100 34.100 33.268 0.832 18990 10967 1 15 . 1 1 450 450 MET H H 450 8.916 8.916 8.222 0.694 18990 10968 1 15 . 1 1 451 451 HIS N N 451 120.490 120.490 119.762 0.728 18990 10969 1 15 . 1 1 451 451 HIS HA H 451 3.679 3.679 5.031 -1.352 18990 10970 1 15 . 1 1 451 451 HIS C C 451 172.443 172.443 174.299 -1.856 18990 10971 1 15 . 1 1 451 451 HIS CA C 451 53.812 53.812 54.682 -0.870 18990 10972 1 15 . 1 1 451 451 HIS CB C 451 28.900 28.900 30.762 -1.862 18990 10973 1 15 . 1 1 451 451 HIS H H 451 7.557 7.557 7.591 -0.034 18990 10974 1 15 . 1 1 452 452 MET N N 452 128.800 128.800 124.400 4.400 18990 10975 1 15 . 1 1 452 452 MET HA H 452 4.320 4.320 4.608 -0.288 18990 10976 1 15 . 1 1 452 452 MET C C 452 175.479 175.479 173.959 1.520 18990 10977 1 15 . 1 1 452 452 MET CA C 452 52.589 52.589 54.059 -1.470 18990 10978 1 15 . 1 1 452 452 MET CB C 452 28.074 28.074 34.364 -6.290 18990 10979 1 15 . 1 1 452 452 MET H H 452 9.087 9.087 8.140 0.947 18990 10980 1 15 . 1 1 453 453 VAL N N 453 122.200 122.200 116.532 5.668 18990 10981 1 15 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.140 0.654 18990 10982 1 15 . 1 1 453 453 VAL C C 453 175.476 175.476 174.751 0.725 18990 10983 1 15 . 1 1 453 453 VAL CA C 453 61.380 61.380 59.170 2.210 18990 10984 1 15 . 1 1 453 453 VAL CB C 453 33.089 33.089 33.942 -0.853 18990 10985 1 15 . 1 1 453 453 VAL H H 453 8.016 8.016 7.871 0.145 18990 10986 1 15 . 1 1 454 454 CYS N N 454 130.353 130.353 125.286 5.067 18990 10987 1 15 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.718 -0.123 18990 10988 1 15 . 1 1 454 454 CYS C C 454 177.833 177.833 175.084 2.749 18990 10989 1 15 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.500 3.071 18990 10990 1 15 . 1 1 454 454 CYS CB C 454 32.045 32.045 25.976 6.069 18990 10991 1 15 . 1 1 454 454 CYS H H 454 8.989 8.989 8.708 0.281 18990 10992 1 15 . 1 1 455 455 THR N N 455 119.000 119.000 123.535 -4.535 18990 10993 1 15 . 1 1 455 455 THR HA H 455 4.393 4.393 4.313 0.080 18990 10994 1 15 . 1 1 455 455 THR C C 455 175.264 175.264 173.685 1.579 18990 10995 1 15 . 1 1 455 455 THR CA C 455 61.644 61.644 62.154 -0.510 18990 10996 1 15 . 1 1 455 455 THR CB C 455 69.400 69.400 68.345 1.055 18990 10997 1 15 . 1 1 455 455 THR H H 455 8.533 8.533 8.514 0.019 18990 10998 1 15 . 1 1 456 456 ARG N N 456 128.900 128.900 129.371 -0.471 18990 10999 1 15 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.583 -0.358 18990 11000 1 15 . 1 1 456 456 ARG C C 456 177.782 177.782 174.581 3.201 18990 11001 1 15 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.322 2.628 18990 11002 1 15 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.107 -3.057 18990 11003 1 15 . 1 1 456 456 ARG H H 456 9.036 9.036 7.841 1.195 18990 11004 1 15 . 1 1 457 457 ALA N N 457 133.152 133.152 127.369 5.783 18990 11005 1 15 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.196 -0.050 18990 11006 1 15 . 1 1 457 457 ALA C C 457 178.757 178.757 177.687 1.070 18990 11007 1 15 . 1 1 457 457 ALA CA C 457 53.929 53.929 53.286 0.643 18990 11008 1 15 . 1 1 457 457 ALA CB C 457 17.710 17.710 18.257 -0.547 18990 11009 1 15 . 1 1 457 457 ALA H H 457 9.042 9.042 8.854 0.188 18990 11010 1 15 . 1 1 458 458 GLY N N 458 111.200 111.200 110.492 0.708 18990 11011 1 15 . 1 1 458 458 GLY C C 458 173.558 173.558 173.959 -0.401 18990 11012 1 15 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.717 0.720 18990 11013 1 15 . 1 1 458 458 GLY H H 458 8.830 8.830 8.530 0.300 18990 11014 1 15 . 1 1 459 459 CYS N N 459 123.040 123.040 118.583 4.457 18990 11015 1 15 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.973 -0.351 18990 11016 1 15 . 1 1 459 459 CYS C C 459 176.591 176.591 174.956 1.635 18990 11017 1 15 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.291 1.208 18990 11018 1 15 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.546 0.628 18990 11019 1 15 . 1 1 459 459 CYS H H 459 8.042 8.042 8.386 -0.344 18990 11020 1 15 . 1 1 460 460 GLY N N 460 104.500 104.500 112.284 -7.784 18990 11021 1 15 . 1 1 460 460 GLY C C 460 173.716 173.716 173.424 0.292 18990 11022 1 15 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.726 0.282 18990 11023 1 15 . 1 1 460 460 GLY H H 460 7.705 7.705 8.357 -0.652 18990 11024 1 15 . 1 1 461 461 PHE N N 461 124.949 124.949 120.913 4.036 18990 11025 1 15 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.856 -0.276 18990 11026 1 15 . 1 1 461 461 PHE C C 461 174.447 174.447 173.137 1.310 18990 11027 1 15 . 1 1 461 461 PHE CA C 461 59.946 59.946 56.889 3.057 18990 11028 1 15 . 1 1 461 461 PHE CB C 461 41.300 41.300 42.434 -1.135 18990 11029 1 15 . 1 1 461 461 PHE H H 461 8.947 8.947 7.645 1.302 18990 11030 1 15 . 1 1 462 462 GLU N N 462 125.272 125.272 125.955 -0.683 18990 11031 1 15 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.508 1.213 18990 11032 1 15 . 1 1 462 462 GLU C C 462 176.067 176.067 174.374 1.693 18990 11033 1 15 . 1 1 462 462 GLU CA C 462 54.624 54.624 54.562 0.062 18990 11034 1 15 . 1 1 462 462 GLU CB C 462 31.255 31.255 31.895 -0.640 18990 11035 1 15 . 1 1 462 462 GLU H H 462 7.799 7.799 7.948 -0.149 18990 11036 1 15 . 1 1 463 463 TRP N N 463 121.524 121.524 117.311 4.213 18990 11037 1 15 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.168 0.338 18990 11038 1 15 . 1 1 463 463 TRP C C 463 172.844 172.844 175.186 -2.342 18990 11039 1 15 . 1 1 463 463 TRP CA C 463 53.771 53.771 55.102 -1.331 18990 11040 1 15 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.305 0.431 18990 11041 1 15 . 1 1 463 463 TRP H H 463 9.300 9.300 7.363 1.937 18990 11042 1 15 . 1 1 464 464 CYS N N 464 120.868 120.868 120.789 0.079 18990 11043 1 15 . 1 1 464 464 CYS HA H 464 5.416 5.416 5.005 0.411 18990 11044 1 15 . 1 1 464 464 CYS C C 464 177.213 177.213 176.343 0.870 18990 11045 1 15 . 1 1 464 464 CYS CA C 464 57.776 57.776 59.478 -1.702 18990 11046 1 15 . 1 1 464 464 CYS CB C 464 32.930 32.930 28.894 4.036 18990 11047 1 15 . 1 1 464 464 CYS H H 464 8.752 8.752 8.983 -0.231 18990 11048 1 15 . 1 1 465 465 TRP N N 465 131.209 131.209 129.052 2.157 18990 11049 1 15 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.546 -0.119 18990 11050 1 15 . 1 1 465 465 TRP C C 465 176.051 176.051 176.060 -0.009 18990 11051 1 15 . 1 1 465 465 TRP CA C 465 60.763 60.763 59.776 0.987 18990 11052 1 15 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.651 1.475 18990 11053 1 15 . 1 1 465 465 TRP H H 465 9.809 9.809 8.430 1.379 18990 11054 1 15 . 1 1 466 466 VAL N N 466 118.233 118.233 116.500 1.733 18990 11055 1 15 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.391 0.233 18990 11056 1 15 . 1 1 466 466 VAL C C 466 178.943 178.943 176.559 2.384 18990 11057 1 15 . 1 1 466 466 VAL CA C 466 65.602 65.602 64.473 1.129 18990 11058 1 15 . 1 1 466 466 VAL CB C 466 33.172 33.172 31.568 1.604 18990 11059 1 15 . 1 1 466 466 VAL H H 466 8.627 8.627 8.162 0.465 18990 11060 1 15 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.588 -1.157 18990 11061 1 15 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.918 0.081 18990 11062 1 15 . 1 1 467 467 CYS CB C 467 31.870 31.870 27.994 3.876 18990 11063 1 15 . 1 1 467 467 CYS H H 467 7.820 7.820 8.020 -0.200 18990 11064 1 15 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.697 -0.661 18990 11065 1 15 . 1 1 468 468 GLN CA C 468 58.051 58.051 55.719 2.332 18990 11066 1 15 . 1 1 468 468 GLN CB C 468 26.476 26.476 27.570 -1.094 18990 11067 1 15 . 1 1 469 469 THR HA H 469 4.685 4.685 4.638 0.047 18990 11068 1 15 . 1 1 469 469 THR C C 469 173.351 173.351 173.268 0.083 18990 11069 1 15 . 1 1 469 469 THR CA C 469 59.176 59.176 60.081 -0.905 18990 11070 1 15 . 1 1 469 469 THR CB C 469 71.775 71.775 71.612 0.163 18990 11071 1 15 . 1 1 470 470 GLU N N 470 120.940 120.940 121.315 -0.375 18990 11072 1 15 . 1 1 470 470 GLU HA H 470 4.293 4.293 5.001 -0.708 18990 11073 1 15 . 1 1 470 470 GLU C C 470 175.539 175.539 177.066 -1.527 18990 11074 1 15 . 1 1 470 470 GLU CA C 470 57.015 57.015 54.414 2.601 18990 11075 1 15 . 1 1 470 470 GLU CB C 470 29.965 29.965 31.746 -1.781 18990 11076 1 15 . 1 1 470 470 GLU H H 470 8.912 8.912 8.711 0.201 18990 11077 1 15 . 1 1 471 471 TRP N N 471 126.998 126.998 124.608 2.390 18990 11078 1 15 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.510 -0.217 18990 11079 1 15 . 1 1 471 471 TRP C C 471 175.408 175.408 174.839 0.569 18990 11080 1 15 . 1 1 471 471 TRP CA C 471 58.220 58.220 56.856 1.364 18990 11081 1 15 . 1 1 471 471 TRP CB C 471 29.500 29.500 27.773 1.726 18990 11082 1 15 . 1 1 471 471 TRP H H 471 8.350 8.350 8.927 -0.577 18990 11083 1 15 . 1 1 472 472 THR N N 472 117.480 117.480 119.689 -2.209 18990 11084 1 15 . 1 1 472 472 THR HA H 472 4.444 4.444 4.475 -0.031 18990 11085 1 15 . 1 1 472 472 THR CA C 472 58.930 58.930 60.649 -1.719 18990 11086 1 15 . 1 1 472 472 THR H H 472 8.069 8.069 7.701 0.368 18990 11087 1 15 . 1 1 473 473 ARG HA H 473 3.773 3.773 4.010 -0.237 18990 11088 1 15 . 1 1 473 473 ARG C C 473 178.053 178.053 177.411 0.642 18990 11089 1 15 . 1 1 473 473 ARG CA C 473 58.088 58.088 58.589 -0.501 18990 11090 1 15 . 1 1 473 473 ARG CB C 473 29.426 29.426 30.191 -0.765 18990 11091 1 15 . 1 1 474 474 ASP N N 474 119.900 119.900 119.025 0.875 18990 11092 1 15 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.485 -0.270 18990 11093 1 15 . 1 1 474 474 ASP C C 474 178.197 178.197 178.250 -0.053 18990 11094 1 15 . 1 1 474 474 ASP CA C 474 56.802 56.802 57.123 -0.321 18990 11095 1 15 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.727 -0.545 18990 11096 1 15 . 1 1 474 474 ASP H H 474 7.718 7.718 8.544 -0.826 18990 11097 1 15 . 1 1 475 475 CYS N N 475 121.000 121.000 117.793 3.207 18990 11098 1 15 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.302 -0.935 18990 11099 1 15 . 1 1 475 475 CYS CA C 475 64.533 64.533 60.984 3.549 18990 11100 1 15 . 1 1 475 475 CYS CB C 475 29.092 29.092 26.139 2.953 18990 11101 1 15 . 1 1 475 475 CYS H H 475 6.953 6.953 7.892 -0.939 18990 11102 1 15 . 1 1 476 476 MET HA H 476 4.021 4.021 3.649 0.372 18990 11103 1 15 . 1 1 476 476 MET CA C 476 58.010 58.010 58.100 -0.090 18990 11104 1 15 . 1 1 476 476 MET CB C 476 32.550 32.550 32.578 -0.028 18990 11105 1 15 . 1 1 477 477 GLY N N 477 111.938 111.938 102.484 9.454 18990 11106 1 15 . 1 1 477 477 GLY C C 477 174.406 174.406 173.823 0.583 18990 11107 1 15 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.985 0.631 18990 11108 1 15 . 1 1 477 477 GLY H H 477 9.155 9.155 7.836 1.319 18990 11109 1 15 . 1 1 478 478 ALA N N 478 121.900 121.900 124.973 -3.073 18990 11110 1 15 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.416 -0.125 18990 11111 1 15 . 1 1 478 478 ALA C C 478 178.196 178.196 177.651 0.545 18990 11112 1 15 . 1 1 478 478 ALA CA C 478 53.440 53.440 53.983 -0.543 18990 11113 1 15 . 1 1 478 478 ALA CB C 478 20.390 20.390 19.708 0.682 18990 11114 1 15 . 1 1 478 478 ALA H H 478 7.347 7.347 7.736 -0.389 18990 11115 1 15 . 1 1 479 479 HIS N N 479 115.200 115.200 111.577 3.623 18990 11116 1 15 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.864 0.039 18990 11117 1 15 . 1 1 479 479 HIS C C 479 173.325 173.325 175.436 -2.111 18990 11118 1 15 . 1 1 479 479 HIS CA C 479 54.526 54.526 55.094 -0.568 18990 11119 1 15 . 1 1 479 479 HIS CB C 479 27.600 27.600 30.278 -2.678 18990 11120 1 15 . 1 1 479 479 HIS H H 479 8.297 8.297 7.706 0.591 18990 11121 1 15 . 1 1 480 480 TRP N N 480 121.780 121.780 122.355 -0.575 18990 11122 1 15 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.150 0.145 18990 11123 1 15 . 1 1 480 480 TRP C C 480 175.568 175.568 175.356 0.212 18990 11124 1 15 . 1 1 480 480 TRP CA C 480 58.358 58.358 58.812 -0.454 18990 11125 1 15 . 1 1 480 480 TRP CB C 480 29.550 29.550 29.878 -0.329 18990 11126 1 15 . 1 1 480 480 TRP H H 480 8.081 8.081 7.294 0.787 18990 11127 1 15 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.514 0.331 18990 11128 1 15 . 1 1 481 481 PHE C C 481 175.126 175.126 175.835 -0.709 18990 11129 1 15 . 1 1 481 481 PHE CA C 481 56.471 56.471 58.756 -2.285 18990 11130 1 15 . 1 1 481 481 PHE CB C 481 41.006 41.006 37.965 3.042 18990 11131 1 16 . 1 1 343 343 GLU N N 343 121.045 121.045 121.285 -0.240 18990 11132 1 16 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.677 -0.512 18990 11133 1 16 . 1 1 343 343 GLU C C 343 176.529 176.529 174.354 2.175 18990 11134 1 16 . 1 1 343 343 GLU CA C 343 57.162 57.162 55.516 1.646 18990 11135 1 16 . 1 1 343 343 GLU CB C 343 30.204 30.204 30.654 -0.450 18990 11136 1 16 . 1 1 343 343 GLU H H 343 8.293 8.293 8.268 0.025 18990 11137 1 16 . 1 1 344 344 TYR N N 344 121.000 121.000 118.265 2.735 18990 11138 1 16 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.618 -0.080 18990 11139 1 16 . 1 1 344 344 TYR C C 344 175.897 175.897 174.541 1.356 18990 11140 1 16 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.620 0.559 18990 11141 1 16 . 1 1 344 344 TYR CB C 344 38.600 38.600 39.230 -0.630 18990 11142 1 16 . 1 1 344 344 TYR H H 344 8.040 8.040 8.405 -0.365 18990 11143 1 16 . 1 1 345 345 VAL N N 345 121.900 121.900 124.576 -2.676 18990 11144 1 16 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.120 -0.181 18990 11145 1 16 . 1 1 345 345 VAL C C 345 176.143 176.143 175.464 0.679 18990 11146 1 16 . 1 1 345 345 VAL CA C 345 62.867 62.867 62.747 0.120 18990 11147 1 16 . 1 1 345 345 VAL CB C 345 32.799 32.799 31.652 1.147 18990 11148 1 16 . 1 1 345 345 VAL H H 345 7.856 7.856 8.163 -0.307 18990 11149 1 16 . 1 1 346 346 LEU N N 346 124.950 124.950 126.848 -1.898 18990 11150 1 16 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.913 -0.670 18990 11151 1 16 . 1 1 346 346 LEU C C 346 177.747 177.747 175.854 1.893 18990 11152 1 16 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.282 1.218 18990 11153 1 16 . 1 1 346 346 LEU CB C 346 42.252 42.252 43.749 -1.497 18990 11154 1 16 . 1 1 346 346 LEU H H 346 8.127 8.127 8.484 -0.357 18990 11155 1 16 . 1 1 347 347 GLN N N 347 121.452 121.452 123.350 -1.898 18990 11156 1 16 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.503 -0.217 18990 11157 1 16 . 1 1 347 347 GLN C C 347 175.833 175.833 174.666 1.167 18990 11158 1 16 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.806 0.182 18990 11159 1 16 . 1 1 347 347 GLN CB C 347 29.375 29.375 31.354 -1.979 18990 11160 1 16 . 1 1 347 347 GLN H H 347 8.270 8.270 8.585 -0.315 18990 11161 1 16 . 1 1 348 348 ALA N N 348 124.466 124.466 126.531 -2.065 18990 11162 1 16 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.734 -0.413 18990 11163 1 16 . 1 1 348 348 ALA C C 348 177.929 177.929 177.243 0.686 18990 11164 1 16 . 1 1 348 348 ALA CA C 348 52.703 52.703 51.536 1.167 18990 11165 1 16 . 1 1 348 348 ALA CB C 348 19.002 19.002 19.235 -0.233 18990 11166 1 16 . 1 1 348 348 ALA H H 348 8.227 8.227 8.655 -0.428 18990 11167 1 16 . 1 1 349 349 GLY N N 349 108.193 108.193 110.460 -2.267 18990 11168 1 16 . 1 1 349 349 GLY C C 349 174.269 174.269 174.224 0.045 18990 11169 1 16 . 1 1 349 349 GLY CA C 349 45.227 45.227 44.806 0.421 18990 11170 1 16 . 1 1 349 349 GLY H H 349 8.298 8.298 8.546 -0.248 18990 11171 1 16 . 1 1 350 350 GLY N N 350 108.073 108.073 109.585 -1.512 18990 11172 1 16 . 1 1 350 350 GLY C C 350 172.979 172.979 173.258 -0.279 18990 11173 1 16 . 1 1 350 350 GLY CA C 350 44.935 44.935 44.167 0.768 18990 11174 1 16 . 1 1 350 350 GLY H H 350 8.156 8.156 8.216 -0.060 18990 11175 1 16 . 1 1 351 351 VAL N N 351 119.058 119.058 118.396 0.662 18990 11176 1 16 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.452 -0.036 18990 11177 1 16 . 1 1 351 351 VAL C C 351 173.412 173.412 174.986 -1.574 18990 11178 1 16 . 1 1 351 351 VAL CA C 351 60.663 60.663 61.281 -0.618 18990 11179 1 16 . 1 1 351 351 VAL CB C 351 34.866 34.866 35.881 -1.015 18990 11180 1 16 . 1 1 351 351 VAL H H 351 8.541 8.541 8.756 -0.215 18990 11181 1 16 . 1 1 352 352 LEU N N 352 125.800 125.800 123.008 2.792 18990 11182 1 16 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.637 0.128 18990 11183 1 16 . 1 1 352 352 LEU C C 352 176.218 176.218 175.658 0.560 18990 11184 1 16 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.207 0.134 18990 11185 1 16 . 1 1 352 352 LEU CB C 352 42.706 42.706 44.301 -1.595 18990 11186 1 16 . 1 1 352 352 LEU H H 352 8.151 8.151 8.242 -0.091 18990 11187 1 16 . 1 1 353 353 CYS N N 353 126.825 126.825 123.638 3.187 18990 11188 1 16 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.182 -0.075 18990 11189 1 16 . 1 1 353 353 CYS C C 353 176.655 176.655 175.518 1.137 18990 11190 1 16 . 1 1 353 353 CYS CA C 353 57.731 57.731 55.971 1.760 18990 11191 1 16 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.527 4.338 18990 11192 1 16 . 1 1 353 353 CYS H H 353 8.794 8.794 8.652 0.142 18990 11193 1 16 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.107 0.313 18990 11194 1 16 . 1 1 354 354 PRO C C 354 177.512 177.512 175.882 1.630 18990 11195 1 16 . 1 1 354 354 PRO CA C 354 62.992 62.992 62.920 0.072 18990 11196 1 16 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.237 1.330 18990 11197 1 16 . 1 1 355 355 GLN N N 355 126.800 126.800 119.855 6.945 18990 11198 1 16 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.218 0.057 18990 11199 1 16 . 1 1 355 355 GLN C C 355 175.516 175.516 174.352 1.164 18990 11200 1 16 . 1 1 355 355 GLN CA C 355 54.793 54.793 53.510 1.283 18990 11201 1 16 . 1 1 355 355 GLN CB C 355 28.547 28.547 27.873 0.673 18990 11202 1 16 . 1 1 355 355 GLN H H 355 9.033 9.033 7.166 1.867 18990 11203 1 16 . 1 1 357 357 GLY C C 357 173.229 173.229 174.411 -1.182 18990 11204 1 16 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.477 0.777 18990 11205 1 16 . 1 1 358 358 CYS N N 358 123.500 123.500 120.737 2.763 18990 11206 1 16 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.470 0.063 18990 11207 1 16 . 1 1 358 358 CYS C C 358 176.157 176.157 176.007 0.150 18990 11208 1 16 . 1 1 358 358 CYS CA C 358 60.268 60.268 60.072 0.196 18990 11209 1 16 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.205 1.170 18990 11210 1 16 . 1 1 358 358 CYS H H 358 7.720 7.720 8.138 -0.418 18990 11211 1 16 . 1 1 359 359 GLY N N 359 104.400 104.400 109.661 -5.261 18990 11212 1 16 . 1 1 359 359 GLY C C 359 174.080 174.080 175.163 -1.083 18990 11213 1 16 . 1 1 359 359 GLY CA C 359 46.064 46.064 45.981 0.083 18990 11214 1 16 . 1 1 359 359 GLY H H 359 7.756 7.756 8.268 -0.512 18990 11215 1 16 . 1 1 360 360 MET N N 360 121.300 121.300 120.157 1.143 18990 11216 1 16 . 1 1 360 360 MET HA H 360 4.343 4.343 4.268 0.075 18990 11217 1 16 . 1 1 360 360 MET C C 360 175.641 175.641 176.729 -1.088 18990 11218 1 16 . 1 1 360 360 MET CA C 360 55.923 55.923 56.913 -0.990 18990 11219 1 16 . 1 1 360 360 MET CB C 360 33.091 33.091 33.438 -0.347 18990 11220 1 16 . 1 1 360 360 MET H H 360 8.229 8.229 7.505 0.724 18990 11221 1 16 . 1 1 361 361 GLY N N 361 109.000 109.000 106.937 2.063 18990 11222 1 16 . 1 1 361 361 GLY C C 361 173.774 173.774 173.001 0.773 18990 11223 1 16 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.490 1.348 18990 11224 1 16 . 1 1 361 361 GLY H H 361 8.347 8.347 7.968 0.379 18990 11225 1 16 . 1 1 362 362 LEU N N 362 126.725 126.725 125.204 1.521 18990 11226 1 16 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.865 -0.191 18990 11227 1 16 . 1 1 362 362 LEU C C 362 175.865 175.865 176.015 -0.150 18990 11228 1 16 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.030 1.160 18990 11229 1 16 . 1 1 362 362 LEU CB C 362 44.050 44.050 44.523 -0.473 18990 11230 1 16 . 1 1 362 362 LEU H H 362 8.935 8.935 8.919 0.016 18990 11231 1 16 . 1 1 363 363 LEU N N 363 123.742 123.742 124.595 -0.853 18990 11232 1 16 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.613 0.064 18990 11233 1 16 . 1 1 363 363 LEU C C 363 176.162 176.162 175.409 0.753 18990 11234 1 16 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.833 -0.491 18990 11235 1 16 . 1 1 363 363 LEU CB C 363 42.210 42.210 43.539 -1.329 18990 11236 1 16 . 1 1 363 363 LEU H H 363 8.481 8.481 8.589 -0.108 18990 11237 1 16 . 1 1 364 364 VAL N N 364 120.980 120.980 127.252 -6.272 18990 11238 1 16 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.353 0.044 18990 11239 1 16 . 1 1 364 364 VAL C C 364 175.592 175.592 174.804 0.788 18990 11240 1 16 . 1 1 364 364 VAL CA C 364 60.460 60.460 61.160 -0.700 18990 11241 1 16 . 1 1 364 364 VAL CB C 364 34.125 34.125 32.496 1.629 18990 11242 1 16 . 1 1 364 364 VAL H H 364 8.155 8.155 8.412 -0.257 18990 11243 1 16 . 1 1 365 365 GLU N N 365 126.950 126.950 128.216 -1.266 18990 11244 1 16 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.779 -0.169 18990 11245 1 16 . 1 1 365 365 GLU C C 365 175.427 175.427 175.693 -0.266 18990 11246 1 16 . 1 1 365 365 GLU CA C 365 54.551 54.551 53.022 1.529 18990 11247 1 16 . 1 1 365 365 GLU CB C 365 29.780 29.780 30.234 -0.454 18990 11248 1 16 . 1 1 365 365 GLU H H 365 8.900 8.900 8.504 0.396 18990 11249 1 16 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.288 -0.026 18990 11250 1 16 . 1 1 366 366 PRO C C 366 177.013 177.013 176.942 0.071 18990 11251 1 16 . 1 1 366 366 PRO CA C 366 64.463 64.463 65.008 -0.545 18990 11252 1 16 . 1 1 366 366 PRO CB C 366 32.048 32.048 32.031 0.017 18990 11253 1 16 . 1 1 367 367 ASP N N 367 115.459 115.459 114.786 0.673 18990 11254 1 16 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.612 -0.117 18990 11255 1 16 . 1 1 367 367 ASP C C 367 175.123 175.123 175.986 -0.863 18990 11256 1 16 . 1 1 367 367 ASP CA C 367 54.503 54.503 54.411 0.091 18990 11257 1 16 . 1 1 367 367 ASP CB C 367 40.123 40.123 41.434 -1.311 18990 11258 1 16 . 1 1 367 367 ASP H H 367 8.439 8.439 8.599 -0.160 18990 11259 1 16 . 1 1 368 368 CYS N N 368 118.700 118.700 120.259 -1.559 18990 11260 1 16 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.501 0.069 18990 11261 1 16 . 1 1 368 368 CYS C C 368 173.806 173.806 174.937 -1.131 18990 11262 1 16 . 1 1 368 368 CYS CA C 368 58.581 58.581 58.846 -0.265 18990 11263 1 16 . 1 1 368 368 CYS CB C 368 28.450 28.450 27.900 0.550 18990 11264 1 16 . 1 1 368 368 CYS H H 368 7.515 7.515 7.650 -0.135 18990 11265 1 16 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.269 -0.004 18990 11266 1 16 . 1 1 369 369 ARG C C 369 174.908 174.908 175.803 -0.895 18990 11267 1 16 . 1 1 369 369 ARG CA C 369 57.669 57.669 56.722 0.947 18990 11268 1 16 . 1 1 369 369 ARG CB C 369 32.274 32.274 30.828 1.446 18990 11269 1 16 . 1 1 370 370 LYS N N 370 121.022 121.022 120.215 0.807 18990 11270 1 16 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.407 -0.237 18990 11271 1 16 . 1 1 370 370 LYS C C 370 174.868 174.868 175.008 -0.140 18990 11272 1 16 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.533 1.021 18990 11273 1 16 . 1 1 370 370 LYS CB C 370 33.140 33.140 32.679 0.461 18990 11274 1 16 . 1 1 370 370 LYS H H 370 7.740 7.740 7.906 -0.166 18990 11275 1 16 . 1 1 371 371 VAL N N 371 128.362 128.362 122.741 5.621 18990 11276 1 16 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.421 -0.288 18990 11277 1 16 . 1 1 371 371 VAL C C 371 173.402 173.402 174.462 -1.060 18990 11278 1 16 . 1 1 371 371 VAL CA C 371 60.777 60.777 61.336 -0.559 18990 11279 1 16 . 1 1 371 371 VAL CB C 371 33.000 33.000 33.711 -0.711 18990 11280 1 16 . 1 1 371 371 VAL H H 371 8.647 8.647 8.157 0.490 18990 11281 1 16 . 1 1 372 372 THR N N 372 119.667 119.667 117.659 2.008 18990 11282 1 16 . 1 1 372 372 THR HA H 372 5.032 5.032 4.600 0.432 18990 11283 1 16 . 1 1 372 372 THR C C 372 174.339 174.339 174.198 0.141 18990 11284 1 16 . 1 1 372 372 THR CA C 372 60.881 60.881 61.771 -0.890 18990 11285 1 16 . 1 1 372 372 THR CB C 372 70.471 70.471 71.471 -1.000 18990 11286 1 16 . 1 1 372 372 THR H H 372 8.087 8.087 8.071 0.016 18990 11287 1 16 . 1 1 373 373 CYS N N 373 132.554 132.554 127.327 5.227 18990 11288 1 16 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.584 0.218 18990 11289 1 16 . 1 1 373 373 CYS C C 373 176.791 176.791 176.167 0.624 18990 11290 1 16 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.214 -0.710 18990 11291 1 16 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.495 3.816 18990 11292 1 16 . 1 1 373 373 CYS H H 373 9.322 9.322 9.480 -0.158 18990 11293 1 16 . 1 1 374 374 GLN N N 374 125.890 125.890 123.630 2.260 18990 11294 1 16 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.159 -0.159 18990 11295 1 16 . 1 1 374 374 GLN C C 374 176.827 176.827 176.130 0.697 18990 11296 1 16 . 1 1 374 374 GLN CA C 374 58.300 58.300 58.026 0.273 18990 11297 1 16 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.780 0.884 18990 11298 1 16 . 1 1 374 374 GLN H H 374 7.856 7.856 8.598 -0.742 18990 11299 1 16 . 1 1 375 375 ASN N N 375 115.342 115.342 114.866 0.476 18990 11300 1 16 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.899 -0.012 18990 11301 1 16 . 1 1 375 375 ASN C C 375 174.049 174.049 174.661 -0.612 18990 11302 1 16 . 1 1 375 375 ASN CA C 375 53.047 53.047 52.766 0.281 18990 11303 1 16 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.046 -0.130 18990 11304 1 16 . 1 1 375 375 ASN H H 375 8.913 8.913 8.287 0.626 18990 11305 1 16 . 1 1 376 376 GLY N N 376 109.098 109.098 107.028 2.070 18990 11306 1 16 . 1 1 376 376 GLY C C 376 174.110 174.110 172.897 1.213 18990 11307 1 16 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.311 1.075 18990 11308 1 16 . 1 1 376 376 GLY H H 376 7.162 7.162 7.797 -0.635 18990 11309 1 16 . 1 1 377 377 CYS N N 377 132.546 132.546 120.594 11.952 18990 11310 1 16 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.922 -0.158 18990 11311 1 16 . 1 1 377 377 CYS C C 377 177.355 177.355 175.385 1.970 18990 11312 1 16 . 1 1 377 377 CYS CA C 377 59.988 59.988 57.483 2.505 18990 11313 1 16 . 1 1 377 377 CYS CB C 377 32.365 32.365 28.846 3.519 18990 11314 1 16 . 1 1 377 377 CYS H H 377 9.800 9.800 8.055 1.745 18990 11315 1 16 . 1 1 378 378 GLY N N 378 113.851 113.851 111.494 2.357 18990 11316 1 16 . 1 1 378 378 GLY C C 378 173.404 173.404 173.499 -0.095 18990 11317 1 16 . 1 1 378 378 GLY CA C 378 45.863 45.863 46.050 -0.188 18990 11318 1 16 . 1 1 378 378 GLY H H 378 8.820 8.820 8.570 0.250 18990 11319 1 16 . 1 1 379 379 TYR N N 379 125.532 125.532 126.684 -1.152 18990 11320 1 16 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.807 -0.329 18990 11321 1 16 . 1 1 379 379 TYR C C 379 173.661 173.661 174.556 -0.895 18990 11322 1 16 . 1 1 379 379 TYR CA C 379 59.180 59.180 56.248 2.932 18990 11323 1 16 . 1 1 379 379 TYR CB C 379 40.108 40.108 42.322 -2.213 18990 11324 1 16 . 1 1 379 379 TYR H H 379 9.054 9.054 8.147 0.907 18990 11325 1 16 . 1 1 380 380 VAL N N 380 124.461 124.461 120.895 3.566 18990 11326 1 16 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.215 0.603 18990 11327 1 16 . 1 1 380 380 VAL C C 380 175.876 175.876 174.488 1.388 18990 11328 1 16 . 1 1 380 380 VAL CA C 380 60.797 60.797 61.571 -0.774 18990 11329 1 16 . 1 1 380 380 VAL CB C 380 32.610 32.610 31.358 1.252 18990 11330 1 16 . 1 1 380 380 VAL H H 380 7.238 7.238 7.688 -0.450 18990 11331 1 16 . 1 1 381 381 PHE N N 381 124.588 124.588 123.880 0.708 18990 11332 1 16 . 1 1 381 381 PHE HA H 381 5.273 5.273 5.264 0.009 18990 11333 1 16 . 1 1 381 381 PHE C C 381 173.242 173.242 173.933 -0.691 18990 11334 1 16 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.830 -0.620 18990 11335 1 16 . 1 1 381 381 PHE CB C 381 42.090 42.090 41.264 0.826 18990 11336 1 16 . 1 1 381 381 PHE H H 381 9.424 9.424 7.713 1.711 18990 11337 1 16 . 1 1 382 382 CYS N N 382 120.221 120.221 120.802 -0.581 18990 11338 1 16 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.870 0.032 18990 11339 1 16 . 1 1 382 382 CYS C C 382 177.165 177.165 175.969 1.196 18990 11340 1 16 . 1 1 382 382 CYS CA C 382 57.691 57.691 57.934 -0.243 18990 11341 1 16 . 1 1 382 382 CYS CB C 382 32.475 32.475 30.862 1.613 18990 11342 1 16 . 1 1 382 382 CYS H H 382 8.673 8.673 8.456 0.217 18990 11343 1 16 . 1 1 383 383 ARG N N 383 129.347 129.347 121.658 7.689 18990 11344 1 16 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.413 -0.392 18990 11345 1 16 . 1 1 383 383 ARG C C 383 175.012 175.012 176.617 -1.605 18990 11346 1 16 . 1 1 383 383 ARG CA C 383 58.686 58.686 58.475 0.211 18990 11347 1 16 . 1 1 383 383 ARG CB C 383 30.900 30.900 30.044 0.856 18990 11348 1 16 . 1 1 383 383 ARG H H 383 9.534 9.534 8.788 0.746 18990 11349 1 16 . 1 1 384 384 ASN N N 384 117.772 117.772 117.105 0.667 18990 11350 1 16 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.737 -0.029 18990 11351 1 16 . 1 1 384 384 ASN C C 384 175.656 175.656 174.821 0.835 18990 11352 1 16 . 1 1 384 384 ASN CA C 384 55.778 55.778 53.558 2.220 18990 11353 1 16 . 1 1 384 384 ASN CB C 384 39.475 39.475 40.034 -0.559 18990 11354 1 16 . 1 1 384 384 ASN H H 384 8.840 8.840 8.216 0.624 18990 11355 1 16 . 1 1 385 385 CYS N N 385 115.876 115.876 114.940 0.936 18990 11356 1 16 . 1 1 385 385 CYS HA H 385 5.028 5.028 5.021 0.007 18990 11357 1 16 . 1 1 385 385 CYS C C 385 175.703 175.703 174.074 1.629 18990 11358 1 16 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.452 1.661 18990 11359 1 16 . 1 1 385 385 CYS CB C 385 32.359 32.359 30.816 1.543 18990 11360 1 16 . 1 1 385 385 CYS H H 385 7.868 7.868 8.277 -0.409 18990 11361 1 16 . 1 1 386 386 LEU N N 386 120.082 120.082 119.508 0.574 18990 11362 1 16 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.775 -0.462 18990 11363 1 16 . 1 1 386 386 LEU C C 386 175.722 175.722 176.746 -1.024 18990 11364 1 16 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.078 2.931 18990 11365 1 16 . 1 1 386 386 LEU CB C 386 38.412 38.412 40.660 -2.248 18990 11366 1 16 . 1 1 386 386 LEU H H 386 8.514 8.514 8.440 0.074 18990 11367 1 16 . 1 1 387 387 GLN N N 387 117.579 117.579 119.682 -2.103 18990 11368 1 16 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.311 0.465 18990 11369 1 16 . 1 1 387 387 GLN C C 387 175.299 175.299 177.027 -1.728 18990 11370 1 16 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.508 -1.491 18990 11371 1 16 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.559 1.748 18990 11372 1 16 . 1 1 387 387 GLN H H 387 8.248 8.248 7.856 0.392 18990 11373 1 16 . 1 1 388 388 GLY N N 388 106.107 106.107 107.901 -1.794 18990 11374 1 16 . 1 1 388 388 GLY C C 388 173.693 173.693 173.852 -0.159 18990 11375 1 16 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.151 1.029 18990 11376 1 16 . 1 1 388 388 GLY H H 388 8.695 8.695 8.275 0.420 18990 11377 1 16 . 1 1 389 389 TYR N N 389 122.514 122.514 117.097 5.417 18990 11378 1 16 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.208 -0.550 18990 11379 1 16 . 1 1 389 389 TYR C C 389 172.860 172.860 173.893 -1.033 18990 11380 1 16 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.786 4.201 18990 11381 1 16 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.907 0.145 18990 11382 1 16 . 1 1 389 389 TYR H H 389 7.923 7.923 8.194 -0.271 18990 11383 1 16 . 1 1 390 390 HIS N N 390 120.080 120.080 122.104 -2.024 18990 11384 1 16 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.618 0.090 18990 11385 1 16 . 1 1 390 390 HIS C C 390 173.235 173.235 173.792 -0.557 18990 11386 1 16 . 1 1 390 390 HIS CA C 390 51.431 51.431 53.808 -2.377 18990 11387 1 16 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.347 0.553 18990 11388 1 16 . 1 1 390 390 HIS H H 390 5.291 5.291 7.734 -2.443 18990 11389 1 16 . 1 1 391 391 ILE N N 391 117.810 117.810 118.127 -0.317 18990 11390 1 16 . 1 1 391 391 ILE HA H 391 4.116 4.116 3.972 0.144 18990 11391 1 16 . 1 1 391 391 ILE C C 391 178.208 178.208 177.237 0.971 18990 11392 1 16 . 1 1 391 391 ILE CA C 391 60.877 60.877 60.138 0.739 18990 11393 1 16 . 1 1 391 391 ILE CB C 391 39.034 39.034 38.060 0.974 18990 11394 1 16 . 1 1 391 391 ILE H H 391 8.418 8.418 8.377 0.041 18990 11395 1 16 . 1 1 392 392 GLY N N 392 112.387 112.387 109.811 2.576 18990 11396 1 16 . 1 1 392 392 GLY C C 392 173.565 173.565 173.290 0.275 18990 11397 1 16 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.875 0.383 18990 11398 1 16 . 1 1 392 392 GLY H H 392 8.654 8.654 8.588 0.066 18990 11399 1 16 . 1 1 393 393 GLU N N 393 119.098 119.098 120.172 -1.074 18990 11400 1 16 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.557 -0.268 18990 11401 1 16 . 1 1 393 393 GLU C C 393 176.899 176.899 175.102 1.797 18990 11402 1 16 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.250 1.183 18990 11403 1 16 . 1 1 393 393 GLU CB C 393 30.470 30.470 31.721 -1.251 18990 11404 1 16 . 1 1 393 393 GLU H H 393 8.391 8.391 7.934 0.457 18990 11405 1 16 . 1 1 394 394 CYS N N 394 122.845 122.845 120.652 2.193 18990 11406 1 16 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.871 -1.105 18990 11407 1 16 . 1 1 394 394 CYS C C 394 175.461 175.461 174.497 0.964 18990 11408 1 16 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.813 1.022 18990 11409 1 16 . 1 1 394 394 CYS CB C 394 30.761 30.761 28.238 2.523 18990 11410 1 16 . 1 1 394 394 CYS H H 394 8.474 8.474 8.595 -0.121 18990 11411 1 16 . 1 1 395 395 LEU N N 395 124.403 124.403 124.100 0.303 18990 11412 1 16 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.793 -0.289 18990 11413 1 16 . 1 1 395 395 LEU C C 395 175.259 175.259 175.121 0.138 18990 11414 1 16 . 1 1 395 395 LEU CA C 395 52.835 52.835 53.449 -0.614 18990 11415 1 16 . 1 1 395 395 LEU CB C 395 41.436 41.436 42.409 -0.973 18990 11416 1 16 . 1 1 395 395 LEU H H 395 8.418 8.418 8.489 -0.071 18990 11417 1 16 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.603 -0.233 18990 11418 1 16 . 1 1 396 396 PRO C C 396 177.006 177.006 175.810 1.196 18990 11419 1 16 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.308 0.788 18990 11420 1 16 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.453 -0.381 18990 11421 1 16 . 1 1 397 397 GLU N N 397 121.574 121.574 119.902 1.672 18990 11422 1 16 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.508 -0.283 18990 11423 1 16 . 1 1 397 397 GLU C C 397 177.202 177.202 175.830 1.372 18990 11424 1 16 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.531 0.503 18990 11425 1 16 . 1 1 397 397 GLU CB C 397 30.263 30.263 30.788 -0.525 18990 11426 1 16 . 1 1 397 397 GLU H H 397 8.568 8.568 8.592 -0.024 18990 11427 1 16 . 1 1 398 398 GLY N N 398 110.495 110.495 112.765 -2.270 18990 11428 1 16 . 1 1 398 398 GLY C C 398 174.579 174.579 173.857 0.722 18990 11429 1 16 . 1 1 398 398 GLY CA C 398 45.462 45.462 45.360 0.102 18990 11430 1 16 . 1 1 398 398 GLY H H 398 8.515 8.515 8.485 0.030 18990 11431 1 16 . 1 1 399 399 THR N N 399 113.234 113.234 114.966 -1.732 18990 11432 1 16 . 1 1 399 399 THR HA H 399 4.398 4.398 4.934 -0.536 18990 11433 1 16 . 1 1 399 399 THR C C 399 175.333 175.333 174.062 1.271 18990 11434 1 16 . 1 1 399 399 THR CA C 399 62.233 62.233 62.641 -0.408 18990 11435 1 16 . 1 1 399 399 THR CB C 399 69.833 69.833 70.170 -0.337 18990 11436 1 16 . 1 1 399 399 THR H H 399 8.090 8.090 8.911 -0.821 18990 11437 1 16 . 1 1 400 400 GLY N N 400 111.479 111.479 114.491 -3.012 18990 11438 1 16 . 1 1 400 400 GLY C C 400 174.048 174.048 172.648 1.400 18990 11439 1 16 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.904 -0.465 18990 11440 1 16 . 1 1 400 400 GLY H H 400 8.524 8.524 8.428 0.096 18990 11441 1 16 . 1 1 401 401 ALA N N 401 123.919 123.919 125.090 -1.171 18990 11442 1 16 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.651 -0.400 18990 11443 1 16 . 1 1 401 401 ALA C C 401 177.942 177.942 176.834 1.108 18990 11444 1 16 . 1 1 401 401 ALA CA C 401 52.730 52.730 52.153 0.577 18990 11445 1 16 . 1 1 401 401 ALA CB C 401 19.142 19.142 19.581 -0.439 18990 11446 1 16 . 1 1 401 401 ALA H H 401 8.179 8.179 8.329 -0.150 18990 11447 1 16 . 1 1 402 402 SER N N 402 114.904 114.904 118.626 -3.722 18990 11448 1 16 . 1 1 402 402 SER HA H 402 4.448 4.448 4.520 -0.072 18990 11449 1 16 . 1 1 402 402 SER C C 402 174.426 174.426 173.216 1.210 18990 11450 1 16 . 1 1 402 402 SER CA C 402 58.289 58.289 59.087 -0.798 18990 11451 1 16 . 1 1 402 402 SER CB C 402 63.772 63.772 64.218 -0.446 18990 11452 1 16 . 1 1 402 402 SER H H 402 8.305 8.305 8.666 -0.361 18990 11453 1 16 . 1 1 403 403 ALA N N 403 125.965 125.965 129.529 -3.564 18990 11454 1 16 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.746 -0.347 18990 11455 1 16 . 1 1 403 403 ALA C C 403 177.984 177.984 176.107 1.877 18990 11456 1 16 . 1 1 403 403 ALA CA C 403 52.655 52.655 52.921 -0.266 18990 11457 1 16 . 1 1 403 403 ALA CB C 403 19.138 19.138 19.573 -0.435 18990 11458 1 16 . 1 1 403 403 ALA H H 403 8.345 8.345 8.411 -0.066 18990 11459 1 16 . 1 1 404 404 THR N N 404 112.790 112.790 115.052 -2.262 18990 11460 1 16 . 1 1 404 404 THR C C 404 174.420 174.420 173.565 0.855 18990 11461 1 16 . 1 1 404 404 THR CA C 404 61.988 61.988 62.347 -0.359 18990 11462 1 16 . 1 1 404 404 THR CB C 404 69.688 69.688 70.373 -0.685 18990 11463 1 16 . 1 1 404 404 THR H H 404 8.118 8.118 7.819 0.299 18990 11464 1 16 . 1 1 405 405 ASN N N 405 121.050 121.050 121.536 -0.486 18990 11465 1 16 . 1 1 405 405 ASN H H 405 8.396 8.396 8.506 -0.110 18990 11466 1 16 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.697 -0.119 18990 11467 1 16 . 1 1 407 407 CYS C C 407 174.489 174.489 174.124 0.365 18990 11468 1 16 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.920 -0.207 18990 11469 1 16 . 1 1 407 407 CYS CB C 407 28.102 28.102 28.794 -0.692 18990 11470 1 16 . 1 1 408 408 GLU N N 408 123.021 123.021 121.962 1.059 18990 11471 1 16 . 1 1 408 408 GLU C C 408 175.954 175.954 175.055 0.899 18990 11472 1 16 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.070 0.732 18990 11473 1 16 . 1 1 408 408 GLU CB C 408 30.328 30.328 31.271 -0.943 18990 11474 1 16 . 1 1 408 408 GLU H H 408 8.415 8.415 7.909 0.506 18990 11475 1 16 . 1 1 409 409 TYR N N 409 121.015 121.015 124.560 -3.545 18990 11476 1 16 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.626 0.028 18990 11477 1 16 . 1 1 409 409 TYR C C 409 175.613 175.613 175.195 0.418 18990 11478 1 16 . 1 1 409 409 TYR CA C 409 57.669 57.669 58.877 -1.208 18990 11479 1 16 . 1 1 409 409 TYR CB C 409 38.825 38.825 39.136 -0.311 18990 11480 1 16 . 1 1 409 409 TYR H H 409 8.135 8.135 8.511 -0.376 18990 11481 1 16 . 1 1 410 410 THR N N 410 116.975 116.975 118.275 -1.300 18990 11482 1 16 . 1 1 410 410 THR HA H 410 4.306 4.306 4.397 -0.091 18990 11483 1 16 . 1 1 410 410 THR C C 410 173.846 173.846 173.399 0.447 18990 11484 1 16 . 1 1 410 410 THR CA C 410 61.730 61.730 61.002 0.728 18990 11485 1 16 . 1 1 410 410 THR CB C 410 69.914 69.914 70.110 -0.196 18990 11486 1 16 . 1 1 410 410 THR H H 410 8.060 8.060 7.883 0.177 18990 11487 1 16 . 1 1 411 411 VAL N N 411 122.900 122.900 122.548 0.352 18990 11488 1 16 . 1 1 411 411 VAL HA H 411 4.053 4.053 3.964 0.089 18990 11489 1 16 . 1 1 411 411 VAL C C 411 175.275 175.275 174.900 0.375 18990 11490 1 16 . 1 1 411 411 VAL CA C 411 61.853 61.853 62.971 -1.118 18990 11491 1 16 . 1 1 411 411 VAL CB C 411 32.976 32.976 31.557 1.419 18990 11492 1 16 . 1 1 411 411 VAL H H 411 8.089 8.089 8.431 -0.342 18990 11493 1 16 . 1 1 412 412 ASP N N 412 125.924 125.924 126.705 -0.781 18990 11494 1 16 . 1 1 412 412 ASP HA H 412 4.850 4.850 5.050 -0.200 18990 11495 1 16 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.167 -0.589 18990 11496 1 16 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.599 -0.061 18990 11497 1 16 . 1 1 412 412 ASP H H 412 8.397 8.397 8.023 0.374 18990 11498 1 16 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.451 -0.065 18990 11499 1 16 . 1 1 413 413 PRO C C 413 177.352 177.352 175.571 1.781 18990 11500 1 16 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.795 1.115 18990 11501 1 16 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.280 -0.012 18990 11502 1 16 . 1 1 414 414 ASN N N 414 117.035 117.035 119.790 -2.755 18990 11503 1 16 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.792 -0.115 18990 11504 1 16 . 1 1 414 414 ASN C C 414 175.532 175.532 174.917 0.615 18990 11505 1 16 . 1 1 414 414 ASN CA C 414 53.824 53.824 52.504 1.320 18990 11506 1 16 . 1 1 414 414 ASN CB C 414 38.728 38.728 40.893 -2.165 18990 11507 1 16 . 1 1 414 414 ASN H H 414 8.496 8.496 8.417 0.079 18990 11508 1 16 . 1 1 415 415 ARG N N 415 121.000 121.000 125.468 -4.468 18990 11509 1 16 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.350 -0.106 18990 11510 1 16 . 1 1 415 415 ARG C C 415 176.243 176.243 175.426 0.817 18990 11511 1 16 . 1 1 415 415 ARG CA C 415 56.404 56.404 56.246 0.158 18990 11512 1 16 . 1 1 415 415 ARG CB C 415 30.637 30.637 30.827 -0.190 18990 11513 1 16 . 1 1 415 415 ARG H H 415 7.804 7.804 8.454 -0.650 18990 11514 1 16 . 1 1 416 416 ALA N N 416 124.880 124.880 126.589 -1.709 18990 11515 1 16 . 1 1 416 416 ALA C C 416 177.831 177.831 176.467 1.364 18990 11516 1 16 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.620 1.337 18990 11517 1 16 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.622 -1.563 18990 11518 1 16 . 1 1 416 416 ALA H H 416 8.189 8.189 8.518 -0.329 18990 11519 1 16 . 1 1 417 417 ALA N N 417 122.614 122.614 126.048 -3.434 18990 11520 1 16 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.605 -0.358 18990 11521 1 16 . 1 1 417 417 ALA C C 417 178.024 178.024 176.476 1.548 18990 11522 1 16 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.779 1.010 18990 11523 1 16 . 1 1 417 417 ALA CB C 417 19.042 19.042 19.753 -0.711 18990 11524 1 16 . 1 1 417 417 ALA H H 417 8.169 8.169 8.701 -0.532 18990 11525 1 16 . 1 1 418 418 GLU N N 418 119.500 119.500 119.570 -0.070 18990 11526 1 16 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.534 -0.345 18990 11527 1 16 . 1 1 418 418 GLU C C 418 176.266 176.266 174.663 1.603 18990 11528 1 16 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.340 1.236 18990 11529 1 16 . 1 1 418 418 GLU CB C 418 30.307 30.307 31.457 -1.150 18990 11530 1 16 . 1 1 418 418 GLU H H 418 8.184 8.184 8.487 -0.303 18990 11531 1 16 . 1 1 419 419 ALA N N 419 124.643 124.643 123.850 0.793 18990 11532 1 16 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.458 -0.208 18990 11533 1 16 . 1 1 419 419 ALA C C 419 177.488 177.488 176.062 1.426 18990 11534 1 16 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.580 0.929 18990 11535 1 16 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.169 -1.008 18990 11536 1 16 . 1 1 419 419 ALA H H 419 8.135 8.135 8.420 -0.285 18990 11537 1 16 . 1 1 420 420 ARG N N 420 120.003 120.003 122.832 -2.829 18990 11538 1 16 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.319 -0.026 18990 11539 1 16 . 1 1 420 420 ARG C C 420 176.297 176.297 175.436 0.861 18990 11540 1 16 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.758 0.175 18990 11541 1 16 . 1 1 420 420 ARG CB C 420 30.850 30.850 30.733 0.117 18990 11542 1 16 . 1 1 420 420 ARG H H 420 8.135 8.135 8.127 0.008 18990 11543 1 16 . 1 1 421 421 TRP N N 421 122.280 122.280 123.045 -0.765 18990 11544 1 16 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.848 -0.185 18990 11545 1 16 . 1 1 421 421 TRP C C 421 175.856 175.856 175.424 0.432 18990 11546 1 16 . 1 1 421 421 TRP CA C 421 57.404 57.404 56.341 1.063 18990 11547 1 16 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.916 -1.479 18990 11548 1 16 . 1 1 421 421 TRP H H 421 8.159 8.159 8.126 0.033 18990 11549 1 16 . 1 1 422 422 ASP N N 422 121.980 121.980 120.974 1.006 18990 11550 1 16 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.819 -0.324 18990 11551 1 16 . 1 1 422 422 ASP C C 422 176.184 176.184 176.178 0.006 18990 11552 1 16 . 1 1 422 422 ASP CA C 422 53.899 53.899 53.817 0.082 18990 11553 1 16 . 1 1 422 422 ASP CB C 422 40.948 40.948 42.020 -1.072 18990 11554 1 16 . 1 1 422 422 ASP H H 422 8.135 8.135 8.545 -0.410 18990 11555 1 16 . 1 1 423 423 GLU N N 423 121.990 121.990 124.433 -2.443 18990 11556 1 16 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.271 -0.181 18990 11557 1 16 . 1 1 423 423 GLU C C 423 176.720 176.720 176.902 -0.182 18990 11558 1 16 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.816 0.353 18990 11559 1 16 . 1 1 423 423 GLU CB C 423 30.156 30.156 29.496 0.660 18990 11560 1 16 . 1 1 423 423 GLU H H 423 8.153 8.153 8.961 -0.808 18990 11561 1 16 . 1 1 424 424 ALA N N 424 123.900 123.900 122.330 1.570 18990 11562 1 16 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.008 0.272 18990 11563 1 16 . 1 1 424 424 ALA C C 424 178.095 178.095 176.872 1.223 18990 11564 1 16 . 1 1 424 424 ALA CA C 424 53.017 53.017 52.108 0.909 18990 11565 1 16 . 1 1 424 424 ALA CB C 424 19.086 19.086 17.779 1.306 18990 11566 1 16 . 1 1 424 424 ALA H H 424 8.243 8.243 8.305 -0.062 18990 11567 1 16 . 1 1 425 425 SER N N 425 113.881 113.881 115.005 -1.124 18990 11568 1 16 . 1 1 425 425 SER HA H 425 4.387 4.387 4.358 0.029 18990 11569 1 16 . 1 1 425 425 SER C C 425 174.338 174.338 174.369 -0.031 18990 11570 1 16 . 1 1 425 425 SER CA C 425 58.546 58.546 57.845 0.701 18990 11571 1 16 . 1 1 425 425 SER CB C 425 63.784 63.784 64.316 -0.532 18990 11572 1 16 . 1 1 425 425 SER H H 425 8.063 8.063 8.080 -0.017 18990 11573 1 16 . 1 1 426 426 ASN N N 426 121.032 121.032 120.091 0.941 18990 11574 1 16 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.761 -0.055 18990 11575 1 16 . 1 1 426 426 ASN C C 426 175.046 175.046 173.879 1.167 18990 11576 1 16 . 1 1 426 426 ASN CA C 426 53.445 53.445 52.661 0.784 18990 11577 1 16 . 1 1 426 426 ASN CB C 426 38.847 38.847 38.893 -0.046 18990 11578 1 16 . 1 1 426 426 ASN H H 426 8.391 8.391 8.451 -0.060 18990 11579 1 16 . 1 1 427 427 VAL N N 427 119.463 119.463 120.164 -0.701 18990 11580 1 16 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.218 -0.025 18990 11581 1 16 . 1 1 427 427 VAL C C 427 176.213 176.213 175.766 0.447 18990 11582 1 16 . 1 1 427 427 VAL CA C 427 62.449 62.449 61.683 0.766 18990 11583 1 16 . 1 1 427 427 VAL CB C 427 32.865 32.865 32.386 0.478 18990 11584 1 16 . 1 1 427 427 VAL H H 427 7.954 7.954 8.340 -0.386 18990 11585 1 16 . 1 1 428 428 THR N N 428 118.226 118.226 121.835 -3.609 18990 11586 1 16 . 1 1 428 428 THR HA H 428 4.353 4.353 4.464 -0.111 18990 11587 1 16 . 1 1 428 428 THR C C 428 174.361 174.361 174.207 0.154 18990 11588 1 16 . 1 1 428 428 THR CA C 428 62.065 62.065 62.039 0.026 18990 11589 1 16 . 1 1 428 428 THR CB C 428 69.729 69.729 69.452 0.277 18990 11590 1 16 . 1 1 428 428 THR H H 428 8.225 8.225 8.324 -0.099 18990 11591 1 16 . 1 1 429 429 ILE N N 429 123.910 123.910 123.212 0.698 18990 11592 1 16 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.728 -0.540 18990 11593 1 16 . 1 1 429 429 ILE C C 429 175.774 175.774 175.347 0.427 18990 11594 1 16 . 1 1 429 429 ILE CA C 429 60.819 60.819 59.908 0.911 18990 11595 1 16 . 1 1 429 429 ILE CB C 429 38.719 38.719 39.712 -0.993 18990 11596 1 16 . 1 1 429 429 ILE H H 429 8.148 8.148 8.167 -0.019 18990 11597 1 16 . 1 1 430 430 LYS N N 430 126.453 126.453 121.751 4.702 18990 11598 1 16 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.564 -0.130 18990 11599 1 16 . 1 1 430 430 LYS C C 430 176.241 176.241 174.977 1.264 18990 11600 1 16 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.089 0.848 18990 11601 1 16 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.508 -0.344 18990 11602 1 16 . 1 1 430 430 LYS H H 430 8.406 8.406 8.185 0.221 18990 11603 1 16 . 1 1 431 431 VAL N N 431 122.496 122.496 120.512 1.984 18990 11604 1 16 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.392 -0.112 18990 11605 1 16 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.643 -0.340 18990 11606 1 16 . 1 1 431 431 VAL CB C 431 33.132 33.132 34.586 -1.454 18990 11607 1 16 . 1 1 431 431 VAL H H 431 8.312 8.312 8.276 0.036 18990 11608 1 16 . 1 1 432 432 SER HA H 432 4.486 4.486 4.768 -0.282 18990 11609 1 16 . 1 1 432 432 SER C C 432 173.834 173.834 173.868 -0.034 18990 11610 1 16 . 1 1 432 432 SER CA C 432 58.650 58.650 58.294 0.356 18990 11611 1 16 . 1 1 432 432 SER CB C 432 64.152 64.152 63.957 0.195 18990 11612 1 16 . 1 1 433 433 THR N N 433 114.706 114.706 114.621 0.085 18990 11613 1 16 . 1 1 433 433 THR HA H 433 5.446 5.446 4.668 0.778 18990 11614 1 16 . 1 1 433 433 THR C C 433 173.979 173.979 174.499 -0.520 18990 11615 1 16 . 1 1 433 433 THR CA C 433 60.412 60.412 61.346 -0.934 18990 11616 1 16 . 1 1 433 433 THR CB C 433 71.896 71.896 69.877 2.019 18990 11617 1 16 . 1 1 433 433 THR H H 433 7.833 7.833 7.579 0.254 18990 11618 1 16 . 1 1 434 434 LYS N N 434 122.492 122.492 125.364 -2.872 18990 11619 1 16 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.913 -0.204 18990 11620 1 16 . 1 1 434 434 LYS C C 434 173.589 173.589 174.680 -1.091 18990 11621 1 16 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.946 1.429 18990 11622 1 16 . 1 1 434 434 LYS CB C 434 36.925 36.925 33.045 3.880 18990 11623 1 16 . 1 1 434 434 LYS H H 434 8.937 8.937 8.363 0.574 18990 11624 1 16 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.487 -0.220 18990 11625 1 16 . 1 1 435 435 PRO C C 435 175.238 175.238 176.459 -1.221 18990 11626 1 16 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.485 -1.562 18990 11627 1 16 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.894 -0.808 18990 11628 1 16 . 1 1 436 436 CYS N N 436 125.422 125.422 124.668 0.754 18990 11629 1 16 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.530 -1.100 18990 11630 1 16 . 1 1 436 436 CYS C C 436 176.770 176.770 175.072 1.698 18990 11631 1 16 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.507 0.509 18990 11632 1 16 . 1 1 436 436 CYS CB C 436 31.698 31.698 28.045 3.653 18990 11633 1 16 . 1 1 436 436 CYS H H 436 7.768 7.768 8.279 -0.511 18990 11634 1 16 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.221 -0.363 18990 11635 1 16 . 1 1 437 437 PRO C C 437 173.608 173.608 176.927 -3.319 18990 11636 1 16 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.497 -0.284 18990 11637 1 16 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.560 0.889 18990 11638 1 16 . 1 1 438 438 LYS N N 438 118.600 118.600 117.858 0.742 18990 11639 1 16 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.191 -0.221 18990 11640 1 16 . 1 1 438 438 LYS C C 438 176.887 176.887 176.841 0.046 18990 11641 1 16 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.617 0.070 18990 11642 1 16 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.577 -0.453 18990 11643 1 16 . 1 1 438 438 LYS H H 438 8.390 8.390 7.842 0.548 18990 11644 1 16 . 1 1 439 439 CYS N N 439 118.950 118.950 114.907 4.043 18990 11645 1 16 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.886 -0.140 18990 11646 1 16 . 1 1 439 439 CYS C C 439 176.650 176.650 174.220 2.430 18990 11647 1 16 . 1 1 439 439 CYS CA C 439 59.348 59.348 56.555 2.793 18990 11648 1 16 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.672 2.524 18990 11649 1 16 . 1 1 439 439 CYS H H 439 8.357 8.357 7.691 0.666 18990 11650 1 16 . 1 1 440 440 ARG N N 440 117.200 117.200 119.255 -2.055 18990 11651 1 16 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.155 -0.187 18990 11652 1 16 . 1 1 440 440 ARG C C 440 175.253 175.253 175.314 -0.061 18990 11653 1 16 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.964 -0.064 18990 11654 1 16 . 1 1 440 440 ARG CB C 440 26.041 26.041 28.648 -2.607 18990 11655 1 16 . 1 1 440 440 ARG H H 440 8.065 8.065 8.154 -0.089 18990 11656 1 16 . 1 1 441 441 THR N N 441 122.400 122.400 112.526 9.874 18990 11657 1 16 . 1 1 441 441 THR HA H 441 4.371 4.371 4.639 -0.268 18990 11658 1 16 . 1 1 441 441 THR C C 441 173.702 173.702 173.039 0.663 18990 11659 1 16 . 1 1 441 441 THR CA C 441 63.194 63.194 59.543 3.651 18990 11660 1 16 . 1 1 441 441 THR CB C 441 68.933 68.933 68.798 0.135 18990 11661 1 16 . 1 1 441 441 THR H H 441 8.643 8.643 7.712 0.931 18990 11662 1 16 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.634 -0.487 18990 11663 1 16 . 1 1 442 442 PRO C C 442 176.215 176.215 176.409 -0.194 18990 11664 1 16 . 1 1 442 442 PRO CA C 442 64.197 64.197 63.233 0.965 18990 11665 1 16 . 1 1 442 442 PRO CB C 442 32.044 32.044 31.392 0.652 18990 11666 1 16 . 1 1 443 443 THR N N 443 122.932 122.932 122.304 0.628 18990 11667 1 16 . 1 1 443 443 THR HA H 443 4.665 4.665 4.480 0.185 18990 11668 1 16 . 1 1 443 443 THR C C 443 172.133 172.133 174.246 -2.113 18990 11669 1 16 . 1 1 443 443 THR CA C 443 62.566 62.566 62.856 -0.290 18990 11670 1 16 . 1 1 443 443 THR CB C 443 71.562 71.562 69.853 1.709 18990 11671 1 16 . 1 1 443 443 THR H H 443 9.116 9.116 9.020 0.096 18990 11672 1 16 . 1 1 444 444 GLU N N 444 126.390 126.390 125.327 1.063 18990 11673 1 16 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.465 0.477 18990 11674 1 16 . 1 1 444 444 GLU C C 444 175.292 175.292 175.808 -0.516 18990 11675 1 16 . 1 1 444 444 GLU CA C 444 55.049 55.049 55.512 -0.463 18990 11676 1 16 . 1 1 444 444 GLU CB C 444 31.861 31.861 30.723 1.138 18990 11677 1 16 . 1 1 444 444 GLU H H 444 8.720 8.720 8.689 0.031 18990 11678 1 16 . 1 1 445 445 ARG N N 445 123.505 123.505 126.274 -2.769 18990 11679 1 16 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.187 -0.476 18990 11680 1 16 . 1 1 445 445 ARG C C 445 175.289 175.289 175.198 0.091 18990 11681 1 16 . 1 1 445 445 ARG CA C 445 55.856 55.856 55.454 0.402 18990 11682 1 16 . 1 1 445 445 ARG CB C 445 30.675 30.675 29.545 1.130 18990 11683 1 16 . 1 1 445 445 ARG H H 445 8.157 8.157 8.649 -0.492 18990 11684 1 16 . 1 1 446 446 ASP N N 446 126.800 126.800 124.969 1.831 18990 11685 1 16 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.692 -0.051 18990 11686 1 16 . 1 1 446 446 ASP C C 446 176.020 176.020 176.401 -0.381 18990 11687 1 16 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.426 -0.474 18990 11688 1 16 . 1 1 446 446 ASP CB C 446 41.400 41.400 42.422 -1.022 18990 11689 1 16 . 1 1 446 446 ASP H H 446 8.476 8.476 7.919 0.557 18990 11690 1 16 . 1 1 447 447 GLY N N 447 111.262 111.262 115.552 -4.290 18990 11691 1 16 . 1 1 447 447 GLY C C 447 174.073 174.073 174.446 -0.373 18990 11692 1 16 . 1 1 447 447 GLY CA C 447 45.832 45.832 45.029 0.803 18990 11693 1 16 . 1 1 447 447 GLY H H 447 8.056 8.056 8.783 -0.727 18990 11694 1 16 . 1 1 448 448 GLY N N 448 108.655 108.655 109.791 -1.136 18990 11695 1 16 . 1 1 448 448 GLY C C 448 174.020 174.020 175.383 -1.363 18990 11696 1 16 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.394 0.873 18990 11697 1 16 . 1 1 448 448 GLY H H 448 8.380 8.380 7.793 0.587 18990 11698 1 16 . 1 1 449 449 CYS N N 449 120.628 120.628 120.171 0.457 18990 11699 1 16 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.096 -0.099 18990 11700 1 16 . 1 1 449 449 CYS C C 449 174.855 174.855 173.686 1.169 18990 11701 1 16 . 1 1 449 449 CYS CA C 449 59.291 59.291 58.383 0.908 18990 11702 1 16 . 1 1 449 449 CYS CB C 449 28.000 28.000 26.096 1.904 18990 11703 1 16 . 1 1 449 449 CYS H H 449 7.832 7.832 8.316 -0.484 18990 11704 1 16 . 1 1 450 450 MET N N 450 123.947 123.947 113.458 10.489 18990 11705 1 16 . 1 1 450 450 MET HA H 450 4.551 4.551 3.816 0.735 18990 11706 1 16 . 1 1 450 450 MET C C 450 174.658 174.658 174.091 0.567 18990 11707 1 16 . 1 1 450 450 MET CA C 450 54.970 54.970 55.413 -0.443 18990 11708 1 16 . 1 1 450 450 MET CB C 450 34.100 34.100 29.869 4.231 18990 11709 1 16 . 1 1 450 450 MET H H 450 8.916 8.916 7.250 1.666 18990 11710 1 16 . 1 1 451 451 HIS N N 451 120.490 120.490 116.677 3.813 18990 11711 1 16 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.054 -0.375 18990 11712 1 16 . 1 1 451 451 HIS C C 451 172.443 172.443 173.829 -1.386 18990 11713 1 16 . 1 1 451 451 HIS CA C 451 53.812 53.812 55.361 -1.549 18990 11714 1 16 . 1 1 451 451 HIS CB C 451 28.900 28.900 28.965 -0.065 18990 11715 1 16 . 1 1 451 451 HIS H H 451 7.557 7.557 7.607 -0.050 18990 11716 1 16 . 1 1 452 452 MET N N 452 128.800 128.800 126.353 2.447 18990 11717 1 16 . 1 1 452 452 MET HA H 452 4.320 4.320 4.441 -0.121 18990 11718 1 16 . 1 1 452 452 MET C C 452 175.479 175.479 173.983 1.496 18990 11719 1 16 . 1 1 452 452 MET CA C 452 52.589 52.589 52.709 -0.120 18990 11720 1 16 . 1 1 452 452 MET CB C 452 28.074 28.074 31.302 -3.228 18990 11721 1 16 . 1 1 452 452 MET H H 452 9.087 9.087 7.906 1.181 18990 11722 1 16 . 1 1 453 453 VAL N N 453 122.200 122.200 117.435 4.765 18990 11723 1 16 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.932 -0.138 18990 11724 1 16 . 1 1 453 453 VAL C C 453 175.476 175.476 174.468 1.008 18990 11725 1 16 . 1 1 453 453 VAL CA C 453 61.380 61.380 59.707 1.673 18990 11726 1 16 . 1 1 453 453 VAL CB C 453 33.089 33.089 34.822 -1.733 18990 11727 1 16 . 1 1 453 453 VAL H H 453 8.016 8.016 7.814 0.202 18990 11728 1 16 . 1 1 454 454 CYS N N 454 130.353 130.353 126.167 4.186 18990 11729 1 16 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.899 -0.303 18990 11730 1 16 . 1 1 454 454 CYS C C 454 177.833 177.833 174.815 3.018 18990 11731 1 16 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.259 3.312 18990 11732 1 16 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.906 5.139 18990 11733 1 16 . 1 1 454 454 CYS H H 454 8.989 8.989 9.042 -0.053 18990 11734 1 16 . 1 1 455 455 THR N N 455 119.000 119.000 123.226 -4.226 18990 11735 1 16 . 1 1 455 455 THR HA H 455 4.393 4.393 4.416 -0.023 18990 11736 1 16 . 1 1 455 455 THR C C 455 175.264 175.264 174.071 1.193 18990 11737 1 16 . 1 1 455 455 THR CA C 455 61.644 61.644 61.881 -0.237 18990 11738 1 16 . 1 1 455 455 THR CB C 455 69.400 69.400 68.314 1.086 18990 11739 1 16 . 1 1 455 455 THR H H 455 8.533 8.533 8.569 -0.036 18990 11740 1 16 . 1 1 456 456 ARG N N 456 128.900 128.900 127.052 1.848 18990 11741 1 16 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.561 -0.336 18990 11742 1 16 . 1 1 456 456 ARG C C 456 177.782 177.782 174.818 2.964 18990 11743 1 16 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.702 2.248 18990 11744 1 16 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.792 -3.742 18990 11745 1 16 . 1 1 456 456 ARG H H 456 9.036 9.036 7.757 1.279 18990 11746 1 16 . 1 1 457 457 ALA N N 457 133.152 133.152 126.401 6.751 18990 11747 1 16 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.266 -0.120 18990 11748 1 16 . 1 1 457 457 ALA C C 457 178.757 178.757 177.546 1.211 18990 11749 1 16 . 1 1 457 457 ALA CA C 457 53.929 53.929 52.754 1.175 18990 11750 1 16 . 1 1 457 457 ALA CB C 457 17.710 17.710 17.689 0.021 18990 11751 1 16 . 1 1 457 457 ALA H H 457 9.042 9.042 8.715 0.327 18990 11752 1 16 . 1 1 458 458 GLY N N 458 111.200 111.200 110.218 0.982 18990 11753 1 16 . 1 1 458 458 GLY C C 458 173.558 173.558 174.003 -0.445 18990 11754 1 16 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.746 0.690 18990 11755 1 16 . 1 1 458 458 GLY H H 458 8.830 8.830 8.318 0.512 18990 11756 1 16 . 1 1 459 459 CYS N N 459 123.040 123.040 119.795 3.245 18990 11757 1 16 . 1 1 459 459 CYS HA H 459 4.622 4.622 5.138 -0.516 18990 11758 1 16 . 1 1 459 459 CYS C C 459 176.591 176.591 174.515 2.076 18990 11759 1 16 . 1 1 459 459 CYS CA C 459 60.499 60.499 58.814 1.685 18990 11760 1 16 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.275 0.899 18990 11761 1 16 . 1 1 459 459 CYS H H 459 8.042 8.042 8.227 -0.185 18990 11762 1 16 . 1 1 460 460 GLY N N 460 104.500 104.500 111.841 -7.341 18990 11763 1 16 . 1 1 460 460 GLY C C 460 173.716 173.716 173.625 0.091 18990 11764 1 16 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.624 0.384 18990 11765 1 16 . 1 1 460 460 GLY H H 460 7.705 7.705 8.124 -0.419 18990 11766 1 16 . 1 1 461 461 PHE N N 461 124.949 124.949 120.295 4.654 18990 11767 1 16 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.665 -0.085 18990 11768 1 16 . 1 1 461 461 PHE C C 461 174.447 174.447 173.496 0.951 18990 11769 1 16 . 1 1 461 461 PHE CA C 461 59.946 59.946 56.188 3.758 18990 11770 1 16 . 1 1 461 461 PHE CB C 461 41.300 41.300 41.905 -0.605 18990 11771 1 16 . 1 1 461 461 PHE H H 461 8.947 8.947 7.608 1.339 18990 11772 1 16 . 1 1 462 462 GLU N N 462 125.272 125.272 127.259 -1.987 18990 11773 1 16 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.515 1.206 18990 11774 1 16 . 1 1 462 462 GLU C C 462 176.067 176.067 174.918 1.149 18990 11775 1 16 . 1 1 462 462 GLU CA C 462 54.624 54.624 55.386 -0.763 18990 11776 1 16 . 1 1 462 462 GLU CB C 462 31.255 31.255 31.183 0.072 18990 11777 1 16 . 1 1 462 462 GLU H H 462 7.799 7.799 7.940 -0.141 18990 11778 1 16 . 1 1 463 463 TRP N N 463 121.524 121.524 120.626 0.898 18990 11779 1 16 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.243 0.263 18990 11780 1 16 . 1 1 463 463 TRP C C 463 172.844 172.844 174.483 -1.639 18990 11781 1 16 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.876 -1.105 18990 11782 1 16 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.249 0.487 18990 11783 1 16 . 1 1 463 463 TRP H H 463 9.300 9.300 8.772 0.528 18990 11784 1 16 . 1 1 464 464 CYS N N 464 120.868 120.868 120.634 0.234 18990 11785 1 16 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.925 0.491 18990 11786 1 16 . 1 1 464 464 CYS C C 464 177.213 177.213 176.372 0.841 18990 11787 1 16 . 1 1 464 464 CYS CA C 464 57.776 57.776 60.931 -3.155 18990 11788 1 16 . 1 1 464 464 CYS CB C 464 32.930 32.930 27.138 5.792 18990 11789 1 16 . 1 1 464 464 CYS H H 464 8.752 8.752 8.798 -0.046 18990 11790 1 16 . 1 1 465 465 TRP N N 465 131.209 131.209 126.848 4.361 18990 11791 1 16 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.171 0.256 18990 11792 1 16 . 1 1 465 465 TRP C C 465 176.051 176.051 175.461 0.590 18990 11793 1 16 . 1 1 465 465 TRP CA C 465 60.763 60.763 60.172 0.591 18990 11794 1 16 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.425 1.701 18990 11795 1 16 . 1 1 465 465 TRP H H 465 9.809 9.809 8.845 0.964 18990 11796 1 16 . 1 1 466 466 VAL N N 466 118.233 118.233 117.513 0.720 18990 11797 1 16 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.250 0.374 18990 11798 1 16 . 1 1 466 466 VAL C C 466 178.943 178.943 176.103 2.840 18990 11799 1 16 . 1 1 466 466 VAL CA C 466 65.602 65.602 63.368 2.234 18990 11800 1 16 . 1 1 466 466 VAL CB C 466 33.172 33.172 30.796 2.376 18990 11801 1 16 . 1 1 466 466 VAL H H 466 8.627 8.627 7.528 1.099 18990 11802 1 16 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.594 -1.163 18990 11803 1 16 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.852 0.147 18990 11804 1 16 . 1 1 467 467 CYS CB C 467 31.870 31.870 27.805 4.066 18990 11805 1 16 . 1 1 467 467 CYS H H 467 7.820 7.820 7.334 0.486 18990 11806 1 16 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.444 -0.408 18990 11807 1 16 . 1 1 468 468 GLN CA C 468 58.051 58.051 56.855 1.196 18990 11808 1 16 . 1 1 468 468 GLN CB C 468 26.476 26.476 29.081 -2.605 18990 11809 1 16 . 1 1 469 469 THR HA H 469 4.685 4.685 4.541 0.144 18990 11810 1 16 . 1 1 469 469 THR C C 469 173.351 173.351 172.452 0.899 18990 11811 1 16 . 1 1 469 469 THR CA C 469 59.176 59.176 61.300 -2.124 18990 11812 1 16 . 1 1 469 469 THR CB C 469 71.775 71.775 70.791 0.984 18990 11813 1 16 . 1 1 470 470 GLU N N 470 120.940 120.940 124.697 -3.757 18990 11814 1 16 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.811 -0.518 18990 11815 1 16 . 1 1 470 470 GLU C C 470 175.539 175.539 177.018 -1.479 18990 11816 1 16 . 1 1 470 470 GLU CA C 470 57.015 57.015 54.949 2.066 18990 11817 1 16 . 1 1 470 470 GLU CB C 470 29.965 29.965 30.596 -0.631 18990 11818 1 16 . 1 1 470 470 GLU H H 470 8.912 8.912 8.837 0.075 18990 11819 1 16 . 1 1 471 471 TRP N N 471 126.998 126.998 128.359 -1.361 18990 11820 1 16 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.274 0.019 18990 11821 1 16 . 1 1 471 471 TRP C C 471 175.408 175.408 174.868 0.540 18990 11822 1 16 . 1 1 471 471 TRP CA C 471 58.220 58.220 57.769 0.451 18990 11823 1 16 . 1 1 471 471 TRP CB C 471 29.500 29.500 28.346 1.155 18990 11824 1 16 . 1 1 471 471 TRP H H 471 8.350 8.350 9.240 -0.890 18990 11825 1 16 . 1 1 472 472 THR N N 472 117.480 117.480 121.243 -3.763 18990 11826 1 16 . 1 1 472 472 THR HA H 472 4.444 4.444 4.470 -0.026 18990 11827 1 16 . 1 1 472 472 THR CA C 472 58.930 58.930 61.422 -2.493 18990 11828 1 16 . 1 1 472 472 THR H H 472 8.069 8.069 8.052 0.017 18990 11829 1 16 . 1 1 473 473 ARG HA H 473 3.773 3.773 3.553 0.220 18990 11830 1 16 . 1 1 473 473 ARG C C 473 178.053 178.053 177.635 0.418 18990 11831 1 16 . 1 1 473 473 ARG CA C 473 58.088 58.088 59.132 -1.044 18990 11832 1 16 . 1 1 473 473 ARG CB C 473 29.426 29.426 29.857 -0.431 18990 11833 1 16 . 1 1 474 474 ASP N N 474 119.900 119.900 119.905 -0.005 18990 11834 1 16 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.389 -0.174 18990 11835 1 16 . 1 1 474 474 ASP C C 474 178.197 178.197 176.813 1.384 18990 11836 1 16 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.564 0.238 18990 11837 1 16 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.764 -0.582 18990 11838 1 16 . 1 1 474 474 ASP H H 474 7.718 7.718 8.453 -0.735 18990 11839 1 16 . 1 1 475 475 CYS N N 475 121.000 121.000 113.678 7.322 18990 11840 1 16 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.704 -1.337 18990 11841 1 16 . 1 1 475 475 CYS CA C 475 64.533 64.533 57.665 6.868 18990 11842 1 16 . 1 1 475 475 CYS CB C 475 29.092 29.092 27.340 1.752 18990 11843 1 16 . 1 1 475 475 CYS H H 475 6.953 6.953 7.727 -0.774 18990 11844 1 16 . 1 1 476 476 MET HA H 476 4.021 4.021 3.852 0.169 18990 11845 1 16 . 1 1 476 476 MET CA C 476 58.010 58.010 58.941 -0.931 18990 11846 1 16 . 1 1 476 476 MET CB C 476 32.550 32.550 32.205 0.345 18990 11847 1 16 . 1 1 477 477 GLY N N 477 111.938 111.938 104.198 7.740 18990 11848 1 16 . 1 1 477 477 GLY C C 477 174.406 174.406 174.149 0.257 18990 11849 1 16 . 1 1 477 477 GLY CA C 477 45.616 45.616 45.861 -0.245 18990 11850 1 16 . 1 1 477 477 GLY H H 477 9.155 9.155 7.840 1.315 18990 11851 1 16 . 1 1 478 478 ALA N N 478 121.900 121.900 123.618 -1.718 18990 11852 1 16 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.318 -0.027 18990 11853 1 16 . 1 1 478 478 ALA C C 478 178.196 178.196 177.666 0.530 18990 11854 1 16 . 1 1 478 478 ALA CA C 478 53.440 53.440 53.541 -0.101 18990 11855 1 16 . 1 1 478 478 ALA CB C 478 20.390 20.390 19.817 0.573 18990 11856 1 16 . 1 1 478 478 ALA H H 478 7.347 7.347 7.487 -0.140 18990 11857 1 16 . 1 1 479 479 HIS N N 479 115.200 115.200 114.283 0.917 18990 11858 1 16 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.632 0.271 18990 11859 1 16 . 1 1 479 479 HIS C C 479 173.325 173.325 176.809 -3.484 18990 11860 1 16 . 1 1 479 479 HIS CA C 479 54.526 54.526 56.715 -2.189 18990 11861 1 16 . 1 1 479 479 HIS CB C 479 27.600 27.600 30.347 -2.747 18990 11862 1 16 . 1 1 479 479 HIS H H 479 8.297 8.297 7.536 0.761 18990 11863 1 16 . 1 1 480 480 TRP N N 480 121.780 121.780 122.006 -0.226 18990 11864 1 16 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.430 -0.135 18990 11865 1 16 . 1 1 480 480 TRP C C 480 175.568 175.568 175.801 -0.233 18990 11866 1 16 . 1 1 480 480 TRP CA C 480 58.358 58.358 59.405 -1.047 18990 11867 1 16 . 1 1 480 480 TRP CB C 480 29.550 29.550 29.954 -0.404 18990 11868 1 16 . 1 1 480 480 TRP H H 480 8.081 8.081 7.184 0.897 18990 11869 1 16 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.560 0.285 18990 11870 1 16 . 1 1 481 481 PHE C C 481 175.126 175.126 175.193 -0.067 18990 11871 1 16 . 1 1 481 481 PHE CA C 481 56.471 56.471 58.225 -1.754 18990 11872 1 16 . 1 1 481 481 PHE CB C 481 41.006 41.006 38.148 2.858 18990 11873 1 17 . 1 1 343 343 GLU N N 343 121.045 121.045 125.826 -4.781 18990 11874 1 17 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.667 -0.502 18990 11875 1 17 . 1 1 343 343 GLU C C 343 176.529 176.529 175.165 1.364 18990 11876 1 17 . 1 1 343 343 GLU CA C 343 57.162 57.162 56.464 0.698 18990 11877 1 17 . 1 1 343 343 GLU CB C 343 30.204 30.204 29.945 0.259 18990 11878 1 17 . 1 1 343 343 GLU H H 343 8.293 8.293 8.701 -0.408 18990 11879 1 17 . 1 1 344 344 TYR N N 344 121.000 121.000 127.383 -6.383 18990 11880 1 17 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.590 -0.052 18990 11881 1 17 . 1 1 344 344 TYR C C 344 175.897 175.897 173.713 2.184 18990 11882 1 17 . 1 1 344 344 TYR CA C 344 58.179 58.179 58.053 0.126 18990 11883 1 17 . 1 1 344 344 TYR CB C 344 38.600 38.600 39.303 -0.703 18990 11884 1 17 . 1 1 344 344 TYR H H 344 8.040 8.040 8.485 -0.445 18990 11885 1 17 . 1 1 345 345 VAL N N 345 121.900 121.900 128.986 -7.086 18990 11886 1 17 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.429 -0.490 18990 11887 1 17 . 1 1 345 345 VAL C C 345 176.143 176.143 174.139 2.004 18990 11888 1 17 . 1 1 345 345 VAL CA C 345 62.867 62.867 61.007 1.860 18990 11889 1 17 . 1 1 345 345 VAL CB C 345 32.799 32.799 33.572 -0.773 18990 11890 1 17 . 1 1 345 345 VAL H H 345 7.856 7.856 8.037 -0.181 18990 11891 1 17 . 1 1 346 346 LEU N N 346 124.950 124.950 122.999 1.951 18990 11892 1 17 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.758 -0.515 18990 11893 1 17 . 1 1 346 346 LEU C C 346 177.747 177.747 175.278 2.469 18990 11894 1 17 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.543 0.957 18990 11895 1 17 . 1 1 346 346 LEU CB C 346 42.252 42.252 43.465 -1.213 18990 11896 1 17 . 1 1 346 346 LEU H H 346 8.127 8.127 8.155 -0.028 18990 11897 1 17 . 1 1 347 347 GLN N N 347 121.452 121.452 122.881 -1.429 18990 11898 1 17 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.548 -0.262 18990 11899 1 17 . 1 1 347 347 GLN C C 347 175.833 175.833 174.447 1.386 18990 11900 1 17 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.253 0.735 18990 11901 1 17 . 1 1 347 347 GLN CB C 347 29.375 29.375 29.811 -0.436 18990 11902 1 17 . 1 1 347 347 GLN H H 347 8.270 8.270 8.274 -0.004 18990 11903 1 17 . 1 1 348 348 ALA N N 348 124.466 124.466 126.745 -2.279 18990 11904 1 17 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.443 -0.122 18990 11905 1 17 . 1 1 348 348 ALA C C 348 177.929 177.929 178.015 -0.086 18990 11906 1 17 . 1 1 348 348 ALA CA C 348 52.703 52.703 52.236 0.467 18990 11907 1 17 . 1 1 348 348 ALA CB C 348 19.002 19.002 19.004 -0.002 18990 11908 1 17 . 1 1 348 348 ALA H H 348 8.227 8.227 8.765 -0.538 18990 11909 1 17 . 1 1 349 349 GLY N N 349 108.193 108.193 108.215 -0.022 18990 11910 1 17 . 1 1 349 349 GLY C C 349 174.269 174.269 174.421 -0.152 18990 11911 1 17 . 1 1 349 349 GLY CA C 349 45.227 45.227 44.954 0.273 18990 11912 1 17 . 1 1 349 349 GLY H H 349 8.298 8.298 8.306 -0.008 18990 11913 1 17 . 1 1 350 350 GLY N N 350 108.073 108.073 107.537 0.536 18990 11914 1 17 . 1 1 350 350 GLY C C 350 172.979 172.979 172.924 0.055 18990 11915 1 17 . 1 1 350 350 GLY CA C 350 44.935 44.935 44.062 0.874 18990 11916 1 17 . 1 1 350 350 GLY H H 350 8.156 8.156 7.966 0.190 18990 11917 1 17 . 1 1 351 351 VAL N N 351 119.058 119.058 118.840 0.218 18990 11918 1 17 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.442 -0.026 18990 11919 1 17 . 1 1 351 351 VAL C C 351 173.412 173.412 174.148 -0.736 18990 11920 1 17 . 1 1 351 351 VAL CA C 351 60.663 60.663 60.719 -0.056 18990 11921 1 17 . 1 1 351 351 VAL CB C 351 34.866 34.866 33.907 0.959 18990 11922 1 17 . 1 1 351 351 VAL H H 351 8.541 8.541 8.156 0.385 18990 11923 1 17 . 1 1 352 352 LEU N N 352 125.800 125.800 123.053 2.747 18990 11924 1 17 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.624 0.141 18990 11925 1 17 . 1 1 352 352 LEU C C 352 176.218 176.218 174.884 1.334 18990 11926 1 17 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.797 -0.456 18990 11927 1 17 . 1 1 352 352 LEU CB C 352 42.706 42.706 44.976 -2.270 18990 11928 1 17 . 1 1 352 352 LEU H H 352 8.151 8.151 8.494 -0.343 18990 11929 1 17 . 1 1 353 353 CYS N N 353 126.825 126.825 122.707 4.118 18990 11930 1 17 . 1 1 353 353 CYS HA H 353 4.107 4.107 3.804 0.303 18990 11931 1 17 . 1 1 353 353 CYS C C 353 176.655 176.655 174.285 2.370 18990 11932 1 17 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.142 0.589 18990 11933 1 17 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.410 4.455 18990 11934 1 17 . 1 1 353 353 CYS H H 353 8.794 8.794 8.418 0.376 18990 11935 1 17 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.100 0.320 18990 11936 1 17 . 1 1 354 354 PRO C C 354 177.512 177.512 175.879 1.633 18990 11937 1 17 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.232 -0.240 18990 11938 1 17 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.123 1.444 18990 11939 1 17 . 1 1 355 355 GLN N N 355 126.800 126.800 120.843 5.957 18990 11940 1 17 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.434 -0.159 18990 11941 1 17 . 1 1 355 355 GLN C C 355 175.516 175.516 175.344 0.172 18990 11942 1 17 . 1 1 355 355 GLN CA C 355 54.793 54.793 52.419 2.374 18990 11943 1 17 . 1 1 355 355 GLN CB C 355 28.547 28.547 29.309 -0.762 18990 11944 1 17 . 1 1 355 355 GLN H H 355 9.033 9.033 7.373 1.660 18990 11945 1 17 . 1 1 357 357 GLY C C 357 173.229 173.229 175.026 -1.797 18990 11946 1 17 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.971 0.283 18990 11947 1 17 . 1 1 358 358 CYS N N 358 123.500 123.500 117.927 5.573 18990 11948 1 17 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.626 -0.093 18990 11949 1 17 . 1 1 358 358 CYS C C 358 176.157 176.157 173.493 2.664 18990 11950 1 17 . 1 1 358 358 CYS CA C 358 60.268 60.268 58.224 2.044 18990 11951 1 17 . 1 1 358 358 CYS CB C 358 29.375 29.375 29.797 -0.422 18990 11952 1 17 . 1 1 358 358 CYS H H 358 7.720 7.720 7.583 0.137 18990 11953 1 17 . 1 1 359 359 GLY N N 359 104.400 104.400 107.794 -3.394 18990 11954 1 17 . 1 1 359 359 GLY C C 359 174.080 174.080 174.758 -0.678 18990 11955 1 17 . 1 1 359 359 GLY CA C 359 46.064 46.064 45.433 0.631 18990 11956 1 17 . 1 1 359 359 GLY H H 359 7.756 7.756 8.579 -0.823 18990 11957 1 17 . 1 1 360 360 MET N N 360 121.300 121.300 119.367 1.933 18990 11958 1 17 . 1 1 360 360 MET HA H 360 4.343 4.343 4.392 -0.049 18990 11959 1 17 . 1 1 360 360 MET C C 360 175.641 175.641 176.819 -1.178 18990 11960 1 17 . 1 1 360 360 MET CA C 360 55.923 55.923 55.376 0.547 18990 11961 1 17 . 1 1 360 360 MET CB C 360 33.091 33.091 32.865 0.226 18990 11962 1 17 . 1 1 360 360 MET H H 360 8.229 8.229 8.047 0.182 18990 11963 1 17 . 1 1 361 361 GLY N N 361 109.000 109.000 107.381 1.619 18990 11964 1 17 . 1 1 361 361 GLY C C 361 173.774 173.774 173.432 0.342 18990 11965 1 17 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.362 1.476 18990 11966 1 17 . 1 1 361 361 GLY H H 361 8.347 8.347 7.825 0.522 18990 11967 1 17 . 1 1 362 362 LEU N N 362 126.725 126.725 126.214 0.511 18990 11968 1 17 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.834 -0.159 18990 11969 1 17 . 1 1 362 362 LEU C C 362 175.865 175.865 175.516 0.349 18990 11970 1 17 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.188 1.002 18990 11971 1 17 . 1 1 362 362 LEU CB C 362 44.050 44.050 42.098 1.952 18990 11972 1 17 . 1 1 362 362 LEU H H 362 8.935 8.935 8.866 0.069 18990 11973 1 17 . 1 1 363 363 LEU N N 363 123.742 123.742 127.087 -3.345 18990 11974 1 17 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.583 0.094 18990 11975 1 17 . 1 1 363 363 LEU C C 363 176.162 176.162 175.915 0.247 18990 11976 1 17 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.136 0.206 18990 11977 1 17 . 1 1 363 363 LEU CB C 363 42.210 42.210 42.171 0.039 18990 11978 1 17 . 1 1 363 363 LEU H H 363 8.481 8.481 8.602 -0.121 18990 11979 1 17 . 1 1 364 364 VAL N N 364 120.980 120.980 127.617 -6.637 18990 11980 1 17 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.140 0.257 18990 11981 1 17 . 1 1 364 364 VAL C C 364 175.592 175.592 175.350 0.242 18990 11982 1 17 . 1 1 364 364 VAL CA C 364 60.460 60.460 62.078 -1.618 18990 11983 1 17 . 1 1 364 364 VAL CB C 364 34.125 34.125 32.542 1.583 18990 11984 1 17 . 1 1 364 364 VAL H H 364 8.155 8.155 8.261 -0.106 18990 11985 1 17 . 1 1 365 365 GLU N N 365 126.950 126.950 129.211 -2.261 18990 11986 1 17 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.693 -0.083 18990 11987 1 17 . 1 1 365 365 GLU C C 365 175.427 175.427 175.811 -0.384 18990 11988 1 17 . 1 1 365 365 GLU CA C 365 54.551 54.551 53.153 1.398 18990 11989 1 17 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.947 -0.167 18990 11990 1 17 . 1 1 365 365 GLU H H 365 8.900 8.900 8.380 0.520 18990 11991 1 17 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.261 0.001 18990 11992 1 17 . 1 1 366 366 PRO C C 366 177.013 177.013 176.756 0.257 18990 11993 1 17 . 1 1 366 366 PRO CA C 366 64.463 64.463 64.852 -0.389 18990 11994 1 17 . 1 1 366 366 PRO CB C 366 32.048 32.048 32.090 -0.042 18990 11995 1 17 . 1 1 367 367 ASP N N 367 115.459 115.459 116.200 -0.741 18990 11996 1 17 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.484 0.011 18990 11997 1 17 . 1 1 367 367 ASP C C 367 175.123 175.123 176.046 -0.923 18990 11998 1 17 . 1 1 367 367 ASP CA C 367 54.503 54.503 54.550 -0.047 18990 11999 1 17 . 1 1 367 367 ASP CB C 367 40.123 40.123 41.135 -1.012 18990 12000 1 17 . 1 1 367 367 ASP H H 367 8.439 8.439 8.367 0.072 18990 12001 1 17 . 1 1 368 368 CYS N N 368 118.700 118.700 120.378 -1.678 18990 12002 1 17 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.309 0.261 18990 12003 1 17 . 1 1 368 368 CYS C C 368 173.806 173.806 174.587 -0.781 18990 12004 1 17 . 1 1 368 368 CYS CA C 368 58.581 58.581 59.773 -1.192 18990 12005 1 17 . 1 1 368 368 CYS CB C 368 28.450 28.450 28.347 0.103 18990 12006 1 17 . 1 1 368 368 CYS H H 368 7.515 7.515 7.745 -0.230 18990 12007 1 17 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.446 -0.181 18990 12008 1 17 . 1 1 369 369 ARG C C 369 174.908 174.908 175.558 -0.650 18990 12009 1 17 . 1 1 369 369 ARG CA C 369 57.669 57.669 55.900 1.769 18990 12010 1 17 . 1 1 369 369 ARG CB C 369 32.274 32.274 31.207 1.067 18990 12011 1 17 . 1 1 370 370 LYS N N 370 121.022 121.022 120.807 0.215 18990 12012 1 17 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.422 -0.252 18990 12013 1 17 . 1 1 370 370 LYS C C 370 174.868 174.868 175.062 -0.194 18990 12014 1 17 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.197 1.357 18990 12015 1 17 . 1 1 370 370 LYS CB C 370 33.140 33.140 32.890 0.250 18990 12016 1 17 . 1 1 370 370 LYS H H 370 7.740 7.740 7.844 -0.104 18990 12017 1 17 . 1 1 371 371 VAL N N 371 128.362 128.362 128.256 0.106 18990 12018 1 17 . 1 1 371 371 VAL HA H 371 4.133 4.133 3.999 0.134 18990 12019 1 17 . 1 1 371 371 VAL C C 371 173.402 173.402 174.915 -1.513 18990 12020 1 17 . 1 1 371 371 VAL CA C 371 60.777 60.777 62.041 -1.264 18990 12021 1 17 . 1 1 371 371 VAL CB C 371 33.000 33.000 31.959 1.041 18990 12022 1 17 . 1 1 371 371 VAL H H 371 8.647 8.647 8.586 0.061 18990 12023 1 17 . 1 1 372 372 THR N N 372 119.667 119.667 121.400 -1.733 18990 12024 1 17 . 1 1 372 372 THR HA H 372 5.032 5.032 4.827 0.205 18990 12025 1 17 . 1 1 372 372 THR C C 372 174.339 174.339 173.860 0.479 18990 12026 1 17 . 1 1 372 372 THR CA C 372 60.881 60.881 61.703 -0.822 18990 12027 1 17 . 1 1 372 372 THR CB C 372 70.471 70.471 71.808 -1.337 18990 12028 1 17 . 1 1 372 372 THR H H 372 8.087 8.087 8.140 -0.053 18990 12029 1 17 . 1 1 373 373 CYS N N 373 132.554 132.554 127.049 5.505 18990 12030 1 17 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.614 0.188 18990 12031 1 17 . 1 1 373 373 CYS C C 373 176.791 176.791 175.472 1.319 18990 12032 1 17 . 1 1 373 373 CYS CA C 373 58.504 58.504 58.695 -0.191 18990 12033 1 17 . 1 1 373 373 CYS CB C 373 28.311 28.311 25.703 2.608 18990 12034 1 17 . 1 1 373 373 CYS H H 373 9.322 9.322 9.064 0.258 18990 12035 1 17 . 1 1 374 374 GLN N N 374 125.890 125.890 124.399 1.491 18990 12036 1 17 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.405 -0.405 18990 12037 1 17 . 1 1 374 374 GLN C C 374 176.827 176.827 176.530 0.297 18990 12038 1 17 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.095 1.205 18990 12039 1 17 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.615 1.049 18990 12040 1 17 . 1 1 374 374 GLN H H 374 7.856 7.856 8.433 -0.577 18990 12041 1 17 . 1 1 375 375 ASN N N 375 115.342 115.342 115.864 -0.522 18990 12042 1 17 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.871 0.016 18990 12043 1 17 . 1 1 375 375 ASN C C 375 174.049 174.049 175.527 -1.478 18990 12044 1 17 . 1 1 375 375 ASN CA C 375 53.047 53.047 53.496 -0.449 18990 12045 1 17 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.044 -0.127 18990 12046 1 17 . 1 1 375 375 ASN H H 375 8.913 8.913 8.301 0.612 18990 12047 1 17 . 1 1 376 376 GLY N N 376 109.098 109.098 108.147 0.951 18990 12048 1 17 . 1 1 376 376 GLY C C 376 174.110 174.110 174.059 0.051 18990 12049 1 17 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.651 0.735 18990 12050 1 17 . 1 1 376 376 GLY H H 376 7.162 7.162 8.310 -1.148 18990 12051 1 17 . 1 1 377 377 CYS N N 377 132.546 132.546 118.365 14.181 18990 12052 1 17 . 1 1 377 377 CYS HA H 377 4.764 4.764 5.032 -0.268 18990 12053 1 17 . 1 1 377 377 CYS C C 377 177.355 177.355 174.212 3.143 18990 12054 1 17 . 1 1 377 377 CYS CA C 377 59.988 59.988 57.444 2.544 18990 12055 1 17 . 1 1 377 377 CYS CB C 377 32.365 32.365 29.672 2.693 18990 12056 1 17 . 1 1 377 377 CYS H H 377 9.800 9.800 8.077 1.723 18990 12057 1 17 . 1 1 378 378 GLY N N 378 113.851 113.851 109.584 4.267 18990 12058 1 17 . 1 1 378 378 GLY C C 378 173.404 173.404 172.634 0.770 18990 12059 1 17 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.640 0.223 18990 12060 1 17 . 1 1 378 378 GLY H H 378 8.820 8.820 8.176 0.644 18990 12061 1 17 . 1 1 379 379 TYR N N 379 125.532 125.532 124.522 1.010 18990 12062 1 17 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.707 -0.229 18990 12063 1 17 . 1 1 379 379 TYR C C 379 173.661 173.661 173.901 -0.240 18990 12064 1 17 . 1 1 379 379 TYR CA C 379 59.180 59.180 57.725 1.455 18990 12065 1 17 . 1 1 379 379 TYR CB C 379 40.108 40.108 41.813 -1.705 18990 12066 1 17 . 1 1 379 379 TYR H H 379 9.054 9.054 8.306 0.748 18990 12067 1 17 . 1 1 380 380 VAL N N 380 124.461 124.461 127.443 -2.982 18990 12068 1 17 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.581 0.237 18990 12069 1 17 . 1 1 380 380 VAL C C 380 175.876 175.876 175.056 0.820 18990 12070 1 17 . 1 1 380 380 VAL CA C 380 60.797 60.797 62.231 -1.434 18990 12071 1 17 . 1 1 380 380 VAL CB C 380 32.610 32.610 31.595 1.015 18990 12072 1 17 . 1 1 380 380 VAL H H 380 7.238 7.238 8.140 -0.902 18990 12073 1 17 . 1 1 381 381 PHE N N 381 124.588 124.588 125.040 -0.452 18990 12074 1 17 . 1 1 381 381 PHE HA H 381 5.273 5.273 5.313 -0.040 18990 12075 1 17 . 1 1 381 381 PHE C C 381 173.242 173.242 174.575 -1.333 18990 12076 1 17 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.204 0.006 18990 12077 1 17 . 1 1 381 381 PHE CB C 381 42.090 42.090 41.303 0.787 18990 12078 1 17 . 1 1 381 381 PHE H H 381 9.424 9.424 7.794 1.630 18990 12079 1 17 . 1 1 382 382 CYS N N 382 120.221 120.221 120.454 -0.233 18990 12080 1 17 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.556 0.346 18990 12081 1 17 . 1 1 382 382 CYS C C 382 177.165 177.165 175.831 1.334 18990 12082 1 17 . 1 1 382 382 CYS CA C 382 57.691 57.691 58.319 -0.628 18990 12083 1 17 . 1 1 382 382 CYS CB C 382 32.475 32.475 29.548 2.927 18990 12084 1 17 . 1 1 382 382 CYS H H 382 8.673 8.673 8.789 -0.116 18990 12085 1 17 . 1 1 383 383 ARG N N 383 129.347 129.347 119.666 9.681 18990 12086 1 17 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.388 -0.367 18990 12087 1 17 . 1 1 383 383 ARG C C 383 175.012 175.012 176.737 -1.725 18990 12088 1 17 . 1 1 383 383 ARG CA C 383 58.686 58.686 57.997 0.689 18990 12089 1 17 . 1 1 383 383 ARG CB C 383 30.900 30.900 30.515 0.385 18990 12090 1 17 . 1 1 383 383 ARG H H 383 9.534 9.534 8.619 0.915 18990 12091 1 17 . 1 1 384 384 ASN N N 384 117.772 117.772 116.754 1.018 18990 12092 1 17 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.830 -0.122 18990 12093 1 17 . 1 1 384 384 ASN C C 384 175.656 175.656 175.097 0.559 18990 12094 1 17 . 1 1 384 384 ASN CA C 384 55.778 55.778 54.215 1.563 18990 12095 1 17 . 1 1 384 384 ASN CB C 384 39.475 39.475 40.749 -1.274 18990 12096 1 17 . 1 1 384 384 ASN H H 384 8.840 8.840 7.868 0.972 18990 12097 1 17 . 1 1 385 385 CYS N N 385 115.876 115.876 114.364 1.512 18990 12098 1 17 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.806 0.222 18990 12099 1 17 . 1 1 385 385 CYS C C 385 175.703 175.703 173.976 1.727 18990 12100 1 17 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.438 1.675 18990 12101 1 17 . 1 1 385 385 CYS CB C 385 32.359 32.359 29.901 2.458 18990 12102 1 17 . 1 1 385 385 CYS H H 385 7.868 7.868 8.086 -0.218 18990 12103 1 17 . 1 1 386 386 LEU N N 386 120.082 120.082 119.378 0.704 18990 12104 1 17 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.700 -0.387 18990 12105 1 17 . 1 1 386 386 LEU C C 386 175.722 175.722 176.876 -1.154 18990 12106 1 17 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.078 2.931 18990 12107 1 17 . 1 1 386 386 LEU CB C 386 38.412 38.412 40.848 -2.436 18990 12108 1 17 . 1 1 386 386 LEU H H 386 8.514 8.514 8.405 0.109 18990 12109 1 17 . 1 1 387 387 GLN N N 387 117.579 117.579 119.598 -2.019 18990 12110 1 17 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.429 0.347 18990 12111 1 17 . 1 1 387 387 GLN C C 387 175.299 175.299 176.873 -1.574 18990 12112 1 17 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.677 -1.660 18990 12113 1 17 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.740 1.567 18990 12114 1 17 . 1 1 387 387 GLN H H 387 8.248 8.248 7.967 0.281 18990 12115 1 17 . 1 1 388 388 GLY N N 388 106.107 106.107 108.030 -1.923 18990 12116 1 17 . 1 1 388 388 GLY C C 388 173.693 173.693 173.936 -0.243 18990 12117 1 17 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.378 0.802 18990 12118 1 17 . 1 1 388 388 GLY H H 388 8.695 8.695 8.423 0.272 18990 12119 1 17 . 1 1 389 389 TYR N N 389 122.514 122.514 117.335 5.179 18990 12120 1 17 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.108 -0.450 18990 12121 1 17 . 1 1 389 389 TYR C C 389 172.860 172.860 173.849 -0.989 18990 12122 1 17 . 1 1 389 389 TYR CA C 389 62.987 62.987 59.269 3.718 18990 12123 1 17 . 1 1 389 389 TYR CB C 389 38.052 38.052 38.477 -0.425 18990 12124 1 17 . 1 1 389 389 TYR H H 389 7.923 7.923 8.190 -0.267 18990 12125 1 17 . 1 1 390 390 HIS N N 390 120.080 120.080 123.634 -3.554 18990 12126 1 17 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.698 0.010 18990 12127 1 17 . 1 1 390 390 HIS C C 390 173.235 173.235 172.884 0.351 18990 12128 1 17 . 1 1 390 390 HIS CA C 390 51.431 51.431 54.288 -2.857 18990 12129 1 17 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.094 0.806 18990 12130 1 17 . 1 1 390 390 HIS H H 390 5.291 5.291 7.474 -2.183 18990 12131 1 17 . 1 1 391 391 ILE N N 391 117.810 117.810 121.076 -3.266 18990 12132 1 17 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.115 0.001 18990 12133 1 17 . 1 1 391 391 ILE C C 391 178.208 178.208 175.985 2.223 18990 12134 1 17 . 1 1 391 391 ILE CA C 391 60.877 60.877 60.891 -0.014 18990 12135 1 17 . 1 1 391 391 ILE CB C 391 39.034 39.034 38.499 0.535 18990 12136 1 17 . 1 1 391 391 ILE H H 391 8.418 8.418 8.402 0.016 18990 12137 1 17 . 1 1 392 392 GLY N N 392 112.387 112.387 114.498 -2.111 18990 12138 1 17 . 1 1 392 392 GLY C C 392 173.565 173.565 173.070 0.495 18990 12139 1 17 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.413 0.845 18990 12140 1 17 . 1 1 392 392 GLY H H 392 8.654 8.654 8.269 0.385 18990 12141 1 17 . 1 1 393 393 GLU N N 393 119.098 119.098 119.022 0.076 18990 12142 1 17 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.530 -0.241 18990 12143 1 17 . 1 1 393 393 GLU C C 393 176.899 176.899 174.917 1.982 18990 12144 1 17 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.172 1.261 18990 12145 1 17 . 1 1 393 393 GLU CB C 393 30.470 30.470 31.665 -1.195 18990 12146 1 17 . 1 1 393 393 GLU H H 393 8.391 8.391 8.238 0.153 18990 12147 1 17 . 1 1 394 394 CYS N N 394 122.845 122.845 118.838 4.007 18990 12148 1 17 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.826 -1.060 18990 12149 1 17 . 1 1 394 394 CYS C C 394 175.461 175.461 174.236 1.225 18990 12150 1 17 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.390 1.445 18990 12151 1 17 . 1 1 394 394 CYS CB C 394 30.761 30.761 27.813 2.948 18990 12152 1 17 . 1 1 394 394 CYS H H 394 8.474 8.474 8.511 -0.037 18990 12153 1 17 . 1 1 395 395 LEU N N 395 124.403 124.403 120.552 3.851 18990 12154 1 17 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.912 -0.408 18990 12155 1 17 . 1 1 395 395 LEU C C 395 175.259 175.259 174.363 0.896 18990 12156 1 17 . 1 1 395 395 LEU CA C 395 52.835 52.835 52.530 0.305 18990 12157 1 17 . 1 1 395 395 LEU CB C 395 41.436 41.436 41.615 -0.179 18990 12158 1 17 . 1 1 395 395 LEU H H 395 8.418 8.418 7.975 0.443 18990 12159 1 17 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.747 -0.377 18990 12160 1 17 . 1 1 396 396 PRO C C 396 177.006 177.006 175.509 1.497 18990 12161 1 17 . 1 1 396 396 PRO CA C 396 63.096 63.096 63.257 -0.161 18990 12162 1 17 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.360 -0.288 18990 12163 1 17 . 1 1 397 397 GLU N N 397 121.574 121.574 119.769 1.805 18990 12164 1 17 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.437 -0.212 18990 12165 1 17 . 1 1 397 397 GLU C C 397 177.202 177.202 175.069 2.133 18990 12166 1 17 . 1 1 397 397 GLU CA C 397 57.034 57.034 55.926 1.108 18990 12167 1 17 . 1 1 397 397 GLU CB C 397 30.263 30.263 31.765 -1.502 18990 12168 1 17 . 1 1 397 397 GLU H H 397 8.568 8.568 8.400 0.168 18990 12169 1 17 . 1 1 398 398 GLY N N 398 110.495 110.495 112.423 -1.928 18990 12170 1 17 . 1 1 398 398 GLY C C 398 174.579 174.579 172.927 1.652 18990 12171 1 17 . 1 1 398 398 GLY CA C 398 45.462 45.462 45.941 -0.479 18990 12172 1 17 . 1 1 398 398 GLY H H 398 8.515 8.515 8.553 -0.038 18990 12173 1 17 . 1 1 399 399 THR N N 399 113.234 113.234 115.785 -2.551 18990 12174 1 17 . 1 1 399 399 THR HA H 399 4.398 4.398 4.415 -0.018 18990 12175 1 17 . 1 1 399 399 THR C C 399 175.333 175.333 174.495 0.838 18990 12176 1 17 . 1 1 399 399 THR CA C 399 62.233 62.233 62.591 -0.358 18990 12177 1 17 . 1 1 399 399 THR CB C 399 69.833 69.833 69.876 -0.043 18990 12178 1 17 . 1 1 399 399 THR H H 399 8.090 8.090 8.429 -0.339 18990 12179 1 17 . 1 1 400 400 GLY N N 400 111.479 111.479 114.671 -3.192 18990 12180 1 17 . 1 1 400 400 GLY C C 400 174.048 174.048 173.068 0.980 18990 12181 1 17 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.255 0.184 18990 12182 1 17 . 1 1 400 400 GLY H H 400 8.524 8.524 8.644 -0.120 18990 12183 1 17 . 1 1 401 401 ALA N N 401 123.919 123.919 126.092 -2.173 18990 12184 1 17 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.651 -0.400 18990 12185 1 17 . 1 1 401 401 ALA C C 401 177.942 177.942 176.200 1.742 18990 12186 1 17 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.546 1.184 18990 12187 1 17 . 1 1 401 401 ALA CB C 401 19.142 19.142 20.142 -1.000 18990 12188 1 17 . 1 1 401 401 ALA H H 401 8.179 8.179 8.245 -0.066 18990 12189 1 17 . 1 1 402 402 SER N N 402 114.904 114.904 114.621 0.283 18990 12190 1 17 . 1 1 402 402 SER HA H 402 4.448 4.448 4.239 0.209 18990 12191 1 17 . 1 1 402 402 SER C C 402 174.426 174.426 173.134 1.292 18990 12192 1 17 . 1 1 402 402 SER CA C 402 58.289 58.289 58.407 -0.118 18990 12193 1 17 . 1 1 402 402 SER CB C 402 63.772 63.772 63.308 0.464 18990 12194 1 17 . 1 1 402 402 SER H H 402 8.305 8.305 8.412 -0.107 18990 12195 1 17 . 1 1 403 403 ALA N N 403 125.965 125.965 127.284 -1.319 18990 12196 1 17 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.549 -0.150 18990 12197 1 17 . 1 1 403 403 ALA C C 403 177.984 177.984 176.135 1.849 18990 12198 1 17 . 1 1 403 403 ALA CA C 403 52.655 52.655 52.343 0.312 18990 12199 1 17 . 1 1 403 403 ALA CB C 403 19.138 19.138 20.292 -1.154 18990 12200 1 17 . 1 1 403 403 ALA H H 403 8.345 8.345 8.174 0.171 18990 12201 1 17 . 1 1 404 404 THR N N 404 112.790 112.790 115.728 -2.938 18990 12202 1 17 . 1 1 404 404 THR C C 404 174.420 174.420 173.317 1.103 18990 12203 1 17 . 1 1 404 404 THR CA C 404 61.988 61.988 61.946 0.042 18990 12204 1 17 . 1 1 404 404 THR CB C 404 69.688 69.688 69.769 -0.081 18990 12205 1 17 . 1 1 404 404 THR H H 404 8.118 8.118 8.004 0.114 18990 12206 1 17 . 1 1 405 405 ASN N N 405 121.050 121.050 121.641 -0.591 18990 12207 1 17 . 1 1 405 405 ASN H H 405 8.396 8.396 8.453 -0.057 18990 12208 1 17 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.572 0.006 18990 12209 1 17 . 1 1 407 407 CYS C C 407 174.489 174.489 173.325 1.164 18990 12210 1 17 . 1 1 407 407 CYS CA C 407 58.713 58.713 59.635 -0.922 18990 12211 1 17 . 1 1 407 407 CYS CB C 407 28.102 28.102 28.878 -0.776 18990 12212 1 17 . 1 1 408 408 GLU N N 408 123.021 123.021 125.758 -2.737 18990 12213 1 17 . 1 1 408 408 GLU C C 408 175.954 175.954 174.440 1.514 18990 12214 1 17 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.286 0.516 18990 12215 1 17 . 1 1 408 408 GLU CB C 408 30.328 30.328 31.573 -1.245 18990 12216 1 17 . 1 1 408 408 GLU H H 408 8.415 8.415 8.410 0.005 18990 12217 1 17 . 1 1 409 409 TYR N N 409 121.015 121.015 122.424 -1.409 18990 12218 1 17 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.961 -0.307 18990 12219 1 17 . 1 1 409 409 TYR C C 409 175.613 175.613 174.611 1.002 18990 12220 1 17 . 1 1 409 409 TYR CA C 409 57.669 57.669 58.194 -0.526 18990 12221 1 17 . 1 1 409 409 TYR CB C 409 38.825 38.825 39.746 -0.921 18990 12222 1 17 . 1 1 409 409 TYR H H 409 8.135 8.135 8.705 -0.570 18990 12223 1 17 . 1 1 410 410 THR N N 410 116.975 116.975 121.307 -4.332 18990 12224 1 17 . 1 1 410 410 THR HA H 410 4.306 4.306 4.463 -0.157 18990 12225 1 17 . 1 1 410 410 THR C C 410 173.846 173.846 172.439 1.407 18990 12226 1 17 . 1 1 410 410 THR CA C 410 61.730 61.730 61.292 0.438 18990 12227 1 17 . 1 1 410 410 THR CB C 410 69.914 69.914 70.081 -0.167 18990 12228 1 17 . 1 1 410 410 THR H H 410 8.060 8.060 7.693 0.367 18990 12229 1 17 . 1 1 411 411 VAL N N 411 122.900 122.900 120.191 2.709 18990 12230 1 17 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.546 -0.493 18990 12231 1 17 . 1 1 411 411 VAL C C 411 175.275 175.275 174.157 1.118 18990 12232 1 17 . 1 1 411 411 VAL CA C 411 61.853 61.853 61.157 0.695 18990 12233 1 17 . 1 1 411 411 VAL CB C 411 32.976 32.976 35.325 -2.349 18990 12234 1 17 . 1 1 411 411 VAL H H 411 8.089 8.089 8.541 -0.452 18990 12235 1 17 . 1 1 412 412 ASP N N 412 125.924 125.924 124.782 1.142 18990 12236 1 17 . 1 1 412 412 ASP HA H 412 4.850 4.850 5.088 -0.238 18990 12237 1 17 . 1 1 412 412 ASP CA C 412 51.578 51.578 53.352 -1.774 18990 12238 1 17 . 1 1 412 412 ASP CB C 412 41.538 41.538 43.091 -1.553 18990 12239 1 17 . 1 1 412 412 ASP H H 412 8.397 8.397 8.852 -0.455 18990 12240 1 17 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.765 -0.379 18990 12241 1 17 . 1 1 413 413 PRO C C 413 177.352 177.352 175.542 1.810 18990 12242 1 17 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.586 1.324 18990 12243 1 17 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.902 -0.634 18990 12244 1 17 . 1 1 414 414 ASN N N 414 117.035 117.035 115.357 1.678 18990 12245 1 17 . 1 1 414 414 ASN HA H 414 4.677 4.677 5.173 -0.496 18990 12246 1 17 . 1 1 414 414 ASN C C 414 175.532 175.532 174.069 1.463 18990 12247 1 17 . 1 1 414 414 ASN CA C 414 53.824 53.824 52.068 1.756 18990 12248 1 17 . 1 1 414 414 ASN CB C 414 38.728 38.728 40.790 -2.062 18990 12249 1 17 . 1 1 414 414 ASN H H 414 8.496 8.496 8.500 -0.004 18990 12250 1 17 . 1 1 415 415 ARG N N 415 121.000 121.000 120.379 0.621 18990 12251 1 17 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.695 -0.451 18990 12252 1 17 . 1 1 415 415 ARG C C 415 176.243 176.243 174.807 1.436 18990 12253 1 17 . 1 1 415 415 ARG CA C 415 56.404 56.404 55.138 1.266 18990 12254 1 17 . 1 1 415 415 ARG CB C 415 30.637 30.637 32.647 -2.010 18990 12255 1 17 . 1 1 415 415 ARG H H 415 7.804 7.804 8.604 -0.800 18990 12256 1 17 . 1 1 416 416 ALA N N 416 124.880 124.880 124.136 0.744 18990 12257 1 17 . 1 1 416 416 ALA C C 416 177.831 177.831 176.142 1.689 18990 12258 1 17 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.994 0.963 18990 12259 1 17 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.139 -1.080 18990 12260 1 17 . 1 1 416 416 ALA H H 416 8.189 8.189 8.576 -0.387 18990 12261 1 17 . 1 1 417 417 ALA N N 417 122.614 122.614 125.727 -3.113 18990 12262 1 17 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.609 -0.362 18990 12263 1 17 . 1 1 417 417 ALA C C 417 178.024 178.024 175.505 2.519 18990 12264 1 17 . 1 1 417 417 ALA CA C 417 52.789 52.789 52.106 0.683 18990 12265 1 17 . 1 1 417 417 ALA CB C 417 19.042 19.042 20.227 -1.185 18990 12266 1 17 . 1 1 417 417 ALA H H 417 8.169 8.169 8.652 -0.483 18990 12267 1 17 . 1 1 418 418 GLU N N 418 119.500 119.500 120.613 -1.113 18990 12268 1 17 . 1 1 418 418 GLU HA H 418 4.189 4.189 5.159 -0.970 18990 12269 1 17 . 1 1 418 418 GLU C C 418 176.266 176.266 175.301 0.965 18990 12270 1 17 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.188 1.388 18990 12271 1 17 . 1 1 418 418 GLU CB C 418 30.307 30.307 32.217 -1.909 18990 12272 1 17 . 1 1 418 418 GLU H H 418 8.184 8.184 9.218 -1.034 18990 12273 1 17 . 1 1 419 419 ALA N N 419 124.643 124.643 124.997 -0.354 18990 12274 1 17 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.562 -0.312 18990 12275 1 17 . 1 1 419 419 ALA C C 419 177.488 177.488 176.191 1.297 18990 12276 1 17 . 1 1 419 419 ALA CA C 419 52.509 52.509 52.444 0.065 18990 12277 1 17 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.083 -0.922 18990 12278 1 17 . 1 1 419 419 ALA H H 419 8.135 8.135 8.594 -0.459 18990 12279 1 17 . 1 1 420 420 ARG N N 420 120.003 120.003 125.766 -5.763 18990 12280 1 17 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.463 -0.170 18990 12281 1 17 . 1 1 420 420 ARG C C 420 176.297 176.297 176.227 0.070 18990 12282 1 17 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.982 -0.049 18990 12283 1 17 . 1 1 420 420 ARG CB C 420 30.850 30.850 30.691 0.159 18990 12284 1 17 . 1 1 420 420 ARG H H 420 8.135 8.135 8.468 -0.333 18990 12285 1 17 . 1 1 421 421 TRP N N 421 122.280 122.280 125.695 -3.415 18990 12286 1 17 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.906 -0.243 18990 12287 1 17 . 1 1 421 421 TRP C C 421 175.856 175.856 174.883 0.973 18990 12288 1 17 . 1 1 421 421 TRP CA C 421 57.404 57.404 55.537 1.867 18990 12289 1 17 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.092 -0.655 18990 12290 1 17 . 1 1 421 421 TRP H H 421 8.159 8.159 8.229 -0.070 18990 12291 1 17 . 1 1 422 422 ASP N N 422 121.980 121.980 122.584 -0.604 18990 12292 1 17 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.490 0.005 18990 12293 1 17 . 1 1 422 422 ASP C C 422 176.184 176.184 176.164 0.020 18990 12294 1 17 . 1 1 422 422 ASP CA C 422 53.899 53.899 54.154 -0.255 18990 12295 1 17 . 1 1 422 422 ASP CB C 422 40.948 40.948 43.313 -2.365 18990 12296 1 17 . 1 1 422 422 ASP H H 422 8.135 8.135 8.425 -0.290 18990 12297 1 17 . 1 1 423 423 GLU N N 423 121.990 121.990 122.815 -0.825 18990 12298 1 17 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.457 -0.367 18990 12299 1 17 . 1 1 423 423 GLU C C 423 176.720 176.720 175.728 0.992 18990 12300 1 17 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.026 1.143 18990 12301 1 17 . 1 1 423 423 GLU CB C 423 30.156 30.156 28.870 1.286 18990 12302 1 17 . 1 1 423 423 GLU H H 423 8.153 8.153 8.690 -0.537 18990 12303 1 17 . 1 1 424 424 ALA N N 424 123.900 123.900 126.168 -2.268 18990 12304 1 17 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.355 -0.075 18990 12305 1 17 . 1 1 424 424 ALA C C 424 178.095 178.095 176.496 1.599 18990 12306 1 17 . 1 1 424 424 ALA CA C 424 53.017 53.017 52.265 0.752 18990 12307 1 17 . 1 1 424 424 ALA CB C 424 19.086 19.086 17.856 1.230 18990 12308 1 17 . 1 1 424 424 ALA H H 424 8.243 8.243 8.167 0.076 18990 12309 1 17 . 1 1 425 425 SER N N 425 113.881 113.881 117.056 -3.175 18990 12310 1 17 . 1 1 425 425 SER HA H 425 4.387 4.387 4.394 -0.007 18990 12311 1 17 . 1 1 425 425 SER C C 425 174.338 174.338 173.170 1.168 18990 12312 1 17 . 1 1 425 425 SER CA C 425 58.546 58.546 58.433 0.113 18990 12313 1 17 . 1 1 425 425 SER CB C 425 63.784 63.784 63.700 0.084 18990 12314 1 17 . 1 1 425 425 SER H H 425 8.063 8.063 7.964 0.099 18990 12315 1 17 . 1 1 426 426 ASN N N 426 121.032 121.032 124.271 -3.239 18990 12316 1 17 . 1 1 426 426 ASN HA H 426 4.706 4.706 5.000 -0.294 18990 12317 1 17 . 1 1 426 426 ASN C C 426 175.046 175.046 174.366 0.680 18990 12318 1 17 . 1 1 426 426 ASN CA C 426 53.445 53.445 53.476 -0.031 18990 12319 1 17 . 1 1 426 426 ASN CB C 426 38.847 38.847 39.532 -0.685 18990 12320 1 17 . 1 1 426 426 ASN H H 426 8.391 8.391 8.470 -0.079 18990 12321 1 17 . 1 1 427 427 VAL N N 427 119.463 119.463 122.772 -3.309 18990 12322 1 17 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.332 -0.139 18990 12323 1 17 . 1 1 427 427 VAL C C 427 176.213 176.213 175.953 0.260 18990 12324 1 17 . 1 1 427 427 VAL CA C 427 62.449 62.449 61.993 0.456 18990 12325 1 17 . 1 1 427 427 VAL CB C 427 32.865 32.865 32.832 0.033 18990 12326 1 17 . 1 1 427 427 VAL H H 427 7.954 7.954 8.300 -0.346 18990 12327 1 17 . 1 1 428 428 THR N N 428 118.226 118.226 121.512 -3.286 18990 12328 1 17 . 1 1 428 428 THR HA H 428 4.353 4.353 4.583 -0.230 18990 12329 1 17 . 1 1 428 428 THR C C 428 174.361 174.361 174.385 -0.024 18990 12330 1 17 . 1 1 428 428 THR CA C 428 62.065 62.065 61.149 0.916 18990 12331 1 17 . 1 1 428 428 THR CB C 428 69.729 69.729 69.719 0.010 18990 12332 1 17 . 1 1 428 428 THR H H 428 8.225 8.225 8.173 0.052 18990 12333 1 17 . 1 1 429 429 ILE N N 429 123.910 123.910 120.220 3.690 18990 12334 1 17 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.532 -0.344 18990 12335 1 17 . 1 1 429 429 ILE C C 429 175.774 175.774 174.694 1.080 18990 12336 1 17 . 1 1 429 429 ILE CA C 429 60.819 60.819 60.020 0.799 18990 12337 1 17 . 1 1 429 429 ILE CB C 429 38.719 38.719 39.290 -0.571 18990 12338 1 17 . 1 1 429 429 ILE H H 429 8.148 8.148 8.080 0.068 18990 12339 1 17 . 1 1 430 430 LYS N N 430 126.453 126.453 121.096 5.357 18990 12340 1 17 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.441 -0.007 18990 12341 1 17 . 1 1 430 430 LYS C C 430 176.241 176.241 176.664 -0.423 18990 12342 1 17 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.637 0.300 18990 12343 1 17 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.299 -0.135 18990 12344 1 17 . 1 1 430 430 LYS H H 430 8.406 8.406 8.278 0.128 18990 12345 1 17 . 1 1 431 431 VAL N N 431 122.496 122.496 124.358 -1.862 18990 12346 1 17 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.104 0.176 18990 12347 1 17 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.756 -0.453 18990 12348 1 17 . 1 1 431 431 VAL CB C 431 33.132 33.132 30.567 2.565 18990 12349 1 17 . 1 1 431 431 VAL H H 431 8.312 8.312 8.540 -0.228 18990 12350 1 17 . 1 1 432 432 SER HA H 432 4.486 4.486 4.669 -0.183 18990 12351 1 17 . 1 1 432 432 SER C C 432 173.834 173.834 174.600 -0.766 18990 12352 1 17 . 1 1 432 432 SER CA C 432 58.650 58.650 58.025 0.625 18990 12353 1 17 . 1 1 432 432 SER CB C 432 64.152 64.152 64.209 -0.057 18990 12354 1 17 . 1 1 433 433 THR N N 433 114.706 114.706 113.382 1.324 18990 12355 1 17 . 1 1 433 433 THR HA H 433 5.446 5.446 4.750 0.696 18990 12356 1 17 . 1 1 433 433 THR C C 433 173.979 173.979 174.411 -0.432 18990 12357 1 17 . 1 1 433 433 THR CA C 433 60.412 60.412 60.722 -0.310 18990 12358 1 17 . 1 1 433 433 THR CB C 433 71.896 71.896 70.384 1.512 18990 12359 1 17 . 1 1 433 433 THR H H 433 7.833 7.833 7.412 0.421 18990 12360 1 17 . 1 1 434 434 LYS N N 434 122.492 122.492 124.376 -1.884 18990 12361 1 17 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.861 -0.152 18990 12362 1 17 . 1 1 434 434 LYS C C 434 173.589 173.589 174.837 -1.248 18990 12363 1 17 . 1 1 434 434 LYS CA C 434 54.375 54.375 53.202 1.173 18990 12364 1 17 . 1 1 434 434 LYS CB C 434 36.925 36.925 32.886 4.039 18990 12365 1 17 . 1 1 434 434 LYS H H 434 8.937 8.937 9.050 -0.113 18990 12366 1 17 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.612 -0.345 18990 12367 1 17 . 1 1 435 435 PRO C C 435 175.238 175.238 176.455 -1.217 18990 12368 1 17 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.201 -1.278 18990 12369 1 17 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.899 -0.813 18990 12370 1 17 . 1 1 436 436 CYS N N 436 125.422 125.422 124.504 0.918 18990 12371 1 17 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.226 -0.796 18990 12372 1 17 . 1 1 436 436 CYS C C 436 176.770 176.770 174.951 1.819 18990 12373 1 17 . 1 1 436 436 CYS CA C 436 57.016 57.016 57.136 -0.120 18990 12374 1 17 . 1 1 436 436 CYS CB C 436 31.698 31.698 27.709 3.989 18990 12375 1 17 . 1 1 436 436 CYS H H 436 7.768 7.768 8.379 -0.611 18990 12376 1 17 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.180 -0.322 18990 12377 1 17 . 1 1 437 437 PRO C C 437 173.608 173.608 176.433 -2.825 18990 12378 1 17 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.060 0.153 18990 12379 1 17 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.318 1.131 18990 12380 1 17 . 1 1 438 438 LYS N N 438 118.600 118.600 117.851 0.749 18990 12381 1 17 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.208 -0.238 18990 12382 1 17 . 1 1 438 438 LYS C C 438 176.887 176.887 176.184 0.703 18990 12383 1 17 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.514 0.173 18990 12384 1 17 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.608 -0.485 18990 12385 1 17 . 1 1 438 438 LYS H H 438 8.390 8.390 7.717 0.673 18990 12386 1 17 . 1 1 439 439 CYS N N 439 118.950 118.950 115.947 3.003 18990 12387 1 17 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.811 -0.065 18990 12388 1 17 . 1 1 439 439 CYS C C 439 176.650 176.650 174.658 1.992 18990 12389 1 17 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.136 2.212 18990 12390 1 17 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.476 2.720 18990 12391 1 17 . 1 1 439 439 CYS H H 439 8.357 8.357 7.646 0.711 18990 12392 1 17 . 1 1 440 440 ARG N N 440 117.200 117.200 116.732 0.468 18990 12393 1 17 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.130 -0.162 18990 12394 1 17 . 1 1 440 440 ARG C C 440 175.253 175.253 175.853 -0.600 18990 12395 1 17 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.721 0.179 18990 12396 1 17 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.374 -1.333 18990 12397 1 17 . 1 1 440 440 ARG H H 440 8.065 8.065 8.142 -0.077 18990 12398 1 17 . 1 1 441 441 THR N N 441 122.400 122.400 110.947 11.453 18990 12399 1 17 . 1 1 441 441 THR HA H 441 4.371 4.371 4.562 -0.191 18990 12400 1 17 . 1 1 441 441 THR C C 441 173.702 173.702 173.368 0.334 18990 12401 1 17 . 1 1 441 441 THR CA C 441 63.194 63.194 59.307 3.887 18990 12402 1 17 . 1 1 441 441 THR CB C 441 68.933 68.933 69.700 -0.767 18990 12403 1 17 . 1 1 441 441 THR H H 441 8.643 8.643 7.527 1.116 18990 12404 1 17 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.640 -0.493 18990 12405 1 17 . 1 1 442 442 PRO C C 442 176.215 176.215 176.131 0.084 18990 12406 1 17 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.757 1.440 18990 12407 1 17 . 1 1 442 442 PRO CB C 442 32.044 32.044 31.281 0.763 18990 12408 1 17 . 1 1 443 443 THR N N 443 122.932 122.932 122.121 0.811 18990 12409 1 17 . 1 1 443 443 THR HA H 443 4.665 4.665 4.667 -0.002 18990 12410 1 17 . 1 1 443 443 THR C C 443 172.133 172.133 174.093 -1.960 18990 12411 1 17 . 1 1 443 443 THR CA C 443 62.566 62.566 61.573 0.993 18990 12412 1 17 . 1 1 443 443 THR CB C 443 71.562 71.562 71.042 0.520 18990 12413 1 17 . 1 1 443 443 THR H H 443 9.116 9.116 9.017 0.099 18990 12414 1 17 . 1 1 444 444 GLU N N 444 126.390 126.390 127.499 -1.109 18990 12415 1 17 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.318 0.624 18990 12416 1 17 . 1 1 444 444 GLU C C 444 175.292 175.292 176.692 -1.400 18990 12417 1 17 . 1 1 444 444 GLU CA C 444 55.049 55.049 57.506 -2.457 18990 12418 1 17 . 1 1 444 444 GLU CB C 444 31.861 31.861 30.557 1.304 18990 12419 1 17 . 1 1 444 444 GLU H H 444 8.720 8.720 8.967 -0.247 18990 12420 1 17 . 1 1 445 445 ARG N N 445 123.505 123.505 122.979 0.526 18990 12421 1 17 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.807 -1.096 18990 12422 1 17 . 1 1 445 445 ARG C C 445 175.289 175.289 175.786 -0.497 18990 12423 1 17 . 1 1 445 445 ARG CA C 445 55.856 55.856 55.107 0.749 18990 12424 1 17 . 1 1 445 445 ARG CB C 445 30.675 30.675 31.864 -1.189 18990 12425 1 17 . 1 1 445 445 ARG H H 445 8.157 8.157 8.424 -0.267 18990 12426 1 17 . 1 1 446 446 ASP N N 446 126.800 126.800 120.520 6.280 18990 12427 1 17 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.775 -0.134 18990 12428 1 17 . 1 1 446 446 ASP C C 446 176.020 176.020 176.897 -0.877 18990 12429 1 17 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.400 -0.448 18990 12430 1 17 . 1 1 446 446 ASP CB C 446 41.400 41.400 42.234 -0.834 18990 12431 1 17 . 1 1 446 446 ASP H H 446 8.476 8.476 8.597 -0.121 18990 12432 1 17 . 1 1 447 447 GLY N N 447 111.262 111.262 108.366 2.896 18990 12433 1 17 . 1 1 447 447 GLY C C 447 174.073 174.073 174.895 -0.822 18990 12434 1 17 . 1 1 447 447 GLY CA C 447 45.832 45.832 46.349 -0.517 18990 12435 1 17 . 1 1 447 447 GLY H H 447 8.056 8.056 8.406 -0.350 18990 12436 1 17 . 1 1 448 448 GLY N N 448 108.655 108.655 105.962 2.693 18990 12437 1 17 . 1 1 448 448 GLY C C 448 174.020 174.020 172.802 1.218 18990 12438 1 17 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.447 0.820 18990 12439 1 17 . 1 1 448 448 GLY H H 448 8.380 8.380 7.989 0.391 18990 12440 1 17 . 1 1 449 449 CYS N N 449 120.628 120.628 118.980 1.648 18990 12441 1 17 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.321 -0.324 18990 12442 1 17 . 1 1 449 449 CYS C C 449 174.855 174.855 173.866 0.989 18990 12443 1 17 . 1 1 449 449 CYS CA C 449 59.291 59.291 57.260 2.031 18990 12444 1 17 . 1 1 449 449 CYS CB C 449 28.000 28.000 29.688 -1.688 18990 12445 1 17 . 1 1 449 449 CYS H H 449 7.832 7.832 7.464 0.368 18990 12446 1 17 . 1 1 450 450 MET N N 450 123.947 123.947 122.683 1.264 18990 12447 1 17 . 1 1 450 450 MET HA H 450 4.551 4.551 3.845 0.706 18990 12448 1 17 . 1 1 450 450 MET C C 450 174.658 174.658 175.554 -0.896 18990 12449 1 17 . 1 1 450 450 MET CA C 450 54.970 54.970 54.803 0.167 18990 12450 1 17 . 1 1 450 450 MET CB C 450 34.100 34.100 32.050 2.050 18990 12451 1 17 . 1 1 450 450 MET H H 450 8.916 8.916 8.152 0.764 18990 12452 1 17 . 1 1 451 451 HIS N N 451 120.490 120.490 121.344 -0.854 18990 12453 1 17 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.698 -1.019 18990 12454 1 17 . 1 1 451 451 HIS C C 451 172.443 172.443 174.206 -1.763 18990 12455 1 17 . 1 1 451 451 HIS CA C 451 53.812 53.812 56.563 -2.751 18990 12456 1 17 . 1 1 451 451 HIS CB C 451 28.900 28.900 29.723 -0.823 18990 12457 1 17 . 1 1 451 451 HIS H H 451 7.557 7.557 7.282 0.275 18990 12458 1 17 . 1 1 452 452 MET N N 452 128.800 128.800 128.240 0.560 18990 12459 1 17 . 1 1 452 452 MET HA H 452 4.320 4.320 4.487 -0.167 18990 12460 1 17 . 1 1 452 452 MET C C 452 175.479 175.479 173.441 2.038 18990 12461 1 17 . 1 1 452 452 MET CA C 452 52.589 52.589 52.987 -0.398 18990 12462 1 17 . 1 1 452 452 MET CB C 452 28.074 28.074 32.149 -4.075 18990 12463 1 17 . 1 1 452 452 MET H H 452 9.087 9.087 7.959 1.128 18990 12464 1 17 . 1 1 453 453 VAL N N 453 122.200 122.200 117.124 5.076 18990 12465 1 17 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.486 0.308 18990 12466 1 17 . 1 1 453 453 VAL C C 453 175.476 175.476 174.623 0.853 18990 12467 1 17 . 1 1 453 453 VAL CA C 453 61.380 61.380 59.268 2.112 18990 12468 1 17 . 1 1 453 453 VAL CB C 453 33.089 33.089 34.449 -1.360 18990 12469 1 17 . 1 1 453 453 VAL H H 453 8.016 8.016 7.841 0.175 18990 12470 1 17 . 1 1 454 454 CYS N N 454 130.353 130.353 125.186 5.167 18990 12471 1 17 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.756 -0.161 18990 12472 1 17 . 1 1 454 454 CYS C C 454 177.833 177.833 175.141 2.692 18990 12473 1 17 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.765 2.806 18990 12474 1 17 . 1 1 454 454 CYS CB C 454 32.045 32.045 27.702 4.343 18990 12475 1 17 . 1 1 454 454 CYS H H 454 8.989 8.989 8.914 0.075 18990 12476 1 17 . 1 1 455 455 THR N N 455 119.000 119.000 124.037 -5.037 18990 12477 1 17 . 1 1 455 455 THR HA H 455 4.393 4.393 4.622 -0.229 18990 12478 1 17 . 1 1 455 455 THR C C 455 175.264 175.264 173.687 1.577 18990 12479 1 17 . 1 1 455 455 THR CA C 455 61.644 61.644 61.700 -0.056 18990 12480 1 17 . 1 1 455 455 THR CB C 455 69.400 69.400 68.094 1.306 18990 12481 1 17 . 1 1 455 455 THR H H 455 8.533 8.533 8.579 -0.046 18990 12482 1 17 . 1 1 456 456 ARG N N 456 128.900 128.900 128.061 0.839 18990 12483 1 17 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.569 -0.344 18990 12484 1 17 . 1 1 456 456 ARG C C 456 177.782 177.782 175.326 2.456 18990 12485 1 17 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.471 2.479 18990 12486 1 17 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.635 -3.585 18990 12487 1 17 . 1 1 456 456 ARG H H 456 9.036 9.036 8.003 1.033 18990 12488 1 17 . 1 1 457 457 ALA N N 457 133.152 133.152 128.309 4.843 18990 12489 1 17 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.272 -0.126 18990 12490 1 17 . 1 1 457 457 ALA C C 457 178.757 178.757 177.533 1.224 18990 12491 1 17 . 1 1 457 457 ALA CA C 457 53.929 53.929 52.957 0.972 18990 12492 1 17 . 1 1 457 457 ALA CB C 457 17.710 17.710 17.686 0.024 18990 12493 1 17 . 1 1 457 457 ALA H H 457 9.042 9.042 8.882 0.160 18990 12494 1 17 . 1 1 458 458 GLY N N 458 111.200 111.200 110.065 1.135 18990 12495 1 17 . 1 1 458 458 GLY C C 458 173.558 173.558 174.756 -1.198 18990 12496 1 17 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.946 0.490 18990 12497 1 17 . 1 1 458 458 GLY H H 458 8.830 8.830 8.449 0.381 18990 12498 1 17 . 1 1 459 459 CYS N N 459 123.040 123.040 120.894 2.146 18990 12499 1 17 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.868 -0.246 18990 12500 1 17 . 1 1 459 459 CYS C C 459 176.591 176.591 175.902 0.689 18990 12501 1 17 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.866 0.633 18990 12502 1 17 . 1 1 459 459 CYS CB C 459 30.174 30.174 28.626 1.548 18990 12503 1 17 . 1 1 459 459 CYS H H 459 8.042 8.042 8.166 -0.124 18990 12504 1 17 . 1 1 460 460 GLY N N 460 104.500 104.500 110.976 -6.476 18990 12505 1 17 . 1 1 460 460 GLY C C 460 173.716 173.716 173.765 -0.049 18990 12506 1 17 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.465 0.542 18990 12507 1 17 . 1 1 460 460 GLY H H 460 7.705 7.705 8.338 -0.633 18990 12508 1 17 . 1 1 461 461 PHE N N 461 124.949 124.949 120.579 4.370 18990 12509 1 17 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.657 -0.077 18990 12510 1 17 . 1 1 461 461 PHE C C 461 174.447 174.447 173.913 0.534 18990 12511 1 17 . 1 1 461 461 PHE CA C 461 59.946 59.946 56.674 3.272 18990 12512 1 17 . 1 1 461 461 PHE CB C 461 41.300 41.300 41.167 0.133 18990 12513 1 17 . 1 1 461 461 PHE H H 461 8.947 8.947 7.787 1.160 18990 12514 1 17 . 1 1 462 462 GLU N N 462 125.272 125.272 127.740 -2.468 18990 12515 1 17 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.269 1.452 18990 12516 1 17 . 1 1 462 462 GLU C C 462 176.067 176.067 174.972 1.095 18990 12517 1 17 . 1 1 462 462 GLU CA C 462 54.624 54.624 55.923 -1.299 18990 12518 1 17 . 1 1 462 462 GLU CB C 462 31.255 31.255 30.345 0.910 18990 12519 1 17 . 1 1 462 462 GLU H H 462 7.799 7.799 8.358 -0.559 18990 12520 1 17 . 1 1 463 463 TRP N N 463 121.524 121.524 119.621 1.903 18990 12521 1 17 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.203 0.303 18990 12522 1 17 . 1 1 463 463 TRP C C 463 172.844 172.844 174.487 -1.643 18990 12523 1 17 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.919 -1.148 18990 12524 1 17 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.138 0.598 18990 12525 1 17 . 1 1 463 463 TRP H H 463 9.300 9.300 8.206 1.094 18990 12526 1 17 . 1 1 464 464 CYS N N 464 120.868 120.868 119.582 1.286 18990 12527 1 17 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.956 0.460 18990 12528 1 17 . 1 1 464 464 CYS C C 464 177.213 177.213 176.477 0.736 18990 12529 1 17 . 1 1 464 464 CYS CA C 464 57.776 57.776 59.876 -2.100 18990 12530 1 17 . 1 1 464 464 CYS CB C 464 32.930 32.930 28.575 4.355 18990 12531 1 17 . 1 1 464 464 CYS H H 464 8.752 8.752 9.020 -0.268 18990 12532 1 17 . 1 1 465 465 TRP N N 465 131.209 131.209 126.539 4.670 18990 12533 1 17 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.459 -0.032 18990 12534 1 17 . 1 1 465 465 TRP C C 465 176.051 176.051 175.622 0.429 18990 12535 1 17 . 1 1 465 465 TRP CA C 465 60.763 60.763 60.273 0.490 18990 12536 1 17 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.594 1.532 18990 12537 1 17 . 1 1 465 465 TRP H H 465 9.809 9.809 9.303 0.506 18990 12538 1 17 . 1 1 466 466 VAL N N 466 118.233 118.233 118.806 -0.573 18990 12539 1 17 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.728 -0.104 18990 12540 1 17 . 1 1 466 466 VAL C C 466 178.943 178.943 176.474 2.469 18990 12541 1 17 . 1 1 466 466 VAL CA C 466 65.602 65.602 64.031 1.571 18990 12542 1 17 . 1 1 466 466 VAL CB C 466 33.172 33.172 31.473 1.699 18990 12543 1 17 . 1 1 466 466 VAL H H 466 8.627 8.627 8.129 0.498 18990 12544 1 17 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.863 -1.432 18990 12545 1 17 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.993 0.006 18990 12546 1 17 . 1 1 467 467 CYS CB C 467 31.870 31.870 29.450 2.421 18990 12547 1 17 . 1 1 467 467 CYS H H 467 7.820 7.820 8.043 -0.223 18990 12548 1 17 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.680 -0.644 18990 12549 1 17 . 1 1 468 468 GLN CA C 468 58.051 58.051 55.346 2.705 18990 12550 1 17 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.241 -1.765 18990 12551 1 17 . 1 1 469 469 THR HA H 469 4.685 4.685 4.535 0.150 18990 12552 1 17 . 1 1 469 469 THR C C 469 173.351 173.351 173.044 0.307 18990 12553 1 17 . 1 1 469 469 THR CA C 469 59.176 59.176 61.375 -2.199 18990 12554 1 17 . 1 1 469 469 THR CB C 469 71.775 71.775 69.948 1.827 18990 12555 1 17 . 1 1 470 470 GLU N N 470 120.940 120.940 122.755 -1.815 18990 12556 1 17 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.860 -0.567 18990 12557 1 17 . 1 1 470 470 GLU C C 470 175.539 175.539 175.714 -0.175 18990 12558 1 17 . 1 1 470 470 GLU CA C 470 57.015 57.015 55.584 1.431 18990 12559 1 17 . 1 1 470 470 GLU CB C 470 29.965 29.965 31.349 -1.384 18990 12560 1 17 . 1 1 470 470 GLU H H 470 8.912 8.912 8.755 0.157 18990 12561 1 17 . 1 1 471 471 TRP N N 471 126.998 126.998 131.002 -4.004 18990 12562 1 17 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.443 -0.150 18990 12563 1 17 . 1 1 471 471 TRP C C 471 175.408 175.408 175.478 -0.070 18990 12564 1 17 . 1 1 471 471 TRP CA C 471 58.220 58.220 58.975 -0.755 18990 12565 1 17 . 1 1 471 471 TRP CB C 471 29.500 29.500 29.005 0.496 18990 12566 1 17 . 1 1 471 471 TRP H H 471 8.350 8.350 8.230 0.120 18990 12567 1 17 . 1 1 472 472 THR N N 472 117.480 117.480 114.360 3.120 18990 12568 1 17 . 1 1 472 472 THR HA H 472 4.444 4.444 4.532 -0.088 18990 12569 1 17 . 1 1 472 472 THR CA C 472 58.930 58.930 59.670 -0.740 18990 12570 1 17 . 1 1 472 472 THR H H 472 8.069 8.069 7.423 0.646 18990 12571 1 17 . 1 1 473 473 ARG HA H 473 3.773 3.773 3.885 -0.112 18990 12572 1 17 . 1 1 473 473 ARG C C 473 178.053 178.053 177.349 0.704 18990 12573 1 17 . 1 1 473 473 ARG CA C 473 58.088 58.088 59.067 -0.979 18990 12574 1 17 . 1 1 473 473 ARG CB C 473 29.426 29.426 29.868 -0.442 18990 12575 1 17 . 1 1 474 474 ASP N N 474 119.900 119.900 118.765 1.135 18990 12576 1 17 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.475 -0.260 18990 12577 1 17 . 1 1 474 474 ASP C C 474 178.197 178.197 176.752 1.445 18990 12578 1 17 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.389 0.413 18990 12579 1 17 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.768 -0.586 18990 12580 1 17 . 1 1 474 474 ASP H H 474 7.718 7.718 8.040 -0.322 18990 12581 1 17 . 1 1 475 475 CYS N N 475 121.000 121.000 118.069 2.931 18990 12582 1 17 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.795 -1.428 18990 12583 1 17 . 1 1 475 475 CYS CA C 475 64.533 64.533 57.054 7.479 18990 12584 1 17 . 1 1 475 475 CYS CB C 475 29.092 29.092 26.406 2.686 18990 12585 1 17 . 1 1 475 475 CYS H H 475 6.953 6.953 7.760 -0.807 18990 12586 1 17 . 1 1 476 476 MET HA H 476 4.021 4.021 3.600 0.421 18990 12587 1 17 . 1 1 476 476 MET CA C 476 58.010 58.010 57.784 0.226 18990 12588 1 17 . 1 1 476 476 MET CB C 476 32.550 32.550 32.425 0.125 18990 12589 1 17 . 1 1 477 477 GLY N N 477 111.938 111.938 102.572 9.366 18990 12590 1 17 . 1 1 477 477 GLY C C 477 174.406 174.406 174.211 0.195 18990 12591 1 17 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.469 1.147 18990 12592 1 17 . 1 1 477 477 GLY H H 477 9.155 9.155 8.244 0.911 18990 12593 1 17 . 1 1 478 478 ALA N N 478 121.900 121.900 123.306 -1.406 18990 12594 1 17 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.175 0.116 18990 12595 1 17 . 1 1 478 478 ALA C C 478 178.196 178.196 177.964 0.232 18990 12596 1 17 . 1 1 478 478 ALA CA C 478 53.440 53.440 54.492 -1.052 18990 12597 1 17 . 1 1 478 478 ALA CB C 478 20.390 20.390 18.759 1.631 18990 12598 1 17 . 1 1 478 478 ALA H H 478 7.347 7.347 8.292 -0.945 18990 12599 1 17 . 1 1 479 479 HIS N N 479 115.200 115.200 109.379 5.821 18990 12600 1 17 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.674 0.229 18990 12601 1 17 . 1 1 479 479 HIS C C 479 173.325 173.325 174.954 -1.629 18990 12602 1 17 . 1 1 479 479 HIS CA C 479 54.526 54.526 55.045 -0.519 18990 12603 1 17 . 1 1 479 479 HIS CB C 479 27.600 27.600 29.666 -2.066 18990 12604 1 17 . 1 1 479 479 HIS H H 479 8.297 8.297 7.941 0.356 18990 12605 1 17 . 1 1 480 480 TRP N N 480 121.780 121.780 123.469 -1.689 18990 12606 1 17 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.088 0.207 18990 12607 1 17 . 1 1 480 480 TRP C C 480 175.568 175.568 175.003 0.565 18990 12608 1 17 . 1 1 480 480 TRP CA C 480 58.358 58.358 58.584 -0.226 18990 12609 1 17 . 1 1 480 480 TRP CB C 480 29.550 29.550 27.866 1.684 18990 12610 1 17 . 1 1 480 480 TRP H H 480 8.081 8.081 7.635 0.446 18990 12611 1 17 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.414 0.431 18990 12612 1 17 . 1 1 481 481 PHE C C 481 175.126 175.126 173.895 1.231 18990 12613 1 17 . 1 1 481 481 PHE CA C 481 56.471 56.471 57.715 -1.244 18990 12614 1 17 . 1 1 481 481 PHE CB C 481 41.006 41.006 41.345 -0.339 18990 12615 1 18 . 1 1 343 343 GLU N N 343 121.045 121.045 120.677 0.368 18990 12616 1 18 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.337 -0.172 18990 12617 1 18 . 1 1 343 343 GLU C C 343 176.529 176.529 175.716 0.813 18990 12618 1 18 . 1 1 343 343 GLU CA C 343 57.162 57.162 56.152 1.010 18990 12619 1 18 . 1 1 343 343 GLU CB C 343 30.204 30.204 29.228 0.976 18990 12620 1 18 . 1 1 343 343 GLU H H 343 8.293 8.293 8.162 0.131 18990 12621 1 18 . 1 1 344 344 TYR N N 344 121.000 121.000 122.709 -1.709 18990 12622 1 18 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.678 -0.140 18990 12623 1 18 . 1 1 344 344 TYR C C 344 175.897 175.897 176.482 -0.585 18990 12624 1 18 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.125 1.054 18990 12625 1 18 . 1 1 344 344 TYR CB C 344 38.600 38.600 39.655 -1.055 18990 12626 1 18 . 1 1 344 344 TYR H H 344 8.040 8.040 8.296 -0.256 18990 12627 1 18 . 1 1 345 345 VAL N N 345 121.900 121.900 120.277 1.623 18990 12628 1 18 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.054 -0.115 18990 12629 1 18 . 1 1 345 345 VAL C C 345 176.143 176.143 176.393 -0.250 18990 12630 1 18 . 1 1 345 345 VAL CA C 345 62.867 62.867 64.070 -1.203 18990 12631 1 18 . 1 1 345 345 VAL CB C 345 32.799 32.799 31.608 1.191 18990 12632 1 18 . 1 1 345 345 VAL H H 345 7.856 7.856 8.421 -0.565 18990 12633 1 18 . 1 1 346 346 LEU N N 346 124.950 124.950 119.169 5.781 18990 12634 1 18 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.731 -0.488 18990 12635 1 18 . 1 1 346 346 LEU C C 346 177.747 177.747 175.676 2.071 18990 12636 1 18 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.534 0.966 18990 12637 1 18 . 1 1 346 346 LEU CB C 346 42.252 42.252 42.886 -0.634 18990 12638 1 18 . 1 1 346 346 LEU H H 346 8.127 8.127 7.577 0.550 18990 12639 1 18 . 1 1 347 347 GLN N N 347 121.452 121.452 119.582 1.870 18990 12640 1 18 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.475 -0.189 18990 12641 1 18 . 1 1 347 347 GLN C C 347 175.833 175.833 175.143 0.690 18990 12642 1 18 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.516 0.472 18990 12643 1 18 . 1 1 347 347 GLN CB C 347 29.375 29.375 31.766 -2.391 18990 12644 1 18 . 1 1 347 347 GLN H H 347 8.270 8.270 8.388 -0.118 18990 12645 1 18 . 1 1 348 348 ALA N N 348 124.466 124.466 128.955 -4.489 18990 12646 1 18 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.420 -0.099 18990 12647 1 18 . 1 1 348 348 ALA C C 348 177.929 177.929 177.307 0.622 18990 12648 1 18 . 1 1 348 348 ALA CA C 348 52.703 52.703 52.313 0.390 18990 12649 1 18 . 1 1 348 348 ALA CB C 348 19.002 19.002 17.886 1.116 18990 12650 1 18 . 1 1 348 348 ALA H H 348 8.227 8.227 8.865 -0.638 18990 12651 1 18 . 1 1 349 349 GLY N N 349 108.193 108.193 109.096 -0.903 18990 12652 1 18 . 1 1 349 349 GLY C C 349 174.269 174.269 173.377 0.892 18990 12653 1 18 . 1 1 349 349 GLY CA C 349 45.227 45.227 45.021 0.206 18990 12654 1 18 . 1 1 349 349 GLY H H 349 8.298 8.298 8.009 0.289 18990 12655 1 18 . 1 1 350 350 GLY N N 350 108.073 108.073 107.743 0.330 18990 12656 1 18 . 1 1 350 350 GLY C C 350 172.979 172.979 172.960 0.019 18990 12657 1 18 . 1 1 350 350 GLY CA C 350 44.935 44.935 44.979 -0.044 18990 12658 1 18 . 1 1 350 350 GLY H H 350 8.156 8.156 7.511 0.645 18990 12659 1 18 . 1 1 351 351 VAL N N 351 119.058 119.058 121.756 -2.698 18990 12660 1 18 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.508 -0.092 18990 12661 1 18 . 1 1 351 351 VAL C C 351 173.412 173.412 174.192 -0.780 18990 12662 1 18 . 1 1 351 351 VAL CA C 351 60.663 60.663 60.552 0.111 18990 12663 1 18 . 1 1 351 351 VAL CB C 351 34.866 34.866 35.574 -0.708 18990 12664 1 18 . 1 1 351 351 VAL H H 351 8.541 8.541 9.094 -0.553 18990 12665 1 18 . 1 1 352 352 LEU N N 352 125.800 125.800 124.195 1.605 18990 12666 1 18 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.779 -0.014 18990 12667 1 18 . 1 1 352 352 LEU C C 352 176.218 176.218 175.084 1.134 18990 12668 1 18 . 1 1 352 352 LEU CA C 352 53.341 53.341 52.824 0.517 18990 12669 1 18 . 1 1 352 352 LEU CB C 352 42.706 42.706 44.160 -1.454 18990 12670 1 18 . 1 1 352 352 LEU H H 352 8.151 8.151 8.486 -0.335 18990 12671 1 18 . 1 1 353 353 CYS N N 353 126.825 126.825 122.700 4.125 18990 12672 1 18 . 1 1 353 353 CYS HA H 353 4.107 4.107 3.691 0.416 18990 12673 1 18 . 1 1 353 353 CYS C C 353 176.655 176.655 174.480 2.175 18990 12674 1 18 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.348 0.383 18990 12675 1 18 . 1 1 353 353 CYS CB C 353 31.865 31.865 28.096 3.769 18990 12676 1 18 . 1 1 353 353 CYS H H 353 8.794 8.794 8.539 0.255 18990 12677 1 18 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.177 0.243 18990 12678 1 18 . 1 1 354 354 PRO C C 354 177.512 177.512 176.168 1.344 18990 12679 1 18 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.681 -0.689 18990 12680 1 18 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.618 0.949 18990 12681 1 18 . 1 1 355 355 GLN N N 355 126.800 126.800 119.061 7.739 18990 12682 1 18 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.458 -0.183 18990 12683 1 18 . 1 1 355 355 GLN C C 355 175.516 175.516 173.965 1.551 18990 12684 1 18 . 1 1 355 355 GLN CA C 355 54.793 54.793 53.456 1.337 18990 12685 1 18 . 1 1 355 355 GLN CB C 355 28.547 28.547 28.139 0.408 18990 12686 1 18 . 1 1 355 355 GLN H H 355 9.033 9.033 7.388 1.645 18990 12687 1 18 . 1 1 357 357 GLY C C 357 173.229 173.229 174.555 -1.326 18990 12688 1 18 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.822 0.432 18990 12689 1 18 . 1 1 358 358 CYS N N 358 123.500 123.500 119.850 3.650 18990 12690 1 18 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.511 0.022 18990 12691 1 18 . 1 1 358 358 CYS C C 358 176.157 176.157 175.715 0.442 18990 12692 1 18 . 1 1 358 358 CYS CA C 358 60.268 60.268 60.553 -0.284 18990 12693 1 18 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.534 0.841 18990 12694 1 18 . 1 1 358 358 CYS H H 358 7.720 7.720 7.931 -0.211 18990 12695 1 18 . 1 1 359 359 GLY N N 359 104.400 104.400 108.581 -4.181 18990 12696 1 18 . 1 1 359 359 GLY C C 359 174.080 174.080 175.113 -1.033 18990 12697 1 18 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.765 -0.701 18990 12698 1 18 . 1 1 359 359 GLY H H 359 7.756 7.756 8.403 -0.647 18990 12699 1 18 . 1 1 360 360 MET N N 360 121.300 121.300 118.993 2.307 18990 12700 1 18 . 1 1 360 360 MET HA H 360 4.343 4.343 4.332 0.011 18990 12701 1 18 . 1 1 360 360 MET C C 360 175.641 175.641 177.143 -1.502 18990 12702 1 18 . 1 1 360 360 MET CA C 360 55.923 55.923 57.247 -1.324 18990 12703 1 18 . 1 1 360 360 MET CB C 360 33.091 33.091 33.589 -0.498 18990 12704 1 18 . 1 1 360 360 MET H H 360 8.229 8.229 7.959 0.270 18990 12705 1 18 . 1 1 361 361 GLY N N 361 109.000 109.000 105.158 3.842 18990 12706 1 18 . 1 1 361 361 GLY C C 361 173.774 173.774 173.124 0.650 18990 12707 1 18 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.556 1.282 18990 12708 1 18 . 1 1 361 361 GLY H H 361 8.347 8.347 7.782 0.565 18990 12709 1 18 . 1 1 362 362 LEU N N 362 126.725 126.725 126.453 0.272 18990 12710 1 18 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.801 -0.126 18990 12711 1 18 . 1 1 362 362 LEU C C 362 175.865 175.865 175.983 -0.118 18990 12712 1 18 . 1 1 362 362 LEU CA C 362 54.190 54.190 52.827 1.363 18990 12713 1 18 . 1 1 362 362 LEU CB C 362 44.050 44.050 43.680 0.370 18990 12714 1 18 . 1 1 362 362 LEU H H 362 8.935 8.935 9.078 -0.142 18990 12715 1 18 . 1 1 363 363 LEU N N 363 123.742 123.742 127.075 -3.333 18990 12716 1 18 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.397 0.280 18990 12717 1 18 . 1 1 363 363 LEU C C 363 176.162 176.162 176.433 -0.271 18990 12718 1 18 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.518 -0.176 18990 12719 1 18 . 1 1 363 363 LEU CB C 363 42.210 42.210 42.260 -0.050 18990 12720 1 18 . 1 1 363 363 LEU H H 363 8.481 8.481 8.813 -0.332 18990 12721 1 18 . 1 1 364 364 VAL N N 364 120.980 120.980 128.681 -7.701 18990 12722 1 18 . 1 1 364 364 VAL HA H 364 4.397 4.397 3.999 0.398 18990 12723 1 18 . 1 1 364 364 VAL C C 364 175.592 175.592 175.328 0.264 18990 12724 1 18 . 1 1 364 364 VAL CA C 364 60.460 60.460 62.470 -2.010 18990 12725 1 18 . 1 1 364 364 VAL CB C 364 34.125 34.125 31.609 2.516 18990 12726 1 18 . 1 1 364 364 VAL H H 364 8.155 8.155 8.654 -0.499 18990 12727 1 18 . 1 1 365 365 GLU N N 365 126.950 126.950 128.760 -1.810 18990 12728 1 18 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.579 0.031 18990 12729 1 18 . 1 1 365 365 GLU C C 365 175.427 175.427 175.262 0.165 18990 12730 1 18 . 1 1 365 365 GLU CA C 365 54.551 54.551 53.539 1.012 18990 12731 1 18 . 1 1 365 365 GLU CB C 365 29.780 29.780 30.144 -0.364 18990 12732 1 18 . 1 1 365 365 GLU H H 365 8.900 8.900 7.868 1.032 18990 12733 1 18 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.236 0.026 18990 12734 1 18 . 1 1 366 366 PRO C C 366 177.013 177.013 178.506 -1.493 18990 12735 1 18 . 1 1 366 366 PRO CA C 366 64.463 64.463 65.628 -1.165 18990 12736 1 18 . 1 1 366 366 PRO CB C 366 32.048 32.048 32.064 -0.016 18990 12737 1 18 . 1 1 367 367 ASP N N 367 115.459 115.459 115.932 -0.473 18990 12738 1 18 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.531 -0.036 18990 12739 1 18 . 1 1 367 367 ASP C C 367 175.123 175.123 175.687 -0.564 18990 12740 1 18 . 1 1 367 367 ASP CA C 367 54.503 54.503 54.639 -0.136 18990 12741 1 18 . 1 1 367 367 ASP CB C 367 40.123 40.123 40.939 -0.816 18990 12742 1 18 . 1 1 367 367 ASP H H 367 8.439 8.439 8.786 -0.347 18990 12743 1 18 . 1 1 368 368 CYS N N 368 118.700 118.700 119.385 -0.685 18990 12744 1 18 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.323 0.247 18990 12745 1 18 . 1 1 368 368 CYS C C 368 173.806 173.806 174.962 -1.156 18990 12746 1 18 . 1 1 368 368 CYS CA C 368 58.581 58.581 60.031 -1.450 18990 12747 1 18 . 1 1 368 368 CYS CB C 368 28.450 28.450 28.771 -0.321 18990 12748 1 18 . 1 1 368 368 CYS H H 368 7.515 7.515 7.316 0.199 18990 12749 1 18 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.493 -0.228 18990 12750 1 18 . 1 1 369 369 ARG C C 369 174.908 174.908 175.466 -0.558 18990 12751 1 18 . 1 1 369 369 ARG CA C 369 57.669 57.669 54.995 2.674 18990 12752 1 18 . 1 1 369 369 ARG CB C 369 32.274 32.274 31.228 1.046 18990 12753 1 18 . 1 1 370 370 LYS N N 370 121.022 121.022 121.018 0.004 18990 12754 1 18 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.601 -0.431 18990 12755 1 18 . 1 1 370 370 LYS C C 370 174.868 174.868 174.644 0.224 18990 12756 1 18 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.544 1.010 18990 12757 1 18 . 1 1 370 370 LYS CB C 370 33.140 33.140 33.378 -0.238 18990 12758 1 18 . 1 1 370 370 LYS H H 370 7.740 7.740 7.625 0.115 18990 12759 1 18 . 1 1 371 371 VAL N N 371 128.362 128.362 123.311 5.051 18990 12760 1 18 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.484 -0.351 18990 12761 1 18 . 1 1 371 371 VAL C C 371 173.402 173.402 174.327 -0.925 18990 12762 1 18 . 1 1 371 371 VAL CA C 371 60.777 60.777 60.681 0.096 18990 12763 1 18 . 1 1 371 371 VAL CB C 371 33.000 33.000 33.456 -0.456 18990 12764 1 18 . 1 1 371 371 VAL H H 371 8.647 8.647 8.398 0.249 18990 12765 1 18 . 1 1 372 372 THR N N 372 119.667 119.667 117.275 2.392 18990 12766 1 18 . 1 1 372 372 THR HA H 372 5.032 5.032 4.822 0.210 18990 12767 1 18 . 1 1 372 372 THR C C 372 174.339 174.339 173.855 0.484 18990 12768 1 18 . 1 1 372 372 THR CA C 372 60.881 60.881 61.780 -0.899 18990 12769 1 18 . 1 1 372 372 THR CB C 372 70.471 70.471 71.528 -1.056 18990 12770 1 18 . 1 1 372 372 THR H H 372 8.087 8.087 7.835 0.252 18990 12771 1 18 . 1 1 373 373 CYS N N 373 132.554 132.554 126.815 5.739 18990 12772 1 18 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.577 0.225 18990 12773 1 18 . 1 1 373 373 CYS C C 373 176.791 176.791 175.631 1.160 18990 12774 1 18 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.274 -0.770 18990 12775 1 18 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.990 3.321 18990 12776 1 18 . 1 1 373 373 CYS H H 373 9.322 9.322 9.044 0.278 18990 12777 1 18 . 1 1 374 374 GLN N N 374 125.890 125.890 123.666 2.224 18990 12778 1 18 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.287 -0.287 18990 12779 1 18 . 1 1 374 374 GLN C C 374 176.827 176.827 176.707 0.120 18990 12780 1 18 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.605 0.695 18990 12781 1 18 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.937 0.727 18990 12782 1 18 . 1 1 374 374 GLN H H 374 7.856 7.856 8.528 -0.672 18990 12783 1 18 . 1 1 375 375 ASN N N 375 115.342 115.342 116.696 -1.354 18990 12784 1 18 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.736 0.151 18990 12785 1 18 . 1 1 375 375 ASN C C 375 174.049 174.049 175.279 -1.230 18990 12786 1 18 . 1 1 375 375 ASN CA C 375 53.047 53.047 54.171 -1.124 18990 12787 1 18 . 1 1 375 375 ASN CB C 375 38.916 38.916 38.703 0.213 18990 12788 1 18 . 1 1 375 375 ASN H H 375 8.913 8.913 8.499 0.414 18990 12789 1 18 . 1 1 376 376 GLY N N 376 109.098 109.098 107.508 1.590 18990 12790 1 18 . 1 1 376 376 GLY C C 376 174.110 174.110 174.333 -0.223 18990 12791 1 18 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.279 1.107 18990 12792 1 18 . 1 1 376 376 GLY H H 376 7.162 7.162 7.593 -0.431 18990 12793 1 18 . 1 1 377 377 CYS N N 377 132.546 132.546 120.195 12.351 18990 12794 1 18 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.890 -0.126 18990 12795 1 18 . 1 1 377 377 CYS C C 377 177.355 177.355 174.465 2.890 18990 12796 1 18 . 1 1 377 377 CYS CA C 377 59.988 59.988 57.572 2.416 18990 12797 1 18 . 1 1 377 377 CYS CB C 377 32.365 32.365 29.159 3.206 18990 12798 1 18 . 1 1 377 377 CYS H H 377 9.800 9.800 7.888 1.912 18990 12799 1 18 . 1 1 378 378 GLY N N 378 113.851 113.851 107.833 6.018 18990 12800 1 18 . 1 1 378 378 GLY C C 378 173.404 173.404 172.413 0.991 18990 12801 1 18 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.546 0.317 18990 12802 1 18 . 1 1 378 378 GLY H H 378 8.820 8.820 8.186 0.634 18990 12803 1 18 . 1 1 379 379 TYR N N 379 125.532 125.532 123.943 1.589 18990 12804 1 18 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.824 -0.346 18990 12805 1 18 . 1 1 379 379 TYR C C 379 173.661 173.661 173.691 -0.030 18990 12806 1 18 . 1 1 379 379 TYR CA C 379 59.180 59.180 57.677 1.503 18990 12807 1 18 . 1 1 379 379 TYR CB C 379 40.108 40.108 42.018 -1.910 18990 12808 1 18 . 1 1 379 379 TYR H H 379 9.054 9.054 8.166 0.888 18990 12809 1 18 . 1 1 380 380 VAL N N 380 124.461 124.461 125.727 -1.266 18990 12810 1 18 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.333 0.485 18990 12811 1 18 . 1 1 380 380 VAL C C 380 175.876 175.876 174.253 1.623 18990 12812 1 18 . 1 1 380 380 VAL CA C 380 60.797 60.797 61.426 -0.629 18990 12813 1 18 . 1 1 380 380 VAL CB C 380 32.610 32.610 32.104 0.506 18990 12814 1 18 . 1 1 380 380 VAL H H 380 7.238 7.238 7.741 -0.503 18990 12815 1 18 . 1 1 381 381 PHE N N 381 124.588 124.588 123.578 1.010 18990 12816 1 18 . 1 1 381 381 PHE HA H 381 5.273 5.273 4.858 0.415 18990 12817 1 18 . 1 1 381 381 PHE C C 381 173.242 173.242 174.410 -1.168 18990 12818 1 18 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.133 0.077 18990 12819 1 18 . 1 1 381 381 PHE CB C 381 42.090 42.090 39.835 2.255 18990 12820 1 18 . 1 1 381 381 PHE H H 381 9.424 9.424 7.604 1.820 18990 12821 1 18 . 1 1 382 382 CYS N N 382 120.221 120.221 120.812 -0.591 18990 12822 1 18 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.639 0.263 18990 12823 1 18 . 1 1 382 382 CYS C C 382 177.165 177.165 175.759 1.406 18990 12824 1 18 . 1 1 382 382 CYS CA C 382 57.691 57.691 58.416 -0.725 18990 12825 1 18 . 1 1 382 382 CYS CB C 382 32.475 32.475 29.707 2.768 18990 12826 1 18 . 1 1 382 382 CYS H H 382 8.673 8.673 8.715 -0.042 18990 12827 1 18 . 1 1 383 383 ARG N N 383 129.347 129.347 122.002 7.345 18990 12828 1 18 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.349 -0.328 18990 12829 1 18 . 1 1 383 383 ARG C C 383 175.012 175.012 176.111 -1.099 18990 12830 1 18 . 1 1 383 383 ARG CA C 383 58.686 58.686 57.959 0.727 18990 12831 1 18 . 1 1 383 383 ARG CB C 383 30.900 30.900 30.207 0.693 18990 12832 1 18 . 1 1 383 383 ARG H H 383 9.534 9.534 8.600 0.934 18990 12833 1 18 . 1 1 384 384 ASN N N 384 117.772 117.772 117.144 0.628 18990 12834 1 18 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.799 -0.091 18990 12835 1 18 . 1 1 384 384 ASN C C 384 175.656 175.656 174.592 1.064 18990 12836 1 18 . 1 1 384 384 ASN CA C 384 55.778 55.778 54.343 1.435 18990 12837 1 18 . 1 1 384 384 ASN CB C 384 39.475 39.475 41.026 -1.551 18990 12838 1 18 . 1 1 384 384 ASN H H 384 8.840 8.840 8.048 0.792 18990 12839 1 18 . 1 1 385 385 CYS N N 385 115.876 115.876 114.155 1.721 18990 12840 1 18 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.815 0.213 18990 12841 1 18 . 1 1 385 385 CYS C C 385 175.703 175.703 173.927 1.776 18990 12842 1 18 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.441 1.671 18990 12843 1 18 . 1 1 385 385 CYS CB C 385 32.359 32.359 30.053 2.306 18990 12844 1 18 . 1 1 385 385 CYS H H 385 7.868 7.868 7.989 -0.121 18990 12845 1 18 . 1 1 386 386 LEU N N 386 120.082 120.082 119.622 0.460 18990 12846 1 18 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.723 -0.410 18990 12847 1 18 . 1 1 386 386 LEU C C 386 175.722 175.722 177.210 -1.488 18990 12848 1 18 . 1 1 386 386 LEU CA C 386 57.009 57.009 53.924 3.085 18990 12849 1 18 . 1 1 386 386 LEU CB C 386 38.412 38.412 41.371 -2.959 18990 12850 1 18 . 1 1 386 386 LEU H H 386 8.514 8.514 8.412 0.102 18990 12851 1 18 . 1 1 387 387 GLN N N 387 117.579 117.579 119.625 -2.046 18990 12852 1 18 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.335 0.441 18990 12853 1 18 . 1 1 387 387 GLN C C 387 175.299 175.299 177.023 -1.724 18990 12854 1 18 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.702 -1.685 18990 12855 1 18 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.495 1.812 18990 12856 1 18 . 1 1 387 387 GLN H H 387 8.248 8.248 7.881 0.367 18990 12857 1 18 . 1 1 388 388 GLY N N 388 106.107 106.107 108.032 -1.925 18990 12858 1 18 . 1 1 388 388 GLY C C 388 173.693 173.693 173.892 -0.199 18990 12859 1 18 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.222 0.958 18990 12860 1 18 . 1 1 388 388 GLY H H 388 8.695 8.695 8.346 0.349 18990 12861 1 18 . 1 1 389 389 TYR N N 389 122.514 122.514 117.221 5.293 18990 12862 1 18 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.165 -0.507 18990 12863 1 18 . 1 1 389 389 TYR C C 389 172.860 172.860 174.077 -1.217 18990 12864 1 18 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.975 4.012 18990 12865 1 18 . 1 1 389 389 TYR CB C 389 38.052 38.052 38.250 -0.198 18990 12866 1 18 . 1 1 389 389 TYR H H 389 7.923 7.923 8.246 -0.323 18990 12867 1 18 . 1 1 390 390 HIS N N 390 120.080 120.080 123.834 -3.754 18990 12868 1 18 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.714 -0.006 18990 12869 1 18 . 1 1 390 390 HIS C C 390 173.235 173.235 173.045 0.190 18990 12870 1 18 . 1 1 390 390 HIS CA C 390 51.431 51.431 54.194 -2.763 18990 12871 1 18 . 1 1 390 390 HIS CB C 390 31.900 31.900 30.834 1.066 18990 12872 1 18 . 1 1 390 390 HIS H H 390 5.291 5.291 7.416 -2.125 18990 12873 1 18 . 1 1 391 391 ILE N N 391 117.810 117.810 120.485 -2.675 18990 12874 1 18 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.142 -0.026 18990 12875 1 18 . 1 1 391 391 ILE C C 391 178.208 178.208 176.427 1.781 18990 12876 1 18 . 1 1 391 391 ILE CA C 391 60.877 60.877 61.357 -0.480 18990 12877 1 18 . 1 1 391 391 ILE CB C 391 39.034 39.034 38.536 0.498 18990 12878 1 18 . 1 1 391 391 ILE H H 391 8.418 8.418 8.329 0.089 18990 12879 1 18 . 1 1 392 392 GLY N N 392 112.387 112.387 112.694 -0.307 18990 12880 1 18 . 1 1 392 392 GLY C C 392 173.565 173.565 172.890 0.675 18990 12881 1 18 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.327 0.931 18990 12882 1 18 . 1 1 392 392 GLY H H 392 8.654 8.654 8.352 0.302 18990 12883 1 18 . 1 1 393 393 GLU N N 393 119.098 119.098 119.649 -0.551 18990 12884 1 18 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.662 -0.373 18990 12885 1 18 . 1 1 393 393 GLU C C 393 176.899 176.899 175.257 1.642 18990 12886 1 18 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.157 1.276 18990 12887 1 18 . 1 1 393 393 GLU CB C 393 30.470 30.470 30.923 -0.453 18990 12888 1 18 . 1 1 393 393 GLU H H 393 8.391 8.391 8.332 0.058 18990 12889 1 18 . 1 1 394 394 CYS N N 394 122.845 122.845 120.745 2.100 18990 12890 1 18 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.753 -0.987 18990 12891 1 18 . 1 1 394 394 CYS C C 394 175.461 175.461 173.695 1.766 18990 12892 1 18 . 1 1 394 394 CYS CA C 394 59.835 59.835 59.296 0.539 18990 12893 1 18 . 1 1 394 394 CYS CB C 394 30.761 30.761 28.835 1.926 18990 12894 1 18 . 1 1 394 394 CYS H H 394 8.474 8.474 8.770 -0.296 18990 12895 1 18 . 1 1 395 395 LEU N N 395 124.403 124.403 120.965 3.438 18990 12896 1 18 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.690 -0.186 18990 12897 1 18 . 1 1 395 395 LEU C C 395 175.259 175.259 174.847 0.412 18990 12898 1 18 . 1 1 395 395 LEU CA C 395 52.835 52.835 53.245 -0.410 18990 12899 1 18 . 1 1 395 395 LEU CB C 395 41.436 41.436 43.820 -2.384 18990 12900 1 18 . 1 1 395 395 LEU H H 395 8.418 8.418 8.194 0.224 18990 12901 1 18 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.415 -0.045 18990 12902 1 18 . 1 1 396 396 PRO C C 396 177.006 177.006 176.828 0.178 18990 12903 1 18 . 1 1 396 396 PRO CA C 396 63.096 63.096 63.233 -0.137 18990 12904 1 18 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.277 -0.205 18990 12905 1 18 . 1 1 397 397 GLU N N 397 121.574 121.574 117.660 3.914 18990 12906 1 18 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.172 0.053 18990 12907 1 18 . 1 1 397 397 GLU C C 397 177.202 177.202 175.618 1.584 18990 12908 1 18 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.585 0.449 18990 12909 1 18 . 1 1 397 397 GLU CB C 397 30.263 30.263 28.889 1.374 18990 12910 1 18 . 1 1 397 397 GLU H H 397 8.568 8.568 8.527 0.041 18990 12911 1 18 . 1 1 398 398 GLY N N 398 110.495 110.495 105.816 4.679 18990 12912 1 18 . 1 1 398 398 GLY C C 398 174.579 174.579 173.582 0.997 18990 12913 1 18 . 1 1 398 398 GLY CA C 398 45.462 45.462 45.031 0.431 18990 12914 1 18 . 1 1 398 398 GLY H H 398 8.515 8.515 7.762 0.753 18990 12915 1 18 . 1 1 399 399 THR N N 399 113.234 113.234 116.969 -3.735 18990 12916 1 18 . 1 1 399 399 THR HA H 399 4.398 4.398 4.561 -0.163 18990 12917 1 18 . 1 1 399 399 THR C C 399 175.333 175.333 176.189 -0.856 18990 12918 1 18 . 1 1 399 399 THR CA C 399 62.233 62.233 60.452 1.781 18990 12919 1 18 . 1 1 399 399 THR CB C 399 69.833 69.833 69.296 0.537 18990 12920 1 18 . 1 1 399 399 THR H H 399 8.090 8.090 8.982 -0.892 18990 12921 1 18 . 1 1 400 400 GLY N N 400 111.479 111.479 111.631 -0.152 18990 12922 1 18 . 1 1 400 400 GLY C C 400 174.048 174.048 173.878 0.170 18990 12923 1 18 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.115 0.324 18990 12924 1 18 . 1 1 400 400 GLY H H 400 8.524 8.524 8.478 0.046 18990 12925 1 18 . 1 1 401 401 ALA N N 401 123.919 123.919 127.508 -3.589 18990 12926 1 18 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.359 -0.108 18990 12927 1 18 . 1 1 401 401 ALA C C 401 177.942 177.942 176.598 1.344 18990 12928 1 18 . 1 1 401 401 ALA CA C 401 52.730 52.730 52.642 0.088 18990 12929 1 18 . 1 1 401 401 ALA CB C 401 19.142 19.142 18.939 0.203 18990 12930 1 18 . 1 1 401 401 ALA H H 401 8.179 8.179 7.899 0.280 18990 12931 1 18 . 1 1 402 402 SER N N 402 114.904 114.904 117.735 -2.831 18990 12932 1 18 . 1 1 402 402 SER HA H 402 4.448 4.448 4.675 -0.227 18990 12933 1 18 . 1 1 402 402 SER C C 402 174.426 174.426 173.485 0.941 18990 12934 1 18 . 1 1 402 402 SER CA C 402 58.289 58.289 58.444 -0.155 18990 12935 1 18 . 1 1 402 402 SER CB C 402 63.772 63.772 64.519 -0.747 18990 12936 1 18 . 1 1 402 402 SER H H 402 8.305 8.305 8.645 -0.340 18990 12937 1 18 . 1 1 403 403 ALA N N 403 125.965 125.965 128.061 -2.096 18990 12938 1 18 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.724 -0.325 18990 12939 1 18 . 1 1 403 403 ALA C C 403 177.984 177.984 176.365 1.619 18990 12940 1 18 . 1 1 403 403 ALA CA C 403 52.655 52.655 51.765 0.890 18990 12941 1 18 . 1 1 403 403 ALA CB C 403 19.138 19.138 20.141 -1.003 18990 12942 1 18 . 1 1 403 403 ALA H H 403 8.345 8.345 8.111 0.234 18990 12943 1 18 . 1 1 404 404 THR N N 404 112.790 112.790 113.918 -1.128 18990 12944 1 18 . 1 1 404 404 THR C C 404 174.420 174.420 173.950 0.470 18990 12945 1 18 . 1 1 404 404 THR CA C 404 61.988 61.988 61.844 0.144 18990 12946 1 18 . 1 1 404 404 THR CB C 404 69.688 69.688 69.670 0.018 18990 12947 1 18 . 1 1 404 404 THR H H 404 8.118 8.118 8.114 0.004 18990 12948 1 18 . 1 1 405 405 ASN N N 405 121.050 121.050 124.020 -2.970 18990 12949 1 18 . 1 1 405 405 ASN H H 405 8.396 8.396 8.594 -0.198 18990 12950 1 18 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.701 -0.123 18990 12951 1 18 . 1 1 407 407 CYS C C 407 174.489 174.489 173.673 0.816 18990 12952 1 18 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.929 -0.216 18990 12953 1 18 . 1 1 407 407 CYS CB C 407 28.102 28.102 27.921 0.181 18990 12954 1 18 . 1 1 408 408 GLU N N 408 123.021 123.021 124.623 -1.602 18990 12955 1 18 . 1 1 408 408 GLU C C 408 175.954 175.954 174.700 1.254 18990 12956 1 18 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.096 0.706 18990 12957 1 18 . 1 1 408 408 GLU CB C 408 30.328 30.328 31.675 -1.347 18990 12958 1 18 . 1 1 408 408 GLU H H 408 8.415 8.415 8.524 -0.109 18990 12959 1 18 . 1 1 409 409 TYR N N 409 121.015 121.015 123.254 -2.239 18990 12960 1 18 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.643 0.011 18990 12961 1 18 . 1 1 409 409 TYR C C 409 175.613 175.613 173.686 1.927 18990 12962 1 18 . 1 1 409 409 TYR CA C 409 57.669 57.669 58.141 -0.472 18990 12963 1 18 . 1 1 409 409 TYR CB C 409 38.825 38.825 40.141 -1.316 18990 12964 1 18 . 1 1 409 409 TYR H H 409 8.135 8.135 8.492 -0.357 18990 12965 1 18 . 1 1 410 410 THR N N 410 116.975 116.975 121.404 -4.429 18990 12966 1 18 . 1 1 410 410 THR HA H 410 4.306 4.306 4.545 -0.239 18990 12967 1 18 . 1 1 410 410 THR C C 410 173.846 173.846 173.016 0.830 18990 12968 1 18 . 1 1 410 410 THR CA C 410 61.730 61.730 61.668 0.062 18990 12969 1 18 . 1 1 410 410 THR CB C 410 69.914 69.914 69.648 0.266 18990 12970 1 18 . 1 1 410 410 THR H H 410 8.060 8.060 7.885 0.175 18990 12971 1 18 . 1 1 411 411 VAL N N 411 122.900 122.900 126.666 -3.766 18990 12972 1 18 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.175 -0.122 18990 12973 1 18 . 1 1 411 411 VAL C C 411 175.275 175.275 174.979 0.296 18990 12974 1 18 . 1 1 411 411 VAL CA C 411 61.853 61.853 61.644 0.209 18990 12975 1 18 . 1 1 411 411 VAL CB C 411 32.976 32.976 31.946 1.030 18990 12976 1 18 . 1 1 411 411 VAL H H 411 8.089 8.089 8.340 -0.251 18990 12977 1 18 . 1 1 412 412 ASP N N 412 125.924 125.924 128.343 -2.419 18990 12978 1 18 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.838 0.012 18990 12979 1 18 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.343 -0.765 18990 12980 1 18 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.732 -0.194 18990 12981 1 18 . 1 1 412 412 ASP H H 412 8.397 8.397 8.494 -0.097 18990 12982 1 18 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.447 -0.061 18990 12983 1 18 . 1 1 413 413 PRO C C 413 177.352 177.352 176.052 1.300 18990 12984 1 18 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.758 1.152 18990 12985 1 18 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.661 -0.393 18990 12986 1 18 . 1 1 414 414 ASN N N 414 117.035 117.035 119.642 -2.607 18990 12987 1 18 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.683 -0.006 18990 12988 1 18 . 1 1 414 414 ASN C C 414 175.532 175.532 175.540 -0.008 18990 12989 1 18 . 1 1 414 414 ASN CA C 414 53.824 53.824 54.028 -0.204 18990 12990 1 18 . 1 1 414 414 ASN CB C 414 38.728 38.728 38.791 -0.063 18990 12991 1 18 . 1 1 414 414 ASN H H 414 8.496 8.496 8.426 0.070 18990 12992 1 18 . 1 1 415 415 ARG N N 415 121.000 121.000 118.586 2.414 18990 12993 1 18 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.631 -0.387 18990 12994 1 18 . 1 1 415 415 ARG C C 415 176.243 176.243 173.953 2.290 18990 12995 1 18 . 1 1 415 415 ARG CA C 415 56.404 56.404 55.674 0.730 18990 12996 1 18 . 1 1 415 415 ARG CB C 415 30.637 30.637 31.436 -0.799 18990 12997 1 18 . 1 1 415 415 ARG H H 415 7.804 7.804 7.845 -0.041 18990 12998 1 18 . 1 1 416 416 ALA N N 416 124.880 124.880 124.028 0.852 18990 12999 1 18 . 1 1 416 416 ALA C C 416 177.831 177.831 175.443 2.388 18990 13000 1 18 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.770 1.187 18990 13001 1 18 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.214 -1.155 18990 13002 1 18 . 1 1 416 416 ALA H H 416 8.189 8.189 8.678 -0.489 18990 13003 1 18 . 1 1 417 417 ALA N N 417 122.614 122.614 126.082 -3.468 18990 13004 1 18 . 1 1 417 417 ALA HA H 417 4.247 4.247 5.002 -0.755 18990 13005 1 18 . 1 1 417 417 ALA C C 417 178.024 178.024 176.375 1.649 18990 13006 1 18 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.986 0.803 18990 13007 1 18 . 1 1 417 417 ALA CB C 417 19.042 19.042 20.224 -1.181 18990 13008 1 18 . 1 1 417 417 ALA H H 417 8.169 8.169 8.632 -0.463 18990 13009 1 18 . 1 1 418 418 GLU N N 418 119.500 119.500 121.242 -1.742 18990 13010 1 18 . 1 1 418 418 GLU HA H 418 4.189 4.189 5.070 -0.881 18990 13011 1 18 . 1 1 418 418 GLU C C 418 176.266 176.266 174.643 1.623 18990 13012 1 18 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.700 0.876 18990 13013 1 18 . 1 1 418 418 GLU CB C 418 30.307 30.307 31.805 -1.498 18990 13014 1 18 . 1 1 418 418 GLU H H 418 8.184 8.184 9.189 -1.005 18990 13015 1 18 . 1 1 419 419 ALA N N 419 124.643 124.643 125.309 -0.666 18990 13016 1 18 . 1 1 419 419 ALA HA H 419 4.250 4.250 5.048 -0.798 18990 13017 1 18 . 1 1 419 419 ALA C C 419 177.488 177.488 175.782 1.706 18990 13018 1 18 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.521 0.988 18990 13019 1 18 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.777 -1.616 18990 13020 1 18 . 1 1 419 419 ALA H H 419 8.135 8.135 8.501 -0.366 18990 13021 1 18 . 1 1 420 420 ARG N N 420 120.003 120.003 120.751 -0.748 18990 13022 1 18 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.831 -0.538 18990 13023 1 18 . 1 1 420 420 ARG C C 420 176.297 176.297 174.682 1.615 18990 13024 1 18 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.624 0.309 18990 13025 1 18 . 1 1 420 420 ARG CB C 420 30.850 30.850 31.876 -1.026 18990 13026 1 18 . 1 1 420 420 ARG H H 420 8.135 8.135 9.056 -0.921 18990 13027 1 18 . 1 1 421 421 TRP N N 421 122.280 122.280 119.516 2.764 18990 13028 1 18 . 1 1 421 421 TRP HA H 421 4.663 4.663 5.197 -0.534 18990 13029 1 18 . 1 1 421 421 TRP C C 421 175.856 175.856 174.342 1.514 18990 13030 1 18 . 1 1 421 421 TRP CA C 421 57.404 57.404 56.626 0.778 18990 13031 1 18 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.951 -1.514 18990 13032 1 18 . 1 1 421 421 TRP H H 421 8.159 8.159 8.139 0.020 18990 13033 1 18 . 1 1 422 422 ASP N N 422 121.980 121.980 123.061 -1.081 18990 13034 1 18 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.743 -0.248 18990 13035 1 18 . 1 1 422 422 ASP C C 422 176.184 176.184 176.185 -0.001 18990 13036 1 18 . 1 1 422 422 ASP CA C 422 53.899 53.899 54.742 -0.844 18990 13037 1 18 . 1 1 422 422 ASP CB C 422 40.948 40.948 41.778 -0.830 18990 13038 1 18 . 1 1 422 422 ASP H H 422 8.135 8.135 8.528 -0.393 18990 13039 1 18 . 1 1 423 423 GLU N N 423 121.990 121.990 125.109 -3.119 18990 13040 1 18 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.297 -0.207 18990 13041 1 18 . 1 1 423 423 GLU C C 423 176.720 176.720 176.339 0.381 18990 13042 1 18 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.793 0.376 18990 13043 1 18 . 1 1 423 423 GLU CB C 423 30.156 30.156 29.480 0.676 18990 13044 1 18 . 1 1 423 423 GLU H H 423 8.153 8.153 8.724 -0.571 18990 13045 1 18 . 1 1 424 424 ALA N N 424 123.900 123.900 124.041 -0.141 18990 13046 1 18 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.073 0.207 18990 13047 1 18 . 1 1 424 424 ALA C C 424 178.095 178.095 176.759 1.336 18990 13048 1 18 . 1 1 424 424 ALA CA C 424 53.017 53.017 52.381 0.636 18990 13049 1 18 . 1 1 424 424 ALA CB C 424 19.086 19.086 17.448 1.637 18990 13050 1 18 . 1 1 424 424 ALA H H 424 8.243 8.243 8.079 0.164 18990 13051 1 18 . 1 1 425 425 SER N N 425 113.881 113.881 115.891 -2.010 18990 13052 1 18 . 1 1 425 425 SER HA H 425 4.387 4.387 4.387 -0.000 18990 13053 1 18 . 1 1 425 425 SER C C 425 174.338 174.338 174.169 0.169 18990 13054 1 18 . 1 1 425 425 SER CA C 425 58.546 58.546 58.454 0.092 18990 13055 1 18 . 1 1 425 425 SER CB C 425 63.784 63.784 63.719 0.065 18990 13056 1 18 . 1 1 425 425 SER H H 425 8.063 8.063 8.341 -0.278 18990 13057 1 18 . 1 1 426 426 ASN N N 426 121.032 121.032 123.916 -2.884 18990 13058 1 18 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.899 -0.193 18990 13059 1 18 . 1 1 426 426 ASN C C 426 175.046 175.046 173.545 1.501 18990 13060 1 18 . 1 1 426 426 ASN CA C 426 53.445 53.445 53.586 -0.141 18990 13061 1 18 . 1 1 426 426 ASN CB C 426 38.847 38.847 40.163 -1.316 18990 13062 1 18 . 1 1 426 426 ASN H H 426 8.391 8.391 8.697 -0.306 18990 13063 1 18 . 1 1 427 427 VAL N N 427 119.463 119.463 123.734 -4.271 18990 13064 1 18 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.519 -0.326 18990 13065 1 18 . 1 1 427 427 VAL C C 427 176.213 176.213 174.491 1.722 18990 13066 1 18 . 1 1 427 427 VAL CA C 427 62.449 62.449 62.167 0.282 18990 13067 1 18 . 1 1 427 427 VAL CB C 427 32.865 32.865 33.893 -1.028 18990 13068 1 18 . 1 1 427 427 VAL H H 427 7.954 7.954 8.139 -0.185 18990 13069 1 18 . 1 1 428 428 THR N N 428 118.226 118.226 120.716 -2.490 18990 13070 1 18 . 1 1 428 428 THR HA H 428 4.353 4.353 4.925 -0.572 18990 13071 1 18 . 1 1 428 428 THR C C 428 174.361 174.361 172.344 2.017 18990 13072 1 18 . 1 1 428 428 THR CA C 428 62.065 62.065 61.213 0.852 18990 13073 1 18 . 1 1 428 428 THR CB C 428 69.729 69.729 70.248 -0.519 18990 13074 1 18 . 1 1 428 428 THR H H 428 8.225 8.225 8.536 -0.311 18990 13075 1 18 . 1 1 429 429 ILE N N 429 123.910 123.910 121.562 2.348 18990 13076 1 18 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.356 -0.168 18990 13077 1 18 . 1 1 429 429 ILE C C 429 175.774 175.774 173.769 2.005 18990 13078 1 18 . 1 1 429 429 ILE CA C 429 60.819 60.819 60.724 0.095 18990 13079 1 18 . 1 1 429 429 ILE CB C 429 38.719 38.719 39.736 -1.017 18990 13080 1 18 . 1 1 429 429 ILE H H 429 8.148 8.148 8.344 -0.196 18990 13081 1 18 . 1 1 430 430 LYS N N 430 126.453 126.453 126.807 -0.354 18990 13082 1 18 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.682 -0.248 18990 13083 1 18 . 1 1 430 430 LYS C C 430 176.241 176.241 175.145 1.096 18990 13084 1 18 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.834 0.103 18990 13085 1 18 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.639 -0.475 18990 13086 1 18 . 1 1 430 430 LYS H H 430 8.406 8.406 8.143 0.263 18990 13087 1 18 . 1 1 431 431 VAL N N 431 122.496 122.496 123.481 -0.985 18990 13088 1 18 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.362 -0.082 18990 13089 1 18 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.111 0.192 18990 13090 1 18 . 1 1 431 431 VAL CB C 431 33.132 33.132 31.956 1.176 18990 13091 1 18 . 1 1 431 431 VAL H H 431 8.312 8.312 8.507 -0.195 18990 13092 1 18 . 1 1 432 432 SER HA H 432 4.486 4.486 4.468 0.018 18990 13093 1 18 . 1 1 432 432 SER C C 432 173.834 173.834 174.758 -0.924 18990 13094 1 18 . 1 1 432 432 SER CA C 432 58.650 58.650 60.162 -1.512 18990 13095 1 18 . 1 1 432 432 SER CB C 432 64.152 64.152 64.109 0.043 18990 13096 1 18 . 1 1 433 433 THR N N 433 114.706 114.706 112.865 1.841 18990 13097 1 18 . 1 1 433 433 THR HA H 433 5.446 5.446 4.396 1.050 18990 13098 1 18 . 1 1 433 433 THR C C 433 173.979 173.979 174.279 -0.300 18990 13099 1 18 . 1 1 433 433 THR CA C 433 60.412 60.412 61.669 -1.257 18990 13100 1 18 . 1 1 433 433 THR CB C 433 71.896 71.896 69.901 1.995 18990 13101 1 18 . 1 1 433 433 THR H H 433 7.833 7.833 7.412 0.421 18990 13102 1 18 . 1 1 434 434 LYS N N 434 122.492 122.492 121.202 1.290 18990 13103 1 18 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.967 -0.258 18990 13104 1 18 . 1 1 434 434 LYS C C 434 173.589 173.589 174.500 -0.911 18990 13105 1 18 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.682 1.692 18990 13106 1 18 . 1 1 434 434 LYS CB C 434 36.925 36.925 34.094 2.831 18990 13107 1 18 . 1 1 434 434 LYS H H 434 8.937 8.937 8.758 0.179 18990 13108 1 18 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.557 -0.290 18990 13109 1 18 . 1 1 435 435 PRO C C 435 175.238 175.238 176.587 -1.349 18990 13110 1 18 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.319 -1.396 18990 13111 1 18 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.354 -0.268 18990 13112 1 18 . 1 1 436 436 CYS N N 436 125.422 125.422 125.371 0.051 18990 13113 1 18 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.149 -0.719 18990 13114 1 18 . 1 1 436 436 CYS C C 436 176.770 176.770 175.267 1.503 18990 13115 1 18 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.809 0.207 18990 13116 1 18 . 1 1 436 436 CYS CB C 436 31.698 31.698 28.049 3.649 18990 13117 1 18 . 1 1 436 436 CYS H H 436 7.768 7.768 8.666 -0.898 18990 13118 1 18 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.152 -0.294 18990 13119 1 18 . 1 1 437 437 PRO C C 437 173.608 173.608 176.046 -2.438 18990 13120 1 18 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.112 0.101 18990 13121 1 18 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.221 1.228 18990 13122 1 18 . 1 1 438 438 LYS N N 438 118.600 118.600 118.889 -0.289 18990 13123 1 18 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.042 -0.072 18990 13124 1 18 . 1 1 438 438 LYS C C 438 176.887 176.887 177.127 -0.240 18990 13125 1 18 . 1 1 438 438 LYS CA C 438 57.687 57.687 56.627 1.060 18990 13126 1 18 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.699 -0.575 18990 13127 1 18 . 1 1 438 438 LYS H H 438 8.390 8.390 7.802 0.588 18990 13128 1 18 . 1 1 439 439 CYS N N 439 118.950 118.950 115.612 3.338 18990 13129 1 18 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.649 0.097 18990 13130 1 18 . 1 1 439 439 CYS C C 439 176.650 176.650 175.065 1.585 18990 13131 1 18 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.493 1.855 18990 13132 1 18 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.314 2.882 18990 13133 1 18 . 1 1 439 439 CYS H H 439 8.357 8.357 7.716 0.641 18990 13134 1 18 . 1 1 440 440 ARG N N 440 117.200 117.200 119.378 -2.178 18990 13135 1 18 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.110 -0.142 18990 13136 1 18 . 1 1 440 440 ARG C C 440 175.253 175.253 175.456 -0.203 18990 13137 1 18 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.902 -0.002 18990 13138 1 18 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.959 -1.918 18990 13139 1 18 . 1 1 440 440 ARG H H 440 8.065 8.065 7.876 0.189 18990 13140 1 18 . 1 1 441 441 THR N N 441 122.400 122.400 111.039 11.361 18990 13141 1 18 . 1 1 441 441 THR HA H 441 4.371 4.371 4.604 -0.233 18990 13142 1 18 . 1 1 441 441 THR C C 441 173.702 173.702 172.849 0.853 18990 13143 1 18 . 1 1 441 441 THR CA C 441 63.194 63.194 59.333 3.861 18990 13144 1 18 . 1 1 441 441 THR CB C 441 68.933 68.933 69.396 -0.463 18990 13145 1 18 . 1 1 441 441 THR H H 441 8.643 8.643 7.593 1.050 18990 13146 1 18 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.576 -0.429 18990 13147 1 18 . 1 1 442 442 PRO C C 442 176.215 176.215 175.928 0.287 18990 13148 1 18 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.548 1.649 18990 13149 1 18 . 1 1 442 442 PRO CB C 442 32.044 32.044 30.649 1.395 18990 13150 1 18 . 1 1 443 443 THR N N 443 122.932 122.932 122.398 0.534 18990 13151 1 18 . 1 1 443 443 THR HA H 443 4.665 4.665 4.424 0.241 18990 13152 1 18 . 1 1 443 443 THR C C 443 172.133 172.133 173.899 -1.766 18990 13153 1 18 . 1 1 443 443 THR CA C 443 62.566 62.566 63.180 -0.614 18990 13154 1 18 . 1 1 443 443 THR CB C 443 71.562 71.562 70.229 1.333 18990 13155 1 18 . 1 1 443 443 THR H H 443 9.116 9.116 8.680 0.436 18990 13156 1 18 . 1 1 444 444 GLU N N 444 126.390 126.390 126.955 -0.565 18990 13157 1 18 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.615 0.327 18990 13158 1 18 . 1 1 444 444 GLU C C 444 175.292 175.292 175.830 -0.538 18990 13159 1 18 . 1 1 444 444 GLU CA C 444 55.049 55.049 55.323 -0.274 18990 13160 1 18 . 1 1 444 444 GLU CB C 444 31.861 31.861 31.886 -0.024 18990 13161 1 18 . 1 1 444 444 GLU H H 444 8.720 8.720 8.712 0.008 18990 13162 1 18 . 1 1 445 445 ARG N N 445 123.505 123.505 122.206 1.299 18990 13163 1 18 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.506 -0.795 18990 13164 1 18 . 1 1 445 445 ARG C C 445 175.289 175.289 174.709 0.580 18990 13165 1 18 . 1 1 445 445 ARG CA C 445 55.856 55.856 55.158 0.698 18990 13166 1 18 . 1 1 445 445 ARG CB C 445 30.675 30.675 31.650 -0.975 18990 13167 1 18 . 1 1 445 445 ARG H H 445 8.157 8.157 8.296 -0.139 18990 13168 1 18 . 1 1 446 446 ASP N N 446 126.800 126.800 121.416 5.384 18990 13169 1 18 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.611 0.030 18990 13170 1 18 . 1 1 446 446 ASP C C 446 176.020 176.020 176.389 -0.369 18990 13171 1 18 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.491 -0.539 18990 13172 1 18 . 1 1 446 446 ASP CB C 446 41.400 41.400 42.834 -1.434 18990 13173 1 18 . 1 1 446 446 ASP H H 446 8.476 8.476 8.443 0.033 18990 13174 1 18 . 1 1 447 447 GLY N N 447 111.262 111.262 110.652 0.610 18990 13175 1 18 . 1 1 447 447 GLY C C 447 174.073 174.073 173.675 0.398 18990 13176 1 18 . 1 1 447 447 GLY CA C 447 45.832 45.832 44.907 0.925 18990 13177 1 18 . 1 1 447 447 GLY H H 447 8.056 8.056 8.513 -0.457 18990 13178 1 18 . 1 1 448 448 GLY N N 448 108.655 108.655 108.523 0.132 18990 13179 1 18 . 1 1 448 448 GLY C C 448 174.020 174.020 173.901 0.119 18990 13180 1 18 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.947 0.320 18990 13181 1 18 . 1 1 448 448 GLY H H 448 8.380 8.380 8.098 0.282 18990 13182 1 18 . 1 1 449 449 CYS N N 449 120.628 120.628 120.071 0.557 18990 13183 1 18 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.800 -0.803 18990 13184 1 18 . 1 1 449 449 CYS C C 449 174.855 174.855 174.398 0.457 18990 13185 1 18 . 1 1 449 449 CYS CA C 449 59.291 59.291 55.982 3.309 18990 13186 1 18 . 1 1 449 449 CYS CB C 449 28.000 28.000 31.135 -3.135 18990 13187 1 18 . 1 1 449 449 CYS H H 449 7.832 7.832 7.907 -0.075 18990 13188 1 18 . 1 1 450 450 MET N N 450 123.947 123.947 117.275 6.672 18990 13189 1 18 . 1 1 450 450 MET HA H 450 4.551 4.551 4.555 -0.004 18990 13190 1 18 . 1 1 450 450 MET C C 450 174.658 174.658 175.200 -0.542 18990 13191 1 18 . 1 1 450 450 MET CA C 450 54.970 54.970 55.718 -0.748 18990 13192 1 18 . 1 1 450 450 MET CB C 450 34.100 34.100 33.308 0.792 18990 13193 1 18 . 1 1 450 450 MET H H 450 8.916 8.916 8.440 0.476 18990 13194 1 18 . 1 1 451 451 HIS N N 451 120.490 120.490 120.338 0.152 18990 13195 1 18 . 1 1 451 451 HIS HA H 451 3.679 3.679 3.690 -0.011 18990 13196 1 18 . 1 1 451 451 HIS C C 451 172.443 172.443 173.941 -1.498 18990 13197 1 18 . 1 1 451 451 HIS CA C 451 53.812 53.812 55.700 -1.888 18990 13198 1 18 . 1 1 451 451 HIS CB C 451 28.900 28.900 29.112 -0.212 18990 13199 1 18 . 1 1 451 451 HIS H H 451 7.557 7.557 7.703 -0.146 18990 13200 1 18 . 1 1 452 452 MET N N 452 128.800 128.800 125.156 3.644 18990 13201 1 18 . 1 1 452 452 MET HA H 452 4.320 4.320 4.446 -0.126 18990 13202 1 18 . 1 1 452 452 MET C C 452 175.479 175.479 173.880 1.599 18990 13203 1 18 . 1 1 452 452 MET CA C 452 52.589 52.589 53.319 -0.730 18990 13204 1 18 . 1 1 452 452 MET CB C 452 28.074 28.074 31.461 -3.387 18990 13205 1 18 . 1 1 452 452 MET H H 452 9.087 9.087 7.824 1.263 18990 13206 1 18 . 1 1 453 453 VAL N N 453 122.200 122.200 123.630 -1.430 18990 13207 1 18 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.365 0.429 18990 13208 1 18 . 1 1 453 453 VAL C C 453 175.476 175.476 175.328 0.148 18990 13209 1 18 . 1 1 453 453 VAL CA C 453 61.380 61.380 60.582 0.798 18990 13210 1 18 . 1 1 453 453 VAL CB C 453 33.089 33.089 31.845 1.244 18990 13211 1 18 . 1 1 453 453 VAL H H 453 8.016 8.016 8.385 -0.369 18990 13212 1 18 . 1 1 454 454 CYS N N 454 130.353 130.353 129.302 1.051 18990 13213 1 18 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.705 -0.110 18990 13214 1 18 . 1 1 454 454 CYS C C 454 177.833 177.833 175.014 2.819 18990 13215 1 18 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.828 2.743 18990 13216 1 18 . 1 1 454 454 CYS CB C 454 32.045 32.045 27.202 4.843 18990 13217 1 18 . 1 1 454 454 CYS H H 454 8.989 8.989 8.691 0.298 18990 13218 1 18 . 1 1 455 455 THR N N 455 119.000 119.000 123.681 -4.681 18990 13219 1 18 . 1 1 455 455 THR HA H 455 4.393 4.393 4.482 -0.089 18990 13220 1 18 . 1 1 455 455 THR C C 455 175.264 175.264 173.854 1.410 18990 13221 1 18 . 1 1 455 455 THR CA C 455 61.644 61.644 61.583 0.061 18990 13222 1 18 . 1 1 455 455 THR CB C 455 69.400 69.400 68.139 1.261 18990 13223 1 18 . 1 1 455 455 THR H H 455 8.533 8.533 8.551 -0.018 18990 13224 1 18 . 1 1 456 456 ARG N N 456 128.900 128.900 127.038 1.862 18990 13225 1 18 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.595 -0.370 18990 13226 1 18 . 1 1 456 456 ARG C C 456 177.782 177.782 175.046 2.736 18990 13227 1 18 . 1 1 456 456 ARG CA C 456 56.950 56.950 55.026 1.923 18990 13228 1 18 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.924 -3.874 18990 13229 1 18 . 1 1 456 456 ARG H H 456 9.036 9.036 7.821 1.215 18990 13230 1 18 . 1 1 457 457 ALA N N 457 133.152 133.152 127.183 5.969 18990 13231 1 18 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.286 -0.140 18990 13232 1 18 . 1 1 457 457 ALA C C 457 178.757 178.757 177.708 1.049 18990 13233 1 18 . 1 1 457 457 ALA CA C 457 53.929 53.929 52.988 0.941 18990 13234 1 18 . 1 1 457 457 ALA CB C 457 17.710 17.710 18.041 -0.331 18990 13235 1 18 . 1 1 457 457 ALA H H 457 9.042 9.042 8.794 0.248 18990 13236 1 18 . 1 1 458 458 GLY N N 458 111.200 111.200 111.807 -0.607 18990 13237 1 18 . 1 1 458 458 GLY C C 458 173.558 173.558 174.148 -0.590 18990 13238 1 18 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.650 0.786 18990 13239 1 18 . 1 1 458 458 GLY H H 458 8.830 8.830 8.698 0.132 18990 13240 1 18 . 1 1 459 459 CYS N N 459 123.040 123.040 120.350 2.690 18990 13241 1 18 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.802 -0.180 18990 13242 1 18 . 1 1 459 459 CYS C C 459 176.591 176.591 175.035 1.556 18990 13243 1 18 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.225 1.274 18990 13244 1 18 . 1 1 459 459 CYS CB C 459 30.174 30.174 28.989 1.185 18990 13245 1 18 . 1 1 459 459 CYS H H 459 8.042 8.042 8.182 -0.140 18990 13246 1 18 . 1 1 460 460 GLY N N 460 104.500 104.500 111.392 -6.892 18990 13247 1 18 . 1 1 460 460 GLY C C 460 173.716 173.716 173.830 -0.114 18990 13248 1 18 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.585 0.423 18990 13249 1 18 . 1 1 460 460 GLY H H 460 7.705 7.705 8.440 -0.735 18990 13250 1 18 . 1 1 461 461 PHE N N 461 124.949 124.949 120.245 4.704 18990 13251 1 18 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.836 -0.256 18990 13252 1 18 . 1 1 461 461 PHE C C 461 174.447 174.447 173.714 0.733 18990 13253 1 18 . 1 1 461 461 PHE CA C 461 59.946 59.946 56.600 3.345 18990 13254 1 18 . 1 1 461 461 PHE CB C 461 41.300 41.300 42.115 -0.815 18990 13255 1 18 . 1 1 461 461 PHE H H 461 8.947 8.947 7.709 1.238 18990 13256 1 18 . 1 1 462 462 GLU N N 462 125.272 125.272 126.875 -1.603 18990 13257 1 18 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.848 0.873 18990 13258 1 18 . 1 1 462 462 GLU C C 462 176.067 176.067 175.128 0.939 18990 13259 1 18 . 1 1 462 462 GLU CA C 462 54.624 54.624 55.393 -0.769 18990 13260 1 18 . 1 1 462 462 GLU CB C 462 31.255 31.255 31.480 -0.225 18990 13261 1 18 . 1 1 462 462 GLU H H 462 7.799 7.799 8.325 -0.526 18990 13262 1 18 . 1 1 463 463 TRP N N 463 121.524 121.524 119.359 2.165 18990 13263 1 18 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.251 0.255 18990 13264 1 18 . 1 1 463 463 TRP C C 463 172.844 172.844 174.430 -1.586 18990 13265 1 18 . 1 1 463 463 TRP CA C 463 53.771 53.771 55.741 -1.970 18990 13266 1 18 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.323 0.413 18990 13267 1 18 . 1 1 463 463 TRP H H 463 9.300 9.300 8.222 1.078 18990 13268 1 18 . 1 1 464 464 CYS N N 464 120.868 120.868 120.072 0.796 18990 13269 1 18 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.850 0.566 18990 13270 1 18 . 1 1 464 464 CYS C C 464 177.213 177.213 176.489 0.724 18990 13271 1 18 . 1 1 464 464 CYS CA C 464 57.776 57.776 59.977 -2.201 18990 13272 1 18 . 1 1 464 464 CYS CB C 464 32.930 32.930 28.624 4.306 18990 13273 1 18 . 1 1 464 464 CYS H H 464 8.752 8.752 9.190 -0.438 18990 13274 1 18 . 1 1 465 465 TRP N N 465 131.209 131.209 126.108 5.101 18990 13275 1 18 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.435 -0.008 18990 13276 1 18 . 1 1 465 465 TRP C C 465 176.051 176.051 175.675 0.376 18990 13277 1 18 . 1 1 465 465 TRP CA C 465 60.763 60.763 60.226 0.537 18990 13278 1 18 . 1 1 465 465 TRP CB C 465 31.126 31.126 30.037 1.089 18990 13279 1 18 . 1 1 465 465 TRP H H 465 9.809 9.809 8.233 1.576 18990 13280 1 18 . 1 1 466 466 VAL N N 466 118.233 118.233 112.478 5.755 18990 13281 1 18 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.569 0.055 18990 13282 1 18 . 1 1 466 466 VAL C C 466 178.943 178.943 175.910 3.033 18990 13283 1 18 . 1 1 466 466 VAL CA C 466 65.602 65.602 63.290 2.312 18990 13284 1 18 . 1 1 466 466 VAL CB C 466 33.172 33.172 31.544 1.628 18990 13285 1 18 . 1 1 466 466 VAL H H 466 8.627 8.627 7.847 0.780 18990 13286 1 18 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.717 -1.286 18990 13287 1 18 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.395 0.604 18990 13288 1 18 . 1 1 467 467 CYS CB C 467 31.870 31.870 27.679 4.191 18990 13289 1 18 . 1 1 467 467 CYS H H 467 7.820 7.820 7.803 0.017 18990 13290 1 18 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.533 -0.497 18990 13291 1 18 . 1 1 468 468 GLN CA C 468 58.051 58.051 56.390 1.661 18990 13292 1 18 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.213 -1.738 18990 13293 1 18 . 1 1 469 469 THR HA H 469 4.685 4.685 4.759 -0.074 18990 13294 1 18 . 1 1 469 469 THR C C 469 173.351 173.351 173.062 0.289 18990 13295 1 18 . 1 1 469 469 THR CA C 469 59.176 59.176 60.247 -1.071 18990 13296 1 18 . 1 1 469 469 THR CB C 469 71.775 71.775 71.336 0.439 18990 13297 1 18 . 1 1 470 470 GLU N N 470 120.940 120.940 119.177 1.763 18990 13298 1 18 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.829 -0.536 18990 13299 1 18 . 1 1 470 470 GLU C C 470 175.539 175.539 176.499 -0.960 18990 13300 1 18 . 1 1 470 470 GLU CA C 470 57.015 57.015 54.644 2.372 18990 13301 1 18 . 1 1 470 470 GLU CB C 470 29.965 29.965 31.587 -1.622 18990 13302 1 18 . 1 1 470 470 GLU H H 470 8.912 8.912 8.570 0.342 18990 13303 1 18 . 1 1 471 471 TRP N N 471 126.998 126.998 122.020 4.978 18990 13304 1 18 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.370 -0.077 18990 13305 1 18 . 1 1 471 471 TRP C C 471 175.408 175.408 175.231 0.177 18990 13306 1 18 . 1 1 471 471 TRP CA C 471 58.220 58.220 56.462 1.758 18990 13307 1 18 . 1 1 471 471 TRP CB C 471 29.500 29.500 27.975 1.525 18990 13308 1 18 . 1 1 471 471 TRP H H 471 8.350 8.350 7.861 0.489 18990 13309 1 18 . 1 1 472 472 THR N N 472 117.480 117.480 115.376 2.104 18990 13310 1 18 . 1 1 472 472 THR HA H 472 4.444 4.444 4.560 -0.116 18990 13311 1 18 . 1 1 472 472 THR CA C 472 58.930 58.930 59.668 -0.738 18990 13312 1 18 . 1 1 472 472 THR H H 472 8.069 8.069 7.719 0.350 18990 13313 1 18 . 1 1 473 473 ARG HA H 473 3.773 3.773 4.301 -0.528 18990 13314 1 18 . 1 1 473 473 ARG C C 473 178.053 178.053 177.674 0.379 18990 13315 1 18 . 1 1 473 473 ARG CA C 473 58.088 58.088 58.398 -0.310 18990 13316 1 18 . 1 1 473 473 ARG CB C 473 29.426 29.426 29.736 -0.310 18990 13317 1 18 . 1 1 474 474 ASP N N 474 119.900 119.900 118.148 1.752 18990 13318 1 18 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.479 -0.264 18990 13319 1 18 . 1 1 474 474 ASP C C 474 178.197 178.197 177.249 0.948 18990 13320 1 18 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.522 0.280 18990 13321 1 18 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.322 -0.140 18990 13322 1 18 . 1 1 474 474 ASP H H 474 7.718 7.718 8.683 -0.965 18990 13323 1 18 . 1 1 475 475 CYS N N 475 121.000 121.000 117.686 3.314 18990 13324 1 18 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.755 -1.388 18990 13325 1 18 . 1 1 475 475 CYS CA C 475 64.533 64.533 60.316 4.217 18990 13326 1 18 . 1 1 475 475 CYS CB C 475 29.092 29.092 27.697 1.395 18990 13327 1 18 . 1 1 475 475 CYS H H 475 6.953 6.953 7.682 -0.729 18990 13328 1 18 . 1 1 476 476 MET HA H 476 4.021 4.021 4.020 0.001 18990 13329 1 18 . 1 1 476 476 MET CA C 476 58.010 58.010 58.126 -0.116 18990 13330 1 18 . 1 1 476 476 MET CB C 476 32.550 32.550 32.258 0.292 18990 13331 1 18 . 1 1 477 477 GLY N N 477 111.938 111.938 103.778 8.160 18990 13332 1 18 . 1 1 477 477 GLY C C 477 174.406 174.406 173.577 0.829 18990 13333 1 18 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.905 0.711 18990 13334 1 18 . 1 1 477 477 GLY H H 477 9.155 9.155 7.980 1.175 18990 13335 1 18 . 1 1 478 478 ALA N N 478 121.900 121.900 124.789 -2.889 18990 13336 1 18 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.743 -0.452 18990 13337 1 18 . 1 1 478 478 ALA C C 478 178.196 178.196 177.610 0.586 18990 13338 1 18 . 1 1 478 478 ALA CA C 478 53.440 53.440 53.191 0.249 18990 13339 1 18 . 1 1 478 478 ALA CB C 478 20.390 20.390 20.491 -0.101 18990 13340 1 18 . 1 1 478 478 ALA H H 478 7.347 7.347 7.636 -0.289 18990 13341 1 18 . 1 1 479 479 HIS N N 479 115.200 115.200 111.489 3.711 18990 13342 1 18 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.923 -0.020 18990 13343 1 18 . 1 1 479 479 HIS C C 479 173.325 173.325 175.759 -2.434 18990 13344 1 18 . 1 1 479 479 HIS CA C 479 54.526 54.526 54.793 -0.267 18990 13345 1 18 . 1 1 479 479 HIS CB C 479 27.600 27.600 30.699 -3.099 18990 13346 1 18 . 1 1 479 479 HIS H H 479 8.297 8.297 7.926 0.371 18990 13347 1 18 . 1 1 480 480 TRP N N 480 121.780 121.780 122.839 -1.059 18990 13348 1 18 . 1 1 480 480 TRP HA H 480 4.295 4.295 3.999 0.296 18990 13349 1 18 . 1 1 480 480 TRP C C 480 175.568 175.568 174.789 0.779 18990 13350 1 18 . 1 1 480 480 TRP CA C 480 58.358 58.358 59.636 -1.278 18990 13351 1 18 . 1 1 480 480 TRP CB C 480 29.550 29.550 29.967 -0.417 18990 13352 1 18 . 1 1 480 480 TRP H H 480 8.081 8.081 7.466 0.615 18990 13353 1 18 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.381 0.464 18990 13354 1 18 . 1 1 481 481 PHE C C 481 175.126 175.126 174.325 0.801 18990 13355 1 18 . 1 1 481 481 PHE CA C 481 56.471 56.471 56.810 -0.339 18990 13356 1 18 . 1 1 481 481 PHE CB C 481 41.006 41.006 39.541 1.466 18990 13357 1 19 . 1 1 343 343 GLU N N 343 121.045 121.045 120.685 0.360 18990 13358 1 19 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.106 0.059 18990 13359 1 19 . 1 1 343 343 GLU C C 343 176.529 176.529 174.851 1.678 18990 13360 1 19 . 1 1 343 343 GLU CA C 343 57.162 57.162 56.898 0.264 18990 13361 1 19 . 1 1 343 343 GLU CB C 343 30.204 30.204 29.334 0.870 18990 13362 1 19 . 1 1 343 343 GLU H H 343 8.293 8.293 8.463 -0.170 18990 13363 1 19 . 1 1 344 344 TYR N N 344 121.000 121.000 121.430 -0.430 18990 13364 1 19 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.807 -0.269 18990 13365 1 19 . 1 1 344 344 TYR C C 344 175.897 175.897 175.148 0.749 18990 13366 1 19 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.636 0.543 18990 13367 1 19 . 1 1 344 344 TYR CB C 344 38.600 38.600 40.180 -1.580 18990 13368 1 19 . 1 1 344 344 TYR H H 344 8.040 8.040 8.252 -0.212 18990 13369 1 19 . 1 1 345 345 VAL N N 345 121.900 121.900 127.371 -5.471 18990 13370 1 19 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.057 -0.118 18990 13371 1 19 . 1 1 345 345 VAL C C 345 176.143 176.143 175.579 0.564 18990 13372 1 19 . 1 1 345 345 VAL CA C 345 62.867 62.867 62.699 0.168 18990 13373 1 19 . 1 1 345 345 VAL CB C 345 32.799 32.799 31.355 1.444 18990 13374 1 19 . 1 1 345 345 VAL H H 345 7.856 7.856 8.098 -0.242 18990 13375 1 19 . 1 1 346 346 LEU N N 346 124.950 124.950 125.028 -0.078 18990 13376 1 19 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.736 -0.493 18990 13377 1 19 . 1 1 346 346 LEU C C 346 177.747 177.747 176.617 1.130 18990 13378 1 19 . 1 1 346 346 LEU CA C 346 55.500 55.500 55.002 0.499 18990 13379 1 19 . 1 1 346 346 LEU CB C 346 42.252 42.252 42.114 0.138 18990 13380 1 19 . 1 1 346 346 LEU H H 346 8.127 8.127 8.444 -0.317 18990 13381 1 19 . 1 1 347 347 GLN N N 347 121.452 121.452 118.426 3.026 18990 13382 1 19 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.443 -0.157 18990 13383 1 19 . 1 1 347 347 GLN C C 347 175.833 175.833 175.036 0.797 18990 13384 1 19 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.462 0.526 18990 13385 1 19 . 1 1 347 347 GLN CB C 347 29.375 29.375 29.831 -0.456 18990 13386 1 19 . 1 1 347 347 GLN H H 347 8.270 8.270 7.796 0.474 18990 13387 1 19 . 1 1 348 348 ALA N N 348 124.466 124.466 126.559 -2.093 18990 13388 1 19 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.806 -0.485 18990 13389 1 19 . 1 1 348 348 ALA C C 348 177.929 177.929 176.378 1.551 18990 13390 1 19 . 1 1 348 348 ALA CA C 348 52.703 52.703 52.312 0.391 18990 13391 1 19 . 1 1 348 348 ALA CB C 348 19.002 19.002 20.041 -1.039 18990 13392 1 19 . 1 1 348 348 ALA H H 348 8.227 8.227 8.659 -0.432 18990 13393 1 19 . 1 1 349 349 GLY N N 349 108.193 108.193 107.068 1.125 18990 13394 1 19 . 1 1 349 349 GLY C C 349 174.269 174.269 172.160 2.109 18990 13395 1 19 . 1 1 349 349 GLY CA C 349 45.227 45.227 45.394 -0.167 18990 13396 1 19 . 1 1 349 349 GLY H H 349 8.298 8.298 8.118 0.180 18990 13397 1 19 . 1 1 350 350 GLY N N 350 108.073 108.073 110.007 -1.934 18990 13398 1 19 . 1 1 350 350 GLY C C 350 172.979 172.979 173.467 -0.488 18990 13399 1 19 . 1 1 350 350 GLY CA C 350 44.935 44.935 45.012 -0.077 18990 13400 1 19 . 1 1 350 350 GLY H H 350 8.156 8.156 8.278 -0.122 18990 13401 1 19 . 1 1 351 351 VAL N N 351 119.058 119.058 120.200 -1.142 18990 13402 1 19 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.833 -0.417 18990 13403 1 19 . 1 1 351 351 VAL C C 351 173.412 173.412 174.316 -0.904 18990 13404 1 19 . 1 1 351 351 VAL CA C 351 60.663 60.663 59.632 1.031 18990 13405 1 19 . 1 1 351 351 VAL CB C 351 34.866 34.866 34.709 0.157 18990 13406 1 19 . 1 1 351 351 VAL H H 351 8.541 8.541 8.669 -0.128 18990 13407 1 19 . 1 1 352 352 LEU N N 352 125.800 125.800 119.634 6.166 18990 13408 1 19 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.719 0.046 18990 13409 1 19 . 1 1 352 352 LEU C C 352 176.218 176.218 175.845 0.373 18990 13410 1 19 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.645 -0.304 18990 13411 1 19 . 1 1 352 352 LEU CB C 352 42.706 42.706 45.541 -2.834 18990 13412 1 19 . 1 1 352 352 LEU H H 352 8.151 8.151 8.168 -0.017 18990 13413 1 19 . 1 1 353 353 CYS N N 353 126.825 126.825 123.274 3.551 18990 13414 1 19 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.139 -0.032 18990 13415 1 19 . 1 1 353 353 CYS C C 353 176.655 176.655 174.742 1.913 18990 13416 1 19 . 1 1 353 353 CYS CA C 353 57.731 57.731 58.032 -0.301 18990 13417 1 19 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.192 4.673 18990 13418 1 19 . 1 1 353 353 CYS H H 353 8.794 8.794 8.552 0.242 18990 13419 1 19 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.046 0.374 18990 13420 1 19 . 1 1 354 354 PRO C C 354 177.512 177.512 176.214 1.298 18990 13421 1 19 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.800 -0.808 18990 13422 1 19 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.409 1.158 18990 13423 1 19 . 1 1 355 355 GLN N N 355 126.800 126.800 119.379 7.421 18990 13424 1 19 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.456 -0.181 18990 13425 1 19 . 1 1 355 355 GLN C C 355 175.516 175.516 174.984 0.532 18990 13426 1 19 . 1 1 355 355 GLN CA C 355 54.793 54.793 53.020 1.773 18990 13427 1 19 . 1 1 355 355 GLN CB C 355 28.547 28.547 29.541 -0.994 18990 13428 1 19 . 1 1 355 355 GLN H H 355 9.033 9.033 7.399 1.634 18990 13429 1 19 . 1 1 357 357 GLY C C 357 173.229 173.229 174.873 -1.644 18990 13430 1 19 . 1 1 357 357 GLY CA C 357 45.254 45.254 45.299 -0.045 18990 13431 1 19 . 1 1 358 358 CYS N N 358 123.500 123.500 120.199 3.301 18990 13432 1 19 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.623 -0.090 18990 13433 1 19 . 1 1 358 358 CYS C C 358 176.157 176.157 176.329 -0.172 18990 13434 1 19 . 1 1 358 358 CYS CA C 358 60.268 60.268 59.823 0.445 18990 13435 1 19 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.515 0.860 18990 13436 1 19 . 1 1 358 358 CYS H H 358 7.720 7.720 7.683 0.037 18990 13437 1 19 . 1 1 359 359 GLY N N 359 104.400 104.400 109.367 -4.967 18990 13438 1 19 . 1 1 359 359 GLY C C 359 174.080 174.080 174.905 -0.825 18990 13439 1 19 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.275 -0.211 18990 13440 1 19 . 1 1 359 359 GLY H H 359 7.756 7.756 7.974 -0.218 18990 13441 1 19 . 1 1 360 360 MET N N 360 121.300 121.300 120.249 1.051 18990 13442 1 19 . 1 1 360 360 MET HA H 360 4.343 4.343 4.298 0.045 18990 13443 1 19 . 1 1 360 360 MET C C 360 175.641 175.641 177.043 -1.402 18990 13444 1 19 . 1 1 360 360 MET CA C 360 55.923 55.923 57.348 -1.425 18990 13445 1 19 . 1 1 360 360 MET CB C 360 33.091 33.091 33.887 -0.796 18990 13446 1 19 . 1 1 360 360 MET H H 360 8.229 8.229 7.606 0.623 18990 13447 1 19 . 1 1 361 361 GLY N N 361 109.000 109.000 105.842 3.158 18990 13448 1 19 . 1 1 361 361 GLY C C 361 173.774 173.774 172.928 0.846 18990 13449 1 19 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.547 1.291 18990 13450 1 19 . 1 1 361 361 GLY H H 361 8.347 8.347 8.038 0.309 18990 13451 1 19 . 1 1 362 362 LEU N N 362 126.725 126.725 125.230 1.495 18990 13452 1 19 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.892 -0.217 18990 13453 1 19 . 1 1 362 362 LEU C C 362 175.865 175.865 175.268 0.597 18990 13454 1 19 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.153 1.037 18990 13455 1 19 . 1 1 362 362 LEU CB C 362 44.050 44.050 44.511 -0.461 18990 13456 1 19 . 1 1 362 362 LEU H H 362 8.935 8.935 8.900 0.035 18990 13457 1 19 . 1 1 363 363 LEU N N 363 123.742 123.742 125.576 -1.834 18990 13458 1 19 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.673 0.004 18990 13459 1 19 . 1 1 363 363 LEU C C 363 176.162 176.162 176.099 0.063 18990 13460 1 19 . 1 1 363 363 LEU CA C 363 54.342 54.342 53.589 0.753 18990 13461 1 19 . 1 1 363 363 LEU CB C 363 42.210 42.210 43.125 -0.915 18990 13462 1 19 . 1 1 363 363 LEU H H 363 8.481 8.481 8.673 -0.192 18990 13463 1 19 . 1 1 364 364 VAL N N 364 120.980 120.980 127.123 -6.143 18990 13464 1 19 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.313 0.084 18990 13465 1 19 . 1 1 364 364 VAL C C 364 175.592 175.592 174.494 1.098 18990 13466 1 19 . 1 1 364 364 VAL CA C 364 60.460 60.460 61.134 -0.674 18990 13467 1 19 . 1 1 364 364 VAL CB C 364 34.125 34.125 32.614 1.511 18990 13468 1 19 . 1 1 364 364 VAL H H 364 8.155 8.155 8.903 -0.748 18990 13469 1 19 . 1 1 365 365 GLU N N 365 126.950 126.950 127.160 -0.210 18990 13470 1 19 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.635 -0.025 18990 13471 1 19 . 1 1 365 365 GLU C C 365 175.427 175.427 176.077 -0.650 18990 13472 1 19 . 1 1 365 365 GLU CA C 365 54.551 54.551 53.566 0.985 18990 13473 1 19 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.211 0.569 18990 13474 1 19 . 1 1 365 365 GLU H H 365 8.900 8.900 8.423 0.477 18990 13475 1 19 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.321 -0.059 18990 13476 1 19 . 1 1 366 366 PRO C C 366 177.013 177.013 176.262 0.751 18990 13477 1 19 . 1 1 366 366 PRO CA C 366 64.463 64.463 64.451 0.012 18990 13478 1 19 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.842 0.206 18990 13479 1 19 . 1 1 367 367 ASP N N 367 115.459 115.459 116.603 -1.144 18990 13480 1 19 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.675 -0.180 18990 13481 1 19 . 1 1 367 367 ASP C C 367 175.123 175.123 175.757 -0.634 18990 13482 1 19 . 1 1 367 367 ASP CA C 367 54.503 54.503 54.366 0.137 18990 13483 1 19 . 1 1 367 367 ASP CB C 367 40.123 40.123 41.209 -1.086 18990 13484 1 19 . 1 1 367 367 ASP H H 367 8.439 8.439 8.392 0.047 18990 13485 1 19 . 1 1 368 368 CYS N N 368 118.700 118.700 119.975 -1.275 18990 13486 1 19 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.532 0.038 18990 13487 1 19 . 1 1 368 368 CYS C C 368 173.806 173.806 173.572 0.234 18990 13488 1 19 . 1 1 368 368 CYS CA C 368 58.581 58.581 57.647 0.935 18990 13489 1 19 . 1 1 368 368 CYS CB C 368 28.450 28.450 30.321 -1.871 18990 13490 1 19 . 1 1 368 368 CYS H H 368 7.515 7.515 7.668 -0.153 18990 13491 1 19 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.412 -0.147 18990 13492 1 19 . 1 1 369 369 ARG C C 369 174.908 174.908 175.602 -0.694 18990 13493 1 19 . 1 1 369 369 ARG CA C 369 57.669 57.669 54.692 2.977 18990 13494 1 19 . 1 1 369 369 ARG CB C 369 32.274 32.274 29.938 2.336 18990 13495 1 19 . 1 1 370 370 LYS N N 370 121.022 121.022 123.227 -2.205 18990 13496 1 19 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.470 -0.300 18990 13497 1 19 . 1 1 370 370 LYS C C 370 174.868 174.868 175.524 -0.656 18990 13498 1 19 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.078 1.476 18990 13499 1 19 . 1 1 370 370 LYS CB C 370 33.140 33.140 31.070 2.070 18990 13500 1 19 . 1 1 370 370 LYS H H 370 7.740 7.740 7.443 0.297 18990 13501 1 19 . 1 1 371 371 VAL N N 371 128.362 128.362 125.842 2.520 18990 13502 1 19 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.118 0.015 18990 13503 1 19 . 1 1 371 371 VAL C C 371 173.402 173.402 174.619 -1.217 18990 13504 1 19 . 1 1 371 371 VAL CA C 371 60.777 60.777 61.526 -0.749 18990 13505 1 19 . 1 1 371 371 VAL CB C 371 33.000 33.000 30.688 2.312 18990 13506 1 19 . 1 1 371 371 VAL H H 371 8.647 8.647 7.812 0.835 18990 13507 1 19 . 1 1 372 372 THR N N 372 119.667 119.667 120.427 -0.760 18990 13508 1 19 . 1 1 372 372 THR HA H 372 5.032 5.032 4.704 0.329 18990 13509 1 19 . 1 1 372 372 THR C C 372 174.339 174.339 174.133 0.206 18990 13510 1 19 . 1 1 372 372 THR CA C 372 60.881 60.881 61.423 -0.542 18990 13511 1 19 . 1 1 372 372 THR CB C 372 70.471 70.471 71.790 -1.319 18990 13512 1 19 . 1 1 372 372 THR H H 372 8.087 8.087 8.005 0.082 18990 13513 1 19 . 1 1 373 373 CYS N N 373 132.554 132.554 127.289 5.265 18990 13514 1 19 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.557 0.245 18990 13515 1 19 . 1 1 373 373 CYS C C 373 176.791 176.791 176.291 0.500 18990 13516 1 19 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.215 -0.710 18990 13517 1 19 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.947 3.364 18990 13518 1 19 . 1 1 373 373 CYS H H 373 9.322 9.322 9.538 -0.216 18990 13519 1 19 . 1 1 374 374 GLN N N 374 125.890 125.890 124.113 1.777 18990 13520 1 19 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.207 -0.207 18990 13521 1 19 . 1 1 374 374 GLN C C 374 176.827 176.827 176.670 0.157 18990 13522 1 19 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.741 0.559 18990 13523 1 19 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.480 1.185 18990 13524 1 19 . 1 1 374 374 GLN H H 374 7.856 7.856 8.495 -0.639 18990 13525 1 19 . 1 1 375 375 ASN N N 375 115.342 115.342 115.030 0.312 18990 13526 1 19 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.861 0.026 18990 13527 1 19 . 1 1 375 375 ASN C C 375 174.049 174.049 174.472 -0.423 18990 13528 1 19 . 1 1 375 375 ASN CA C 375 53.047 53.047 52.856 0.191 18990 13529 1 19 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.034 -0.118 18990 13530 1 19 . 1 1 375 375 ASN H H 375 8.913 8.913 8.231 0.682 18990 13531 1 19 . 1 1 376 376 GLY N N 376 109.098 109.098 107.846 1.252 18990 13532 1 19 . 1 1 376 376 GLY C C 376 174.110 174.110 172.814 1.296 18990 13533 1 19 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.855 0.531 18990 13534 1 19 . 1 1 376 376 GLY H H 376 7.162 7.162 7.845 -0.683 18990 13535 1 19 . 1 1 377 377 CYS N N 377 132.546 132.546 122.248 10.298 18990 13536 1 19 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.802 -0.038 18990 13537 1 19 . 1 1 377 377 CYS C C 377 177.355 177.355 175.990 1.365 18990 13538 1 19 . 1 1 377 377 CYS CA C 377 59.988 59.988 56.574 3.414 18990 13539 1 19 . 1 1 377 377 CYS CB C 377 32.365 32.365 25.423 6.942 18990 13540 1 19 . 1 1 377 377 CYS H H 377 9.800 9.800 8.409 1.391 18990 13541 1 19 . 1 1 378 378 GLY N N 378 113.851 113.851 112.074 1.777 18990 13542 1 19 . 1 1 378 378 GLY C C 378 173.404 173.404 173.036 0.368 18990 13543 1 19 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.389 0.474 18990 13544 1 19 . 1 1 378 378 GLY H H 378 8.820 8.820 8.220 0.600 18990 13545 1 19 . 1 1 379 379 TYR N N 379 125.532 125.532 125.737 -0.205 18990 13546 1 19 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.789 -0.311 18990 13547 1 19 . 1 1 379 379 TYR C C 379 173.661 173.661 174.933 -1.272 18990 13548 1 19 . 1 1 379 379 TYR CA C 379 59.180 59.180 56.600 2.579 18990 13549 1 19 . 1 1 379 379 TYR CB C 379 40.108 40.108 42.376 -2.268 18990 13550 1 19 . 1 1 379 379 TYR H H 379 9.054 9.054 7.910 1.144 18990 13551 1 19 . 1 1 380 380 VAL N N 380 124.461 124.461 123.561 0.900 18990 13552 1 19 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.155 0.663 18990 13553 1 19 . 1 1 380 380 VAL C C 380 175.876 175.876 174.527 1.349 18990 13554 1 19 . 1 1 380 380 VAL CA C 380 60.797 60.797 62.053 -1.256 18990 13555 1 19 . 1 1 380 380 VAL CB C 380 32.610 32.610 30.868 1.742 18990 13556 1 19 . 1 1 380 380 VAL H H 380 7.238 7.238 7.836 -0.598 18990 13557 1 19 . 1 1 381 381 PHE N N 381 124.588 124.588 123.864 0.724 18990 13558 1 19 . 1 1 381 381 PHE HA H 381 5.273 5.273 5.151 0.122 18990 13559 1 19 . 1 1 381 381 PHE C C 381 173.242 173.242 173.626 -0.384 18990 13560 1 19 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.294 -0.084 18990 13561 1 19 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.359 1.731 18990 13562 1 19 . 1 1 381 381 PHE H H 381 9.424 9.424 7.807 1.617 18990 13563 1 19 . 1 1 382 382 CYS N N 382 120.221 120.221 120.128 0.093 18990 13564 1 19 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.702 0.200 18990 13565 1 19 . 1 1 382 382 CYS C C 382 177.165 177.165 176.021 1.144 18990 13566 1 19 . 1 1 382 382 CYS CA C 382 57.691 57.691 57.380 0.311 18990 13567 1 19 . 1 1 382 382 CYS CB C 382 32.475 32.475 30.463 2.012 18990 13568 1 19 . 1 1 382 382 CYS H H 382 8.673 8.673 8.383 0.290 18990 13569 1 19 . 1 1 383 383 ARG N N 383 129.347 129.347 120.528 8.819 18990 13570 1 19 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.208 -0.187 18990 13571 1 19 . 1 1 383 383 ARG C C 383 175.012 175.012 176.872 -1.860 18990 13572 1 19 . 1 1 383 383 ARG CA C 383 58.686 58.686 58.731 -0.045 18990 13573 1 19 . 1 1 383 383 ARG CB C 383 30.900 30.900 30.269 0.631 18990 13574 1 19 . 1 1 383 383 ARG H H 383 9.534 9.534 8.712 0.822 18990 13575 1 19 . 1 1 384 384 ASN N N 384 117.772 117.772 115.932 1.840 18990 13576 1 19 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.816 -0.108 18990 13577 1 19 . 1 1 384 384 ASN C C 384 175.656 175.656 174.443 1.213 18990 13578 1 19 . 1 1 384 384 ASN CA C 384 55.778 55.778 53.979 1.799 18990 13579 1 19 . 1 1 384 384 ASN CB C 384 39.475 39.475 40.025 -0.550 18990 13580 1 19 . 1 1 384 384 ASN H H 384 8.840 8.840 8.663 0.177 18990 13581 1 19 . 1 1 385 385 CYS N N 385 115.876 115.876 113.717 2.159 18990 13582 1 19 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.803 0.225 18990 13583 1 19 . 1 1 385 385 CYS C C 385 175.703 175.703 173.015 2.688 18990 13584 1 19 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.573 1.539 18990 13585 1 19 . 1 1 385 385 CYS CB C 385 32.359 32.359 29.995 2.364 18990 13586 1 19 . 1 1 385 385 CYS H H 385 7.868 7.868 7.772 0.096 18990 13587 1 19 . 1 1 386 386 LEU N N 386 120.082 120.082 119.884 0.198 18990 13588 1 19 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.787 -0.474 18990 13589 1 19 . 1 1 386 386 LEU C C 386 175.722 175.722 177.087 -1.365 18990 13590 1 19 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.164 2.845 18990 13591 1 19 . 1 1 386 386 LEU CB C 386 38.412 38.412 41.825 -3.413 18990 13592 1 19 . 1 1 386 386 LEU H H 386 8.514 8.514 8.520 -0.006 18990 13593 1 19 . 1 1 387 387 GLN N N 387 117.579 117.579 119.191 -1.612 18990 13594 1 19 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.422 0.354 18990 13595 1 19 . 1 1 387 387 GLN C C 387 175.299 175.299 177.040 -1.741 18990 13596 1 19 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.641 -1.624 18990 13597 1 19 . 1 1 387 387 GLN CB C 387 30.307 30.307 29.000 1.307 18990 13598 1 19 . 1 1 387 387 GLN H H 387 8.248 8.248 7.857 0.391 18990 13599 1 19 . 1 1 388 388 GLY N N 388 106.107 106.107 106.428 -0.321 18990 13600 1 19 . 1 1 388 388 GLY C C 388 173.693 173.693 174.148 -0.455 18990 13601 1 19 . 1 1 388 388 GLY CA C 388 46.180 46.180 44.975 1.205 18990 13602 1 19 . 1 1 388 388 GLY H H 388 8.695 8.695 8.242 0.453 18990 13603 1 19 . 1 1 389 389 TYR N N 389 122.514 122.514 117.732 4.782 18990 13604 1 19 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.090 -0.432 18990 13605 1 19 . 1 1 389 389 TYR C C 389 172.860 172.860 173.983 -1.123 18990 13606 1 19 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.712 4.275 18990 13607 1 19 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.716 0.336 18990 13608 1 19 . 1 1 389 389 TYR H H 389 7.923 7.923 8.222 -0.299 18990 13609 1 19 . 1 1 390 390 HIS N N 390 120.080 120.080 125.278 -5.198 18990 13610 1 19 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.759 -0.051 18990 13611 1 19 . 1 1 390 390 HIS C C 390 173.235 173.235 173.813 -0.578 18990 13612 1 19 . 1 1 390 390 HIS CA C 390 51.431 51.431 53.343 -1.912 18990 13613 1 19 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.868 0.032 18990 13614 1 19 . 1 1 390 390 HIS H H 390 5.291 5.291 7.488 -2.197 18990 13615 1 19 . 1 1 391 391 ILE N N 391 117.810 117.810 121.509 -3.699 18990 13616 1 19 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.008 0.108 18990 13617 1 19 . 1 1 391 391 ILE C C 391 178.208 178.208 176.668 1.540 18990 13618 1 19 . 1 1 391 391 ILE CA C 391 60.877 60.877 61.132 -0.255 18990 13619 1 19 . 1 1 391 391 ILE CB C 391 39.034 39.034 36.423 2.611 18990 13620 1 19 . 1 1 391 391 ILE H H 391 8.418 8.418 8.513 -0.095 18990 13621 1 19 . 1 1 392 392 GLY N N 392 112.387 112.387 116.147 -3.760 18990 13622 1 19 . 1 1 392 392 GLY C C 392 173.565 173.565 172.764 0.801 18990 13623 1 19 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.643 0.615 18990 13624 1 19 . 1 1 392 392 GLY H H 392 8.654 8.654 8.323 0.331 18990 13625 1 19 . 1 1 393 393 GLU N N 393 119.098 119.098 120.338 -1.240 18990 13626 1 19 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.789 -0.500 18990 13627 1 19 . 1 1 393 393 GLU C C 393 176.899 176.899 175.864 1.035 18990 13628 1 19 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.109 1.323 18990 13629 1 19 . 1 1 393 393 GLU CB C 393 30.470 30.470 32.379 -1.909 18990 13630 1 19 . 1 1 393 393 GLU H H 393 8.391 8.391 8.500 -0.109 18990 13631 1 19 . 1 1 394 394 CYS N N 394 122.845 122.845 120.029 2.816 18990 13632 1 19 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.664 -0.898 18990 13633 1 19 . 1 1 394 394 CYS C C 394 175.461 175.461 175.229 0.232 18990 13634 1 19 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.643 1.192 18990 13635 1 19 . 1 1 394 394 CYS CB C 394 30.761 30.761 27.882 2.879 18990 13636 1 19 . 1 1 394 394 CYS H H 394 8.474 8.474 8.546 -0.072 18990 13637 1 19 . 1 1 395 395 LEU N N 395 124.403 124.403 123.260 1.143 18990 13638 1 19 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.666 -0.162 18990 13639 1 19 . 1 1 395 395 LEU C C 395 175.259 175.259 175.998 -0.739 18990 13640 1 19 . 1 1 395 395 LEU CA C 395 52.835 52.835 53.727 -0.892 18990 13641 1 19 . 1 1 395 395 LEU CB C 395 41.436 41.436 41.375 0.061 18990 13642 1 19 . 1 1 395 395 LEU H H 395 8.418 8.418 8.040 0.378 18990 13643 1 19 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.756 -0.386 18990 13644 1 19 . 1 1 396 396 PRO C C 396 177.006 177.006 176.734 0.272 18990 13645 1 19 . 1 1 396 396 PRO CA C 396 63.096 63.096 61.917 1.179 18990 13646 1 19 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.499 -0.427 18990 13647 1 19 . 1 1 397 397 GLU N N 397 121.574 121.574 117.878 3.696 18990 13648 1 19 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.152 0.073 18990 13649 1 19 . 1 1 397 397 GLU C C 397 177.202 177.202 176.987 0.215 18990 13650 1 19 . 1 1 397 397 GLU CA C 397 57.034 57.034 57.240 -0.206 18990 13651 1 19 . 1 1 397 397 GLU CB C 397 30.263 30.263 29.759 0.504 18990 13652 1 19 . 1 1 397 397 GLU H H 397 8.568 8.568 8.526 0.042 18990 13653 1 19 . 1 1 398 398 GLY N N 398 110.495 110.495 108.536 1.959 18990 13654 1 19 . 1 1 398 398 GLY C C 398 174.579 174.579 173.235 1.344 18990 13655 1 19 . 1 1 398 398 GLY CA C 398 45.462 45.462 44.963 0.499 18990 13656 1 19 . 1 1 398 398 GLY H H 398 8.515 8.515 8.300 0.215 18990 13657 1 19 . 1 1 399 399 THR N N 399 113.234 113.234 113.387 -0.153 18990 13658 1 19 . 1 1 399 399 THR HA H 399 4.398 4.398 4.927 -0.529 18990 13659 1 19 . 1 1 399 399 THR C C 399 175.333 175.333 173.440 1.893 18990 13660 1 19 . 1 1 399 399 THR CA C 399 62.233 62.233 61.262 0.971 18990 13661 1 19 . 1 1 399 399 THR CB C 399 69.833 69.833 70.294 -0.461 18990 13662 1 19 . 1 1 399 399 THR H H 399 8.090 8.090 8.838 -0.748 18990 13663 1 19 . 1 1 400 400 GLY N N 400 111.479 111.479 111.550 -0.071 18990 13664 1 19 . 1 1 400 400 GLY C C 400 174.048 174.048 172.756 1.292 18990 13665 1 19 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.968 -0.529 18990 13666 1 19 . 1 1 400 400 GLY H H 400 8.524 8.524 8.387 0.137 18990 13667 1 19 . 1 1 401 401 ALA N N 401 123.919 123.919 125.047 -1.128 18990 13668 1 19 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.715 -0.464 18990 13669 1 19 . 1 1 401 401 ALA C C 401 177.942 177.942 177.000 0.942 18990 13670 1 19 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.911 0.819 18990 13671 1 19 . 1 1 401 401 ALA CB C 401 19.142 19.142 19.423 -0.281 18990 13672 1 19 . 1 1 401 401 ALA H H 401 8.179 8.179 8.200 -0.021 18990 13673 1 19 . 1 1 402 402 SER N N 402 114.904 114.904 119.789 -4.885 18990 13674 1 19 . 1 1 402 402 SER HA H 402 4.448 4.448 4.575 -0.127 18990 13675 1 19 . 1 1 402 402 SER C C 402 174.426 174.426 173.527 0.899 18990 13676 1 19 . 1 1 402 402 SER CA C 402 58.289 58.289 58.135 0.155 18990 13677 1 19 . 1 1 402 402 SER CB C 402 63.772 63.772 65.036 -1.264 18990 13678 1 19 . 1 1 402 402 SER H H 402 8.305 8.305 8.626 -0.321 18990 13679 1 19 . 1 1 403 403 ALA N N 403 125.965 125.965 128.506 -2.541 18990 13680 1 19 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.475 -0.076 18990 13681 1 19 . 1 1 403 403 ALA C C 403 177.984 177.984 177.301 0.683 18990 13682 1 19 . 1 1 403 403 ALA CA C 403 52.655 52.655 52.364 0.291 18990 13683 1 19 . 1 1 403 403 ALA CB C 403 19.138 19.138 19.029 0.110 18990 13684 1 19 . 1 1 403 403 ALA H H 403 8.345 8.345 8.322 0.023 18990 13685 1 19 . 1 1 404 404 THR N N 404 112.790 112.790 115.860 -3.070 18990 13686 1 19 . 1 1 404 404 THR C C 404 174.420 174.420 173.416 1.004 18990 13687 1 19 . 1 1 404 404 THR CA C 404 61.988 61.988 61.506 0.482 18990 13688 1 19 . 1 1 404 404 THR CB C 404 69.688 69.688 69.759 -0.071 18990 13689 1 19 . 1 1 404 404 THR H H 404 8.118 8.118 8.375 -0.257 18990 13690 1 19 . 1 1 405 405 ASN N N 405 121.050 121.050 124.127 -3.077 18990 13691 1 19 . 1 1 405 405 ASN H H 405 8.396 8.396 8.558 -0.162 18990 13692 1 19 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.758 -0.180 18990 13693 1 19 . 1 1 407 407 CYS C C 407 174.489 174.489 175.010 -0.521 18990 13694 1 19 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.907 -0.194 18990 13695 1 19 . 1 1 407 407 CYS CB C 407 28.102 28.102 28.171 -0.069 18990 13696 1 19 . 1 1 408 408 GLU N N 408 123.021 123.021 119.326 3.695 18990 13697 1 19 . 1 1 408 408 GLU C C 408 175.954 175.954 175.109 0.845 18990 13698 1 19 . 1 1 408 408 GLU CA C 408 56.802 56.802 57.288 -0.486 18990 13699 1 19 . 1 1 408 408 GLU CB C 408 30.328 30.328 29.698 0.629 18990 13700 1 19 . 1 1 408 408 GLU H H 408 8.415 8.415 8.628 -0.213 18990 13701 1 19 . 1 1 409 409 TYR N N 409 121.015 121.015 118.511 2.504 18990 13702 1 19 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.674 -0.020 18990 13703 1 19 . 1 1 409 409 TYR C C 409 175.613 175.613 175.349 0.264 18990 13704 1 19 . 1 1 409 409 TYR CA C 409 57.669 57.669 58.371 -0.702 18990 13705 1 19 . 1 1 409 409 TYR CB C 409 38.825 38.825 39.993 -1.168 18990 13706 1 19 . 1 1 409 409 TYR H H 409 8.135 8.135 8.248 -0.113 18990 13707 1 19 . 1 1 410 410 THR N N 410 116.975 116.975 114.360 2.615 18990 13708 1 19 . 1 1 410 410 THR HA H 410 4.306 4.306 4.222 0.084 18990 13709 1 19 . 1 1 410 410 THR C C 410 173.846 173.846 172.049 1.797 18990 13710 1 19 . 1 1 410 410 THR CA C 410 61.730 61.730 61.985 -0.255 18990 13711 1 19 . 1 1 410 410 THR CB C 410 69.914 69.914 70.421 -0.506 18990 13712 1 19 . 1 1 410 410 THR H H 410 8.060 8.060 6.807 1.253 18990 13713 1 19 . 1 1 411 411 VAL N N 411 122.900 122.900 119.219 3.681 18990 13714 1 19 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.437 -0.384 18990 13715 1 19 . 1 1 411 411 VAL C C 411 175.275 175.275 174.669 0.606 18990 13716 1 19 . 1 1 411 411 VAL CA C 411 61.853 61.853 60.489 1.364 18990 13717 1 19 . 1 1 411 411 VAL CB C 411 32.976 32.976 34.380 -1.403 18990 13718 1 19 . 1 1 411 411 VAL H H 411 8.089 8.089 8.033 0.056 18990 13719 1 19 . 1 1 412 412 ASP N N 412 125.924 125.924 125.631 0.293 18990 13720 1 19 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.831 0.019 18990 13721 1 19 . 1 1 412 412 ASP CA C 412 51.578 51.578 51.965 -0.387 18990 13722 1 19 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.291 0.246 18990 13723 1 19 . 1 1 412 412 ASP H H 412 8.397 8.397 8.232 0.165 18990 13724 1 19 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.410 -0.024 18990 13725 1 19 . 1 1 413 413 PRO C C 413 177.352 177.352 176.100 1.252 18990 13726 1 19 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.822 1.087 18990 13727 1 19 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.266 0.002 18990 13728 1 19 . 1 1 414 414 ASN N N 414 117.035 117.035 123.091 -6.056 18990 13729 1 19 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.897 -0.220 18990 13730 1 19 . 1 1 414 414 ASN C C 414 175.532 175.532 175.251 0.281 18990 13731 1 19 . 1 1 414 414 ASN CA C 414 53.824 53.824 52.711 1.113 18990 13732 1 19 . 1 1 414 414 ASN CB C 414 38.728 38.728 39.845 -1.117 18990 13733 1 19 . 1 1 414 414 ASN H H 414 8.496 8.496 8.511 -0.015 18990 13734 1 19 . 1 1 415 415 ARG N N 415 121.000 121.000 123.810 -2.810 18990 13735 1 19 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.646 -0.402 18990 13736 1 19 . 1 1 415 415 ARG C C 415 176.243 176.243 175.160 1.083 18990 13737 1 19 . 1 1 415 415 ARG CA C 415 56.404 56.404 54.936 1.468 18990 13738 1 19 . 1 1 415 415 ARG CB C 415 30.637 30.637 30.778 -0.141 18990 13739 1 19 . 1 1 415 415 ARG H H 415 7.804 7.804 8.510 -0.706 18990 13740 1 19 . 1 1 416 416 ALA N N 416 124.880 124.880 123.415 1.465 18990 13741 1 19 . 1 1 416 416 ALA C C 416 177.831 177.831 176.660 1.171 18990 13742 1 19 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.673 1.284 18990 13743 1 19 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.006 -0.947 18990 13744 1 19 . 1 1 416 416 ALA H H 416 8.189 8.189 8.579 -0.390 18990 13745 1 19 . 1 1 417 417 ALA N N 417 122.614 122.614 124.904 -2.290 18990 13746 1 19 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.602 -0.355 18990 13747 1 19 . 1 1 417 417 ALA C C 417 178.024 178.024 176.237 1.787 18990 13748 1 19 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.600 1.189 18990 13749 1 19 . 1 1 417 417 ALA CB C 417 19.042 19.042 20.235 -1.193 18990 13750 1 19 . 1 1 417 417 ALA H H 417 8.169 8.169 8.477 -0.308 18990 13751 1 19 . 1 1 418 418 GLU N N 418 119.500 119.500 118.730 0.770 18990 13752 1 19 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.637 -0.448 18990 13753 1 19 . 1 1 418 418 GLU C C 418 176.266 176.266 174.910 1.356 18990 13754 1 19 . 1 1 418 418 GLU CA C 418 56.576 56.576 56.123 0.453 18990 13755 1 19 . 1 1 418 418 GLU CB C 418 30.307 30.307 30.835 -0.528 18990 13756 1 19 . 1 1 418 418 GLU H H 418 8.184 8.184 8.545 -0.361 18990 13757 1 19 . 1 1 419 419 ALA N N 419 124.643 124.643 126.127 -1.484 18990 13758 1 19 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.610 -0.360 18990 13759 1 19 . 1 1 419 419 ALA C C 419 177.488 177.488 177.249 0.239 18990 13760 1 19 . 1 1 419 419 ALA CA C 419 52.509 52.509 52.186 0.323 18990 13761 1 19 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.168 -1.007 18990 13762 1 19 . 1 1 419 419 ALA H H 419 8.135 8.135 8.240 -0.105 18990 13763 1 19 . 1 1 420 420 ARG N N 420 120.003 120.003 121.774 -1.771 18990 13764 1 19 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.504 -0.211 18990 13765 1 19 . 1 1 420 420 ARG C C 420 176.297 176.297 176.181 0.116 18990 13766 1 19 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.474 0.459 18990 13767 1 19 . 1 1 420 420 ARG CB C 420 30.850 30.850 30.988 -0.138 18990 13768 1 19 . 1 1 420 420 ARG H H 420 8.135 8.135 8.184 -0.049 18990 13769 1 19 . 1 1 421 421 TRP N N 421 122.280 122.280 121.916 0.364 18990 13770 1 19 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.661 0.002 18990 13771 1 19 . 1 1 421 421 TRP C C 421 175.856 175.856 175.250 0.606 18990 13772 1 19 . 1 1 421 421 TRP CA C 421 57.404 57.404 57.222 0.182 18990 13773 1 19 . 1 1 421 421 TRP CB C 421 29.437 29.437 29.960 -0.523 18990 13774 1 19 . 1 1 421 421 TRP H H 421 8.159 8.159 8.669 -0.510 18990 13775 1 19 . 1 1 422 422 ASP N N 422 121.980 121.980 121.941 0.039 18990 13776 1 19 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.431 0.064 18990 13777 1 19 . 1 1 422 422 ASP C C 422 176.184 176.184 176.098 0.086 18990 13778 1 19 . 1 1 422 422 ASP CA C 422 53.899 53.899 55.173 -1.274 18990 13779 1 19 . 1 1 422 422 ASP CB C 422 40.948 40.948 40.481 0.467 18990 13780 1 19 . 1 1 422 422 ASP H H 422 8.135 8.135 8.414 -0.279 18990 13781 1 19 . 1 1 423 423 GLU N N 423 121.990 121.990 123.322 -1.332 18990 13782 1 19 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.262 -0.172 18990 13783 1 19 . 1 1 423 423 GLU C C 423 176.720 176.720 175.824 0.896 18990 13784 1 19 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.523 0.646 18990 13785 1 19 . 1 1 423 423 GLU CB C 423 30.156 30.156 30.108 0.048 18990 13786 1 19 . 1 1 423 423 GLU H H 423 8.153 8.153 8.089 0.064 18990 13787 1 19 . 1 1 424 424 ALA N N 424 123.900 123.900 122.383 1.517 18990 13788 1 19 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.625 -0.345 18990 13789 1 19 . 1 1 424 424 ALA C C 424 178.095 178.095 176.447 1.648 18990 13790 1 19 . 1 1 424 424 ALA CA C 424 53.017 53.017 51.241 1.776 18990 13791 1 19 . 1 1 424 424 ALA CB C 424 19.086 19.086 20.935 -1.849 18990 13792 1 19 . 1 1 424 424 ALA H H 424 8.243 8.243 7.589 0.654 18990 13793 1 19 . 1 1 425 425 SER N N 425 113.881 113.881 115.151 -1.270 18990 13794 1 19 . 1 1 425 425 SER HA H 425 4.387 4.387 4.465 -0.078 18990 13795 1 19 . 1 1 425 425 SER C C 425 174.338 174.338 174.358 -0.020 18990 13796 1 19 . 1 1 425 425 SER CA C 425 58.546 58.546 58.193 0.353 18990 13797 1 19 . 1 1 425 425 SER CB C 425 63.784 63.784 64.283 -0.499 18990 13798 1 19 . 1 1 425 425 SER H H 425 8.063 8.063 8.415 -0.352 18990 13799 1 19 . 1 1 426 426 ASN N N 426 121.032 121.032 119.361 1.671 18990 13800 1 19 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.406 0.300 18990 13801 1 19 . 1 1 426 426 ASN C C 426 175.046 175.046 174.302 0.744 18990 13802 1 19 . 1 1 426 426 ASN CA C 426 53.445 53.445 53.479 -0.034 18990 13803 1 19 . 1 1 426 426 ASN CB C 426 38.847 38.847 36.107 2.740 18990 13804 1 19 . 1 1 426 426 ASN H H 426 8.391 8.391 8.527 -0.136 18990 13805 1 19 . 1 1 427 427 VAL N N 427 119.463 119.463 120.232 -0.769 18990 13806 1 19 . 1 1 427 427 VAL HA H 427 4.193 4.193 3.943 0.250 18990 13807 1 19 . 1 1 427 427 VAL C C 427 176.213 176.213 176.313 -0.100 18990 13808 1 19 . 1 1 427 427 VAL CA C 427 62.449 62.449 63.245 -0.796 18990 13809 1 19 . 1 1 427 427 VAL CB C 427 32.865 32.865 31.837 1.028 18990 13810 1 19 . 1 1 427 427 VAL H H 427 7.954 7.954 7.982 -0.028 18990 13811 1 19 . 1 1 428 428 THR N N 428 118.226 118.226 122.845 -4.619 18990 13812 1 19 . 1 1 428 428 THR HA H 428 4.353 4.353 4.449 -0.096 18990 13813 1 19 . 1 1 428 428 THR C C 428 174.361 174.361 173.977 0.384 18990 13814 1 19 . 1 1 428 428 THR CA C 428 62.065 62.065 62.191 -0.126 18990 13815 1 19 . 1 1 428 428 THR CB C 428 69.729 69.729 69.385 0.344 18990 13816 1 19 . 1 1 428 428 THR H H 428 8.225 8.225 8.258 -0.033 18990 13817 1 19 . 1 1 429 429 ILE N N 429 123.910 123.910 123.777 0.133 18990 13818 1 19 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.331 -0.143 18990 13819 1 19 . 1 1 429 429 ILE C C 429 175.774 175.774 175.392 0.382 18990 13820 1 19 . 1 1 429 429 ILE CA C 429 60.819 60.819 60.892 -0.073 18990 13821 1 19 . 1 1 429 429 ILE CB C 429 38.719 38.719 39.300 -0.581 18990 13822 1 19 . 1 1 429 429 ILE H H 429 8.148 8.148 8.334 -0.186 18990 13823 1 19 . 1 1 430 430 LYS N N 430 126.453 126.453 127.043 -0.590 18990 13824 1 19 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.455 -0.021 18990 13825 1 19 . 1 1 430 430 LYS C C 430 176.241 176.241 175.538 0.703 18990 13826 1 19 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.495 0.442 18990 13827 1 19 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.190 -0.026 18990 13828 1 19 . 1 1 430 430 LYS H H 430 8.406 8.406 8.383 0.023 18990 13829 1 19 . 1 1 431 431 VAL N N 431 122.496 122.496 121.774 0.722 18990 13830 1 19 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.131 0.149 18990 13831 1 19 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.331 -0.028 18990 13832 1 19 . 1 1 431 431 VAL CB C 431 33.132 33.132 32.892 0.240 18990 13833 1 19 . 1 1 431 431 VAL H H 431 8.312 8.312 8.384 -0.072 18990 13834 1 19 . 1 1 432 432 SER HA H 432 4.486 4.486 4.612 -0.126 18990 13835 1 19 . 1 1 432 432 SER C C 432 173.834 173.834 174.383 -0.549 18990 13836 1 19 . 1 1 432 432 SER CA C 432 58.650 58.650 58.247 0.403 18990 13837 1 19 . 1 1 432 432 SER CB C 432 64.152 64.152 63.529 0.623 18990 13838 1 19 . 1 1 433 433 THR N N 433 114.706 114.706 112.710 1.996 18990 13839 1 19 . 1 1 433 433 THR HA H 433 5.446 5.446 4.820 0.626 18990 13840 1 19 . 1 1 433 433 THR C C 433 173.979 173.979 173.436 0.543 18990 13841 1 19 . 1 1 433 433 THR CA C 433 60.412 60.412 60.127 0.284 18990 13842 1 19 . 1 1 433 433 THR CB C 433 71.896 71.896 71.148 0.748 18990 13843 1 19 . 1 1 433 433 THR H H 433 7.833 7.833 7.481 0.352 18990 13844 1 19 . 1 1 434 434 LYS N N 434 122.492 122.492 120.968 1.524 18990 13845 1 19 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.921 -0.212 18990 13846 1 19 . 1 1 434 434 LYS C C 434 173.589 173.589 174.385 -0.796 18990 13847 1 19 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.865 1.510 18990 13848 1 19 . 1 1 434 434 LYS CB C 434 36.925 36.925 35.041 1.884 18990 13849 1 19 . 1 1 434 434 LYS H H 434 8.937 8.937 8.618 0.319 18990 13850 1 19 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.426 -0.159 18990 13851 1 19 . 1 1 435 435 PRO C C 435 175.238 175.238 176.561 -1.323 18990 13852 1 19 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.526 -1.603 18990 13853 1 19 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.633 -0.547 18990 13854 1 19 . 1 1 436 436 CYS N N 436 125.422 125.422 124.091 1.331 18990 13855 1 19 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.269 -0.839 18990 13856 1 19 . 1 1 436 436 CYS C C 436 176.770 176.770 175.046 1.724 18990 13857 1 19 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.544 0.472 18990 13858 1 19 . 1 1 436 436 CYS CB C 436 31.698 31.698 27.685 4.013 18990 13859 1 19 . 1 1 436 436 CYS H H 436 7.768 7.768 8.338 -0.570 18990 13860 1 19 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.113 -0.255 18990 13861 1 19 . 1 1 437 437 PRO C C 437 173.608 173.608 175.796 -2.188 18990 13862 1 19 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.068 0.145 18990 13863 1 19 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.163 1.286 18990 13864 1 19 . 1 1 438 438 LYS N N 438 118.600 118.600 118.319 0.281 18990 13865 1 19 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.005 -0.035 18990 13866 1 19 . 1 1 438 438 LYS C C 438 176.887 176.887 177.109 -0.222 18990 13867 1 19 . 1 1 438 438 LYS CA C 438 57.687 57.687 56.611 1.075 18990 13868 1 19 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.215 -0.090 18990 13869 1 19 . 1 1 438 438 LYS H H 438 8.390 8.390 7.599 0.791 18990 13870 1 19 . 1 1 439 439 CYS N N 439 118.950 118.950 115.943 3.007 18990 13871 1 19 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.632 0.114 18990 13872 1 19 . 1 1 439 439 CYS C C 439 176.650 176.650 174.965 1.685 18990 13873 1 19 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.763 1.585 18990 13874 1 19 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.706 2.490 18990 13875 1 19 . 1 1 439 439 CYS H H 439 8.357 8.357 7.676 0.681 18990 13876 1 19 . 1 1 440 440 ARG N N 440 117.200 117.200 116.340 0.860 18990 13877 1 19 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.188 -0.220 18990 13878 1 19 . 1 1 440 440 ARG C C 440 175.253 175.253 175.627 -0.374 18990 13879 1 19 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.854 0.046 18990 13880 1 19 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.662 -1.621 18990 13881 1 19 . 1 1 440 440 ARG H H 440 8.065 8.065 8.117 -0.052 18990 13882 1 19 . 1 1 441 441 THR N N 441 122.400 122.400 112.300 10.100 18990 13883 1 19 . 1 1 441 441 THR HA H 441 4.371 4.371 4.605 -0.234 18990 13884 1 19 . 1 1 441 441 THR C C 441 173.702 173.702 173.337 0.365 18990 13885 1 19 . 1 1 441 441 THR CA C 441 63.194 63.194 59.517 3.676 18990 13886 1 19 . 1 1 441 441 THR CB C 441 68.933 68.933 69.459 -0.526 18990 13887 1 19 . 1 1 441 441 THR H H 441 8.643 8.643 7.413 1.230 18990 13888 1 19 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.451 -0.304 18990 13889 1 19 . 1 1 442 442 PRO C C 442 176.215 176.215 176.023 0.192 18990 13890 1 19 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.698 1.499 18990 13891 1 19 . 1 1 442 442 PRO CB C 442 32.044 32.044 31.006 1.038 18990 13892 1 19 . 1 1 443 443 THR N N 443 122.932 122.932 121.887 1.045 18990 13893 1 19 . 1 1 443 443 THR HA H 443 4.665 4.665 4.484 0.181 18990 13894 1 19 . 1 1 443 443 THR C C 443 172.133 172.133 174.591 -2.458 18990 13895 1 19 . 1 1 443 443 THR CA C 443 62.566 62.566 62.491 0.075 18990 13896 1 19 . 1 1 443 443 THR CB C 443 71.562 71.562 70.052 1.510 18990 13897 1 19 . 1 1 443 443 THR H H 443 9.116 9.116 8.680 0.436 18990 13898 1 19 . 1 1 444 444 GLU N N 444 126.390 126.390 125.955 0.435 18990 13899 1 19 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.449 0.493 18990 13900 1 19 . 1 1 444 444 GLU C C 444 175.292 175.292 176.111 -0.819 18990 13901 1 19 . 1 1 444 444 GLU CA C 444 55.049 55.049 56.438 -1.389 18990 13902 1 19 . 1 1 444 444 GLU CB C 444 31.861 31.861 30.743 1.118 18990 13903 1 19 . 1 1 444 444 GLU H H 444 8.720 8.720 8.698 0.022 18990 13904 1 19 . 1 1 445 445 ARG N N 445 123.505 123.505 122.545 0.960 18990 13905 1 19 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.478 -0.767 18990 13906 1 19 . 1 1 445 445 ARG C C 445 175.289 175.289 175.574 -0.285 18990 13907 1 19 . 1 1 445 445 ARG CA C 445 55.856 55.856 55.635 0.222 18990 13908 1 19 . 1 1 445 445 ARG CB C 445 30.675 30.675 31.620 -0.945 18990 13909 1 19 . 1 1 445 445 ARG H H 445 8.157 8.157 8.425 -0.268 18990 13910 1 19 . 1 1 446 446 ASP N N 446 126.800 126.800 122.037 4.763 18990 13911 1 19 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.623 0.018 18990 13912 1 19 . 1 1 446 446 ASP C C 446 176.020 176.020 176.352 -0.332 18990 13913 1 19 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.424 -0.472 18990 13914 1 19 . 1 1 446 446 ASP CB C 446 41.400 41.400 42.827 -1.427 18990 13915 1 19 . 1 1 446 446 ASP H H 446 8.476 8.476 8.327 0.149 18990 13916 1 19 . 1 1 447 447 GLY N N 447 111.262 111.262 108.355 2.907 18990 13917 1 19 . 1 1 447 447 GLY C C 447 174.073 174.073 173.611 0.462 18990 13918 1 19 . 1 1 447 447 GLY CA C 447 45.832 45.832 45.062 0.770 18990 13919 1 19 . 1 1 447 447 GLY H H 447 8.056 8.056 8.240 -0.184 18990 13920 1 19 . 1 1 448 448 GLY N N 448 108.655 108.655 110.728 -2.073 18990 13921 1 19 . 1 1 448 448 GLY C C 448 174.020 174.020 173.691 0.329 18990 13922 1 19 . 1 1 448 448 GLY CA C 448 45.267 45.267 45.757 -0.490 18990 13923 1 19 . 1 1 448 448 GLY H H 448 8.380 8.380 8.134 0.246 18990 13924 1 19 . 1 1 449 449 CYS N N 449 120.628 120.628 121.001 -0.373 18990 13925 1 19 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.831 -0.834 18990 13926 1 19 . 1 1 449 449 CYS C C 449 174.855 174.855 175.549 -0.694 18990 13927 1 19 . 1 1 449 449 CYS CA C 449 59.291 59.291 57.693 1.598 18990 13928 1 19 . 1 1 449 449 CYS CB C 449 28.000 28.000 26.856 1.144 18990 13929 1 19 . 1 1 449 449 CYS H H 449 7.832 7.832 8.554 -0.722 18990 13930 1 19 . 1 1 450 450 MET N N 450 123.947 123.947 114.781 9.166 18990 13931 1 19 . 1 1 450 450 MET HA H 450 4.551 4.551 3.823 0.728 18990 13932 1 19 . 1 1 450 450 MET C C 450 174.658 174.658 173.389 1.269 18990 13933 1 19 . 1 1 450 450 MET CA C 450 54.970 54.970 56.486 -1.516 18990 13934 1 19 . 1 1 450 450 MET CB C 450 34.100 34.100 31.045 3.055 18990 13935 1 19 . 1 1 450 450 MET H H 450 8.916 8.916 7.500 1.416 18990 13936 1 19 . 1 1 451 451 HIS N N 451 120.490 120.490 118.793 1.697 18990 13937 1 19 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.658 -0.979 18990 13938 1 19 . 1 1 451 451 HIS C C 451 172.443 172.443 173.771 -1.328 18990 13939 1 19 . 1 1 451 451 HIS CA C 451 53.812 53.812 54.595 -0.783 18990 13940 1 19 . 1 1 451 451 HIS CB C 451 28.900 28.900 30.269 -1.369 18990 13941 1 19 . 1 1 451 451 HIS H H 451 7.557 7.557 7.821 -0.264 18990 13942 1 19 . 1 1 452 452 MET N N 452 128.800 128.800 127.343 1.457 18990 13943 1 19 . 1 1 452 452 MET HA H 452 4.320 4.320 4.655 -0.335 18990 13944 1 19 . 1 1 452 452 MET C C 452 175.479 175.479 173.612 1.867 18990 13945 1 19 . 1 1 452 452 MET CA C 452 52.589 52.589 53.584 -0.995 18990 13946 1 19 . 1 1 452 452 MET CB C 452 28.074 28.074 34.033 -5.959 18990 13947 1 19 . 1 1 452 452 MET H H 452 9.087 9.087 7.825 1.262 18990 13948 1 19 . 1 1 453 453 VAL N N 453 122.200 122.200 120.425 1.775 18990 13949 1 19 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.776 0.018 18990 13950 1 19 . 1 1 453 453 VAL C C 453 175.476 175.476 174.523 0.953 18990 13951 1 19 . 1 1 453 453 VAL CA C 453 61.380 61.380 59.162 2.218 18990 13952 1 19 . 1 1 453 453 VAL CB C 453 33.089 33.089 34.966 -1.877 18990 13953 1 19 . 1 1 453 453 VAL H H 453 8.016 8.016 8.015 0.001 18990 13954 1 19 . 1 1 454 454 CYS N N 454 130.353 130.353 123.831 6.522 18990 13955 1 19 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.801 -0.206 18990 13956 1 19 . 1 1 454 454 CYS C C 454 177.833 177.833 175.242 2.591 18990 13957 1 19 . 1 1 454 454 CYS CA C 454 61.571 61.571 59.814 1.757 18990 13958 1 19 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.635 5.410 18990 13959 1 19 . 1 1 454 454 CYS H H 454 8.989 8.989 9.135 -0.146 18990 13960 1 19 . 1 1 455 455 THR N N 455 119.000 119.000 124.110 -5.110 18990 13961 1 19 . 1 1 455 455 THR HA H 455 4.393 4.393 4.367 0.026 18990 13962 1 19 . 1 1 455 455 THR C C 455 175.264 175.264 173.539 1.725 18990 13963 1 19 . 1 1 455 455 THR CA C 455 61.644 61.644 62.346 -0.702 18990 13964 1 19 . 1 1 455 455 THR CB C 455 69.400 69.400 68.484 0.916 18990 13965 1 19 . 1 1 455 455 THR H H 455 8.533 8.533 8.682 -0.149 18990 13966 1 19 . 1 1 456 456 ARG N N 456 128.900 128.900 129.070 -0.170 18990 13967 1 19 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.612 -0.387 18990 13968 1 19 . 1 1 456 456 ARG C C 456 177.782 177.782 175.247 2.535 18990 13969 1 19 . 1 1 456 456 ARG CA C 456 56.950 56.950 53.742 3.208 18990 13970 1 19 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.527 -3.477 18990 13971 1 19 . 1 1 456 456 ARG H H 456 9.036 9.036 7.888 1.148 18990 13972 1 19 . 1 1 457 457 ALA N N 457 133.152 133.152 128.707 4.445 18990 13973 1 19 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.297 -0.151 18990 13974 1 19 . 1 1 457 457 ALA C C 457 178.757 178.757 177.631 1.126 18990 13975 1 19 . 1 1 457 457 ALA CA C 457 53.929 53.929 52.982 0.947 18990 13976 1 19 . 1 1 457 457 ALA CB C 457 17.710 17.710 17.584 0.126 18990 13977 1 19 . 1 1 457 457 ALA H H 457 9.042 9.042 8.875 0.167 18990 13978 1 19 . 1 1 458 458 GLY N N 458 111.200 111.200 110.038 1.162 18990 13979 1 19 . 1 1 458 458 GLY C C 458 173.558 173.558 174.717 -1.159 18990 13980 1 19 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.918 0.518 18990 13981 1 19 . 1 1 458 458 GLY H H 458 8.830 8.830 8.464 0.366 18990 13982 1 19 . 1 1 459 459 CYS N N 459 123.040 123.040 120.799 2.241 18990 13983 1 19 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.972 -0.350 18990 13984 1 19 . 1 1 459 459 CYS C C 459 176.591 176.591 176.140 0.451 18990 13985 1 19 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.962 0.537 18990 13986 1 19 . 1 1 459 459 CYS CB C 459 30.174 30.174 28.851 1.323 18990 13987 1 19 . 1 1 459 459 CYS H H 459 8.042 8.042 8.243 -0.201 18990 13988 1 19 . 1 1 460 460 GLY N N 460 104.500 104.500 109.910 -5.410 18990 13989 1 19 . 1 1 460 460 GLY C C 460 173.716 173.716 174.119 -0.403 18990 13990 1 19 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.647 0.361 18990 13991 1 19 . 1 1 460 460 GLY H H 460 7.705 7.705 8.186 -0.481 18990 13992 1 19 . 1 1 461 461 PHE N N 461 124.949 124.949 121.334 3.615 18990 13993 1 19 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.511 0.069 18990 13994 1 19 . 1 1 461 461 PHE C C 461 174.447 174.447 174.564 -0.117 18990 13995 1 19 . 1 1 461 461 PHE CA C 461 59.946 59.946 58.233 1.713 18990 13996 1 19 . 1 1 461 461 PHE CB C 461 41.300 41.300 40.286 1.014 18990 13997 1 19 . 1 1 461 461 PHE H H 461 8.947 8.947 7.715 1.232 18990 13998 1 19 . 1 1 462 462 GLU N N 462 125.272 125.272 127.564 -2.292 18990 13999 1 19 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.603 1.118 18990 14000 1 19 . 1 1 462 462 GLU C C 462 176.067 176.067 175.574 0.493 18990 14001 1 19 . 1 1 462 462 GLU CA C 462 54.624 54.624 56.156 -1.532 18990 14002 1 19 . 1 1 462 462 GLU CB C 462 31.255 31.255 31.272 -0.017 18990 14003 1 19 . 1 1 462 462 GLU H H 462 7.799 7.799 8.502 -0.703 18990 14004 1 19 . 1 1 463 463 TRP N N 463 121.524 121.524 120.281 1.243 18990 14005 1 19 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.338 0.168 18990 14006 1 19 . 1 1 463 463 TRP C C 463 172.844 172.844 174.162 -1.318 18990 14007 1 19 . 1 1 463 463 TRP CA C 463 53.771 53.771 55.093 -1.322 18990 14008 1 19 . 1 1 463 463 TRP CB C 463 31.736 31.736 30.793 0.943 18990 14009 1 19 . 1 1 463 463 TRP H H 463 9.300 9.300 8.201 1.099 18990 14010 1 19 . 1 1 464 464 CYS N N 464 120.868 120.868 120.562 0.306 18990 14011 1 19 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.368 1.048 18990 14012 1 19 . 1 1 464 464 CYS C C 464 177.213 177.213 176.192 1.021 18990 14013 1 19 . 1 1 464 464 CYS CA C 464 57.776 57.776 59.642 -1.866 18990 14014 1 19 . 1 1 464 464 CYS CB C 464 32.930 32.930 29.042 3.888 18990 14015 1 19 . 1 1 464 464 CYS H H 464 8.752 8.752 8.744 0.008 18990 14016 1 19 . 1 1 465 465 TRP N N 465 131.209 131.209 127.687 3.522 18990 14017 1 19 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.228 0.199 18990 14018 1 19 . 1 1 465 465 TRP C C 465 176.051 176.051 176.095 -0.044 18990 14019 1 19 . 1 1 465 465 TRP CA C 465 60.763 60.763 60.138 0.625 18990 14020 1 19 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.768 1.358 18990 14021 1 19 . 1 1 465 465 TRP H H 465 9.809 9.809 8.005 1.804 18990 14022 1 19 . 1 1 466 466 VAL N N 466 118.233 118.233 116.716 1.517 18990 14023 1 19 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.407 0.217 18990 14024 1 19 . 1 1 466 466 VAL C C 466 178.943 178.943 176.388 2.555 18990 14025 1 19 . 1 1 466 466 VAL CA C 466 65.602 65.602 64.324 1.278 18990 14026 1 19 . 1 1 466 466 VAL CB C 466 33.172 33.172 32.220 0.952 18990 14027 1 19 . 1 1 466 466 VAL H H 466 8.627 8.627 7.387 1.240 18990 14028 1 19 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.766 -1.335 18990 14029 1 19 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.398 0.601 18990 14030 1 19 . 1 1 467 467 CYS CB C 467 31.870 31.870 26.170 5.700 18990 14031 1 19 . 1 1 467 467 CYS H H 467 7.820 7.820 7.881 -0.061 18990 14032 1 19 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.999 -0.963 18990 14033 1 19 . 1 1 468 468 GLN CA C 468 58.051 58.051 55.836 2.215 18990 14034 1 19 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.312 -1.836 18990 14035 1 19 . 1 1 469 469 THR HA H 469 4.685 4.685 4.395 0.290 18990 14036 1 19 . 1 1 469 469 THR C C 469 173.351 173.351 172.237 1.114 18990 14037 1 19 . 1 1 469 469 THR CA C 469 59.176 59.176 61.305 -2.129 18990 14038 1 19 . 1 1 469 469 THR CB C 469 71.775 71.775 70.470 1.305 18990 14039 1 19 . 1 1 470 470 GLU N N 470 120.940 120.940 123.587 -2.647 18990 14040 1 19 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.381 -0.088 18990 14041 1 19 . 1 1 470 470 GLU C C 470 175.539 175.539 175.214 0.325 18990 14042 1 19 . 1 1 470 470 GLU CA C 470 57.015 57.015 56.932 0.083 18990 14043 1 19 . 1 1 470 470 GLU CB C 470 29.965 29.965 29.558 0.407 18990 14044 1 19 . 1 1 470 470 GLU H H 470 8.912 8.912 8.385 0.527 18990 14045 1 19 . 1 1 471 471 TRP N N 471 126.998 126.998 125.634 1.364 18990 14046 1 19 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.848 -0.555 18990 14047 1 19 . 1 1 471 471 TRP C C 471 175.408 175.408 175.453 -0.045 18990 14048 1 19 . 1 1 471 471 TRP CA C 471 58.220 58.220 56.469 1.750 18990 14049 1 19 . 1 1 471 471 TRP CB C 471 29.500 29.500 32.833 -3.333 18990 14050 1 19 . 1 1 471 471 TRP H H 471 8.350 8.350 7.997 0.353 18990 14051 1 19 . 1 1 472 472 THR N N 472 117.480 117.480 113.527 3.953 18990 14052 1 19 . 1 1 472 472 THR HA H 472 4.444 4.444 4.244 0.200 18990 14053 1 19 . 1 1 472 472 THR CA C 472 58.930 58.930 62.215 -3.285 18990 14054 1 19 . 1 1 472 472 THR H H 472 8.069 8.069 8.463 -0.395 18990 14055 1 19 . 1 1 473 473 ARG HA H 473 3.773 3.773 4.243 -0.470 18990 14056 1 19 . 1 1 473 473 ARG C C 473 178.053 178.053 177.271 0.782 18990 14057 1 19 . 1 1 473 473 ARG CA C 473 58.088 58.088 57.571 0.517 18990 14058 1 19 . 1 1 473 473 ARG CB C 473 29.426 29.426 29.991 -0.566 18990 14059 1 19 . 1 1 474 474 ASP N N 474 119.900 119.900 121.274 -1.374 18990 14060 1 19 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.247 -0.032 18990 14061 1 19 . 1 1 474 474 ASP C C 474 178.197 178.197 177.484 0.713 18990 14062 1 19 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.832 -0.030 18990 14063 1 19 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.237 -0.055 18990 14064 1 19 . 1 1 474 474 ASP H H 474 7.718 7.718 8.436 -0.718 18990 14065 1 19 . 1 1 475 475 CYS N N 475 121.000 121.000 117.701 3.299 18990 14066 1 19 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.132 -0.765 18990 14067 1 19 . 1 1 475 475 CYS CA C 475 64.533 64.533 60.214 4.319 18990 14068 1 19 . 1 1 475 475 CYS CB C 475 29.092 29.092 25.539 3.553 18990 14069 1 19 . 1 1 475 475 CYS H H 475 6.953 6.953 7.960 -1.007 18990 14070 1 19 . 1 1 476 476 MET HA H 476 4.021 4.021 4.109 -0.088 18990 14071 1 19 . 1 1 476 476 MET CA C 476 58.010 58.010 58.597 -0.587 18990 14072 1 19 . 1 1 476 476 MET CB C 476 32.550 32.550 32.041 0.509 18990 14073 1 19 . 1 1 477 477 GLY N N 477 111.938 111.938 103.809 8.129 18990 14074 1 19 . 1 1 477 477 GLY C C 477 174.406 174.406 175.049 -0.643 18990 14075 1 19 . 1 1 477 477 GLY CA C 477 45.616 45.616 45.389 0.227 18990 14076 1 19 . 1 1 477 477 GLY H H 477 9.155 9.155 7.699 1.456 18990 14077 1 19 . 1 1 478 478 ALA N N 478 121.900 121.900 123.783 -1.883 18990 14078 1 19 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.181 0.110 18990 14079 1 19 . 1 1 478 478 ALA C C 478 178.196 178.196 178.115 0.081 18990 14080 1 19 . 1 1 478 478 ALA CA C 478 53.440 53.440 54.440 -1.000 18990 14081 1 19 . 1 1 478 478 ALA CB C 478 20.390 20.390 19.180 1.210 18990 14082 1 19 . 1 1 478 478 ALA H H 478 7.347 7.347 7.504 -0.157 18990 14083 1 19 . 1 1 479 479 HIS N N 479 115.200 115.200 109.746 5.454 18990 14084 1 19 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.867 0.036 18990 14085 1 19 . 1 1 479 479 HIS C C 479 173.325 173.325 176.028 -2.703 18990 14086 1 19 . 1 1 479 479 HIS CA C 479 54.526 54.526 55.564 -1.038 18990 14087 1 19 . 1 1 479 479 HIS CB C 479 27.600 27.600 30.270 -2.670 18990 14088 1 19 . 1 1 479 479 HIS H H 479 8.297 8.297 7.682 0.615 18990 14089 1 19 . 1 1 480 480 TRP N N 480 121.780 121.780 122.264 -0.484 18990 14090 1 19 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.354 -0.059 18990 14091 1 19 . 1 1 480 480 TRP C C 480 175.568 175.568 176.673 -1.105 18990 14092 1 19 . 1 1 480 480 TRP CA C 480 58.358 58.358 59.616 -1.258 18990 14093 1 19 . 1 1 480 480 TRP CB C 480 29.550 29.550 29.807 -0.257 18990 14094 1 19 . 1 1 480 480 TRP H H 480 8.081 8.081 7.785 0.296 18990 14095 1 19 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.489 0.356 18990 14096 1 19 . 1 1 481 481 PHE C C 481 175.126 175.126 174.908 0.218 18990 14097 1 19 . 1 1 481 481 PHE CA C 481 56.471 56.471 58.667 -2.196 18990 14098 1 19 . 1 1 481 481 PHE CB C 481 41.006 41.006 38.464 2.542 18990 14099 1 20 . 1 1 343 343 GLU N N 343 121.045 121.045 125.063 -4.018 18990 14100 1 20 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.411 -0.246 18990 14101 1 20 . 1 1 343 343 GLU C C 343 176.529 176.529 175.570 0.959 18990 14102 1 20 . 1 1 343 343 GLU CA C 343 57.162 57.162 55.592 1.570 18990 14103 1 20 . 1 1 343 343 GLU CB C 343 30.204 30.204 29.279 0.925 18990 14104 1 20 . 1 1 343 343 GLU H H 343 8.293 8.293 8.581 -0.288 18990 14105 1 20 . 1 1 344 344 TYR N N 344 121.000 121.000 120.077 0.923 18990 14106 1 20 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.870 -0.332 18990 14107 1 20 . 1 1 344 344 TYR C C 344 175.897 175.897 175.063 0.834 18990 14108 1 20 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.303 0.876 18990 14109 1 20 . 1 1 344 344 TYR CB C 344 38.600 38.600 38.885 -0.285 18990 14110 1 20 . 1 1 344 344 TYR H H 344 8.040 8.040 7.789 0.251 18990 14111 1 20 . 1 1 345 345 VAL N N 345 121.900 121.900 125.252 -3.352 18990 14112 1 20 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.017 -0.078 18990 14113 1 20 . 1 1 345 345 VAL C C 345 176.143 176.143 176.080 0.063 18990 14114 1 20 . 1 1 345 345 VAL CA C 345 62.867 62.867 62.348 0.519 18990 14115 1 20 . 1 1 345 345 VAL CB C 345 32.799 32.799 32.393 0.406 18990 14116 1 20 . 1 1 345 345 VAL H H 345 7.856 7.856 8.669 -0.813 18990 14117 1 20 . 1 1 346 346 LEU N N 346 124.950 124.950 115.768 9.182 18990 14118 1 20 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.038 0.205 18990 14119 1 20 . 1 1 346 346 LEU C C 346 177.747 177.747 176.194 1.553 18990 14120 1 20 . 1 1 346 346 LEU CA C 346 55.500 55.500 55.300 0.201 18990 14121 1 20 . 1 1 346 346 LEU CB C 346 42.252 42.252 40.787 1.465 18990 14122 1 20 . 1 1 346 346 LEU H H 346 8.127 8.127 7.911 0.216 18990 14123 1 20 . 1 1 347 347 GLN N N 347 121.452 121.452 119.472 1.980 18990 14124 1 20 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.470 -0.184 18990 14125 1 20 . 1 1 347 347 GLN C C 347 175.833 175.833 175.914 -0.081 18990 14126 1 20 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.441 0.547 18990 14127 1 20 . 1 1 347 347 GLN CB C 347 29.375 29.375 29.640 -0.265 18990 14128 1 20 . 1 1 347 347 GLN H H 347 8.270 8.270 7.948 0.322 18990 14129 1 20 . 1 1 348 348 ALA N N 348 124.466 124.466 125.784 -1.318 18990 14130 1 20 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.874 -0.553 18990 14131 1 20 . 1 1 348 348 ALA C C 348 177.929 177.929 176.961 0.968 18990 14132 1 20 . 1 1 348 348 ALA CA C 348 52.703 52.703 51.597 1.105 18990 14133 1 20 . 1 1 348 348 ALA CB C 348 19.002 19.002 20.226 -1.224 18990 14134 1 20 . 1 1 348 348 ALA H H 348 8.227 8.227 8.576 -0.349 18990 14135 1 20 . 1 1 349 349 GLY N N 349 108.193 108.193 106.289 1.904 18990 14136 1 20 . 1 1 349 349 GLY C C 349 174.269 174.269 173.436 0.833 18990 14137 1 20 . 1 1 349 349 GLY CA C 349 45.227 45.227 44.733 0.494 18990 14138 1 20 . 1 1 349 349 GLY H H 349 8.298 8.298 8.446 -0.148 18990 14139 1 20 . 1 1 350 350 GLY N N 350 108.073 108.073 107.528 0.545 18990 14140 1 20 . 1 1 350 350 GLY C C 350 172.979 172.979 172.553 0.426 18990 14141 1 20 . 1 1 350 350 GLY CA C 350 44.935 44.935 43.748 1.187 18990 14142 1 20 . 1 1 350 350 GLY H H 350 8.156 8.156 7.706 0.450 18990 14143 1 20 . 1 1 351 351 VAL N N 351 119.058 119.058 119.860 -0.802 18990 14144 1 20 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.709 -0.293 18990 14145 1 20 . 1 1 351 351 VAL C C 351 173.412 173.412 174.643 -1.231 18990 14146 1 20 . 1 1 351 351 VAL CA C 351 60.663 60.663 59.493 1.169 18990 14147 1 20 . 1 1 351 351 VAL CB C 351 34.866 34.866 35.237 -0.371 18990 14148 1 20 . 1 1 351 351 VAL H H 351 8.541 8.541 8.955 -0.414 18990 14149 1 20 . 1 1 352 352 LEU N N 352 125.800 125.800 121.431 4.369 18990 14150 1 20 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.654 0.111 18990 14151 1 20 . 1 1 352 352 LEU C C 352 176.218 176.218 175.506 0.712 18990 14152 1 20 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.179 0.162 18990 14153 1 20 . 1 1 352 352 LEU CB C 352 42.706 42.706 44.047 -1.341 18990 14154 1 20 . 1 1 352 352 LEU H H 352 8.151 8.151 8.315 -0.164 18990 14155 1 20 . 1 1 353 353 CYS N N 353 126.825 126.825 122.797 4.028 18990 14156 1 20 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.206 -0.099 18990 14157 1 20 . 1 1 353 353 CYS C C 353 176.655 176.655 174.699 1.956 18990 14158 1 20 . 1 1 353 353 CYS CA C 353 57.731 57.731 56.984 0.747 18990 14159 1 20 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.092 4.773 18990 14160 1 20 . 1 1 353 353 CYS H H 353 8.794 8.794 8.542 0.252 18990 14161 1 20 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.124 0.296 18990 14162 1 20 . 1 1 354 354 PRO C C 354 177.512 177.512 176.154 1.358 18990 14163 1 20 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.912 -0.920 18990 14164 1 20 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.441 1.126 18990 14165 1 20 . 1 1 355 355 GLN N N 355 126.800 126.800 119.577 7.223 18990 14166 1 20 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.520 -0.245 18990 14167 1 20 . 1 1 355 355 GLN C C 355 175.516 175.516 174.959 0.557 18990 14168 1 20 . 1 1 355 355 GLN CA C 355 54.793 54.793 52.824 1.969 18990 14169 1 20 . 1 1 355 355 GLN CB C 355 28.547 28.547 29.090 -0.543 18990 14170 1 20 . 1 1 355 355 GLN H H 355 9.033 9.033 7.433 1.600 18990 14171 1 20 . 1 1 357 357 GLY C C 357 173.229 173.229 174.966 -1.737 18990 14172 1 20 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.722 0.532 18990 14173 1 20 . 1 1 358 358 CYS N N 358 123.500 123.500 120.279 3.221 18990 14174 1 20 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.470 0.063 18990 14175 1 20 . 1 1 358 358 CYS C C 358 176.157 176.157 176.452 -0.295 18990 14176 1 20 . 1 1 358 358 CYS CA C 358 60.268 60.268 60.129 0.139 18990 14177 1 20 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.083 1.292 18990 14178 1 20 . 1 1 358 358 CYS H H 358 7.720 7.720 7.640 0.080 18990 14179 1 20 . 1 1 359 359 GLY N N 359 104.400 104.400 109.074 -4.674 18990 14180 1 20 . 1 1 359 359 GLY C C 359 174.080 174.080 175.347 -1.267 18990 14181 1 20 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.321 -0.257 18990 14182 1 20 . 1 1 359 359 GLY H H 359 7.756 7.756 8.358 -0.602 18990 14183 1 20 . 1 1 360 360 MET N N 360 121.300 121.300 119.603 1.697 18990 14184 1 20 . 1 1 360 360 MET HA H 360 4.343 4.343 4.307 0.036 18990 14185 1 20 . 1 1 360 360 MET C C 360 175.641 175.641 177.532 -1.891 18990 14186 1 20 . 1 1 360 360 MET CA C 360 55.923 55.923 56.525 -0.602 18990 14187 1 20 . 1 1 360 360 MET CB C 360 33.091 33.091 33.573 -0.482 18990 14188 1 20 . 1 1 360 360 MET H H 360 8.229 8.229 7.613 0.616 18990 14189 1 20 . 1 1 361 361 GLY N N 361 109.000 109.000 106.897 2.103 18990 14190 1 20 . 1 1 361 361 GLY C C 361 173.774 173.774 173.442 0.332 18990 14191 1 20 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.383 1.455 18990 14192 1 20 . 1 1 361 361 GLY H H 361 8.347 8.347 7.929 0.418 18990 14193 1 20 . 1 1 362 362 LEU N N 362 126.725 126.725 124.368 2.357 18990 14194 1 20 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.830 -0.155 18990 14195 1 20 . 1 1 362 362 LEU C C 362 175.865 175.865 176.543 -0.678 18990 14196 1 20 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.133 1.057 18990 14197 1 20 . 1 1 362 362 LEU CB C 362 44.050 44.050 44.072 -0.021 18990 14198 1 20 . 1 1 362 362 LEU H H 362 8.935 8.935 8.909 0.026 18990 14199 1 20 . 1 1 363 363 LEU N N 363 123.742 123.742 125.108 -1.366 18990 14200 1 20 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.484 0.193 18990 14201 1 20 . 1 1 363 363 LEU C C 363 176.162 176.162 175.046 1.116 18990 14202 1 20 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.633 -0.291 18990 14203 1 20 . 1 1 363 363 LEU CB C 363 42.210 42.210 42.377 -0.167 18990 14204 1 20 . 1 1 363 363 LEU H H 363 8.481 8.481 8.651 -0.170 18990 14205 1 20 . 1 1 364 364 VAL N N 364 120.980 120.980 127.772 -6.792 18990 14206 1 20 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.276 0.121 18990 14207 1 20 . 1 1 364 364 VAL C C 364 175.592 175.592 174.037 1.555 18990 14208 1 20 . 1 1 364 364 VAL CA C 364 60.460 60.460 60.636 -0.177 18990 14209 1 20 . 1 1 364 364 VAL CB C 364 34.125 34.125 32.389 1.736 18990 14210 1 20 . 1 1 364 364 VAL H H 364 8.155 8.155 7.973 0.182 18990 14211 1 20 . 1 1 365 365 GLU N N 365 126.950 126.950 126.634 0.316 18990 14212 1 20 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.788 -0.178 18990 14213 1 20 . 1 1 365 365 GLU C C 365 175.427 175.427 176.269 -0.842 18990 14214 1 20 . 1 1 365 365 GLU CA C 365 54.551 54.551 52.769 1.782 18990 14215 1 20 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.923 -0.143 18990 14216 1 20 . 1 1 365 365 GLU H H 365 8.900 8.900 8.099 0.801 18990 14217 1 20 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.362 -0.100 18990 14218 1 20 . 1 1 366 366 PRO C C 366 177.013 177.013 176.955 0.058 18990 14219 1 20 . 1 1 366 366 PRO CA C 366 64.463 64.463 64.952 -0.489 18990 14220 1 20 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.965 0.083 18990 14221 1 20 . 1 1 367 367 ASP N N 367 115.459 115.459 117.273 -1.814 18990 14222 1 20 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.611 -0.116 18990 14223 1 20 . 1 1 367 367 ASP C C 367 175.123 175.123 175.611 -0.488 18990 14224 1 20 . 1 1 367 367 ASP CA C 367 54.503 54.503 54.812 -0.309 18990 14225 1 20 . 1 1 367 367 ASP CB C 367 40.123 40.123 40.387 -0.264 18990 14226 1 20 . 1 1 367 367 ASP H H 367 8.439 8.439 8.621 -0.182 18990 14227 1 20 . 1 1 368 368 CYS N N 368 118.700 118.700 120.104 -1.404 18990 14228 1 20 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.600 -0.030 18990 14229 1 20 . 1 1 368 368 CYS C C 368 173.806 173.806 173.774 0.032 18990 14230 1 20 . 1 1 368 368 CYS CA C 368 58.581 58.581 58.422 0.159 18990 14231 1 20 . 1 1 368 368 CYS CB C 368 28.450 28.450 28.543 -0.092 18990 14232 1 20 . 1 1 368 368 CYS H H 368 7.515 7.515 7.977 -0.462 18990 14233 1 20 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.617 -0.352 18990 14234 1 20 . 1 1 369 369 ARG C C 369 174.908 174.908 175.904 -0.996 18990 14235 1 20 . 1 1 369 369 ARG CA C 369 57.669 57.669 54.977 2.692 18990 14236 1 20 . 1 1 369 369 ARG CB C 369 32.274 32.274 30.860 1.414 18990 14237 1 20 . 1 1 370 370 LYS N N 370 121.022 121.022 119.771 1.251 18990 14238 1 20 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.790 -0.620 18990 14239 1 20 . 1 1 370 370 LYS C C 370 174.868 174.868 174.429 0.439 18990 14240 1 20 . 1 1 370 370 LYS CA C 370 56.554 56.554 54.886 1.668 18990 14241 1 20 . 1 1 370 370 LYS CB C 370 33.140 33.140 33.228 -0.088 18990 14242 1 20 . 1 1 370 370 LYS H H 370 7.740 7.740 7.685 0.055 18990 14243 1 20 . 1 1 371 371 VAL N N 371 128.362 128.362 125.412 2.950 18990 14244 1 20 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.035 0.098 18990 14245 1 20 . 1 1 371 371 VAL C C 371 173.402 173.402 174.427 -1.025 18990 14246 1 20 . 1 1 371 371 VAL CA C 371 60.777 60.777 61.056 -0.279 18990 14247 1 20 . 1 1 371 371 VAL CB C 371 33.000 33.000 31.689 1.310 18990 14248 1 20 . 1 1 371 371 VAL H H 371 8.647 8.647 8.336 0.311 18990 14249 1 20 . 1 1 372 372 THR N N 372 119.667 119.667 122.758 -3.091 18990 14250 1 20 . 1 1 372 372 THR HA H 372 5.032 5.032 4.778 0.254 18990 14251 1 20 . 1 1 372 372 THR C C 372 174.339 174.339 173.605 0.734 18990 14252 1 20 . 1 1 372 372 THR CA C 372 60.881 60.881 61.071 -0.190 18990 14253 1 20 . 1 1 372 372 THR CB C 372 70.471 70.471 71.736 -1.264 18990 14254 1 20 . 1 1 372 372 THR H H 372 8.087 8.087 8.180 -0.093 18990 14255 1 20 . 1 1 373 373 CYS N N 373 132.554 132.554 125.659 6.895 18990 14256 1 20 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.547 0.255 18990 14257 1 20 . 1 1 373 373 CYS C C 373 176.791 176.791 176.398 0.393 18990 14258 1 20 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.384 -0.880 18990 14259 1 20 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.665 3.646 18990 14260 1 20 . 1 1 373 373 CYS H H 373 9.322 9.322 9.390 -0.068 18990 14261 1 20 . 1 1 374 374 GLN N N 374 125.890 125.890 124.002 1.888 18990 14262 1 20 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.176 -0.176 18990 14263 1 20 . 1 1 374 374 GLN C C 374 176.827 176.827 176.717 0.110 18990 14264 1 20 . 1 1 374 374 GLN CA C 374 58.300 58.300 58.131 0.169 18990 14265 1 20 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.637 1.027 18990 14266 1 20 . 1 1 374 374 GLN H H 374 7.856 7.856 8.544 -0.688 18990 14267 1 20 . 1 1 375 375 ASN N N 375 115.342 115.342 115.115 0.227 18990 14268 1 20 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.806 0.081 18990 14269 1 20 . 1 1 375 375 ASN C C 375 174.049 174.049 174.804 -0.755 18990 14270 1 20 . 1 1 375 375 ASN CA C 375 53.047 53.047 52.910 0.137 18990 14271 1 20 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.366 -0.450 18990 14272 1 20 . 1 1 375 375 ASN H H 375 8.913 8.913 8.189 0.724 18990 14273 1 20 . 1 1 376 376 GLY N N 376 109.098 109.098 107.456 1.642 18990 14274 1 20 . 1 1 376 376 GLY C C 376 174.110 174.110 173.076 1.034 18990 14275 1 20 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.411 0.975 18990 14276 1 20 . 1 1 376 376 GLY H H 376 7.162 7.162 7.628 -0.466 18990 14277 1 20 . 1 1 377 377 CYS N N 377 132.546 132.546 122.207 10.339 18990 14278 1 20 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.675 0.089 18990 14279 1 20 . 1 1 377 377 CYS C C 377 177.355 177.355 176.072 1.283 18990 14280 1 20 . 1 1 377 377 CYS CA C 377 59.988 59.988 56.707 3.281 18990 14281 1 20 . 1 1 377 377 CYS CB C 377 32.365 32.365 25.140 7.225 18990 14282 1 20 . 1 1 377 377 CYS H H 377 9.800 9.800 8.407 1.393 18990 14283 1 20 . 1 1 378 378 GLY N N 378 113.851 113.851 111.800 2.051 18990 14284 1 20 . 1 1 378 378 GLY C C 378 173.404 173.404 172.955 0.449 18990 14285 1 20 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.834 0.029 18990 14286 1 20 . 1 1 378 378 GLY H H 378 8.820 8.820 8.379 0.441 18990 14287 1 20 . 1 1 379 379 TYR N N 379 125.532 125.532 126.932 -1.400 18990 14288 1 20 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.657 -0.179 18990 14289 1 20 . 1 1 379 379 TYR C C 379 173.661 173.661 174.111 -0.450 18990 14290 1 20 . 1 1 379 379 TYR CA C 379 59.180 59.180 56.870 2.310 18990 14291 1 20 . 1 1 379 379 TYR CB C 379 40.108 40.108 42.049 -1.941 18990 14292 1 20 . 1 1 379 379 TYR H H 379 9.054 9.054 8.045 1.009 18990 14293 1 20 . 1 1 380 380 VAL N N 380 124.461 124.461 128.645 -4.184 18990 14294 1 20 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.680 0.138 18990 14295 1 20 . 1 1 380 380 VAL C C 380 175.876 175.876 174.019 1.857 18990 14296 1 20 . 1 1 380 380 VAL CA C 380 60.797 60.797 61.113 -0.316 18990 14297 1 20 . 1 1 380 380 VAL CB C 380 32.610 32.610 33.030 -0.420 18990 14298 1 20 . 1 1 380 380 VAL H H 380 7.238 7.238 8.028 -0.790 18990 14299 1 20 . 1 1 381 381 PHE N N 381 124.588 124.588 124.647 -0.059 18990 14300 1 20 . 1 1 381 381 PHE HA H 381 5.273 5.273 4.755 0.518 18990 14301 1 20 . 1 1 381 381 PHE C C 381 173.242 173.242 173.681 -0.439 18990 14302 1 20 . 1 1 381 381 PHE CA C 381 55.210 55.210 54.943 0.267 18990 14303 1 20 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.790 1.300 18990 14304 1 20 . 1 1 381 381 PHE H H 381 9.424 9.424 7.289 2.135 18990 14305 1 20 . 1 1 382 382 CYS N N 382 120.221 120.221 120.605 -0.384 18990 14306 1 20 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.564 0.338 18990 14307 1 20 . 1 1 382 382 CYS C C 382 177.165 177.165 176.148 1.017 18990 14308 1 20 . 1 1 382 382 CYS CA C 382 57.691 57.691 57.817 -0.126 18990 14309 1 20 . 1 1 382 382 CYS CB C 382 32.475 32.475 29.777 2.697 18990 14310 1 20 . 1 1 382 382 CYS H H 382 8.673 8.673 8.705 -0.032 18990 14311 1 20 . 1 1 383 383 ARG N N 383 129.347 129.347 123.486 5.861 18990 14312 1 20 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.263 -0.242 18990 14313 1 20 . 1 1 383 383 ARG C C 383 175.012 175.012 176.528 -1.516 18990 14314 1 20 . 1 1 383 383 ARG CA C 383 58.686 58.686 57.804 0.881 18990 14315 1 20 . 1 1 383 383 ARG CB C 383 30.900 30.900 29.980 0.920 18990 14316 1 20 . 1 1 383 383 ARG H H 383 9.534 9.534 8.662 0.872 18990 14317 1 20 . 1 1 384 384 ASN N N 384 117.772 117.772 117.357 0.415 18990 14318 1 20 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.714 -0.006 18990 14319 1 20 . 1 1 384 384 ASN C C 384 175.656 175.656 174.571 1.085 18990 14320 1 20 . 1 1 384 384 ASN CA C 384 55.778 55.778 53.845 1.933 18990 14321 1 20 . 1 1 384 384 ASN CB C 384 39.475 39.475 40.146 -0.671 18990 14322 1 20 . 1 1 384 384 ASN H H 384 8.840 8.840 8.328 0.512 18990 14323 1 20 . 1 1 385 385 CYS N N 385 115.876 115.876 113.840 2.036 18990 14324 1 20 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.925 0.103 18990 14325 1 20 . 1 1 385 385 CYS C C 385 175.703 175.703 173.761 1.942 18990 14326 1 20 . 1 1 385 385 CYS CA C 385 58.112 58.112 57.015 1.097 18990 14327 1 20 . 1 1 385 385 CYS CB C 385 32.359 32.359 30.163 2.196 18990 14328 1 20 . 1 1 385 385 CYS H H 385 7.868 7.868 7.950 -0.082 18990 14329 1 20 . 1 1 386 386 LEU N N 386 120.082 120.082 118.907 1.175 18990 14330 1 20 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.760 -0.447 18990 14331 1 20 . 1 1 386 386 LEU C C 386 175.722 175.722 177.478 -1.756 18990 14332 1 20 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.184 2.825 18990 14333 1 20 . 1 1 386 386 LEU CB C 386 38.412 38.412 42.283 -3.871 18990 14334 1 20 . 1 1 386 386 LEU H H 386 8.514 8.514 8.211 0.303 18990 14335 1 20 . 1 1 387 387 GLN N N 387 117.579 117.579 120.093 -2.514 18990 14336 1 20 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.249 0.527 18990 14337 1 20 . 1 1 387 387 GLN C C 387 175.299 175.299 176.902 -1.603 18990 14338 1 20 . 1 1 387 387 GLN CA C 387 54.017 54.017 56.478 -2.461 18990 14339 1 20 . 1 1 387 387 GLN CB C 387 30.307 30.307 27.964 2.343 18990 14340 1 20 . 1 1 387 387 GLN H H 387 8.248 8.248 7.687 0.561 18990 14341 1 20 . 1 1 388 388 GLY N N 388 106.107 106.107 107.418 -1.311 18990 14342 1 20 . 1 1 388 388 GLY C C 388 173.693 173.693 173.842 -0.149 18990 14343 1 20 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.166 1.014 18990 14344 1 20 . 1 1 388 388 GLY H H 388 8.695 8.695 8.271 0.424 18990 14345 1 20 . 1 1 389 389 TYR N N 389 122.514 122.514 117.220 5.294 18990 14346 1 20 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.263 -0.605 18990 14347 1 20 . 1 1 389 389 TYR C C 389 172.860 172.860 174.528 -1.668 18990 14348 1 20 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.317 4.670 18990 14349 1 20 . 1 1 389 389 TYR CB C 389 38.052 38.052 36.926 1.126 18990 14350 1 20 . 1 1 389 389 TYR H H 389 7.923 7.923 8.159 -0.236 18990 14351 1 20 . 1 1 390 390 HIS N N 390 120.080 120.080 122.964 -2.884 18990 14352 1 20 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.608 0.100 18990 14353 1 20 . 1 1 390 390 HIS C C 390 173.235 173.235 174.683 -1.448 18990 14354 1 20 . 1 1 390 390 HIS CA C 390 51.431 51.431 56.000 -4.569 18990 14355 1 20 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.192 0.708 18990 14356 1 20 . 1 1 390 390 HIS H H 390 5.291 5.291 8.854 -3.563 18990 14357 1 20 . 1 1 391 391 ILE N N 391 117.810 117.810 120.381 -2.571 18990 14358 1 20 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.210 -0.094 18990 14359 1 20 . 1 1 391 391 ILE C C 391 178.208 178.208 176.180 2.028 18990 14360 1 20 . 1 1 391 391 ILE CA C 391 60.877 60.877 59.789 1.088 18990 14361 1 20 . 1 1 391 391 ILE CB C 391 39.034 39.034 40.487 -1.454 18990 14362 1 20 . 1 1 391 391 ILE H H 391 8.418 8.418 7.217 1.201 18990 14363 1 20 . 1 1 392 392 GLY N N 392 112.387 112.387 111.305 1.082 18990 14364 1 20 . 1 1 392 392 GLY C C 392 173.565 173.565 174.149 -0.584 18990 14365 1 20 . 1 1 392 392 GLY CA C 392 45.258 45.258 46.118 -0.860 18990 14366 1 20 . 1 1 392 392 GLY H H 392 8.654 8.654 8.462 0.192 18990 14367 1 20 . 1 1 393 393 GLU N N 393 119.098 119.098 117.947 1.151 18990 14368 1 20 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.671 -0.382 18990 14369 1 20 . 1 1 393 393 GLU C C 393 176.899 176.899 175.032 1.867 18990 14370 1 20 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.380 1.053 18990 14371 1 20 . 1 1 393 393 GLU CB C 393 30.470 30.470 32.527 -2.057 18990 14372 1 20 . 1 1 393 393 GLU H H 393 8.391 8.391 8.147 0.244 18990 14373 1 20 . 1 1 394 394 CYS N N 394 122.845 122.845 120.659 2.186 18990 14374 1 20 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.810 -1.044 18990 14375 1 20 . 1 1 394 394 CYS C C 394 175.461 175.461 173.118 2.343 18990 14376 1 20 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.048 1.787 18990 14377 1 20 . 1 1 394 394 CYS CB C 394 30.761 30.761 30.319 0.442 18990 14378 1 20 . 1 1 394 394 CYS H H 394 8.474 8.474 8.734 -0.260 18990 14379 1 20 . 1 1 395 395 LEU N N 395 124.403 124.403 122.750 1.653 18990 14380 1 20 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.777 -0.273 18990 14381 1 20 . 1 1 395 395 LEU C C 395 175.259 175.259 174.706 0.553 18990 14382 1 20 . 1 1 395 395 LEU CA C 395 52.835 52.835 53.273 -0.438 18990 14383 1 20 . 1 1 395 395 LEU CB C 395 41.436 41.436 42.717 -1.281 18990 14384 1 20 . 1 1 395 395 LEU H H 395 8.418 8.418 8.124 0.294 18990 14385 1 20 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.642 -0.272 18990 14386 1 20 . 1 1 396 396 PRO C C 396 177.006 177.006 175.522 1.484 18990 14387 1 20 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.565 0.531 18990 14388 1 20 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.331 -0.259 18990 14389 1 20 . 1 1 397 397 GLU N N 397 121.574 121.574 120.255 1.319 18990 14390 1 20 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.493 -0.268 18990 14391 1 20 . 1 1 397 397 GLU C C 397 177.202 177.202 175.764 1.438 18990 14392 1 20 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.375 0.659 18990 14393 1 20 . 1 1 397 397 GLU CB C 397 30.263 30.263 30.394 -0.131 18990 14394 1 20 . 1 1 397 397 GLU H H 397 8.568 8.568 8.523 0.045 18990 14395 1 20 . 1 1 398 398 GLY N N 398 110.495 110.495 114.270 -3.775 18990 14396 1 20 . 1 1 398 398 GLY C C 398 174.579 174.579 173.816 0.763 18990 14397 1 20 . 1 1 398 398 GLY CA C 398 45.462 45.462 45.664 -0.202 18990 14398 1 20 . 1 1 398 398 GLY H H 398 8.515 8.515 8.535 -0.020 18990 14399 1 20 . 1 1 399 399 THR N N 399 113.234 113.234 112.867 0.367 18990 14400 1 20 . 1 1 399 399 THR HA H 399 4.398 4.398 4.690 -0.292 18990 14401 1 20 . 1 1 399 399 THR C C 399 175.333 175.333 173.867 1.466 18990 14402 1 20 . 1 1 399 399 THR CA C 399 62.233 62.233 60.584 1.649 18990 14403 1 20 . 1 1 399 399 THR CB C 399 69.833 69.833 71.477 -1.644 18990 14404 1 20 . 1 1 399 399 THR H H 399 8.090 8.090 8.672 -0.582 18990 14405 1 20 . 1 1 400 400 GLY N N 400 111.479 111.479 108.103 3.376 18990 14406 1 20 . 1 1 400 400 GLY C C 400 174.048 174.048 173.170 0.878 18990 14407 1 20 . 1 1 400 400 GLY CA C 400 45.439 45.439 44.483 0.955 18990 14408 1 20 . 1 1 400 400 GLY H H 400 8.524 8.524 8.371 0.153 18990 14409 1 20 . 1 1 401 401 ALA N N 401 123.919 123.919 124.404 -0.485 18990 14410 1 20 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.838 -0.587 18990 14411 1 20 . 1 1 401 401 ALA C C 401 177.942 177.942 176.286 1.656 18990 14412 1 20 . 1 1 401 401 ALA CA C 401 52.730 52.730 52.210 0.520 18990 14413 1 20 . 1 1 401 401 ALA CB C 401 19.142 19.142 20.368 -1.226 18990 14414 1 20 . 1 1 401 401 ALA H H 401 8.179 8.179 8.014 0.165 18990 14415 1 20 . 1 1 402 402 SER N N 402 114.904 114.904 116.656 -1.752 18990 14416 1 20 . 1 1 402 402 SER HA H 402 4.448 4.448 4.858 -0.410 18990 14417 1 20 . 1 1 402 402 SER C C 402 174.426 174.426 173.481 0.945 18990 14418 1 20 . 1 1 402 402 SER CA C 402 58.289 58.289 58.041 0.248 18990 14419 1 20 . 1 1 402 402 SER CB C 402 63.772 63.772 64.372 -0.600 18990 14420 1 20 . 1 1 402 402 SER H H 402 8.305 8.305 8.364 -0.059 18990 14421 1 20 . 1 1 403 403 ALA N N 403 125.965 125.965 124.669 1.296 18990 14422 1 20 . 1 1 403 403 ALA HA H 403 4.399 4.399 5.220 -0.821 18990 14423 1 20 . 1 1 403 403 ALA C C 403 177.984 177.984 175.717 2.267 18990 14424 1 20 . 1 1 403 403 ALA CA C 403 52.655 52.655 51.594 1.061 18990 14425 1 20 . 1 1 403 403 ALA CB C 403 19.138 19.138 21.430 -2.292 18990 14426 1 20 . 1 1 403 403 ALA H H 403 8.345 8.345 8.823 -0.478 18990 14427 1 20 . 1 1 404 404 THR N N 404 112.790 112.790 114.671 -1.881 18990 14428 1 20 . 1 1 404 404 THR C C 404 174.420 174.420 173.112 1.308 18990 14429 1 20 . 1 1 404 404 THR CA C 404 61.988 61.988 62.366 -0.378 18990 14430 1 20 . 1 1 404 404 THR CB C 404 69.688 69.688 69.613 0.075 18990 14431 1 20 . 1 1 404 404 THR H H 404 8.118 8.118 8.162 -0.044 18990 14432 1 20 . 1 1 405 405 ASN N N 405 121.050 121.050 123.791 -2.741 18990 14433 1 20 . 1 1 405 405 ASN H H 405 8.396 8.396 8.480 -0.084 18990 14434 1 20 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.596 -0.018 18990 14435 1 20 . 1 1 407 407 CYS C C 407 174.489 174.489 173.309 1.180 18990 14436 1 20 . 1 1 407 407 CYS CA C 407 58.713 58.713 59.572 -0.859 18990 14437 1 20 . 1 1 407 407 CYS CB C 407 28.102 28.102 28.547 -0.445 18990 14438 1 20 . 1 1 408 408 GLU N N 408 123.021 123.021 127.204 -4.183 18990 14439 1 20 . 1 1 408 408 GLU C C 408 175.954 175.954 174.835 1.119 18990 14440 1 20 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.315 0.487 18990 14441 1 20 . 1 1 408 408 GLU CB C 408 30.328 30.328 30.333 -0.005 18990 14442 1 20 . 1 1 408 408 GLU H H 408 8.415 8.415 8.529 -0.114 18990 14443 1 20 . 1 1 409 409 TYR N N 409 121.015 121.015 122.616 -1.601 18990 14444 1 20 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.796 -0.142 18990 14445 1 20 . 1 1 409 409 TYR C C 409 175.613 175.613 174.081 1.532 18990 14446 1 20 . 1 1 409 409 TYR CA C 409 57.669 57.669 56.743 0.926 18990 14447 1 20 . 1 1 409 409 TYR CB C 409 38.825 38.825 39.599 -0.774 18990 14448 1 20 . 1 1 409 409 TYR H H 409 8.135 8.135 7.900 0.235 18990 14449 1 20 . 1 1 410 410 THR N N 410 116.975 116.975 116.243 0.732 18990 14450 1 20 . 1 1 410 410 THR HA H 410 4.306 4.306 4.476 -0.170 18990 14451 1 20 . 1 1 410 410 THR C C 410 173.846 173.846 173.682 0.164 18990 14452 1 20 . 1 1 410 410 THR CA C 410 61.730 61.730 61.988 -0.258 18990 14453 1 20 . 1 1 410 410 THR CB C 410 69.914 69.914 69.832 0.082 18990 14454 1 20 . 1 1 410 410 THR H H 410 8.060 8.060 8.298 -0.238 18990 14455 1 20 . 1 1 411 411 VAL N N 411 122.900 122.900 124.591 -1.691 18990 14456 1 20 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.180 -0.127 18990 14457 1 20 . 1 1 411 411 VAL C C 411 175.275 175.275 175.482 -0.207 18990 14458 1 20 . 1 1 411 411 VAL CA C 411 61.853 61.853 62.765 -0.912 18990 14459 1 20 . 1 1 411 411 VAL CB C 411 32.976 32.976 32.083 0.893 18990 14460 1 20 . 1 1 411 411 VAL H H 411 8.089 8.089 8.507 -0.418 18990 14461 1 20 . 1 1 412 412 ASP N N 412 125.924 125.924 130.162 -4.238 18990 14462 1 20 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.954 -0.104 18990 14463 1 20 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.240 -0.662 18990 14464 1 20 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.977 -0.439 18990 14465 1 20 . 1 1 412 412 ASP H H 412 8.397 8.397 8.488 -0.091 18990 14466 1 20 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.515 -0.129 18990 14467 1 20 . 1 1 413 413 PRO C C 413 177.352 177.352 176.207 1.145 18990 14468 1 20 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.654 1.256 18990 14469 1 20 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.318 -0.050 18990 14470 1 20 . 1 1 414 414 ASN N N 414 117.035 117.035 121.534 -4.499 18990 14471 1 20 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.952 -0.275 18990 14472 1 20 . 1 1 414 414 ASN C C 414 175.532 175.532 174.325 1.207 18990 14473 1 20 . 1 1 414 414 ASN CA C 414 53.824 53.824 53.189 0.635 18990 14474 1 20 . 1 1 414 414 ASN CB C 414 38.728 38.728 40.739 -2.011 18990 14475 1 20 . 1 1 414 414 ASN H H 414 8.496 8.496 8.629 -0.133 18990 14476 1 20 . 1 1 415 415 ARG N N 415 121.000 121.000 121.189 -0.189 18990 14477 1 20 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.705 -0.461 18990 14478 1 20 . 1 1 415 415 ARG C C 415 176.243 176.243 174.280 1.963 18990 14479 1 20 . 1 1 415 415 ARG CA C 415 56.404 56.404 55.590 0.814 18990 14480 1 20 . 1 1 415 415 ARG CB C 415 30.637 30.637 31.229 -0.592 18990 14481 1 20 . 1 1 415 415 ARG H H 415 7.804 7.804 8.589 -0.785 18990 14482 1 20 . 1 1 416 416 ALA N N 416 124.880 124.880 123.011 1.869 18990 14483 1 20 . 1 1 416 416 ALA C C 416 177.831 177.831 175.798 2.033 18990 14484 1 20 . 1 1 416 416 ALA CA C 416 52.957 52.957 52.150 0.807 18990 14485 1 20 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.215 -1.156 18990 14486 1 20 . 1 1 416 416 ALA H H 416 8.189 8.189 9.014 -0.825 18990 14487 1 20 . 1 1 417 417 ALA N N 417 122.614 122.614 125.560 -2.946 18990 14488 1 20 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.508 -0.261 18990 14489 1 20 . 1 1 417 417 ALA C C 417 178.024 178.024 175.588 2.436 18990 14490 1 20 . 1 1 417 417 ALA CA C 417 52.789 52.789 52.120 0.669 18990 14491 1 20 . 1 1 417 417 ALA CB C 417 19.042 19.042 20.229 -1.187 18990 14492 1 20 . 1 1 417 417 ALA H H 417 8.169 8.169 8.322 -0.153 18990 14493 1 20 . 1 1 418 418 GLU N N 418 119.500 119.500 121.016 -1.516 18990 14494 1 20 . 1 1 418 418 GLU HA H 418 4.189 4.189 5.010 -0.821 18990 14495 1 20 . 1 1 418 418 GLU C C 418 176.266 176.266 175.072 1.194 18990 14496 1 20 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.508 1.068 18990 14497 1 20 . 1 1 418 418 GLU CB C 418 30.307 30.307 31.648 -1.341 18990 14498 1 20 . 1 1 418 418 GLU H H 418 8.184 8.184 8.406 -0.222 18990 14499 1 20 . 1 1 419 419 ALA N N 419 124.643 124.643 123.714 0.929 18990 14500 1 20 . 1 1 419 419 ALA HA H 419 4.250 4.250 5.219 -0.969 18990 14501 1 20 . 1 1 419 419 ALA C C 419 177.488 177.488 175.744 1.744 18990 14502 1 20 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.311 1.198 18990 14503 1 20 . 1 1 419 419 ALA CB C 419 19.161 19.161 21.068 -1.907 18990 14504 1 20 . 1 1 419 419 ALA H H 419 8.135 8.135 8.867 -0.732 18990 14505 1 20 . 1 1 420 420 ARG N N 420 120.003 120.003 120.674 -0.671 18990 14506 1 20 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.875 -0.582 18990 14507 1 20 . 1 1 420 420 ARG C C 420 176.297 176.297 174.223 2.074 18990 14508 1 20 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.941 -0.008 18990 14509 1 20 . 1 1 420 420 ARG CB C 420 30.850 30.850 31.211 -0.361 18990 14510 1 20 . 1 1 420 420 ARG H H 420 8.135 8.135 9.749 -1.614 18990 14511 1 20 . 1 1 421 421 TRP N N 421 122.280 122.280 123.168 -0.888 18990 14512 1 20 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.844 -0.181 18990 14513 1 20 . 1 1 421 421 TRP C C 421 175.856 175.856 174.419 1.437 18990 14514 1 20 . 1 1 421 421 TRP CA C 421 57.404 57.404 56.713 0.691 18990 14515 1 20 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.046 -0.609 18990 14516 1 20 . 1 1 421 421 TRP H H 421 8.159 8.159 8.022 0.137 18990 14517 1 20 . 1 1 422 422 ASP N N 422 121.980 121.980 119.092 2.888 18990 14518 1 20 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.615 -0.120 18990 14519 1 20 . 1 1 422 422 ASP C C 422 176.184 176.184 175.887 0.297 18990 14520 1 20 . 1 1 422 422 ASP CA C 422 53.899 53.899 54.219 -0.320 18990 14521 1 20 . 1 1 422 422 ASP CB C 422 40.948 40.948 42.798 -1.850 18990 14522 1 20 . 1 1 422 422 ASP H H 422 8.135 8.135 8.446 -0.311 18990 14523 1 20 . 1 1 423 423 GLU N N 423 121.990 121.990 120.969 1.021 18990 14524 1 20 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.403 -0.313 18990 14525 1 20 . 1 1 423 423 GLU C C 423 176.720 176.720 176.481 0.239 18990 14526 1 20 . 1 1 423 423 GLU CA C 423 57.169 57.169 55.929 1.240 18990 14527 1 20 . 1 1 423 423 GLU CB C 423 30.156 30.156 29.394 0.762 18990 14528 1 20 . 1 1 423 423 GLU H H 423 8.153 8.153 8.839 -0.686 18990 14529 1 20 . 1 1 424 424 ALA N N 424 123.900 123.900 124.198 -0.298 18990 14530 1 20 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.336 -0.056 18990 14531 1 20 . 1 1 424 424 ALA C C 424 178.095 178.095 177.321 0.774 18990 14532 1 20 . 1 1 424 424 ALA CA C 424 53.017 53.017 52.645 0.371 18990 14533 1 20 . 1 1 424 424 ALA CB C 424 19.086 19.086 18.847 0.239 18990 14534 1 20 . 1 1 424 424 ALA H H 424 8.243 8.243 7.786 0.457 18990 14535 1 20 . 1 1 425 425 SER N N 425 113.881 113.881 118.207 -4.326 18990 14536 1 20 . 1 1 425 425 SER HA H 425 4.387 4.387 4.593 -0.206 18990 14537 1 20 . 1 1 425 425 SER C C 425 174.338 174.338 173.599 0.739 18990 14538 1 20 . 1 1 425 425 SER CA C 425 58.546 58.546 58.078 0.468 18990 14539 1 20 . 1 1 425 425 SER CB C 425 63.784 63.784 64.135 -0.351 18990 14540 1 20 . 1 1 425 425 SER H H 425 8.063 8.063 8.507 -0.444 18990 14541 1 20 . 1 1 426 426 ASN N N 426 121.032 121.032 125.190 -4.158 18990 14542 1 20 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.920 -0.214 18990 14543 1 20 . 1 1 426 426 ASN C C 426 175.046 175.046 174.196 0.850 18990 14544 1 20 . 1 1 426 426 ASN CA C 426 53.445 53.445 53.038 0.408 18990 14545 1 20 . 1 1 426 426 ASN CB C 426 38.847 38.847 40.201 -1.354 18990 14546 1 20 . 1 1 426 426 ASN H H 426 8.391 8.391 8.499 -0.108 18990 14547 1 20 . 1 1 427 427 VAL N N 427 119.463 119.463 123.083 -3.620 18990 14548 1 20 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.306 -0.113 18990 14549 1 20 . 1 1 427 427 VAL C C 427 176.213 176.213 176.030 0.183 18990 14550 1 20 . 1 1 427 427 VAL CA C 427 62.449 62.449 61.657 0.792 18990 14551 1 20 . 1 1 427 427 VAL CB C 427 32.865 32.865 33.127 -0.262 18990 14552 1 20 . 1 1 427 427 VAL H H 427 7.954 7.954 8.323 -0.369 18990 14553 1 20 . 1 1 428 428 THR N N 428 118.226 118.226 118.913 -0.687 18990 14554 1 20 . 1 1 428 428 THR HA H 428 4.353 4.353 4.507 -0.154 18990 14555 1 20 . 1 1 428 428 THR C C 428 174.361 174.361 174.472 -0.111 18990 14556 1 20 . 1 1 428 428 THR CA C 428 62.065 62.065 61.419 0.645 18990 14557 1 20 . 1 1 428 428 THR CB C 428 69.729 69.729 69.813 -0.084 18990 14558 1 20 . 1 1 428 428 THR H H 428 8.225 8.225 8.303 -0.078 18990 14559 1 20 . 1 1 429 429 ILE N N 429 123.910 123.910 124.586 -0.676 18990 14560 1 20 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.345 -0.157 18990 14561 1 20 . 1 1 429 429 ILE C C 429 175.774 175.774 175.175 0.599 18990 14562 1 20 . 1 1 429 429 ILE CA C 429 60.819 60.819 60.644 0.175 18990 14563 1 20 . 1 1 429 429 ILE CB C 429 38.719 38.719 37.863 0.856 18990 14564 1 20 . 1 1 429 429 ILE H H 429 8.148 8.148 8.454 -0.306 18990 14565 1 20 . 1 1 430 430 LYS N N 430 126.453 126.453 128.743 -2.290 18990 14566 1 20 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.656 -0.222 18990 14567 1 20 . 1 1 430 430 LYS C C 430 176.241 176.241 175.464 0.777 18990 14568 1 20 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.192 0.745 18990 14569 1 20 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.960 -0.796 18990 14570 1 20 . 1 1 430 430 LYS H H 430 8.406 8.406 8.364 0.042 18990 14571 1 20 . 1 1 431 431 VAL N N 431 122.496 122.496 122.962 -0.466 18990 14572 1 20 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.314 -0.034 18990 14573 1 20 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.496 -0.193 18990 14574 1 20 . 1 1 431 431 VAL CB C 431 33.132 33.132 31.785 1.347 18990 14575 1 20 . 1 1 431 431 VAL H H 431 8.312 8.312 8.649 -0.337 18990 14576 1 20 . 1 1 432 432 SER HA H 432 4.486 4.486 4.548 -0.062 18990 14577 1 20 . 1 1 432 432 SER C C 432 173.834 173.834 174.792 -0.958 18990 14578 1 20 . 1 1 432 432 SER CA C 432 58.650 58.650 59.328 -0.678 18990 14579 1 20 . 1 1 432 432 SER CB C 432 64.152 64.152 64.015 0.137 18990 14580 1 20 . 1 1 433 433 THR N N 433 114.706 114.706 112.579 2.127 18990 14581 1 20 . 1 1 433 433 THR HA H 433 5.446 5.446 4.517 0.929 18990 14582 1 20 . 1 1 433 433 THR C C 433 173.979 173.979 173.830 0.149 18990 14583 1 20 . 1 1 433 433 THR CA C 433 60.412 60.412 60.879 -0.467 18990 14584 1 20 . 1 1 433 433 THR CB C 433 71.896 71.896 70.728 1.168 18990 14585 1 20 . 1 1 433 433 THR H H 433 7.833 7.833 7.443 0.390 18990 14586 1 20 . 1 1 434 434 LYS N N 434 122.492 122.492 122.385 0.107 18990 14587 1 20 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.924 -0.215 18990 14588 1 20 . 1 1 434 434 LYS C C 434 173.589 173.589 174.683 -1.094 18990 14589 1 20 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.713 1.662 18990 14590 1 20 . 1 1 434 434 LYS CB C 434 36.925 36.925 34.191 2.735 18990 14591 1 20 . 1 1 434 434 LYS H H 434 8.937 8.937 8.956 -0.019 18990 14592 1 20 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.472 -0.205 18990 14593 1 20 . 1 1 435 435 PRO C C 435 175.238 175.238 176.525 -1.287 18990 14594 1 20 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.396 -1.473 18990 14595 1 20 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.751 -0.665 18990 14596 1 20 . 1 1 436 436 CYS N N 436 125.422 125.422 124.255 1.167 18990 14597 1 20 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.088 -0.658 18990 14598 1 20 . 1 1 436 436 CYS C C 436 176.770 176.770 175.356 1.414 18990 14599 1 20 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.670 0.346 18990 14600 1 20 . 1 1 436 436 CYS CB C 436 31.698 31.698 27.968 3.730 18990 14601 1 20 . 1 1 436 436 CYS H H 436 7.768 7.768 8.458 -0.690 18990 14602 1 20 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.185 -0.327 18990 14603 1 20 . 1 1 437 437 PRO C C 437 173.608 173.608 176.277 -2.669 18990 14604 1 20 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.268 -0.055 18990 14605 1 20 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.430 1.019 18990 14606 1 20 . 1 1 438 438 LYS N N 438 118.600 118.600 118.719 -0.119 18990 14607 1 20 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.318 -0.348 18990 14608 1 20 . 1 1 438 438 LYS C C 438 176.887 176.887 177.579 -0.692 18990 14609 1 20 . 1 1 438 438 LYS CA C 438 57.687 57.687 56.973 0.714 18990 14610 1 20 . 1 1 438 438 LYS CB C 438 33.124 33.124 32.917 0.207 18990 14611 1 20 . 1 1 438 438 LYS H H 438 8.390 8.390 8.057 0.333 18990 14612 1 20 . 1 1 439 439 CYS N N 439 118.950 118.950 114.989 3.961 18990 14613 1 20 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.912 -0.166 18990 14614 1 20 . 1 1 439 439 CYS C C 439 176.650 176.650 174.984 1.666 18990 14615 1 20 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.060 2.288 18990 14616 1 20 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.749 2.447 18990 14617 1 20 . 1 1 439 439 CYS H H 439 8.357 8.357 7.820 0.537 18990 14618 1 20 . 1 1 440 440 ARG N N 440 117.200 117.200 119.677 -2.477 18990 14619 1 20 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.106 -0.138 18990 14620 1 20 . 1 1 440 440 ARG C C 440 175.253 175.253 175.357 -0.104 18990 14621 1 20 . 1 1 440 440 ARG CA C 440 56.900 56.900 57.162 -0.262 18990 14622 1 20 . 1 1 440 440 ARG CB C 440 26.041 26.041 28.046 -2.005 18990 14623 1 20 . 1 1 440 440 ARG H H 440 8.065 8.065 7.914 0.151 18990 14624 1 20 . 1 1 441 441 THR N N 441 122.400 122.400 112.449 9.951 18990 14625 1 20 . 1 1 441 441 THR HA H 441 4.371 4.371 4.658 -0.287 18990 14626 1 20 . 1 1 441 441 THR C C 441 173.702 173.702 172.986 0.716 18990 14627 1 20 . 1 1 441 441 THR CA C 441 63.194 63.194 59.697 3.497 18990 14628 1 20 . 1 1 441 441 THR CB C 441 68.933 68.933 69.292 -0.359 18990 14629 1 20 . 1 1 441 441 THR H H 441 8.643 8.643 7.583 1.060 18990 14630 1 20 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.485 -0.338 18990 14631 1 20 . 1 1 442 442 PRO C C 442 176.215 176.215 175.798 0.417 18990 14632 1 20 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.999 1.198 18990 14633 1 20 . 1 1 442 442 PRO CB C 442 32.044 32.044 31.284 0.760 18990 14634 1 20 . 1 1 443 443 THR N N 443 122.932 122.932 121.698 1.234 18990 14635 1 20 . 1 1 443 443 THR HA H 443 4.665 4.665 4.698 -0.033 18990 14636 1 20 . 1 1 443 443 THR C C 443 172.133 172.133 174.147 -2.014 18990 14637 1 20 . 1 1 443 443 THR CA C 443 62.566 62.566 62.026 0.540 18990 14638 1 20 . 1 1 443 443 THR CB C 443 71.562 71.562 71.337 0.225 18990 14639 1 20 . 1 1 443 443 THR H H 443 9.116 9.116 8.559 0.557 18990 14640 1 20 . 1 1 444 444 GLU N N 444 126.390 126.390 125.102 1.288 18990 14641 1 20 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.740 0.202 18990 14642 1 20 . 1 1 444 444 GLU C C 444 175.292 175.292 175.126 0.166 18990 14643 1 20 . 1 1 444 444 GLU CA C 444 55.049 55.049 54.599 0.450 18990 14644 1 20 . 1 1 444 444 GLU CB C 444 31.861 31.861 32.174 -0.313 18990 14645 1 20 . 1 1 444 444 GLU H H 444 8.720 8.720 8.733 -0.013 18990 14646 1 20 . 1 1 445 445 ARG N N 445 123.505 123.505 120.005 3.500 18990 14647 1 20 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.351 -0.640 18990 14648 1 20 . 1 1 445 445 ARG C C 445 175.289 175.289 175.244 0.045 18990 14649 1 20 . 1 1 445 445 ARG CA C 445 55.856 55.856 54.997 0.859 18990 14650 1 20 . 1 1 445 445 ARG CB C 445 30.675 30.675 31.487 -0.812 18990 14651 1 20 . 1 1 445 445 ARG H H 445 8.157 8.157 8.245 -0.088 18990 14652 1 20 . 1 1 446 446 ASP N N 446 126.800 126.800 119.935 6.865 18990 14653 1 20 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.685 -0.044 18990 14654 1 20 . 1 1 446 446 ASP C C 446 176.020 176.020 176.071 -0.051 18990 14655 1 20 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.107 -0.155 18990 14656 1 20 . 1 1 446 446 ASP CB C 446 41.400 41.400 41.817 -0.417 18990 14657 1 20 . 1 1 446 446 ASP H H 446 8.476 8.476 8.205 0.271 18990 14658 1 20 . 1 1 447 447 GLY N N 447 111.262 111.262 113.602 -2.340 18990 14659 1 20 . 1 1 447 447 GLY C C 447 174.073 174.073 174.123 -0.050 18990 14660 1 20 . 1 1 447 447 GLY CA C 447 45.832 45.832 45.664 0.168 18990 14661 1 20 . 1 1 447 447 GLY H H 447 8.056 8.056 8.762 -0.706 18990 14662 1 20 . 1 1 448 448 GLY N N 448 108.655 108.655 110.660 -2.005 18990 14663 1 20 . 1 1 448 448 GLY C C 448 174.020 174.020 174.161 -0.141 18990 14664 1 20 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.338 0.929 18990 14665 1 20 . 1 1 448 448 GLY H H 448 8.380 8.380 8.126 0.254 18990 14666 1 20 . 1 1 449 449 CYS N N 449 120.628 120.628 119.035 1.593 18990 14667 1 20 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.329 -0.332 18990 14668 1 20 . 1 1 449 449 CYS C C 449 174.855 174.855 175.320 -0.465 18990 14669 1 20 . 1 1 449 449 CYS CA C 449 59.291 59.291 59.523 -0.231 18990 14670 1 20 . 1 1 449 449 CYS CB C 449 28.000 28.000 28.904 -0.904 18990 14671 1 20 . 1 1 449 449 CYS H H 449 7.832 7.832 7.366 0.466 18990 14672 1 20 . 1 1 450 450 MET N N 450 123.947 123.947 120.921 3.026 18990 14673 1 20 . 1 1 450 450 MET HA H 450 4.551 4.551 4.150 0.401 18990 14674 1 20 . 1 1 450 450 MET C C 450 174.658 174.658 175.552 -0.894 18990 14675 1 20 . 1 1 450 450 MET CA C 450 54.970 54.970 56.866 -1.896 18990 14676 1 20 . 1 1 450 450 MET CB C 450 34.100 34.100 32.824 1.276 18990 14677 1 20 . 1 1 450 450 MET H H 450 8.916 8.916 8.419 0.497 18990 14678 1 20 . 1 1 451 451 HIS N N 451 120.490 120.490 119.445 1.045 18990 14679 1 20 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.703 -1.024 18990 14680 1 20 . 1 1 451 451 HIS C C 451 172.443 172.443 174.193 -1.750 18990 14681 1 20 . 1 1 451 451 HIS CA C 451 53.812 53.812 56.318 -2.506 18990 14682 1 20 . 1 1 451 451 HIS CB C 451 28.900 28.900 29.255 -0.355 18990 14683 1 20 . 1 1 451 451 HIS H H 451 7.557 7.557 7.995 -0.438 18990 14684 1 20 . 1 1 452 452 MET N N 452 128.800 128.800 126.659 2.141 18990 14685 1 20 . 1 1 452 452 MET HA H 452 4.320 4.320 4.498 -0.178 18990 14686 1 20 . 1 1 452 452 MET C C 452 175.479 175.479 173.501 1.978 18990 14687 1 20 . 1 1 452 452 MET CA C 452 52.589 52.589 53.339 -0.750 18990 14688 1 20 . 1 1 452 452 MET CB C 452 28.074 28.074 32.551 -4.478 18990 14689 1 20 . 1 1 452 452 MET H H 452 9.087 9.087 8.142 0.945 18990 14690 1 20 . 1 1 453 453 VAL N N 453 122.200 122.200 125.458 -3.258 18990 14691 1 20 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.573 0.221 18990 14692 1 20 . 1 1 453 453 VAL C C 453 175.476 175.476 174.521 0.955 18990 14693 1 20 . 1 1 453 453 VAL CA C 453 61.380 61.380 59.313 2.067 18990 14694 1 20 . 1 1 453 453 VAL CB C 453 33.089 33.089 34.503 -1.414 18990 14695 1 20 . 1 1 453 453 VAL H H 453 8.016 8.016 8.059 -0.043 18990 14696 1 20 . 1 1 454 454 CYS N N 454 130.353 130.353 128.369 1.984 18990 14697 1 20 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.635 -0.040 18990 14698 1 20 . 1 1 454 454 CYS C C 454 177.833 177.833 174.173 3.660 18990 14699 1 20 . 1 1 454 454 CYS CA C 454 61.571 61.571 59.497 2.074 18990 14700 1 20 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.704 5.341 18990 14701 1 20 . 1 1 454 454 CYS H H 454 8.989 8.989 9.082 -0.093 18990 14702 1 20 . 1 1 455 455 THR N N 455 119.000 119.000 121.963 -2.963 18990 14703 1 20 . 1 1 455 455 THR HA H 455 4.393 4.393 4.545 -0.152 18990 14704 1 20 . 1 1 455 455 THR C C 455 175.264 175.264 173.709 1.555 18990 14705 1 20 . 1 1 455 455 THR CA C 455 61.644 61.644 61.243 0.401 18990 14706 1 20 . 1 1 455 455 THR CB C 455 69.400 69.400 68.704 0.696 18990 14707 1 20 . 1 1 455 455 THR H H 455 8.533 8.533 8.518 0.015 18990 14708 1 20 . 1 1 456 456 ARG N N 456 128.900 128.900 126.956 1.944 18990 14709 1 20 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.572 -0.347 18990 14710 1 20 . 1 1 456 456 ARG C C 456 177.782 177.782 176.672 1.110 18990 14711 1 20 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.732 2.218 18990 14712 1 20 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.354 -3.304 18990 14713 1 20 . 1 1 456 456 ARG H H 456 9.036 9.036 8.044 0.992 18990 14714 1 20 . 1 1 457 457 ALA N N 457 133.152 133.152 125.772 7.380 18990 14715 1 20 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.263 -0.117 18990 14716 1 20 . 1 1 457 457 ALA C C 457 178.757 178.757 176.707 2.050 18990 14717 1 20 . 1 1 457 457 ALA CA C 457 53.929 53.929 53.470 0.459 18990 14718 1 20 . 1 1 457 457 ALA CB C 457 17.710 17.710 18.540 -0.830 18990 14719 1 20 . 1 1 457 457 ALA H H 457 9.042 9.042 8.739 0.303 18990 14720 1 20 . 1 1 458 458 GLY N N 458 111.200 111.200 105.134 6.066 18990 14721 1 20 . 1 1 458 458 GLY C C 458 173.558 173.558 173.608 -0.050 18990 14722 1 20 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.661 0.775 18990 14723 1 20 . 1 1 458 458 GLY H H 458 8.830 8.830 7.928 0.902 18990 14724 1 20 . 1 1 459 459 CYS N N 459 123.040 123.040 119.353 3.687 18990 14725 1 20 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.790 -0.168 18990 14726 1 20 . 1 1 459 459 CYS C C 459 176.591 176.591 173.160 3.431 18990 14727 1 20 . 1 1 459 459 CYS CA C 459 60.499 60.499 58.448 2.051 18990 14728 1 20 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.290 0.884 18990 14729 1 20 . 1 1 459 459 CYS H H 459 8.042 8.042 7.845 0.197 18990 14730 1 20 . 1 1 460 460 GLY N N 460 104.500 104.500 109.759 -5.259 18990 14731 1 20 . 1 1 460 460 GLY C C 460 173.716 173.716 173.330 0.386 18990 14732 1 20 . 1 1 460 460 GLY CA C 460 46.008 46.008 44.969 1.039 18990 14733 1 20 . 1 1 460 460 GLY H H 460 7.705 7.705 8.582 -0.877 18990 14734 1 20 . 1 1 461 461 PHE N N 461 124.949 124.949 121.259 3.690 18990 14735 1 20 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.876 -0.296 18990 14736 1 20 . 1 1 461 461 PHE C C 461 174.447 174.447 173.598 0.849 18990 14737 1 20 . 1 1 461 461 PHE CA C 461 59.946 59.946 56.963 2.983 18990 14738 1 20 . 1 1 461 461 PHE CB C 461 41.300 41.300 42.701 -1.401 18990 14739 1 20 . 1 1 461 461 PHE H H 461 8.947 8.947 7.806 1.141 18990 14740 1 20 . 1 1 462 462 GLU N N 462 125.272 125.272 127.814 -2.542 18990 14741 1 20 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.555 1.166 18990 14742 1 20 . 1 1 462 462 GLU C C 462 176.067 176.067 175.004 1.063 18990 14743 1 20 . 1 1 462 462 GLU CA C 462 54.624 54.624 56.169 -1.545 18990 14744 1 20 . 1 1 462 462 GLU CB C 462 31.255 31.255 29.849 1.406 18990 14745 1 20 . 1 1 462 462 GLU H H 462 7.799 7.799 8.293 -0.494 18990 14746 1 20 . 1 1 463 463 TRP N N 463 121.524 121.524 120.783 0.741 18990 14747 1 20 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.250 0.256 18990 14748 1 20 . 1 1 463 463 TRP C C 463 172.844 172.844 174.762 -1.918 18990 14749 1 20 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.522 -0.751 18990 14750 1 20 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.176 0.560 18990 14751 1 20 . 1 1 463 463 TRP H H 463 9.300 9.300 8.604 0.696 18990 14752 1 20 . 1 1 464 464 CYS N N 464 120.868 120.868 120.923 -0.055 18990 14753 1 20 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.397 1.019 18990 14754 1 20 . 1 1 464 464 CYS C C 464 177.213 177.213 176.238 0.975 18990 14755 1 20 . 1 1 464 464 CYS CA C 464 57.776 57.776 60.211 -2.435 18990 14756 1 20 . 1 1 464 464 CYS CB C 464 32.930 32.930 28.301 4.629 18990 14757 1 20 . 1 1 464 464 CYS H H 464 8.752 8.752 8.664 0.088 18990 14758 1 20 . 1 1 465 465 TRP N N 465 131.209 131.209 128.227 2.982 18990 14759 1 20 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.325 0.102 18990 14760 1 20 . 1 1 465 465 TRP C C 465 176.051 176.051 175.580 0.471 18990 14761 1 20 . 1 1 465 465 TRP CA C 465 60.763 60.763 59.796 0.967 18990 14762 1 20 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.618 1.508 18990 14763 1 20 . 1 1 465 465 TRP H H 465 9.809 9.809 8.265 1.544 18990 14764 1 20 . 1 1 466 466 VAL N N 466 118.233 118.233 115.979 2.254 18990 14765 1 20 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.227 0.397 18990 14766 1 20 . 1 1 466 466 VAL C C 466 178.943 178.943 176.476 2.467 18990 14767 1 20 . 1 1 466 466 VAL CA C 466 65.602 65.602 64.827 0.775 18990 14768 1 20 . 1 1 466 466 VAL CB C 466 33.172 33.172 31.731 1.441 18990 14769 1 20 . 1 1 466 466 VAL H H 466 8.627 8.627 7.863 0.764 18990 14770 1 20 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.536 -1.105 18990 14771 1 20 . 1 1 467 467 CYS CA C 467 56.999 56.999 57.146 -0.147 18990 14772 1 20 . 1 1 467 467 CYS CB C 467 31.870 31.870 28.496 3.374 18990 14773 1 20 . 1 1 467 467 CYS H H 467 7.820 7.820 7.824 -0.004 18990 14774 1 20 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.751 -0.715 18990 14775 1 20 . 1 1 468 468 GLN CA C 468 58.051 58.051 55.914 2.136 18990 14776 1 20 . 1 1 468 468 GLN CB C 468 26.476 26.476 29.825 -3.349 18990 14777 1 20 . 1 1 469 469 THR HA H 469 4.685 4.685 4.615 0.070 18990 14778 1 20 . 1 1 469 469 THR C C 469 173.351 173.351 173.435 -0.084 18990 14779 1 20 . 1 1 469 469 THR CA C 469 59.176 59.176 61.063 -1.887 18990 14780 1 20 . 1 1 469 469 THR CB C 469 71.775 71.775 71.296 0.479 18990 14781 1 20 . 1 1 470 470 GLU N N 470 120.940 120.940 121.673 -0.733 18990 14782 1 20 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.759 -0.466 18990 14783 1 20 . 1 1 470 470 GLU C C 470 175.539 175.539 176.553 -1.014 18990 14784 1 20 . 1 1 470 470 GLU CA C 470 57.015 57.015 56.675 0.340 18990 14785 1 20 . 1 1 470 470 GLU CB C 470 29.965 29.965 30.872 -0.907 18990 14786 1 20 . 1 1 470 470 GLU H H 470 8.912 8.912 8.853 0.059 18990 14787 1 20 . 1 1 471 471 TRP N N 471 126.998 126.998 124.690 2.308 18990 14788 1 20 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.457 -0.164 18990 14789 1 20 . 1 1 471 471 TRP C C 471 175.408 175.408 175.038 0.370 18990 14790 1 20 . 1 1 471 471 TRP CA C 471 58.220 58.220 58.887 -0.667 18990 14791 1 20 . 1 1 471 471 TRP CB C 471 29.500 29.500 29.048 0.452 18990 14792 1 20 . 1 1 471 471 TRP H H 471 8.350 8.350 8.895 -0.545 18990 14793 1 20 . 1 1 472 472 THR N N 472 117.480 117.480 118.123 -0.643 18990 14794 1 20 . 1 1 472 472 THR HA H 472 4.444 4.444 4.495 -0.051 18990 14795 1 20 . 1 1 472 472 THR CA C 472 58.930 58.930 59.438 -0.508 18990 14796 1 20 . 1 1 472 472 THR H H 472 8.069 8.069 7.166 0.903 18990 14797 1 20 . 1 1 473 473 ARG HA H 473 3.773 3.773 3.834 -0.061 18990 14798 1 20 . 1 1 473 473 ARG C C 473 178.053 178.053 177.139 0.914 18990 14799 1 20 . 1 1 473 473 ARG CA C 473 58.088 58.088 58.476 -0.388 18990 14800 1 20 . 1 1 473 473 ARG CB C 473 29.426 29.426 30.094 -0.668 18990 14801 1 20 . 1 1 474 474 ASP N N 474 119.900 119.900 118.890 1.010 18990 14802 1 20 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.455 -0.240 18990 14803 1 20 . 1 1 474 474 ASP C C 474 178.197 178.197 177.138 1.059 18990 14804 1 20 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.718 0.084 18990 14805 1 20 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.557 -0.375 18990 14806 1 20 . 1 1 474 474 ASP H H 474 7.718 7.718 8.417 -0.699 18990 14807 1 20 . 1 1 475 475 CYS N N 475 121.000 121.000 117.001 3.999 18990 14808 1 20 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.703 -1.336 18990 14809 1 20 . 1 1 475 475 CYS CA C 475 64.533 64.533 59.818 4.715 18990 14810 1 20 . 1 1 475 475 CYS CB C 475 29.092 29.092 27.631 1.461 18990 14811 1 20 . 1 1 475 475 CYS H H 475 6.953 6.953 7.858 -0.905 18990 14812 1 20 . 1 1 476 476 MET HA H 476 4.021 4.021 3.496 0.525 18990 14813 1 20 . 1 1 476 476 MET CA C 476 58.010 58.010 57.865 0.145 18990 14814 1 20 . 1 1 476 476 MET CB C 476 32.550 32.550 31.863 0.687 18990 14815 1 20 . 1 1 477 477 GLY N N 477 111.938 111.938 104.426 7.512 18990 14816 1 20 . 1 1 477 477 GLY C C 477 174.406 174.406 173.521 0.885 18990 14817 1 20 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.852 0.764 18990 14818 1 20 . 1 1 477 477 GLY H H 477 9.155 9.155 7.793 1.362 18990 14819 1 20 . 1 1 478 478 ALA N N 478 121.900 121.900 124.840 -2.940 18990 14820 1 20 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.580 -0.289 18990 14821 1 20 . 1 1 478 478 ALA C C 478 178.196 178.196 177.371 0.825 18990 14822 1 20 . 1 1 478 478 ALA CA C 478 53.440 53.440 53.104 0.336 18990 14823 1 20 . 1 1 478 478 ALA CB C 478 20.390 20.390 20.133 0.257 18990 14824 1 20 . 1 1 478 478 ALA H H 478 7.347 7.347 7.916 -0.569 18990 14825 1 20 . 1 1 479 479 HIS N N 479 115.200 115.200 113.612 1.588 18990 14826 1 20 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.894 0.009 18990 14827 1 20 . 1 1 479 479 HIS C C 479 173.325 173.325 175.554 -2.229 18990 14828 1 20 . 1 1 479 479 HIS CA C 479 54.526 54.526 54.772 -0.246 18990 14829 1 20 . 1 1 479 479 HIS CB C 479 27.600 27.600 30.432 -2.832 18990 14830 1 20 . 1 1 479 479 HIS H H 479 8.297 8.297 8.172 0.125 18990 14831 1 20 . 1 1 480 480 TRP N N 480 121.780 121.780 122.180 -0.400 18990 14832 1 20 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.365 -0.070 18990 14833 1 20 . 1 1 480 480 TRP C C 480 175.568 175.568 174.753 0.815 18990 14834 1 20 . 1 1 480 480 TRP CA C 480 58.358 58.358 58.665 -0.307 18990 14835 1 20 . 1 1 480 480 TRP CB C 480 29.550 29.550 30.004 -0.454 18990 14836 1 20 . 1 1 480 480 TRP H H 480 8.081 8.081 7.710 0.371 18990 14837 1 20 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.699 0.146 18990 14838 1 20 . 1 1 481 481 PHE C C 481 175.126 175.126 174.109 1.017 18990 14839 1 20 . 1 1 481 481 PHE CA C 481 56.471 56.471 57.550 -1.079 18990 14840 1 20 . 1 1 481 481 PHE CB C 481 41.006 41.006 41.036 -0.030 18990 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 120 3.499 -0.726 3.438 18990 2 1 1 "Average Difference" HA 146 0.371 0.119 0.352 18990 3 1 1 "Average Difference" C 129 1.219 -0.498 1.116 18990 4 1 1 "Average Difference" CA 136 1.370 -0.559 1.255 18990 5 1 1 "Average Difference" CB 119 1.857 -0.108 1.862 18990 6 1 1 "Average Difference" HN 121 0.611 -0.098 0.606 18990 7 1 2 "Average Difference" N 120 3.324 -0.652 3.274 18990 8 1 2 "Average Difference" HA 146 0.371 0.089 0.361 18990 9 1 2 "Average Difference" C 129 1.155 -0.344 1.107 18990 10 1 2 "Average Difference" CA 136 1.335 -0.545 1.224 18990 11 1 2 "Average Difference" CB 119 1.830 -0.202 1.826 18990 12 1 2 "Average Difference" HN 121 0.614 -0.054 0.614 18990 13 1 3 "Average Difference" N 120 3.521 -0.724 3.460 18990 14 1 3 "Average Difference" HA 146 0.406 0.106 0.393 18990 15 1 3 "Average Difference" C 129 1.219 -0.450 1.138 18990 16 1 3 "Average Difference" CA 136 1.283 -0.438 1.211 18990 17 1 3 "Average Difference" CB 119 1.785 -0.107 1.790 18990 18 1 3 "Average Difference" HN 121 0.659 -0.076 0.657 18990 19 1 4 "Average Difference" N 120 3.365 -0.828 3.275 18990 20 1 4 "Average Difference" HA 146 0.405 0.149 0.378 18990 21 1 4 "Average Difference" C 129 1.232 -0.432 1.158 18990 22 1 4 "Average Difference" CA 136 1.278 -0.441 1.203 18990 23 1 4 "Average Difference" CB 119 1.809 -0.167 1.809 18990 24 1 4 "Average Difference" HN 121 0.635 -0.031 0.637 18990 25 1 5 "Average Difference" N 120 3.562 -0.481 3.544 18990 26 1 5 "Average Difference" HA 146 0.381 0.073 0.375 18990 27 1 5 "Average Difference" C 129 1.181 -0.287 1.150 18990 28 1 5 "Average Difference" CA 136 1.341 -0.448 1.269 18990 29 1 5 "Average Difference" CB 119 1.586 -0.176 1.583 18990 30 1 5 "Average Difference" HN 121 0.690 -0.093 0.686 18990 31 1 6 "Average Difference" N 120 3.379 -0.864 3.281 18990 32 1 6 "Average Difference" HA 146 0.386 0.113 0.371 18990 33 1 6 "Average Difference" C 129 1.211 -0.511 1.102 18990 34 1 6 "Average Difference" CA 136 1.290 -0.499 1.194 18990 35 1 6 "Average Difference" CB 119 1.707 -0.105 1.711 18990 36 1 6 "Average Difference" HN 121 0.647 -0.118 0.639 18990 37 1 7 "Average Difference" N 120 3.396 -0.231 3.402 18990 38 1 7 "Average Difference" HA 146 0.368 0.046 0.367 18990 39 1 7 "Average Difference" C 129 1.191 -0.344 1.145 18990 40 1 7 "Average Difference" CA 136 1.370 -0.421 1.308 18990 41 1 7 "Average Difference" CB 119 1.700 -0.332 1.675 18990 42 1 7 "Average Difference" HN 121 0.654 -0.135 0.643 18990 43 1 8 "Average Difference" N 120 3.221 -0.889 3.109 18990 44 1 8 "Average Difference" HA 146 0.377 0.114 0.361 18990 45 1 8 "Average Difference" C 129 1.212 -0.386 1.153 18990 46 1 8 "Average Difference" CA 136 1.348 -0.484 1.263 18990 47 1 8 "Average Difference" CB 119 1.744 -0.126 1.747 18990 48 1 8 "Average Difference" HN 121 0.577 -0.070 0.575 18990 49 1 9 "Average Difference" N 120 3.545 -0.686 3.493 18990 50 1 9 "Average Difference" HA 146 0.418 0.132 0.398 18990 51 1 9 "Average Difference" C 129 1.245 -0.370 1.193 18990 52 1 9 "Average Difference" CA 136 1.459 -0.479 1.383 18990 53 1 9 "Average Difference" CB 119 1.723 -0.135 1.725 18990 54 1 9 "Average Difference" HN 121 0.647 -0.107 0.641 18990 55 1 10 "Average Difference" N 120 3.117 -0.412 3.102 18990 56 1 10 "Average Difference" HA 146 0.384 0.111 0.369 18990 57 1 10 "Average Difference" C 129 1.190 -0.460 1.102 18990 58 1 10 "Average Difference" CA 136 1.322 -0.533 1.214 18990 59 1 10 "Average Difference" CB 119 1.821 -0.142 1.823 18990 60 1 10 "Average Difference" HN 121 0.631 -0.046 0.632 18990 61 1 11 "Average Difference" N 120 3.346 -0.446 3.330 18990 62 1 11 "Average Difference" HA 146 0.378 0.108 0.364 18990 63 1 11 "Average Difference" C 129 1.251 -0.382 1.196 18990 64 1 11 "Average Difference" CA 136 1.356 -0.438 1.288 18990 65 1 11 "Average Difference" CB 119 1.678 -0.260 1.664 18990 66 1 11 "Average Difference" HN 121 0.610 -0.086 0.606 18990 67 1 12 "Average Difference" N 120 3.771 -0.755 3.710 18990 68 1 12 "Average Difference" HA 146 0.397 0.112 0.382 18990 69 1 12 "Average Difference" C 129 1.224 -0.375 1.169 18990 70 1 12 "Average Difference" CA 136 1.354 -0.457 1.280 18990 71 1 12 "Average Difference" CB 119 1.646 -0.142 1.647 18990 72 1 12 "Average Difference" HN 121 0.610 -0.104 0.604 18990 73 1 13 "Average Difference" N 120 3.430 -0.112 3.442 18990 74 1 13 "Average Difference" HA 146 0.343 0.076 0.336 18990 75 1 13 "Average Difference" C 129 1.167 -0.371 1.111 18990 76 1 13 "Average Difference" CA 136 1.333 -0.411 1.273 18990 77 1 13 "Average Difference" CB 119 1.703 -0.354 1.673 18990 78 1 13 "Average Difference" HN 121 0.640 -0.096 0.635 18990 79 1 14 "Average Difference" N 120 3.242 -0.761 3.165 18990 80 1 14 "Average Difference" HA 146 0.417 0.150 0.390 18990 81 1 14 "Average Difference" C 129 1.303 -0.548 1.187 18990 82 1 14 "Average Difference" CA 136 1.428 -0.483 1.349 18990 83 1 14 "Average Difference" CB 119 1.903 -0.004 1.911 18990 84 1 14 "Average Difference" HN 121 0.660 -0.057 0.660 18990 85 1 15 "Average Difference" N 120 3.629 -0.791 3.556 18990 86 1 15 "Average Difference" HA 146 0.374 0.079 0.367 18990 87 1 15 "Average Difference" C 129 1.232 -0.324 1.194 18990 88 1 15 "Average Difference" CA 136 1.287 -0.364 1.239 18990 89 1 15 "Average Difference" CB 119 1.746 -0.148 1.747 18990 90 1 15 "Average Difference" HN 121 0.604 -0.074 0.602 18990 91 1 16 "Average Difference" N 120 3.376 -0.495 3.354 18990 92 1 16 "Average Difference" HA 146 0.368 0.062 0.364 18990 93 1 16 "Average Difference" C 129 1.204 -0.383 1.146 18990 94 1 16 "Average Difference" CA 136 1.411 -0.416 1.353 18990 95 1 16 "Average Difference" CB 119 1.712 -0.255 1.700 18990 96 1 16 "Average Difference" HN 121 0.615 -0.080 0.612 18990 97 1 17 "Average Difference" N 120 3.609 -0.364 3.605 18990 98 1 17 "Average Difference" HA 146 0.398 0.117 0.381 18990 99 1 17 "Average Difference" C 129 1.305 -0.499 1.210 18990 100 1 17 "Average Difference" CA 136 1.439 -0.468 1.366 18990 101 1 17 "Average Difference" CB 119 1.634 -0.159 1.633 18990 102 1 17 "Average Difference" HN 121 0.573 -0.053 0.573 18990 103 1 18 "Average Difference" N 120 3.517 -0.667 3.468 18990 104 1 18 "Average Difference" HA 146 0.387 0.101 0.375 18990 105 1 18 "Average Difference" C 129 1.239 -0.457 1.156 18990 106 1 18 "Average Difference" CA 136 1.294 -0.387 1.240 18990 107 1 18 "Average Difference" CB 119 1.623 -0.162 1.622 18990 108 1 18 "Average Difference" HN 121 0.619 -0.081 0.617 18990 109 1 19 "Average Difference" N 120 3.322 -0.726 3.255 18990 110 1 19 "Average Difference" HA 146 0.372 0.081 0.364 18990 111 1 19 "Average Difference" C 129 1.122 -0.320 1.080 18990 112 1 19 "Average Difference" CA 136 1.304 -0.364 1.257 18990 113 1 19 "Average Difference" CB 119 1.915 -0.332 1.894 18990 114 1 19 "Average Difference" HN 121 0.620 -0.117 0.611 18990 115 1 20 "Average Difference" N 120 3.294 -0.564 3.259 18990 116 1 20 "Average Difference" HA 146 0.396 0.123 0.378 18990 117 1 20 "Average Difference" C 129 1.279 -0.458 1.199 18990 118 1 20 "Average Difference" CA 136 1.354 -0.472 1.273 18990 119 1 20 "Average Difference" CB 119 1.737 -0.109 1.741 18990 120 1 20 "Average Difference" HN 121 0.678 -0.056 0.679 18990 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.Model_type average _Entity_delta_chem_shifts.Entry_ID 18990 _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.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_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.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 343 343 GLU N N 343 121.045 121.045 122.347 -1.302 18990 2 1 . 1 1 343 343 GLU HA H 343 4.165 4.165 4.535 -0.370 18990 3 1 . 1 1 343 343 GLU C C 343 176.529 176.529 175.297 1.232 18990 4 1 . 1 1 343 343 GLU CA C 343 57.162 57.162 56.072 1.090 18990 5 1 . 1 1 343 343 GLU CB C 343 30.204 30.204 30.217 -0.013 18990 6 1 . 1 1 343 343 GLU H H 343 8.293 8.293 8.449 -0.156 18990 7 1 . 1 1 344 344 TYR N N 344 121.000 121.000 122.238 -1.238 18990 8 1 . 1 1 344 344 TYR HA H 344 4.538 4.538 4.650 -0.112 18990 9 1 . 1 1 344 344 TYR C C 344 175.897 175.897 175.177 0.720 18990 10 1 . 1 1 344 344 TYR CA C 344 58.179 58.179 57.646 0.533 18990 11 1 . 1 1 344 344 TYR CB C 344 38.600 38.600 38.962 -0.362 18990 12 1 . 1 1 344 344 TYR H H 344 8.040 8.040 8.398 -0.358 18990 13 1 . 1 1 345 345 VAL N N 345 121.900 121.900 125.100 -3.200 18990 14 1 . 1 1 345 345 VAL HA H 345 3.939 3.939 4.191 -0.252 18990 15 1 . 1 1 345 345 VAL C C 345 176.143 176.143 175.124 1.019 18990 16 1 . 1 1 345 345 VAL CA C 345 62.867 62.867 62.374 0.493 18990 17 1 . 1 1 345 345 VAL CB C 345 32.799 32.799 32.264 0.535 18990 18 1 . 1 1 345 345 VAL H H 345 7.856 7.856 8.300 -0.444 18990 19 1 . 1 1 346 346 LEU N N 346 124.950 124.950 124.684 0.266 18990 20 1 . 1 1 346 346 LEU HA H 346 4.243 4.243 4.710 -0.467 18990 21 1 . 1 1 346 346 LEU C C 346 177.747 177.747 175.744 2.003 18990 22 1 . 1 1 346 346 LEU CA C 346 55.500 55.500 54.419 1.081 18990 23 1 . 1 1 346 346 LEU CB C 346 42.252 42.252 42.972 -0.720 18990 24 1 . 1 1 346 346 LEU H H 346 8.127 8.127 8.189 -0.062 18990 25 1 . 1 1 347 347 GLN N N 347 121.452 121.452 121.495 -0.043 18990 26 1 . 1 1 347 347 GLN HA H 347 4.286 4.286 4.561 -0.275 18990 27 1 . 1 1 347 347 GLN C C 347 175.833 175.833 174.626 1.207 18990 28 1 . 1 1 347 347 GLN CA C 347 55.988 55.988 55.416 0.572 18990 29 1 . 1 1 347 347 GLN CB C 347 29.375 29.375 30.462 -1.087 18990 30 1 . 1 1 347 347 GLN H H 347 8.270 8.270 8.395 -0.125 18990 31 1 . 1 1 348 348 ALA N N 348 124.466 124.466 125.472 -1.006 18990 32 1 . 1 1 348 348 ALA HA H 348 4.321 4.321 4.638 -0.317 18990 33 1 . 1 1 348 348 ALA C C 348 177.929 177.929 177.106 0.823 18990 34 1 . 1 1 348 348 ALA CA C 348 52.703 52.703 51.906 0.797 18990 35 1 . 1 1 348 348 ALA CB C 348 19.002 19.002 19.662 -0.660 18990 36 1 . 1 1 348 348 ALA H H 348 8.227 8.227 8.589 -0.362 18990 37 1 . 1 1 349 349 GLY N N 349 108.193 108.193 108.644 -0.451 18990 38 1 . 1 1 349 349 GLY C C 349 174.269 174.269 173.903 0.366 18990 39 1 . 1 1 349 349 GLY CA C 349 45.227 45.227 45.080 0.147 18990 40 1 . 1 1 349 349 GLY H H 349 8.298 8.298 8.437 -0.139 18990 41 1 . 1 1 350 350 GLY N N 350 108.073 108.073 108.506 -0.433 18990 42 1 . 1 1 350 350 GLY C C 350 172.979 172.979 172.972 0.007 18990 43 1 . 1 1 350 350 GLY CA C 350 44.935 44.935 44.607 0.328 18990 44 1 . 1 1 350 350 GLY H H 350 8.156 8.156 7.827 0.329 18990 45 1 . 1 1 351 351 VAL N N 351 119.058 119.058 119.023 0.035 18990 46 1 . 1 1 351 351 VAL HA H 351 4.416 4.416 4.584 -0.168 18990 47 1 . 1 1 351 351 VAL C C 351 173.412 173.412 174.332 -0.920 18990 48 1 . 1 1 351 351 VAL CA C 351 60.663 60.663 60.324 0.338 18990 49 1 . 1 1 351 351 VAL CB C 351 34.866 34.866 35.070 -0.204 18990 50 1 . 1 1 351 351 VAL H H 351 8.541 8.541 8.660 -0.119 18990 51 1 . 1 1 352 352 LEU N N 352 125.800 125.800 121.572 4.228 18990 52 1 . 1 1 352 352 LEU HA H 352 4.765 4.765 4.705 0.060 18990 53 1 . 1 1 352 352 LEU C C 352 176.218 176.218 175.546 0.672 18990 54 1 . 1 1 352 352 LEU CA C 352 53.341 53.341 53.329 0.012 18990 55 1 . 1 1 352 352 LEU CB C 352 42.706 42.706 44.675 -1.969 18990 56 1 . 1 1 352 352 LEU H H 352 8.151 8.151 8.325 -0.174 18990 57 1 . 1 1 353 353 CYS N N 353 126.825 126.825 123.183 3.642 18990 58 1 . 1 1 353 353 CYS HA H 353 4.107 4.107 4.112 -0.006 18990 59 1 . 1 1 353 353 CYS C C 353 176.655 176.655 174.565 2.091 18990 60 1 . 1 1 353 353 CYS CA C 353 57.731 57.731 57.315 0.416 18990 61 1 . 1 1 353 353 CYS CB C 353 31.865 31.865 27.561 4.304 18990 62 1 . 1 1 353 353 CYS H H 353 8.794 8.794 8.562 0.232 18990 63 1 . 1 1 354 354 PRO HA H 354 4.420 4.420 4.160 0.260 18990 64 1 . 1 1 354 354 PRO C C 354 177.512 177.512 176.024 1.488 18990 65 1 . 1 1 354 354 PRO CA C 354 62.992 62.992 63.387 -0.395 18990 66 1 . 1 1 354 354 PRO CB C 354 32.567 32.567 31.359 1.208 18990 67 1 . 1 1 355 355 GLN N N 355 126.800 126.800 119.509 7.291 18990 68 1 . 1 1 355 355 GLN HA H 355 4.275 4.275 4.464 -0.189 18990 69 1 . 1 1 355 355 GLN C C 355 175.516 175.516 174.955 0.561 18990 70 1 . 1 1 355 355 GLN CA C 355 54.793 54.793 53.077 1.716 18990 71 1 . 1 1 355 355 GLN CB C 355 28.547 28.547 29.025 -0.478 18990 72 1 . 1 1 355 355 GLN H H 355 9.033 9.033 7.368 1.665 18990 73 1 . 1 1 357 357 GLY C C 357 173.229 173.229 174.559 -1.330 18990 74 1 . 1 1 357 357 GLY CA C 357 45.254 45.254 44.832 0.422 18990 75 1 . 1 1 358 358 CYS N N 358 123.500 123.500 119.688 3.812 18990 76 1 . 1 1 358 358 CYS HA H 358 4.533 4.533 4.621 -0.088 18990 77 1 . 1 1 358 358 CYS C C 358 176.157 176.157 175.793 0.364 18990 78 1 . 1 1 358 358 CYS CA C 358 60.268 60.268 59.474 0.794 18990 79 1 . 1 1 358 358 CYS CB C 358 29.375 29.375 28.797 0.578 18990 80 1 . 1 1 358 358 CYS H H 358 7.720 7.720 7.670 0.050 18990 81 1 . 1 1 359 359 GLY N N 359 104.400 104.400 109.423 -5.023 18990 82 1 . 1 1 359 359 GLY C C 359 174.080 174.080 175.028 -0.948 18990 83 1 . 1 1 359 359 GLY CA C 359 46.064 46.064 46.121 -0.057 18990 84 1 . 1 1 359 359 GLY H H 359 7.756 7.756 8.283 -0.527 18990 85 1 . 1 1 360 360 MET N N 360 121.300 121.300 119.851 1.449 18990 86 1 . 1 1 360 360 MET HA H 360 4.343 4.343 4.313 0.030 18990 87 1 . 1 1 360 360 MET C C 360 175.641 175.641 176.992 -1.351 18990 88 1 . 1 1 360 360 MET CA C 360 55.923 55.923 56.780 -0.857 18990 89 1 . 1 1 360 360 MET CB C 360 33.091 33.091 33.698 -0.607 18990 90 1 . 1 1 360 360 MET H H 360 8.229 8.229 7.682 0.546 18990 91 1 . 1 1 361 361 GLY N N 361 109.000 109.000 106.284 2.716 18990 92 1 . 1 1 361 361 GLY C C 361 173.774 173.774 173.116 0.658 18990 93 1 . 1 1 361 361 GLY CA C 361 45.838 45.838 44.464 1.374 18990 94 1 . 1 1 361 361 GLY H H 361 8.347 8.347 7.945 0.402 18990 95 1 . 1 1 362 362 LEU N N 362 126.725 126.725 125.294 1.431 18990 96 1 . 1 1 362 362 LEU HA H 362 4.675 4.675 4.841 -0.166 18990 97 1 . 1 1 362 362 LEU C C 362 175.865 175.865 175.720 0.145 18990 98 1 . 1 1 362 362 LEU CA C 362 54.190 54.190 53.138 1.052 18990 99 1 . 1 1 362 362 LEU CB C 362 44.050 44.050 43.933 0.117 18990 100 1 . 1 1 362 362 LEU H H 362 8.935 8.935 8.902 0.033 18990 101 1 . 1 1 363 363 LEU N N 363 123.742 123.742 125.347 -1.605 18990 102 1 . 1 1 363 363 LEU HA H 363 4.677 4.677 4.589 0.088 18990 103 1 . 1 1 363 363 LEU C C 363 176.162 176.162 175.718 0.444 18990 104 1 . 1 1 363 363 LEU CA C 363 54.342 54.342 54.208 0.134 18990 105 1 . 1 1 363 363 LEU CB C 363 42.210 42.210 42.998 -0.788 18990 106 1 . 1 1 363 363 LEU H H 363 8.481 8.481 8.671 -0.190 18990 107 1 . 1 1 364 364 VAL N N 364 120.980 120.980 127.132 -6.152 18990 108 1 . 1 1 364 364 VAL HA H 364 4.397 4.397 4.154 0.243 18990 109 1 . 1 1 364 364 VAL C C 364 175.592 175.592 175.108 0.484 18990 110 1 . 1 1 364 364 VAL CA C 364 60.460 60.460 61.513 -1.053 18990 111 1 . 1 1 364 364 VAL CB C 364 34.125 34.125 32.236 1.889 18990 112 1 . 1 1 364 364 VAL H H 364 8.155 8.155 8.351 -0.196 18990 113 1 . 1 1 365 365 GLU N N 365 126.950 126.950 127.694 -0.744 18990 114 1 . 1 1 365 365 GLU HA H 365 4.610 4.610 4.579 0.031 18990 115 1 . 1 1 365 365 GLU C C 365 175.427 175.427 176.103 -0.676 18990 116 1 . 1 1 365 365 GLU CA C 365 54.551 54.551 53.986 0.565 18990 117 1 . 1 1 365 365 GLU CB C 365 29.780 29.780 29.579 0.201 18990 118 1 . 1 1 365 365 GLU H H 365 8.900 8.900 8.257 0.643 18990 119 1 . 1 1 366 366 PRO HA H 366 4.262 4.262 4.263 -0.001 18990 120 1 . 1 1 366 366 PRO C C 366 177.013 177.013 176.758 0.255 18990 121 1 . 1 1 366 366 PRO CA C 366 64.463 64.463 64.943 -0.480 18990 122 1 . 1 1 366 366 PRO CB C 366 32.048 32.048 31.904 0.144 18990 123 1 . 1 1 367 367 ASP N N 367 115.459 115.459 115.737 -0.278 18990 124 1 . 1 1 367 367 ASP HA H 367 4.495 4.495 4.624 -0.129 18990 125 1 . 1 1 367 367 ASP C C 367 175.123 175.123 175.655 -0.532 18990 126 1 . 1 1 367 367 ASP CA C 367 54.503 54.503 53.684 0.819 18990 127 1 . 1 1 367 367 ASP CB C 367 40.123 40.123 40.455 -0.332 18990 128 1 . 1 1 367 367 ASP H H 367 8.439 8.439 8.473 -0.034 18990 129 1 . 1 1 368 368 CYS N N 368 118.700 118.700 120.771 -2.071 18990 130 1 . 1 1 368 368 CYS HA H 368 4.570 4.570 4.408 0.162 18990 131 1 . 1 1 368 368 CYS C C 368 173.806 173.806 174.800 -0.994 18990 132 1 . 1 1 368 368 CYS CA C 368 58.581 58.581 59.218 -0.637 18990 133 1 . 1 1 368 368 CYS CB C 368 28.450 28.450 28.393 0.057 18990 134 1 . 1 1 368 368 CYS H H 368 7.515 7.515 7.829 -0.314 18990 135 1 . 1 1 369 369 ARG HA H 369 4.265 4.265 4.378 -0.113 18990 136 1 . 1 1 369 369 ARG C C 369 174.908 174.908 175.592 -0.684 18990 137 1 . 1 1 369 369 ARG CA C 369 57.669 57.669 56.166 1.503 18990 138 1 . 1 1 369 369 ARG CB C 369 32.274 32.274 30.398 1.876 18990 139 1 . 1 1 370 370 LYS N N 370 121.022 121.022 120.329 0.693 18990 140 1 . 1 1 370 370 LYS HA H 370 4.170 4.170 4.418 -0.248 18990 141 1 . 1 1 370 370 LYS C C 370 174.868 174.868 174.724 0.144 18990 142 1 . 1 1 370 370 LYS CA C 370 56.554 56.554 55.504 1.050 18990 143 1 . 1 1 370 370 LYS CB C 370 33.140 33.140 33.436 -0.296 18990 144 1 . 1 1 370 370 LYS H H 370 7.740 7.740 7.659 0.081 18990 145 1 . 1 1 371 371 VAL N N 371 128.362 128.362 125.638 2.724 18990 146 1 . 1 1 371 371 VAL HA H 371 4.133 4.133 4.185 -0.052 18990 147 1 . 1 1 371 371 VAL C C 371 173.402 173.402 174.295 -0.893 18990 148 1 . 1 1 371 371 VAL CA C 371 60.777 60.777 61.205 -0.428 18990 149 1 . 1 1 371 371 VAL CB C 371 33.000 33.000 32.547 0.453 18990 150 1 . 1 1 371 371 VAL H H 371 8.647 8.647 8.355 0.292 18990 151 1 . 1 1 372 372 THR N N 372 119.667 119.667 121.651 -1.984 18990 152 1 . 1 1 372 372 THR HA H 372 5.032 5.032 4.858 0.174 18990 153 1 . 1 1 372 372 THR C C 372 174.339 174.339 173.873 0.466 18990 154 1 . 1 1 372 372 THR CA C 372 60.881 60.881 61.450 -0.569 18990 155 1 . 1 1 372 372 THR CB C 372 70.471 70.471 71.668 -1.197 18990 156 1 . 1 1 372 372 THR H H 372 8.087 8.087 8.124 -0.037 18990 157 1 . 1 1 373 373 CYS N N 373 132.554 132.554 126.806 5.748 18990 158 1 . 1 1 373 373 CYS HA H 373 4.802 4.802 4.576 0.226 18990 159 1 . 1 1 373 373 CYS C C 373 176.791 176.791 175.979 0.812 18990 160 1 . 1 1 373 373 CYS CA C 373 58.504 58.504 59.017 -0.513 18990 161 1 . 1 1 373 373 CYS CB C 373 28.311 28.311 24.884 3.427 18990 162 1 . 1 1 373 373 CYS H H 373 9.322 9.322 9.295 0.027 18990 163 1 . 1 1 374 374 GLN N N 374 125.890 125.890 123.994 1.896 18990 164 1 . 1 1 374 374 GLN HA H 374 4.000 4.000 4.251 -0.251 18990 165 1 . 1 1 374 374 GLN C C 374 176.827 176.827 176.682 0.145 18990 166 1 . 1 1 374 374 GLN CA C 374 58.300 58.300 57.764 0.535 18990 167 1 . 1 1 374 374 GLN CB C 374 29.664 29.664 28.643 1.021 18990 168 1 . 1 1 374 374 GLN H H 374 7.856 7.856 8.499 -0.643 18990 169 1 . 1 1 375 375 ASN N N 375 115.342 115.342 115.892 -0.550 18990 170 1 . 1 1 375 375 ASN HA H 375 4.887 4.887 4.811 0.076 18990 171 1 . 1 1 375 375 ASN C C 375 174.049 174.049 175.072 -1.023 18990 172 1 . 1 1 375 375 ASN CA C 375 53.047 53.047 53.245 -0.198 18990 173 1 . 1 1 375 375 ASN CB C 375 38.916 38.916 39.073 -0.157 18990 174 1 . 1 1 375 375 ASN H H 375 8.913 8.913 8.337 0.576 18990 175 1 . 1 1 376 376 GLY N N 376 109.098 109.098 107.817 1.281 18990 176 1 . 1 1 376 376 GLY C C 376 174.110 174.110 173.494 0.616 18990 177 1 . 1 1 376 376 GLY CA C 376 46.386 46.386 45.513 0.873 18990 178 1 . 1 1 376 376 GLY H H 376 7.162 7.162 7.867 -0.705 18990 179 1 . 1 1 377 377 CYS N N 377 132.546 132.546 120.604 11.942 18990 180 1 . 1 1 377 377 CYS HA H 377 4.764 4.764 4.864 -0.100 18990 181 1 . 1 1 377 377 CYS C C 377 177.355 177.355 175.148 2.207 18990 182 1 . 1 1 377 377 CYS CA C 377 59.988 59.988 57.174 2.814 18990 183 1 . 1 1 377 377 CYS CB C 377 32.365 32.365 27.565 4.800 18990 184 1 . 1 1 377 377 CYS H H 377 9.800 9.800 8.190 1.610 18990 185 1 . 1 1 378 378 GLY N N 378 113.851 113.851 109.904 3.947 18990 186 1 . 1 1 378 378 GLY C C 378 173.404 173.404 172.797 0.607 18990 187 1 . 1 1 378 378 GLY CA C 378 45.863 45.863 45.654 0.209 18990 188 1 . 1 1 378 378 GLY H H 378 8.820 8.820 8.305 0.515 18990 189 1 . 1 1 379 379 TYR N N 379 125.532 125.532 124.925 0.607 18990 190 1 . 1 1 379 379 TYR HA H 379 4.478 4.478 4.761 -0.283 18990 191 1 . 1 1 379 379 TYR C C 379 173.661 173.661 173.952 -0.291 18990 192 1 . 1 1 379 379 TYR CA C 379 59.180 59.180 57.152 2.028 18990 193 1 . 1 1 379 379 TYR CB C 379 40.108 40.108 41.877 -1.769 18990 194 1 . 1 1 379 379 TYR H H 379 9.054 9.054 8.111 0.943 18990 195 1 . 1 1 380 380 VAL N N 380 124.461 124.461 125.383 -0.922 18990 196 1 . 1 1 380 380 VAL HA H 380 4.818 4.818 4.632 0.186 18990 197 1 . 1 1 380 380 VAL C C 380 175.876 175.876 174.530 1.346 18990 198 1 . 1 1 380 380 VAL CA C 380 60.797 60.797 61.271 -0.474 18990 199 1 . 1 1 380 380 VAL CB C 380 32.610 32.610 32.194 0.416 18990 200 1 . 1 1 380 380 VAL H H 380 7.238 7.238 7.938 -0.700 18990 201 1 . 1 1 381 381 PHE N N 381 124.588 124.588 123.912 0.676 18990 202 1 . 1 1 381 381 PHE HA H 381 5.273 5.273 5.049 0.224 18990 203 1 . 1 1 381 381 PHE C C 381 173.242 173.242 173.777 -0.535 18990 204 1 . 1 1 381 381 PHE CA C 381 55.210 55.210 55.363 -0.153 18990 205 1 . 1 1 381 381 PHE CB C 381 42.090 42.090 40.401 1.689 18990 206 1 . 1 1 381 381 PHE H H 381 9.424 9.424 7.698 1.726 18990 207 1 . 1 1 382 382 CYS N N 382 120.221 120.221 120.469 -0.248 18990 208 1 . 1 1 382 382 CYS HA H 382 4.902 4.902 4.598 0.304 18990 209 1 . 1 1 382 382 CYS C C 382 177.165 177.165 175.829 1.336 18990 210 1 . 1 1 382 382 CYS CA C 382 57.691 57.691 57.919 -0.227 18990 211 1 . 1 1 382 382 CYS CB C 382 32.475 32.475 30.006 2.469 18990 212 1 . 1 1 382 382 CYS H H 382 8.673 8.673 8.589 0.084 18990 213 1 . 1 1 383 383 ARG N N 383 129.347 129.347 121.433 7.914 18990 214 1 . 1 1 383 383 ARG HA H 383 4.021 4.021 4.284 -0.263 18990 215 1 . 1 1 383 383 ARG C C 383 175.012 175.012 176.359 -1.347 18990 216 1 . 1 1 383 383 ARG CA C 383 58.686 58.686 58.036 0.650 18990 217 1 . 1 1 383 383 ARG CB C 383 30.900 30.900 30.083 0.817 18990 218 1 . 1 1 383 383 ARG H H 383 9.534 9.534 8.622 0.912 18990 219 1 . 1 1 384 384 ASN N N 384 117.772 117.772 117.016 0.756 18990 220 1 . 1 1 384 384 ASN HA H 384 4.708 4.708 4.787 -0.079 18990 221 1 . 1 1 384 384 ASN C C 384 175.656 175.656 174.694 0.962 18990 222 1 . 1 1 384 384 ASN CA C 384 55.778 55.778 53.943 1.835 18990 223 1 . 1 1 384 384 ASN CB C 384 39.475 39.475 40.279 -0.804 18990 224 1 . 1 1 384 384 ASN H H 384 8.840 8.840 8.113 0.727 18990 225 1 . 1 1 385 385 CYS N N 385 115.876 115.876 114.365 1.511 18990 226 1 . 1 1 385 385 CYS HA H 385 5.028 5.028 4.888 0.140 18990 227 1 . 1 1 385 385 CYS C C 385 175.703 175.703 173.737 1.966 18990 228 1 . 1 1 385 385 CYS CA C 385 58.112 58.112 56.877 1.235 18990 229 1 . 1 1 385 385 CYS CB C 385 32.359 32.359 30.320 2.039 18990 230 1 . 1 1 385 385 CYS H H 385 7.868 7.868 7.857 0.011 18990 231 1 . 1 1 386 386 LEU N N 386 120.082 120.082 119.648 0.434 18990 232 1 . 1 1 386 386 LEU HA H 386 4.313 4.313 4.754 -0.441 18990 233 1 . 1 1 386 386 LEU C C 386 175.722 175.722 177.068 -1.346 18990 234 1 . 1 1 386 386 LEU CA C 386 57.009 57.009 54.379 2.630 18990 235 1 . 1 1 386 386 LEU CB C 386 38.412 38.412 41.489 -3.077 18990 236 1 . 1 1 386 386 LEU H H 386 8.514 8.514 8.434 0.080 18990 237 1 . 1 1 387 387 GLN N N 387 117.579 117.579 119.749 -2.170 18990 238 1 . 1 1 387 387 GLN HA H 387 4.776 4.776 4.356 0.420 18990 239 1 . 1 1 387 387 GLN C C 387 175.299 175.299 176.760 -1.461 18990 240 1 . 1 1 387 387 GLN CA C 387 54.017 54.017 55.750 -1.733 18990 241 1 . 1 1 387 387 GLN CB C 387 30.307 30.307 28.508 1.799 18990 242 1 . 1 1 387 387 GLN H H 387 8.248 8.248 7.794 0.454 18990 243 1 . 1 1 388 388 GLY N N 388 106.107 106.107 107.605 -1.498 18990 244 1 . 1 1 388 388 GLY C C 388 173.693 173.693 173.979 -0.286 18990 245 1 . 1 1 388 388 GLY CA C 388 46.180 46.180 45.214 0.966 18990 246 1 . 1 1 388 388 GLY H H 388 8.695 8.695 8.264 0.431 18990 247 1 . 1 1 389 389 TYR N N 389 122.514 122.514 117.354 5.160 18990 248 1 . 1 1 389 389 TYR HA H 389 3.658 3.658 4.173 -0.515 18990 249 1 . 1 1 389 389 TYR C C 389 172.860 172.860 174.113 -1.254 18990 250 1 . 1 1 389 389 TYR CA C 389 62.987 62.987 58.716 4.271 18990 251 1 . 1 1 389 389 TYR CB C 389 38.052 38.052 37.695 0.357 18990 252 1 . 1 1 389 389 TYR H H 389 7.923 7.923 8.199 -0.276 18990 253 1 . 1 1 390 390 HIS N N 390 120.080 120.080 123.263 -3.183 18990 254 1 . 1 1 390 390 HIS HA H 390 4.708 4.708 4.713 -0.005 18990 255 1 . 1 1 390 390 HIS C C 390 173.235 173.235 173.596 -0.361 18990 256 1 . 1 1 390 390 HIS CA C 390 51.431 51.431 54.411 -2.980 18990 257 1 . 1 1 390 390 HIS CB C 390 31.900 31.900 31.423 0.477 18990 258 1 . 1 1 390 390 HIS H H 390 5.291 5.291 7.862 -2.571 18990 259 1 . 1 1 391 391 ILE N N 391 117.810 117.810 119.916 -2.106 18990 260 1 . 1 1 391 391 ILE HA H 391 4.116 4.116 4.143 -0.027 18990 261 1 . 1 1 391 391 ILE C C 391 178.208 178.208 176.241 1.967 18990 262 1 . 1 1 391 391 ILE CA C 391 60.877 60.877 60.698 0.179 18990 263 1 . 1 1 391 391 ILE CB C 391 39.034 39.034 38.878 0.156 18990 264 1 . 1 1 391 391 ILE H H 391 8.418 8.418 8.106 0.312 18990 265 1 . 1 1 392 392 GLY N N 392 112.387 112.387 113.056 -0.669 18990 266 1 . 1 1 392 392 GLY C C 392 173.565 173.565 173.611 -0.046 18990 267 1 . 1 1 392 392 GLY CA C 392 45.258 45.258 44.913 0.345 18990 268 1 . 1 1 392 392 GLY H H 392 8.654 8.654 8.409 0.245 18990 269 1 . 1 1 393 393 GLU N N 393 119.098 119.098 119.710 -0.612 18990 270 1 . 1 1 393 393 GLU HA H 393 4.289 4.289 4.565 -0.276 18990 271 1 . 1 1 393 393 GLU C C 393 176.899 176.899 175.477 1.422 18990 272 1 . 1 1 393 393 GLU CA C 393 56.433 56.433 55.471 0.962 18990 273 1 . 1 1 393 393 GLU CB C 393 30.470 30.470 31.202 -0.732 18990 274 1 . 1 1 393 393 GLU H H 393 8.391 8.391 8.217 0.174 18990 275 1 . 1 1 394 394 CYS N N 394 122.845 122.845 119.873 2.972 18990 276 1 . 1 1 394 394 CYS HA H 394 3.766 3.766 4.738 -0.972 18990 277 1 . 1 1 394 394 CYS C C 394 175.461 175.461 174.347 1.114 18990 278 1 . 1 1 394 394 CYS CA C 394 59.835 59.835 58.497 1.338 18990 279 1 . 1 1 394 394 CYS CB C 394 30.761 30.761 28.403 2.358 18990 280 1 . 1 1 394 394 CYS H H 394 8.474 8.474 8.546 -0.072 18990 281 1 . 1 1 395 395 LEU N N 395 124.403 124.403 122.926 1.477 18990 282 1 . 1 1 395 395 LEU HA H 395 4.504 4.504 4.787 -0.283 18990 283 1 . 1 1 395 395 LEU C C 395 175.259 175.259 175.220 0.039 18990 284 1 . 1 1 395 395 LEU CA C 395 52.835 52.835 53.302 -0.467 18990 285 1 . 1 1 395 395 LEU CB C 395 41.436 41.436 42.356 -0.920 18990 286 1 . 1 1 395 395 LEU H H 395 8.418 8.418 8.212 0.205 18990 287 1 . 1 1 396 396 PRO HA H 396 4.370 4.370 4.642 -0.272 18990 288 1 . 1 1 396 396 PRO C C 396 177.006 177.006 176.176 0.830 18990 289 1 . 1 1 396 396 PRO CA C 396 63.096 63.096 62.458 0.638 18990 290 1 . 1 1 396 396 PRO CB C 396 32.072 32.072 32.680 -0.608 18990 291 1 . 1 1 397 397 GLU N N 397 121.574 121.574 119.142 2.432 18990 292 1 . 1 1 397 397 GLU HA H 397 4.225 4.225 4.384 -0.159 18990 293 1 . 1 1 397 397 GLU C C 397 177.202 177.202 176.398 0.804 18990 294 1 . 1 1 397 397 GLU CA C 397 57.034 57.034 56.420 0.614 18990 295 1 . 1 1 397 397 GLU CB C 397 30.263 30.263 30.188 0.075 18990 296 1 . 1 1 397 397 GLU H H 397 8.568 8.568 8.582 -0.014 18990 297 1 . 1 1 398 398 GLY N N 398 110.495 110.495 110.807 -0.312 18990 298 1 . 1 1 398 398 GLY C C 398 174.579 174.579 173.819 0.760 18990 299 1 . 1 1 398 398 GLY CA C 398 45.462 45.462 45.079 0.383 18990 300 1 . 1 1 398 398 GLY H H 398 8.515 8.515 8.294 0.221 18990 301 1 . 1 1 399 399 THR N N 399 113.234 113.234 115.182 -1.948 18990 302 1 . 1 1 399 399 THR HA H 399 4.398 4.398 4.672 -0.274 18990 303 1 . 1 1 399 399 THR C C 399 175.333 175.333 174.487 0.846 18990 304 1 . 1 1 399 399 THR CA C 399 62.233 62.233 61.800 0.433 18990 305 1 . 1 1 399 399 THR CB C 399 69.833 69.833 70.076 -0.243 18990 306 1 . 1 1 399 399 THR H H 399 8.090 8.090 8.533 -0.443 18990 307 1 . 1 1 400 400 GLY N N 400 111.479 111.479 110.868 0.611 18990 308 1 . 1 1 400 400 GLY C C 400 174.048 174.048 173.020 1.028 18990 309 1 . 1 1 400 400 GLY CA C 400 45.439 45.439 45.171 0.268 18990 310 1 . 1 1 400 400 GLY H H 400 8.524 8.524 8.441 0.083 18990 311 1 . 1 1 401 401 ALA N N 401 123.919 123.919 124.256 -0.337 18990 312 1 . 1 1 401 401 ALA HA H 401 4.251 4.251 4.705 -0.454 18990 313 1 . 1 1 401 401 ALA C C 401 177.942 177.942 176.574 1.368 18990 314 1 . 1 1 401 401 ALA CA C 401 52.730 52.730 51.872 0.858 18990 315 1 . 1 1 401 401 ALA CB C 401 19.142 19.142 20.026 -0.884 18990 316 1 . 1 1 401 401 ALA H H 401 8.179 8.179 8.288 -0.109 18990 317 1 . 1 1 402 402 SER N N 402 114.904 114.904 116.811 -1.907 18990 318 1 . 1 1 402 402 SER HA H 402 4.448 4.448 4.636 -0.188 18990 319 1 . 1 1 402 402 SER C C 402 174.426 174.426 173.667 0.759 18990 320 1 . 1 1 402 402 SER CA C 402 58.289 58.289 58.308 -0.019 18990 321 1 . 1 1 402 402 SER CB C 402 63.772 63.772 63.979 -0.207 18990 322 1 . 1 1 402 402 SER H H 402 8.305 8.305 8.562 -0.257 18990 323 1 . 1 1 403 403 ALA N N 403 125.965 125.965 126.686 -0.721 18990 324 1 . 1 1 403 403 ALA HA H 403 4.399 4.399 4.654 -0.255 18990 325 1 . 1 1 403 403 ALA C C 403 177.984 177.984 176.304 1.680 18990 326 1 . 1 1 403 403 ALA CA C 403 52.655 52.655 52.123 0.532 18990 327 1 . 1 1 403 403 ALA CB C 403 19.138 19.138 20.197 -1.058 18990 328 1 . 1 1 403 403 ALA H H 403 8.345 8.345 8.263 0.082 18990 329 1 . 1 1 404 404 THR N N 404 112.790 112.790 115.192 -2.402 18990 330 1 . 1 1 404 404 THR C C 404 174.420 174.420 173.630 0.790 18990 331 1 . 1 1 404 404 THR CA C 404 61.988 61.988 62.000 -0.012 18990 332 1 . 1 1 404 404 THR CB C 404 69.688 69.688 69.761 -0.072 18990 333 1 . 1 1 404 404 THR H H 404 8.118 8.118 8.153 -0.035 18990 334 1 . 1 1 405 405 ASN N N 405 121.050 121.050 122.386 -1.336 18990 335 1 . 1 1 405 405 ASN H H 405 8.396 8.396 8.586 -0.190 18990 336 1 . 1 1 407 407 CYS HA H 407 4.578 4.578 4.721 -0.143 18990 337 1 . 1 1 407 407 CYS C C 407 174.489 174.489 173.930 0.559 18990 338 1 . 1 1 407 407 CYS CA C 407 58.713 58.713 58.687 0.026 18990 339 1 . 1 1 407 407 CYS CB C 407 28.102 28.102 29.076 -0.974 18990 340 1 . 1 1 408 408 GLU N N 408 123.021 123.021 123.524 -0.503 18990 341 1 . 1 1 408 408 GLU C C 408 175.954 175.954 174.983 0.971 18990 342 1 . 1 1 408 408 GLU CA C 408 56.802 56.802 56.259 0.543 18990 343 1 . 1 1 408 408 GLU CB C 408 30.328 30.328 30.818 -0.490 18990 344 1 . 1 1 408 408 GLU H H 408 8.415 8.415 8.551 -0.136 18990 345 1 . 1 1 409 409 TYR N N 409 121.015 121.015 121.692 -0.677 18990 346 1 . 1 1 409 409 TYR HA H 409 4.654 4.654 4.809 -0.155 18990 347 1 . 1 1 409 409 TYR C C 409 175.613 175.613 174.476 1.137 18990 348 1 . 1 1 409 409 TYR CA C 409 57.669 57.669 57.866 -0.197 18990 349 1 . 1 1 409 409 TYR CB C 409 38.825 38.825 39.874 -1.049 18990 350 1 . 1 1 409 409 TYR H H 409 8.135 8.135 8.335 -0.200 18990 351 1 . 1 1 410 410 THR N N 410 116.975 116.975 118.425 -1.450 18990 352 1 . 1 1 410 410 THR HA H 410 4.306 4.306 4.461 -0.155 18990 353 1 . 1 1 410 410 THR C C 410 173.846 173.846 173.157 0.689 18990 354 1 . 1 1 410 410 THR CA C 410 61.730 61.730 61.340 0.390 18990 355 1 . 1 1 410 410 THR CB C 410 69.914 69.914 69.953 -0.039 18990 356 1 . 1 1 410 410 THR H H 410 8.060 8.060 7.978 0.082 18990 357 1 . 1 1 411 411 VAL N N 411 122.900 122.900 121.162 1.738 18990 358 1 . 1 1 411 411 VAL HA H 411 4.053 4.053 4.363 -0.310 18990 359 1 . 1 1 411 411 VAL C C 411 175.275 175.275 174.851 0.424 18990 360 1 . 1 1 411 411 VAL CA C 411 61.853 61.853 61.401 0.452 18990 361 1 . 1 1 411 411 VAL CB C 411 32.976 32.976 33.448 -0.471 18990 362 1 . 1 1 411 411 VAL H H 411 8.089 8.089 8.237 -0.148 18990 363 1 . 1 1 412 412 ASP N N 412 125.924 125.924 124.739 1.185 18990 364 1 . 1 1 412 412 ASP HA H 412 4.850 4.850 4.931 -0.082 18990 365 1 . 1 1 412 412 ASP CA C 412 51.578 51.578 52.450 -0.872 18990 366 1 . 1 1 412 412 ASP CB C 412 41.538 41.538 41.618 -0.080 18990 367 1 . 1 1 412 412 ASP H H 412 8.397 8.397 8.366 0.031 18990 368 1 . 1 1 413 413 PRO HA H 413 4.386 4.386 4.549 -0.163 18990 369 1 . 1 1 413 413 PRO C C 413 177.352 177.352 175.886 1.466 18990 370 1 . 1 1 413 413 PRO CA C 413 63.910 63.910 62.701 1.209 18990 371 1 . 1 1 413 413 PRO CB C 413 32.268 32.268 32.493 -0.225 18990 372 1 . 1 1 414 414 ASN N N 414 117.035 117.035 119.461 -2.426 18990 373 1 . 1 1 414 414 ASN HA H 414 4.677 4.677 4.772 -0.095 18990 374 1 . 1 1 414 414 ASN C C 414 175.532 175.532 174.746 0.786 18990 375 1 . 1 1 414 414 ASN CA C 414 53.824 53.824 52.927 0.897 18990 376 1 . 1 1 414 414 ASN CB C 414 38.728 38.728 39.804 -1.076 18990 377 1 . 1 1 414 414 ASN H H 414 8.496 8.496 8.484 0.012 18990 378 1 . 1 1 415 415 ARG N N 415 121.000 121.000 121.577 -0.577 18990 379 1 . 1 1 415 415 ARG HA H 415 4.244 4.244 4.628 -0.384 18990 380 1 . 1 1 415 415 ARG C C 415 176.243 176.243 174.618 1.625 18990 381 1 . 1 1 415 415 ARG CA C 415 56.404 56.404 55.641 0.763 18990 382 1 . 1 1 415 415 ARG CB C 415 30.637 30.637 31.135 -0.498 18990 383 1 . 1 1 415 415 ARG H H 415 7.804 7.804 8.472 -0.668 18990 384 1 . 1 1 416 416 ALA N N 416 124.880 124.880 124.793 0.087 18990 385 1 . 1 1 416 416 ALA C C 416 177.831 177.831 176.071 1.760 18990 386 1 . 1 1 416 416 ALA CA C 416 52.957 52.957 51.933 1.024 18990 387 1 . 1 1 416 416 ALA CB C 416 19.059 19.059 20.024 -0.965 18990 388 1 . 1 1 416 416 ALA H H 416 8.189 8.189 8.495 -0.306 18990 389 1 . 1 1 417 417 ALA N N 417 122.614 122.614 124.854 -2.240 18990 390 1 . 1 1 417 417 ALA HA H 417 4.247 4.247 4.703 -0.456 18990 391 1 . 1 1 417 417 ALA C C 417 178.024 178.024 176.328 1.696 18990 392 1 . 1 1 417 417 ALA CA C 417 52.789 52.789 51.917 0.872 18990 393 1 . 1 1 417 417 ALA CB C 417 19.042 19.042 20.121 -1.079 18990 394 1 . 1 1 417 417 ALA H H 417 8.169 8.169 8.436 -0.267 18990 395 1 . 1 1 418 418 GLU N N 418 119.500 119.500 120.768 -1.268 18990 396 1 . 1 1 418 418 GLU HA H 418 4.189 4.189 4.697 -0.508 18990 397 1 . 1 1 418 418 GLU C C 418 176.266 176.266 175.261 1.005 18990 398 1 . 1 1 418 418 GLU CA C 418 56.576 56.576 55.812 0.764 18990 399 1 . 1 1 418 418 GLU CB C 418 30.307 30.307 31.196 -0.889 18990 400 1 . 1 1 418 418 GLU H H 418 8.184 8.184 8.704 -0.520 18990 401 1 . 1 1 419 419 ALA N N 419 124.643 124.643 124.774 -0.131 18990 402 1 . 1 1 419 419 ALA HA H 419 4.250 4.250 4.663 -0.413 18990 403 1 . 1 1 419 419 ALA C C 419 177.488 177.488 176.112 1.376 18990 404 1 . 1 1 419 419 ALA CA C 419 52.509 52.509 51.714 0.795 18990 405 1 . 1 1 419 419 ALA CB C 419 19.161 19.161 20.506 -1.345 18990 406 1 . 1 1 419 419 ALA H H 419 8.135 8.135 8.429 -0.294 18990 407 1 . 1 1 420 420 ARG N N 420 120.003 120.003 121.664 -1.661 18990 408 1 . 1 1 420 420 ARG HA H 420 4.293 4.293 4.559 -0.266 18990 409 1 . 1 1 420 420 ARG C C 420 176.297 176.297 174.867 1.430 18990 410 1 . 1 1 420 420 ARG CA C 420 55.933 55.933 55.645 0.288 18990 411 1 . 1 1 420 420 ARG CB C 420 30.850 30.850 31.300 -0.450 18990 412 1 . 1 1 420 420 ARG H H 420 8.135 8.135 8.437 -0.302 18990 413 1 . 1 1 421 421 TRP N N 421 122.280 122.280 122.928 -0.648 18990 414 1 . 1 1 421 421 TRP HA H 421 4.663 4.663 4.861 -0.198 18990 415 1 . 1 1 421 421 TRP C C 421 175.856 175.856 175.093 0.763 18990 416 1 . 1 1 421 421 TRP CA C 421 57.404 57.404 56.753 0.651 18990 417 1 . 1 1 421 421 TRP CB C 421 29.437 29.437 30.542 -1.105 18990 418 1 . 1 1 421 421 TRP H H 421 8.159 8.159 8.298 -0.139 18990 419 1 . 1 1 422 422 ASP N N 422 121.980 121.980 121.578 0.402 18990 420 1 . 1 1 422 422 ASP HA H 422 4.495 4.495 4.682 -0.187 18990 421 1 . 1 1 422 422 ASP C C 422 176.184 176.184 175.811 0.373 18990 422 1 . 1 1 422 422 ASP CA C 422 53.899 53.899 53.986 -0.087 18990 423 1 . 1 1 422 422 ASP CB C 422 40.948 40.948 42.339 -1.391 18990 424 1 . 1 1 422 422 ASP H H 422 8.135 8.135 8.360 -0.225 18990 425 1 . 1 1 423 423 GLU N N 423 121.990 121.990 122.473 -0.483 18990 426 1 . 1 1 423 423 GLU HA H 423 4.090 4.090 4.324 -0.234 18990 427 1 . 1 1 423 423 GLU C C 423 176.720 176.720 176.218 0.502 18990 428 1 . 1 1 423 423 GLU CA C 423 57.169 57.169 56.643 0.526 18990 429 1 . 1 1 423 423 GLU CB C 423 30.156 30.156 29.772 0.384 18990 430 1 . 1 1 423 423 GLU H H 423 8.153 8.153 8.712 -0.559 18990 431 1 . 1 1 424 424 ALA N N 424 123.900 123.900 122.989 0.911 18990 432 1 . 1 1 424 424 ALA HA H 424 4.280 4.280 4.275 0.005 18990 433 1 . 1 1 424 424 ALA C C 424 178.095 178.095 176.529 1.566 18990 434 1 . 1 1 424 424 ALA CA C 424 53.017 53.017 52.257 0.760 18990 435 1 . 1 1 424 424 ALA CB C 424 19.086 19.086 18.723 0.363 18990 436 1 . 1 1 424 424 ALA H H 424 8.243 8.243 7.982 0.261 18990 437 1 . 1 1 425 425 SER N N 425 113.881 113.881 115.595 -1.714 18990 438 1 . 1 1 425 425 SER HA H 425 4.387 4.387 4.586 -0.199 18990 439 1 . 1 1 425 425 SER C C 425 174.338 174.338 173.563 0.775 18990 440 1 . 1 1 425 425 SER CA C 425 58.546 58.546 57.946 0.600 18990 441 1 . 1 1 425 425 SER CB C 425 63.784 63.784 64.253 -0.469 18990 442 1 . 1 1 425 425 SER H H 425 8.063 8.063 8.347 -0.284 18990 443 1 . 1 1 426 426 ASN N N 426 121.032 121.032 122.718 -1.685 18990 444 1 . 1 1 426 426 ASN HA H 426 4.706 4.706 4.887 -0.181 18990 445 1 . 1 1 426 426 ASN C C 426 175.046 175.046 174.075 0.971 18990 446 1 . 1 1 426 426 ASN CA C 426 53.445 53.445 53.029 0.416 18990 447 1 . 1 1 426 426 ASN CB C 426 38.847 38.847 39.277 -0.430 18990 448 1 . 1 1 426 426 ASN H H 426 8.391 8.391 8.528 -0.137 18990 449 1 . 1 1 427 427 VAL N N 427 119.463 119.463 121.889 -2.426 18990 450 1 . 1 1 427 427 VAL HA H 427 4.193 4.193 4.347 -0.154 18990 451 1 . 1 1 427 427 VAL C C 427 176.213 176.213 175.484 0.729 18990 452 1 . 1 1 427 427 VAL CA C 427 62.449 62.449 61.878 0.571 18990 453 1 . 1 1 427 427 VAL CB C 427 32.865 32.865 33.092 -0.227 18990 454 1 . 1 1 427 427 VAL H H 427 7.954 7.954 8.297 -0.343 18990 455 1 . 1 1 428 428 THR N N 428 118.226 118.226 120.357 -2.131 18990 456 1 . 1 1 428 428 THR HA H 428 4.353 4.353 4.595 -0.242 18990 457 1 . 1 1 428 428 THR C C 428 174.361 174.361 173.862 0.499 18990 458 1 . 1 1 428 428 THR CA C 428 62.065 62.065 61.803 0.261 18990 459 1 . 1 1 428 428 THR CB C 428 69.729 69.729 69.602 0.127 18990 460 1 . 1 1 428 428 THR H H 428 8.225 8.225 8.235 -0.010 18990 461 1 . 1 1 429 429 ILE N N 429 123.910 123.910 122.822 1.088 18990 462 1 . 1 1 429 429 ILE HA H 429 4.188 4.188 4.440 -0.252 18990 463 1 . 1 1 429 429 ILE C C 429 175.774 175.774 175.069 0.705 18990 464 1 . 1 1 429 429 ILE CA C 429 60.819 60.819 60.470 0.349 18990 465 1 . 1 1 429 429 ILE CB C 429 38.719 38.719 39.267 -0.548 18990 466 1 . 1 1 429 429 ILE H H 429 8.148 8.148 8.313 -0.165 18990 467 1 . 1 1 430 430 LYS N N 430 126.453 126.453 124.498 1.955 18990 468 1 . 1 1 430 430 LYS HA H 430 4.434 4.434 4.511 -0.077 18990 469 1 . 1 1 430 430 LYS C C 430 176.241 176.241 175.596 0.645 18990 470 1 . 1 1 430 430 LYS CA C 430 55.937 55.937 55.577 0.360 18990 471 1 . 1 1 430 430 LYS CB C 430 33.164 33.164 33.479 -0.315 18990 472 1 . 1 1 430 430 LYS H H 430 8.406 8.406 8.344 0.062 18990 473 1 . 1 1 431 431 VAL N N 431 122.496 122.496 123.009 -0.513 18990 474 1 . 1 1 431 431 VAL HA H 431 4.280 4.280 4.215 0.065 18990 475 1 . 1 1 431 431 VAL CA C 431 62.303 62.303 62.537 -0.234 18990 476 1 . 1 1 431 431 VAL CB C 431 33.132 33.132 32.538 0.594 18990 477 1 . 1 1 431 431 VAL H H 431 8.312 8.312 8.423 -0.111 18990 478 1 . 1 1 432 432 SER HA H 432 4.486 4.486 4.652 -0.166 18990 479 1 . 1 1 432 432 SER C C 432 173.834 173.834 174.075 -0.241 18990 480 1 . 1 1 432 432 SER CA C 432 58.650 58.650 58.671 -0.021 18990 481 1 . 1 1 432 432 SER CB C 432 64.152 64.152 63.924 0.228 18990 482 1 . 1 1 433 433 THR N N 433 114.706 114.706 113.341 1.365 18990 483 1 . 1 1 433 433 THR HA H 433 5.446 5.446 4.698 0.748 18990 484 1 . 1 1 433 433 THR C C 433 173.979 173.979 174.220 -0.241 18990 485 1 . 1 1 433 433 THR CA C 433 60.412 60.412 60.969 -0.557 18990 486 1 . 1 1 433 433 THR CB C 433 71.896 71.896 70.351 1.545 18990 487 1 . 1 1 433 433 THR H H 433 7.833 7.833 7.503 0.330 18990 488 1 . 1 1 434 434 LYS N N 434 122.492 122.492 123.232 -0.740 18990 489 1 . 1 1 434 434 LYS HA H 434 4.709 4.709 4.906 -0.197 18990 490 1 . 1 1 434 434 LYS C C 434 173.589 173.589 174.675 -1.086 18990 491 1 . 1 1 434 434 LYS CA C 434 54.375 54.375 52.892 1.483 18990 492 1 . 1 1 434 434 LYS CB C 434 36.925 36.925 33.731 3.195 18990 493 1 . 1 1 434 434 LYS H H 434 8.937 8.937 8.805 0.132 18990 494 1 . 1 1 435 435 PRO HA H 435 4.267 4.267 4.594 -0.327 18990 495 1 . 1 1 435 435 PRO C C 435 175.238 175.238 176.551 -1.313 18990 496 1 . 1 1 435 435 PRO CA C 435 60.923 60.923 62.362 -1.439 18990 497 1 . 1 1 435 435 PRO CB C 435 31.086 31.086 31.545 -0.459 18990 498 1 . 1 1 436 436 CYS N N 436 125.422 125.422 125.233 0.189 18990 499 1 . 1 1 436 436 CYS HA H 436 3.430 3.430 4.293 -0.863 18990 500 1 . 1 1 436 436 CYS C C 436 176.770 176.770 175.364 1.406 18990 501 1 . 1 1 436 436 CYS CA C 436 57.016 57.016 56.885 0.131 18990 502 1 . 1 1 436 436 CYS CB C 436 31.698 31.698 27.945 3.753 18990 503 1 . 1 1 436 436 CYS H H 436 7.768 7.768 8.535 -0.767 18990 504 1 . 1 1 437 437 PRO HA H 437 3.858 3.858 4.155 -0.297 18990 505 1 . 1 1 437 437 PRO C C 437 173.608 173.608 176.334 -2.726 18990 506 1 . 1 1 437 437 PRO CA C 437 64.213 64.213 64.230 -0.017 18990 507 1 . 1 1 437 437 PRO CB C 437 32.449 32.449 31.383 1.066 18990 508 1 . 1 1 438 438 LYS N N 438 118.600 118.600 117.738 0.862 18990 509 1 . 1 1 438 438 LYS HA H 438 3.970 3.970 4.164 -0.194 18990 510 1 . 1 1 438 438 LYS C C 438 176.887 176.887 177.350 -0.463 18990 511 1 . 1 1 438 438 LYS CA C 438 57.687 57.687 57.317 0.370 18990 512 1 . 1 1 438 438 LYS CB C 438 33.124 33.124 33.361 -0.237 18990 513 1 . 1 1 438 438 LYS H H 438 8.390 8.390 7.671 0.719 18990 514 1 . 1 1 439 439 CYS N N 439 118.950 118.950 115.171 3.779 18990 515 1 . 1 1 439 439 CYS HA H 439 4.746 4.746 4.755 -0.009 18990 516 1 . 1 1 439 439 CYS C C 439 176.650 176.650 175.011 1.639 18990 517 1 . 1 1 439 439 CYS CA C 439 59.348 59.348 57.519 1.829 18990 518 1 . 1 1 439 439 CYS CB C 439 31.196 31.196 28.478 2.718 18990 519 1 . 1 1 439 439 CYS H H 439 8.357 8.357 7.747 0.610 18990 520 1 . 1 1 440 440 ARG N N 440 117.200 117.200 118.320 -1.120 18990 521 1 . 1 1 440 440 ARG HA H 440 3.968 3.968 4.135 -0.167 18990 522 1 . 1 1 440 440 ARG C C 440 175.253 175.253 175.597 -0.344 18990 523 1 . 1 1 440 440 ARG CA C 440 56.900 56.900 56.869 0.031 18990 524 1 . 1 1 440 440 ARG CB C 440 26.041 26.041 27.460 -1.419 18990 525 1 . 1 1 440 440 ARG H H 440 8.065 8.065 8.049 0.016 18990 526 1 . 1 1 441 441 THR N N 441 122.400 122.400 111.883 10.517 18990 527 1 . 1 1 441 441 THR HA H 441 4.371 4.371 4.654 -0.283 18990 528 1 . 1 1 441 441 THR C C 441 173.702 173.702 173.107 0.595 18990 529 1 . 1 1 441 441 THR CA C 441 63.194 63.194 59.236 3.958 18990 530 1 . 1 1 441 441 THR CB C 441 68.933 68.933 69.441 -0.508 18990 531 1 . 1 1 441 441 THR H H 441 8.643 8.643 7.571 1.072 18990 532 1 . 1 1 442 442 PRO HA H 442 4.147 4.147 4.585 -0.439 18990 533 1 . 1 1 442 442 PRO C C 442 176.215 176.215 176.042 0.173 18990 534 1 . 1 1 442 442 PRO CA C 442 64.197 64.197 62.834 1.363 18990 535 1 . 1 1 442 442 PRO CB C 442 32.044 32.044 31.028 1.016 18990 536 1 . 1 1 443 443 THR N N 443 122.932 122.932 122.165 0.767 18990 537 1 . 1 1 443 443 THR HA H 443 4.665 4.665 4.530 0.135 18990 538 1 . 1 1 443 443 THR C C 443 172.133 172.133 174.222 -2.089 18990 539 1 . 1 1 443 443 THR CA C 443 62.566 62.566 62.391 0.175 18990 540 1 . 1 1 443 443 THR CB C 443 71.562 71.562 70.305 1.257 18990 541 1 . 1 1 443 443 THR H H 443 9.116 9.116 8.830 0.286 18990 542 1 . 1 1 444 444 GLU N N 444 126.390 126.390 126.777 -0.388 18990 543 1 . 1 1 444 444 GLU HA H 444 4.942 4.942 4.498 0.444 18990 544 1 . 1 1 444 444 GLU C C 444 175.292 175.292 175.955 -0.663 18990 545 1 . 1 1 444 444 GLU CA C 444 55.049 55.049 55.994 -0.945 18990 546 1 . 1 1 444 444 GLU CB C 444 31.861 31.861 30.987 0.874 18990 547 1 . 1 1 444 444 GLU H H 444 8.720 8.720 8.783 -0.063 18990 548 1 . 1 1 445 445 ARG N N 445 123.505 123.505 124.274 -0.769 18990 549 1 . 1 1 445 445 ARG HA H 445 3.711 3.711 4.468 -0.757 18990 550 1 . 1 1 445 445 ARG C C 445 175.289 175.289 175.290 -0.001 18990 551 1 . 1 1 445 445 ARG CA C 445 55.856 55.856 55.108 0.748 18990 552 1 . 1 1 445 445 ARG CB C 445 30.675 30.675 31.297 -0.622 18990 553 1 . 1 1 445 445 ARG H H 445 8.157 8.157 8.433 -0.276 18990 554 1 . 1 1 446 446 ASP N N 446 126.800 126.800 123.106 3.694 18990 555 1 . 1 1 446 446 ASP HA H 446 4.641 4.641 4.676 -0.035 18990 556 1 . 1 1 446 446 ASP C C 446 176.020 176.020 176.323 -0.303 18990 557 1 . 1 1 446 446 ASP CA C 446 52.952 52.952 53.653 -0.701 18990 558 1 . 1 1 446 446 ASP CB C 446 41.400 41.400 42.398 -0.998 18990 559 1 . 1 1 446 446 ASP H H 446 8.476 8.476 8.286 0.190 18990 560 1 . 1 1 447 447 GLY N N 447 111.262 111.262 110.582 0.680 18990 561 1 . 1 1 447 447 GLY C C 447 174.073 174.073 174.296 -0.223 18990 562 1 . 1 1 447 447 GLY CA C 447 45.832 45.832 45.169 0.663 18990 563 1 . 1 1 447 447 GLY H H 447 8.056 8.056 8.493 -0.437 18990 564 1 . 1 1 448 448 GLY N N 448 108.655 108.655 109.548 -0.893 18990 565 1 . 1 1 448 448 GLY C C 448 174.020 174.020 173.986 0.034 18990 566 1 . 1 1 448 448 GLY CA C 448 45.267 45.267 44.725 0.542 18990 567 1 . 1 1 448 448 GLY H H 448 8.380 8.380 8.110 0.271 18990 568 1 . 1 1 449 449 CYS N N 449 120.628 120.628 120.129 0.499 18990 569 1 . 1 1 449 449 CYS HA H 449 3.997 3.997 4.482 -0.485 18990 570 1 . 1 1 449 449 CYS C C 449 174.855 174.855 174.830 0.025 18990 571 1 . 1 1 449 449 CYS CA C 449 59.291 59.291 57.981 1.310 18990 572 1 . 1 1 449 449 CYS CB C 449 28.000 28.000 29.074 -1.074 18990 573 1 . 1 1 449 449 CYS H H 449 7.832 7.832 7.872 -0.040 18990 574 1 . 1 1 450 450 MET N N 450 123.947 123.947 119.691 4.256 18990 575 1 . 1 1 450 450 MET HA H 450 4.551 4.551 4.219 0.332 18990 576 1 . 1 1 450 450 MET C C 450 174.658 174.658 174.956 -0.297 18990 577 1 . 1 1 450 450 MET CA C 450 54.970 54.970 55.822 -0.852 18990 578 1 . 1 1 450 450 MET CB C 450 34.100 34.100 32.208 1.892 18990 579 1 . 1 1 450 450 MET H H 450 8.916 8.916 8.253 0.663 18990 580 1 . 1 1 451 451 HIS N N 451 120.490 120.490 119.467 1.023 18990 581 1 . 1 1 451 451 HIS HA H 451 3.679 3.679 4.461 -0.782 18990 582 1 . 1 1 451 451 HIS C C 451 172.443 172.443 173.922 -1.479 18990 583 1 . 1 1 451 451 HIS CA C 451 53.812 53.812 55.098 -1.286 18990 584 1 . 1 1 451 451 HIS CB C 451 28.900 28.900 29.976 -1.076 18990 585 1 . 1 1 451 451 HIS H H 451 7.557 7.557 7.642 -0.085 18990 586 1 . 1 1 452 452 MET N N 452 128.800 128.800 125.700 3.099 18990 587 1 . 1 1 452 452 MET HA H 452 4.320 4.320 4.507 -0.187 18990 588 1 . 1 1 452 452 MET C C 452 175.479 175.479 173.807 1.672 18990 589 1 . 1 1 452 452 MET CA C 452 52.589 52.589 53.504 -0.915 18990 590 1 . 1 1 452 452 MET CB C 452 28.074 28.074 32.851 -4.777 18990 591 1 . 1 1 452 452 MET H H 452 9.087 9.087 7.955 1.132 18990 592 1 . 1 1 453 453 VAL N N 453 122.200 122.200 121.308 0.892 18990 593 1 . 1 1 453 453 VAL HA H 453 4.794 4.794 4.367 0.427 18990 594 1 . 1 1 453 453 VAL C C 453 175.476 175.476 174.809 0.667 18990 595 1 . 1 1 453 453 VAL CA C 453 61.380 61.380 60.039 1.341 18990 596 1 . 1 1 453 453 VAL CB C 453 33.089 33.089 33.607 -0.518 18990 597 1 . 1 1 453 453 VAL H H 453 8.016 8.016 8.095 -0.079 18990 598 1 . 1 1 454 454 CYS N N 454 130.353 130.353 127.133 3.220 18990 599 1 . 1 1 454 454 CYS HA H 454 4.595 4.595 4.733 -0.138 18990 600 1 . 1 1 454 454 CYS C C 454 177.833 177.833 174.825 3.008 18990 601 1 . 1 1 454 454 CYS CA C 454 61.571 61.571 58.755 2.816 18990 602 1 . 1 1 454 454 CYS CB C 454 32.045 32.045 26.690 5.355 18990 603 1 . 1 1 454 454 CYS H H 454 8.989 8.989 8.921 0.068 18990 604 1 . 1 1 455 455 THR N N 455 119.000 119.000 122.953 -3.953 18990 605 1 . 1 1 455 455 THR HA H 455 4.393 4.393 4.408 -0.016 18990 606 1 . 1 1 455 455 THR C C 455 175.264 175.264 173.819 1.445 18990 607 1 . 1 1 455 455 THR CA C 455 61.644 61.644 61.920 -0.276 18990 608 1 . 1 1 455 455 THR CB C 455 69.400 69.400 68.376 1.024 18990 609 1 . 1 1 455 455 THR H H 455 8.533 8.533 8.466 0.067 18990 610 1 . 1 1 456 456 ARG N N 456 128.900 128.900 127.529 1.371 18990 611 1 . 1 1 456 456 ARG HA H 456 4.225 4.225 4.574 -0.349 18990 612 1 . 1 1 456 456 ARG C C 456 177.782 177.782 175.623 2.159 18990 613 1 . 1 1 456 456 ARG CA C 456 56.950 56.950 54.537 2.413 18990 614 1 . 1 1 456 456 ARG CB C 456 30.050 30.050 33.494 -3.444 18990 615 1 . 1 1 456 456 ARG H H 456 9.036 9.036 7.870 1.166 18990 616 1 . 1 1 457 457 ALA N N 457 133.152 133.152 127.403 5.749 18990 617 1 . 1 1 457 457 ALA HA H 457 4.146 4.146 4.241 -0.095 18990 618 1 . 1 1 457 457 ALA C C 457 178.757 178.757 177.521 1.235 18990 619 1 . 1 1 457 457 ALA CA C 457 53.929 53.929 53.357 0.572 18990 620 1 . 1 1 457 457 ALA CB C 457 17.710 17.710 18.045 -0.336 18990 621 1 . 1 1 457 457 ALA H H 457 9.042 9.042 8.753 0.289 18990 622 1 . 1 1 458 458 GLY N N 458 111.200 111.200 108.879 2.321 18990 623 1 . 1 1 458 458 GLY C C 458 173.558 173.558 173.965 -0.407 18990 624 1 . 1 1 458 458 GLY CA C 458 45.436 45.436 44.576 0.860 18990 625 1 . 1 1 458 458 GLY H H 458 8.830 8.830 8.328 0.502 18990 626 1 . 1 1 459 459 CYS N N 459 123.040 123.040 119.907 3.133 18990 627 1 . 1 1 459 459 CYS HA H 459 4.622 4.622 4.959 -0.337 18990 628 1 . 1 1 459 459 CYS C C 459 176.591 176.591 174.870 1.721 18990 629 1 . 1 1 459 459 CYS CA C 459 60.499 60.499 59.173 1.326 18990 630 1 . 1 1 459 459 CYS CB C 459 30.174 30.174 29.176 0.998 18990 631 1 . 1 1 459 459 CYS H H 459 8.042 8.042 8.145 -0.103 18990 632 1 . 1 1 460 460 GLY N N 460 104.500 104.500 111.110 -6.610 18990 633 1 . 1 1 460 460 GLY C C 460 173.716 173.716 173.860 -0.144 18990 634 1 . 1 1 460 460 GLY CA C 460 46.008 46.008 45.565 0.443 18990 635 1 . 1 1 460 460 GLY H H 460 7.705 7.705 8.267 -0.562 18990 636 1 . 1 1 461 461 PHE N N 461 124.949 124.949 121.249 3.700 18990 637 1 . 1 1 461 461 PHE HA H 461 4.580 4.580 4.684 -0.104 18990 638 1 . 1 1 461 461 PHE C C 461 174.447 174.447 173.902 0.545 18990 639 1 . 1 1 461 461 PHE CA C 461 59.946 59.946 57.004 2.942 18990 640 1 . 1 1 461 461 PHE CB C 461 41.300 41.300 41.365 -0.065 18990 641 1 . 1 1 461 461 PHE H H 461 8.947 8.947 7.671 1.276 18990 642 1 . 1 1 462 462 GLU N N 462 125.272 125.272 127.097 -1.825 18990 643 1 . 1 1 462 462 GLU HA H 462 5.721 5.721 4.719 1.002 18990 644 1 . 1 1 462 462 GLU C C 462 176.067 176.067 175.010 1.057 18990 645 1 . 1 1 462 462 GLU CA C 462 54.624 54.624 55.241 -0.617 18990 646 1 . 1 1 462 462 GLU CB C 462 31.255 31.255 31.422 -0.167 18990 647 1 . 1 1 462 462 GLU H H 462 7.799 7.799 8.154 -0.355 18990 648 1 . 1 1 463 463 TRP N N 463 121.524 121.524 119.485 2.039 18990 649 1 . 1 1 463 463 TRP HA H 463 5.506 5.506 5.331 0.175 18990 650 1 . 1 1 463 463 TRP C C 463 172.844 172.844 174.755 -1.911 18990 651 1 . 1 1 463 463 TRP CA C 463 53.771 53.771 54.913 -1.142 18990 652 1 . 1 1 463 463 TRP CB C 463 31.736 31.736 31.193 0.543 18990 653 1 . 1 1 463 463 TRP H H 463 9.300 9.300 8.303 0.997 18990 654 1 . 1 1 464 464 CYS N N 464 120.868 120.868 120.562 0.307 18990 655 1 . 1 1 464 464 CYS HA H 464 5.416 5.416 4.703 0.713 18990 656 1 . 1 1 464 464 CYS C C 464 177.213 177.213 176.329 0.884 18990 657 1 . 1 1 464 464 CYS CA C 464 57.776 57.776 59.907 -2.131 18990 658 1 . 1 1 464 464 CYS CB C 464 32.930 32.930 28.513 4.417 18990 659 1 . 1 1 464 464 CYS H H 464 8.752 8.752 8.970 -0.217 18990 660 1 . 1 1 465 465 TRP N N 465 131.209 131.209 127.603 3.606 18990 661 1 . 1 1 465 465 TRP HA H 465 4.427 4.427 4.347 0.080 18990 662 1 . 1 1 465 465 TRP C C 465 176.051 176.051 175.916 0.135 18990 663 1 . 1 1 465 465 TRP CA C 465 60.763 60.763 59.984 0.779 18990 664 1 . 1 1 465 465 TRP CB C 465 31.126 31.126 29.665 1.461 18990 665 1 . 1 1 465 465 TRP H H 465 9.809 9.809 8.456 1.353 18990 666 1 . 1 1 466 466 VAL N N 466 118.233 118.233 116.557 1.676 18990 667 1 . 1 1 466 466 VAL HA H 466 3.624 3.624 3.493 0.131 18990 668 1 . 1 1 466 466 VAL C C 466 178.943 178.943 176.181 2.762 18990 669 1 . 1 1 466 466 VAL CA C 466 65.602 65.602 63.976 1.626 18990 670 1 . 1 1 466 466 VAL CB C 466 33.172 33.172 31.587 1.585 18990 671 1 . 1 1 466 466 VAL H H 466 8.627 8.627 7.809 0.818 18990 672 1 . 1 1 467 467 CYS HA H 467 3.431 3.431 4.719 -1.288 18990 673 1 . 1 1 467 467 CYS CA C 467 56.999 56.999 56.646 0.353 18990 674 1 . 1 1 467 467 CYS CB C 467 31.870 31.870 28.626 3.244 18990 675 1 . 1 1 467 467 CYS H H 467 7.820 7.820 7.752 0.068 18990 676 1 . 1 1 468 468 GLN HA H 468 4.036 4.036 4.663 -0.627 18990 677 1 . 1 1 468 468 GLN CA C 468 58.051 58.051 56.304 1.747 18990 678 1 . 1 1 468 468 GLN CB C 468 26.476 26.476 28.588 -2.112 18990 679 1 . 1 1 469 469 THR HA H 469 4.685 4.685 4.653 0.032 18990 680 1 . 1 1 469 469 THR C C 469 173.351 173.351 173.065 0.286 18990 681 1 . 1 1 469 469 THR CA C 469 59.176 59.176 60.517 -1.341 18990 682 1 . 1 1 469 469 THR CB C 469 71.775 71.775 71.176 0.599 18990 683 1 . 1 1 470 470 GLU N N 470 120.940 120.940 121.413 -0.473 18990 684 1 . 1 1 470 470 GLU HA H 470 4.293 4.293 4.755 -0.462 18990 685 1 . 1 1 470 470 GLU C C 470 175.539 175.539 176.462 -0.923 18990 686 1 . 1 1 470 470 GLU CA C 470 57.015 57.015 55.407 1.608 18990 687 1 . 1 1 470 470 GLU CB C 470 29.965 29.965 31.145 -1.180 18990 688 1 . 1 1 470 470 GLU H H 470 8.912 8.912 8.649 0.263 18990 689 1 . 1 1 471 471 TRP N N 471 126.998 126.998 125.634 1.364 18990 690 1 . 1 1 471 471 TRP HA H 471 4.293 4.293 4.389 -0.096 18990 691 1 . 1 1 471 471 TRP C C 471 175.408 175.408 175.310 0.098 18990 692 1 . 1 1 471 471 TRP CA C 471 58.220 58.220 57.865 0.355 18990 693 1 . 1 1 471 471 TRP CB C 471 29.500 29.500 28.693 0.808 18990 694 1 . 1 1 471 471 TRP H H 471 8.350 8.350 8.439 -0.089 18990 695 1 . 1 1 472 472 THR N N 472 117.480 117.480 117.520 -0.040 18990 696 1 . 1 1 472 472 THR HA H 472 4.444 4.444 4.426 0.018 18990 697 1 . 1 1 472 472 THR CA C 472 58.930 58.930 60.087 -1.157 18990 698 1 . 1 1 472 472 THR H H 472 8.069 8.069 7.573 0.496 18990 699 1 . 1 1 473 473 ARG HA H 473 3.773 3.773 3.991 -0.218 18990 700 1 . 1 1 473 473 ARG C C 473 178.053 178.053 177.577 0.476 18990 701 1 . 1 1 473 473 ARG CA C 473 58.088 58.088 58.520 -0.432 18990 702 1 . 1 1 473 473 ARG CB C 473 29.426 29.426 30.029 -0.603 18990 703 1 . 1 1 474 474 ASP N N 474 119.900 119.900 119.658 0.242 18990 704 1 . 1 1 474 474 ASP HA H 474 4.215 4.215 4.457 -0.242 18990 705 1 . 1 1 474 474 ASP C C 474 178.197 178.197 177.032 1.165 18990 706 1 . 1 1 474 474 ASP CA C 474 56.802 56.802 56.656 0.146 18990 707 1 . 1 1 474 474 ASP CB C 474 40.182 40.182 40.688 -0.506 18990 708 1 . 1 1 474 474 ASP H H 474 7.718 7.718 8.296 -0.577 18990 709 1 . 1 1 475 475 CYS N N 475 121.000 121.000 117.845 3.155 18990 710 1 . 1 1 475 475 CYS HA H 475 3.367 3.367 4.550 -1.183 18990 711 1 . 1 1 475 475 CYS CA C 475 64.533 64.533 59.002 5.531 18990 712 1 . 1 1 475 475 CYS CB C 475 29.092 29.092 26.574 2.518 18990 713 1 . 1 1 475 475 CYS H H 475 6.953 6.953 7.927 -0.974 18990 714 1 . 1 1 476 476 MET HA H 476 4.021 4.021 4.045 -0.024 18990 715 1 . 1 1 476 476 MET CA C 476 58.010 58.010 57.850 0.160 18990 716 1 . 1 1 476 476 MET CB C 476 32.550 32.550 32.533 0.017 18990 717 1 . 1 1 477 477 GLY N N 477 111.938 111.938 103.934 8.004 18990 718 1 . 1 1 477 477 GLY C C 477 174.406 174.406 174.069 0.337 18990 719 1 . 1 1 477 477 GLY CA C 477 45.616 45.616 44.904 0.712 18990 720 1 . 1 1 477 477 GLY H H 477 9.155 9.155 7.935 1.220 18990 721 1 . 1 1 478 478 ALA N N 478 121.900 121.900 124.415 -2.515 18990 722 1 . 1 1 478 478 ALA HA H 478 4.291 4.291 4.369 -0.078 18990 723 1 . 1 1 478 478 ALA C C 478 178.196 178.196 177.526 0.670 18990 724 1 . 1 1 478 478 ALA CA C 478 53.440 53.440 53.700 -0.260 18990 725 1 . 1 1 478 478 ALA CB C 478 20.390 20.390 19.563 0.827 18990 726 1 . 1 1 478 478 ALA H H 478 7.347 7.347 7.910 -0.563 18990 727 1 . 1 1 479 479 HIS N N 479 115.200 115.200 111.745 3.455 18990 728 1 . 1 1 479 479 HIS HA H 479 4.903 4.903 4.829 0.074 18990 729 1 . 1 1 479 479 HIS C C 479 173.325 173.325 175.370 -2.045 18990 730 1 . 1 1 479 479 HIS CA C 479 54.526 54.526 54.845 -0.319 18990 731 1 . 1 1 479 479 HIS CB C 479 27.600 27.600 30.058 -2.458 18990 732 1 . 1 1 479 479 HIS H H 479 8.297 8.297 7.787 0.510 18990 733 1 . 1 1 480 480 TRP N N 480 121.780 121.780 122.406 -0.626 18990 734 1 . 1 1 480 480 TRP HA H 480 4.295 4.295 4.403 -0.108 18990 735 1 . 1 1 480 480 TRP C C 480 175.568 175.568 175.104 0.464 18990 736 1 . 1 1 480 480 TRP CA C 480 58.358 58.358 58.667 -0.309 18990 737 1 . 1 1 480 480 TRP CB C 480 29.550 29.550 29.387 0.163 18990 738 1 . 1 1 480 480 TRP H H 480 8.081 8.081 7.606 0.475 18990 739 1 . 1 1 481 481 PHE HA H 481 4.845 4.845 4.625 0.220 18990 740 1 . 1 1 481 481 PHE C C 481 175.126 175.126 174.717 0.409 18990 741 1 . 1 1 481 481 PHE CA C 481 56.471 56.471 57.864 -1.393 18990 742 1 . 1 1 481 481 PHE CB C 481 41.006 41.006 39.940 1.066 18990 stop_ save_