data_19685 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19685 _Entry.PDB_ID 2MIK 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 19685 _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 1 395 395 SER N N 395 115.500 115.500 114.732 0.768 19685 2 1 1 . 1 1 395 395 SER HA H 395 4.300 4.300 4.546 -0.246 19685 3 1 1 . 1 1 395 395 SER C C 395 173.900 173.900 173.631 0.269 19685 4 1 1 . 1 1 395 395 SER CA C 395 57.900 57.900 57.838 0.062 19685 5 1 1 . 1 1 395 395 SER CB C 395 63.400 63.400 64.187 -0.787 19685 6 1 1 . 1 1 395 395 SER H H 395 8.200 8.200 8.335 -0.135 19685 7 1 1 . 1 1 396 396 HIS N N 396 123.500 123.500 119.288 4.212 19685 8 1 1 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.911 -0.351 19685 9 1 1 . 1 1 396 396 HIS C C 396 174.100 174.100 173.928 0.172 19685 10 1 1 . 1 1 396 396 HIS CA C 396 53.700 53.700 55.838 -2.138 19685 11 1 1 . 1 1 396 396 HIS CB C 396 32.200 32.200 31.076 1.124 19685 12 1 1 . 1 1 396 396 HIS H H 396 8.120 8.120 8.344 -0.224 19685 13 1 1 . 1 1 397 397 MET N N 397 121.200 121.200 119.493 1.707 19685 14 1 1 . 1 1 397 397 MET HA H 397 4.320 4.320 4.745 -0.425 19685 15 1 1 . 1 1 397 397 MET C C 397 175.400 175.400 174.200 1.200 19685 16 1 1 . 1 1 397 397 MET CA C 397 55.000 55.000 54.615 0.385 19685 17 1 1 . 1 1 397 397 MET CB C 397 32.500 32.500 34.896 -2.396 19685 18 1 1 . 1 1 397 397 MET H H 397 8.300 8.300 7.603 0.697 19685 19 1 1 . 1 1 398 398 GLN N N 398 122.100 122.100 121.669 0.431 19685 20 1 1 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.593 -0.403 19685 21 1 1 . 1 1 398 398 GLN C C 398 174.800 174.800 174.815 -0.015 19685 22 1 1 . 1 1 398 398 GLN CA C 398 55.200 55.200 55.534 -0.334 19685 23 1 1 . 1 1 398 398 GLN CB C 398 28.900 28.900 31.833 -2.933 19685 24 1 1 . 1 1 398 398 GLN H H 398 8.540 8.540 8.350 0.190 19685 25 1 1 . 1 1 399 399 LYS N N 399 123.000 123.000 121.443 1.557 19685 26 1 1 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.205 0.015 19685 27 1 1 . 1 1 399 399 LYS C C 399 174.800 174.800 176.866 -2.066 19685 28 1 1 . 1 1 399 399 LYS CA C 399 55.600 55.600 57.821 -2.221 19685 29 1 1 . 1 1 399 399 LYS CB C 399 33.000 33.000 32.431 0.569 19685 30 1 1 . 1 1 399 399 LYS H H 399 8.180 8.180 8.823 -0.643 19685 31 1 1 . 1 1 400 400 GLU N N 400 122.000 122.000 116.333 5.667 19685 32 1 1 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.528 -0.098 19685 33 1 1 . 1 1 400 400 GLU C C 400 176.400 176.400 176.755 -0.355 19685 34 1 1 . 1 1 400 400 GLU CA C 400 55.400 55.400 55.752 -0.352 19685 35 1 1 . 1 1 400 400 GLU CB C 400 31.400 31.400 29.607 1.793 19685 36 1 1 . 1 1 400 400 GLU H H 400 8.350 8.350 8.162 0.188 19685 37 1 1 . 1 1 401 401 GLY N N 401 109.500 109.500 109.589 -0.089 19685 38 1 1 . 1 1 401 401 GLY C C 401 171.500 171.500 172.325 -0.825 19685 39 1 1 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.316 -0.616 19685 40 1 1 . 1 1 401 401 GLY H H 401 9.050 9.050 7.414 1.636 19685 41 1 1 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.681 -0.261 19685 42 1 1 . 1 1 402 402 PRO C C 402 173.900 173.900 177.485 -3.585 19685 43 1 1 . 1 1 402 402 PRO CA C 402 61.900 61.900 62.423 -0.523 19685 44 1 1 . 1 1 402 402 PRO CB C 402 32.200 32.200 33.277 -1.077 19685 45 1 1 . 1 1 403 403 GLU N N 403 119.600 119.600 119.205 0.395 19685 46 1 1 . 1 1 403 403 GLU HA H 403 3.960 3.960 3.945 0.015 19685 47 1 1 . 1 1 403 403 GLU C C 403 177.300 177.300 176.143 1.157 19685 48 1 1 . 1 1 403 403 GLU CA C 403 58.100 58.100 57.687 0.413 19685 49 1 1 . 1 1 403 403 GLU CB C 403 29.000 29.000 29.550 -0.550 19685 50 1 1 . 1 1 403 403 GLU H H 403 8.420 8.420 9.070 -0.650 19685 51 1 1 . 1 1 404 404 GLY N N 404 112.800 112.800 104.082 8.718 19685 52 1 1 . 1 1 404 404 GLY C C 404 173.300 173.300 173.721 -0.421 19685 53 1 1 . 1 1 404 404 GLY CA C 404 44.900 44.900 44.794 0.106 19685 54 1 1 . 1 1 404 404 GLY H H 404 8.500 8.500 7.789 0.711 19685 55 1 1 . 1 1 405 405 ALA N N 405 120.000 120.000 125.333 -5.333 19685 56 1 1 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.363 0.187 19685 57 1 1 . 1 1 405 405 ALA C C 405 174.100 174.100 175.425 -1.325 19685 58 1 1 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.838 -1.338 19685 59 1 1 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.456 3.344 19685 60 1 1 . 1 1 405 405 ALA H H 405 8.360 8.360 8.181 0.179 19685 61 1 1 . 1 1 406 406 ASN N N 406 115.500 115.500 119.048 -3.548 19685 62 1 1 . 1 1 406 406 ASN HA H 406 5.190 5.190 4.996 0.194 19685 63 1 1 . 1 1 406 406 ASN C C 406 172.900 172.900 173.668 -0.768 19685 64 1 1 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.946 0.654 19685 65 1 1 . 1 1 406 406 ASN CB C 406 40.900 40.900 40.329 0.571 19685 66 1 1 . 1 1 406 406 ASN H H 406 7.690 7.690 8.185 -0.495 19685 67 1 1 . 1 1 407 407 LEU N N 407 123.400 123.400 122.661 0.739 19685 68 1 1 . 1 1 407 407 LEU HA H 407 4.960 4.960 5.331 -0.371 19685 69 1 1 . 1 1 407 407 LEU C C 407 174.900 174.900 175.696 -0.796 19685 70 1 1 . 1 1 407 407 LEU CA C 407 53.100 53.100 53.002 0.098 19685 71 1 1 . 1 1 407 407 LEU CB C 407 45.400 45.400 42.672 2.728 19685 72 1 1 . 1 1 407 407 LEU H H 407 9.290 9.290 7.957 1.333 19685 73 1 1 . 1 1 408 408 PHE N N 408 118.700 118.700 123.586 -4.886 19685 74 1 1 . 1 1 408 408 PHE HA H 408 5.300 5.300 5.028 0.272 19685 75 1 1 . 1 1 408 408 PHE C C 408 174.200 174.200 175.485 -1.285 19685 76 1 1 . 1 1 408 408 PHE CA C 408 56.300 56.300 57.918 -1.618 19685 77 1 1 . 1 1 408 408 PHE CB C 408 42.700 42.700 39.018 3.682 19685 78 1 1 . 1 1 408 408 PHE H H 408 9.150 9.150 8.274 0.876 19685 79 1 1 . 1 1 409 409 ILE N N 409 120.800 120.800 124.277 -3.477 19685 80 1 1 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.543 0.427 19685 81 1 1 . 1 1 409 409 ILE C C 409 173.900 173.900 174.529 -0.629 19685 82 1 1 . 1 1 409 409 ILE CA C 409 59.000 59.000 61.110 -2.110 19685 83 1 1 . 1 1 409 409 ILE CB C 409 40.400 40.400 40.083 0.317 19685 84 1 1 . 1 1 409 409 ILE H H 409 8.380 8.380 9.065 -0.685 19685 85 1 1 . 1 1 410 410 TYR N N 410 123.200 123.200 121.547 1.653 19685 86 1 1 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.894 0.046 19685 87 1 1 . 1 1 410 410 TYR C C 410 174.300 174.300 174.246 0.054 19685 88 1 1 . 1 1 410 410 TYR CA C 410 56.200 56.200 57.530 -1.330 19685 89 1 1 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.206 1.593 19685 90 1 1 . 1 1 410 410 TYR H H 410 9.440 9.440 8.604 0.836 19685 91 1 1 . 1 1 411 411 HIS N N 411 112.100 112.100 118.750 -6.650 19685 92 1 1 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.430 0.020 19685 93 1 1 . 1 1 411 411 HIS C C 411 173.300 173.300 175.800 -2.500 19685 94 1 1 . 1 1 411 411 HIS CA C 411 55.900 55.900 56.029 -0.129 19685 95 1 1 . 1 1 411 411 HIS CB C 411 26.200 26.200 29.480 -3.280 19685 96 1 1 . 1 1 411 411 HIS H H 411 8.580 8.580 8.380 0.200 19685 97 1 1 . 1 1 412 412 LEU N N 412 115.100 115.100 115.142 -0.042 19685 98 1 1 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.749 -0.789 19685 99 1 1 . 1 1 412 412 LEU C C 412 175.100 175.100 175.373 -0.273 19685 100 1 1 . 1 1 412 412 LEU CA C 412 52.400 52.400 55.251 -2.851 19685 101 1 1 . 1 1 412 412 LEU CB C 412 42.000 42.000 40.554 1.446 19685 102 1 1 . 1 1 412 412 LEU H H 412 7.560 7.560 8.007 -0.447 19685 103 1 1 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.348 -0.078 19685 104 1 1 . 1 1 413 413 PRO C C 413 177.600 177.600 175.280 2.320 19685 105 1 1 . 1 1 413 413 PRO CA C 413 62.300 62.300 64.100 -1.800 19685 106 1 1 . 1 1 413 413 PRO CB C 413 32.200 32.200 31.306 0.894 19685 107 1 1 . 1 1 414 414 GLN N N 414 125.500 125.500 122.047 3.453 19685 108 1 1 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.236 -0.156 19685 109 1 1 . 1 1 414 414 GLN C C 414 175.400 175.400 174.080 1.320 19685 110 1 1 . 1 1 414 414 GLN CA C 414 57.000 57.000 55.885 1.115 19685 111 1 1 . 1 1 414 414 GLN CB C 414 28.500 28.500 30.059 -1.559 19685 112 1 1 . 1 1 414 414 GLN H H 414 9.170 9.170 7.847 1.323 19685 113 1 1 . 1 1 415 415 GLU N N 415 115.300 115.300 121.285 -5.985 19685 114 1 1 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.018 0.242 19685 115 1 1 . 1 1 415 415 GLU C C 415 176.700 176.700 174.973 1.727 19685 116 1 1 . 1 1 415 415 GLU CA C 415 58.700 58.700 57.827 0.873 19685 117 1 1 . 1 1 415 415 GLU CB C 415 28.300 28.300 28.688 -0.388 19685 118 1 1 . 1 1 415 415 GLU H H 415 9.390 9.390 8.973 0.416 19685 119 1 1 . 1 1 416 416 PHE N N 416 121.700 121.700 115.635 6.065 19685 120 1 1 . 1 1 416 416 PHE HA H 416 4.610 4.610 4.962 -0.352 19685 121 1 1 . 1 1 416 416 PHE C C 416 176.400 176.400 176.395 0.005 19685 122 1 1 . 1 1 416 416 PHE CA C 416 57.400 57.400 55.367 2.034 19685 123 1 1 . 1 1 416 416 PHE CB C 416 38.700 38.700 41.094 -2.394 19685 124 1 1 . 1 1 416 416 PHE H H 416 7.610 7.610 7.597 0.013 19685 125 1 1 . 1 1 417 417 GLY N N 417 113.000 113.000 107.174 5.826 19685 126 1 1 . 1 1 417 417 GLY C C 417 174.300 174.300 172.955 1.345 19685 127 1 1 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.170 -3.271 19685 128 1 1 . 1 1 417 417 GLY H H 417 9.740 9.740 9.508 0.232 19685 129 1 1 . 1 1 418 418 ASP N N 418 121.500 121.500 117.912 3.588 19685 130 1 1 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.701 -0.761 19685 131 1 1 . 1 1 418 418 ASP C C 418 177.900 177.900 176.389 1.511 19685 132 1 1 . 1 1 418 418 ASP CA C 418 57.600 57.600 55.066 2.534 19685 133 1 1 . 1 1 418 418 ASP CB C 418 39.700 39.700 42.162 -2.462 19685 134 1 1 . 1 1 418 418 ASP H H 418 8.680 8.680 8.470 0.210 19685 135 1 1 . 1 1 419 419 GLN N N 419 116.400 116.400 118.969 -2.569 19685 136 1 1 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.226 -0.316 19685 137 1 1 . 1 1 419 419 GLN C C 419 177.600 177.600 175.382 2.218 19685 138 1 1 . 1 1 419 419 GLN CA C 419 58.000 58.000 57.737 0.263 19685 139 1 1 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.417 -1.017 19685 140 1 1 . 1 1 419 419 GLN H H 419 8.780 8.780 8.517 0.263 19685 141 1 1 . 1 1 420 420 ASP N N 420 117.500 117.500 116.077 1.423 19685 142 1 1 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.544 -0.534 19685 143 1 1 . 1 1 420 420 ASP C C 420 178.000 178.000 177.258 0.742 19685 144 1 1 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.349 3.351 19685 145 1 1 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.483 -0.683 19685 146 1 1 . 1 1 420 420 ASP H H 420 7.210 7.210 8.299 -1.089 19685 147 1 1 . 1 1 421 421 ILE N N 421 117.000 117.000 121.545 -4.545 19685 148 1 1 . 1 1 421 421 ILE HA H 421 4.080 4.080 3.870 0.210 19685 149 1 1 . 1 1 421 421 ILE C C 421 176.500 176.500 175.731 0.769 19685 150 1 1 . 1 1 421 421 ILE CA C 421 64.000 64.000 63.660 0.340 19685 151 1 1 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.256 -0.956 19685 152 1 1 . 1 1 421 421 ILE H H 421 7.610 7.610 7.755 -0.145 19685 153 1 1 . 1 1 422 422 LEU N N 422 123.200 123.200 119.244 3.956 19685 154 1 1 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.126 -0.366 19685 155 1 1 . 1 1 422 422 LEU C C 422 177.800 177.800 176.811 0.989 19685 156 1 1 . 1 1 422 422 LEU CA C 422 58.600 58.600 56.169 2.431 19685 157 1 1 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.701 -0.501 19685 158 1 1 . 1 1 422 422 LEU H H 422 7.870 7.870 7.800 0.070 19685 159 1 1 . 1 1 423 423 GLN N N 423 115.600 115.600 117.980 -2.380 19685 160 1 1 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.293 -0.413 19685 161 1 1 . 1 1 423 423 GLN C C 423 177.800 177.800 175.647 2.153 19685 162 1 1 . 1 1 423 423 GLN CA C 423 58.600 58.600 55.938 2.662 19685 163 1 1 . 1 1 423 423 GLN CB C 423 27.900 27.900 30.621 -2.721 19685 164 1 1 . 1 1 423 423 GLN H H 423 7.860 7.860 7.946 -0.086 19685 165 1 1 . 1 1 424 424 MET N N 424 115.500 115.500 116.773 -1.273 19685 166 1 1 . 1 1 424 424 MET HA H 424 3.910 3.910 4.316 -0.406 19685 167 1 1 . 1 1 424 424 MET C C 424 175.500 175.500 176.421 -0.921 19685 168 1 1 . 1 1 424 424 MET CA C 424 57.800 57.800 55.134 2.666 19685 169 1 1 . 1 1 424 424 MET CB C 424 34.300 34.300 34.436 -0.136 19685 170 1 1 . 1 1 424 424 MET H H 424 7.560 7.560 7.782 -0.222 19685 171 1 1 . 1 1 425 425 PHE N N 425 112.300 112.300 116.214 -3.914 19685 172 1 1 . 1 1 425 425 PHE HA H 425 4.700 4.700 4.673 0.027 19685 173 1 1 . 1 1 425 425 PHE C C 425 177.300 177.300 176.861 0.439 19685 174 1 1 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.429 1.471 19685 175 1 1 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.350 -1.850 19685 176 1 1 . 1 1 425 425 PHE H H 425 7.680 7.680 7.686 -0.006 19685 177 1 1 . 1 1 426 426 MET N N 426 127.400 127.400 119.086 8.314 19685 178 1 1 . 1 1 426 426 MET HA H 426 4.630 4.630 4.204 0.426 19685 179 1 1 . 1 1 426 426 MET C C 426 173.800 173.800 174.947 -1.147 19685 180 1 1 . 1 1 426 426 MET CA C 426 59.100 59.100 59.102 -0.003 19685 181 1 1 . 1 1 426 426 MET CB C 426 31.800 31.800 30.209 1.591 19685 182 1 1 . 1 1 426 426 MET H H 426 8.540 8.540 8.378 0.162 19685 183 1 1 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.218 -0.208 19685 184 1 1 . 1 1 427 427 PRO C C 427 176.800 176.800 176.665 0.135 19685 185 1 1 . 1 1 427 427 PRO CA C 427 65.200 65.200 63.794 1.407 19685 186 1 1 . 1 1 427 427 PRO CB C 427 30.600 30.600 31.367 -0.767 19685 187 1 1 . 1 1 428 428 PHE N N 428 110.000 110.000 118.841 -8.841 19685 188 1 1 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.550 -0.280 19685 189 1 1 . 1 1 428 428 PHE C C 428 174.600 174.600 176.240 -1.640 19685 190 1 1 . 1 1 428 428 PHE CA C 428 57.700 57.700 59.440 -1.740 19685 191 1 1 . 1 1 428 428 PHE CB C 428 38.000 38.000 40.156 -2.156 19685 192 1 1 . 1 1 428 428 PHE H H 428 6.560 6.560 7.270 -0.710 19685 193 1 1 . 1 1 429 429 GLY N N 429 105.500 105.500 103.838 1.662 19685 194 1 1 . 1 1 429 429 GLY C C 429 170.100 170.100 171.373 -1.273 19685 195 1 1 . 1 1 429 429 GLY CA C 429 44.400 44.400 44.269 0.131 19685 196 1 1 . 1 1 429 429 GLY H H 429 7.650 7.650 7.394 0.256 19685 197 1 1 . 1 1 430 430 ASN N N 430 117.400 117.400 117.973 -0.573 19685 198 1 1 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.547 0.083 19685 199 1 1 . 1 1 430 430 ASN C C 430 173.200 173.200 176.362 -3.162 19685 200 1 1 . 1 1 430 430 ASN CA C 430 52.600 52.600 52.512 0.088 19685 201 1 1 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.368 -2.168 19685 202 1 1 . 1 1 430 430 ASN H H 430 9.020 9.020 8.240 0.780 19685 203 1 1 . 1 1 431 431 VAL N N 431 128.000 128.000 123.617 4.383 19685 204 1 1 . 1 1 431 431 VAL HA H 431 3.750 3.750 3.917 -0.167 19685 205 1 1 . 1 1 431 431 VAL C C 431 176.400 176.400 176.876 -0.476 19685 206 1 1 . 1 1 431 431 VAL CA C 431 61.800 61.800 63.123 -1.323 19685 207 1 1 . 1 1 431 431 VAL CB C 431 31.900 31.900 31.927 -0.028 19685 208 1 1 . 1 1 431 431 VAL H H 431 8.480 8.480 8.463 0.017 19685 209 1 1 . 1 1 432 432 ILE N N 432 128.000 128.000 117.641 10.359 19685 210 1 1 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.555 0.365 19685 211 1 1 . 1 1 432 432 ILE C C 432 176.100 176.100 176.027 0.073 19685 212 1 1 . 1 1 432 432 ILE CA C 432 62.500 62.500 63.987 -1.487 19685 213 1 1 . 1 1 432 432 ILE CB C 432 37.400 37.400 36.755 0.645 19685 214 1 1 . 1 1 432 432 ILE H H 432 8.840 8.840 8.529 0.311 19685 215 1 1 . 1 1 433 433 SER N N 433 113.600 113.600 115.403 -1.803 19685 216 1 1 . 1 1 433 433 SER HA H 433 4.440 4.440 4.664 -0.224 19685 217 1 1 . 1 1 433 433 SER C C 433 171.000 171.000 172.218 -1.218 19685 218 1 1 . 1 1 433 433 SER CA C 433 57.300 57.300 57.712 -0.412 19685 219 1 1 . 1 1 433 433 SER CB C 433 65.200 65.200 66.897 -1.697 19685 220 1 1 . 1 1 433 433 SER H H 433 7.280 7.280 8.006 -0.726 19685 221 1 1 . 1 1 434 434 ALA N N 434 125.700 125.700 124.698 1.002 19685 222 1 1 . 1 1 434 434 ALA HA H 434 4.910 4.910 4.865 0.045 19685 223 1 1 . 1 1 434 434 ALA C C 434 174.600 174.600 175.868 -1.268 19685 224 1 1 . 1 1 434 434 ALA CA C 434 51.000 51.000 51.234 -0.234 19685 225 1 1 . 1 1 434 434 ALA CB C 434 21.200 21.200 21.806 -0.606 19685 226 1 1 . 1 1 434 434 ALA H H 434 8.270 8.270 8.185 0.085 19685 227 1 1 . 1 1 435 435 LYS N N 435 120.900 120.900 120.310 0.590 19685 228 1 1 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.624 -0.154 19685 229 1 1 . 1 1 435 435 LYS C C 435 173.800 173.800 174.279 -0.479 19685 230 1 1 . 1 1 435 435 LYS CA C 435 53.700 53.700 54.788 -1.089 19685 231 1 1 . 1 1 435 435 LYS CB C 435 36.400 36.400 34.565 1.835 19685 232 1 1 . 1 1 435 435 LYS H H 435 8.490 8.490 7.852 0.638 19685 233 1 1 . 1 1 436 436 VAL N N 436 122.200 122.200 118.398 3.802 19685 234 1 1 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.448 -0.528 19685 235 1 1 . 1 1 436 436 VAL C C 436 175.100 175.100 174.163 0.937 19685 236 1 1 . 1 1 436 436 VAL CA C 436 63.600 63.600 61.931 1.669 19685 237 1 1 . 1 1 436 436 VAL CB C 436 33.500 33.500 31.736 1.764 19685 238 1 1 . 1 1 436 436 VAL H H 436 8.390 8.390 8.374 0.016 19685 239 1 1 . 1 1 437 437 PHE N N 437 125.900 125.900 118.771 7.129 19685 240 1 1 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.735 -0.335 19685 241 1 1 . 1 1 437 437 PHE C C 437 173.600 173.600 174.583 -0.983 19685 242 1 1 . 1 1 437 437 PHE CA C 437 57.700 57.700 56.514 1.185 19685 243 1 1 . 1 1 437 437 PHE CB C 437 39.000 39.000 42.855 -3.855 19685 244 1 1 . 1 1 437 437 PHE H H 437 8.250 8.250 7.818 0.432 19685 245 1 1 . 1 1 438 438 ILE N N 438 121.900 121.900 115.830 6.070 19685 246 1 1 . 1 1 438 438 ILE HA H 438 4.460 4.460 3.214 1.246 19685 247 1 1 . 1 1 438 438 ILE C C 438 175.700 175.700 174.158 1.542 19685 248 1 1 . 1 1 438 438 ILE CA C 438 58.300 58.300 62.334 -4.034 19685 249 1 1 . 1 1 438 438 ILE CB C 438 39.700 39.700 37.014 2.686 19685 250 1 1 . 1 1 438 438 ILE H H 438 8.520 8.520 7.111 1.409 19685 251 1 1 . 1 1 439 439 ASP N N 439 126.500 126.500 114.251 12.249 19685 252 1 1 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.597 -0.017 19685 253 1 1 . 1 1 439 439 ASP C C 439 176.300 176.300 176.110 0.190 19685 254 1 1 . 1 1 439 439 ASP CA C 439 53.600 53.600 53.930 -0.330 19685 255 1 1 . 1 1 439 439 ASP CB C 439 42.300 42.300 41.166 1.134 19685 256 1 1 . 1 1 439 439 ASP H H 439 8.730 8.730 8.005 0.725 19685 257 1 1 . 1 1 440 440 LYS N N 440 127.300 127.300 118.957 8.343 19685 258 1 1 . 1 1 440 440 LYS HA H 440 4.070 4.070 4.401 -0.331 19685 259 1 1 . 1 1 440 440 LYS C C 440 176.900 176.900 177.387 -0.487 19685 260 1 1 . 1 1 440 440 LYS CA C 440 57.800 57.800 57.180 0.620 19685 261 1 1 . 1 1 440 440 LYS CB C 440 32.100 32.100 32.977 -0.878 19685 262 1 1 . 1 1 440 440 LYS H H 440 8.930 8.930 8.190 0.740 19685 263 1 1 . 1 1 441 441 GLN N N 441 117.400 117.400 114.967 2.433 19685 264 1 1 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.524 -0.294 19685 265 1 1 . 1 1 441 441 GLN C C 441 177.200 177.200 174.861 2.339 19685 266 1 1 . 1 1 441 441 GLN CA C 441 57.600 57.600 56.159 1.441 19685 267 1 1 . 1 1 441 441 GLN CB C 441 28.800 28.800 30.134 -1.334 19685 268 1 1 . 1 1 441 441 GLN H H 441 8.650 8.650 7.846 0.804 19685 269 1 1 . 1 1 442 442 THR N N 442 107.300 107.300 114.016 -6.716 19685 270 1 1 . 1 1 442 442 THR HA H 442 4.290 4.290 4.328 -0.038 19685 271 1 1 . 1 1 442 442 THR C C 442 175.100 175.100 173.700 1.400 19685 272 1 1 . 1 1 442 442 THR CA C 442 61.200 61.200 62.183 -0.983 19685 273 1 1 . 1 1 442 442 THR CB C 442 70.300 70.300 69.421 0.879 19685 274 1 1 . 1 1 442 442 THR H H 442 7.830 7.830 7.867 -0.037 19685 275 1 1 . 1 1 443 443 ASN N N 443 117.300 117.300 119.115 -1.815 19685 276 1 1 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.840 -0.540 19685 277 1 1 . 1 1 443 443 ASN C C 443 173.400 173.400 173.438 -0.038 19685 278 1 1 . 1 1 443 443 ASN CA C 443 54.300 54.300 52.568 1.732 19685 279 1 1 . 1 1 443 443 ASN CB C 443 37.600 37.600 39.094 -1.494 19685 280 1 1 . 1 1 443 443 ASN H H 443 8.470 8.470 7.660 0.810 19685 281 1 1 . 1 1 444 444 LEU N N 444 118.000 118.000 121.454 -3.454 19685 282 1 1 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.215 0.345 19685 283 1 1 . 1 1 444 444 LEU C C 444 176.700 176.700 176.737 -0.037 19685 284 1 1 . 1 1 444 444 LEU CA C 444 53.300 53.300 55.803 -2.503 19685 285 1 1 . 1 1 444 444 LEU CB C 444 43.500 43.500 41.538 1.962 19685 286 1 1 . 1 1 444 444 LEU H H 444 7.660 7.660 7.981 -0.321 19685 287 1 1 . 1 1 445 445 SER N N 445 115.500 115.500 119.714 -4.214 19685 288 1 1 . 1 1 445 445 SER HA H 445 4.460 4.460 4.447 0.013 19685 289 1 1 . 1 1 445 445 SER C C 445 176.500 176.500 173.241 3.259 19685 290 1 1 . 1 1 445 445 SER CA C 445 57.900 57.900 57.255 0.645 19685 291 1 1 . 1 1 445 445 SER CB C 445 63.500 63.500 64.634 -1.134 19685 292 1 1 . 1 1 445 445 SER H H 445 8.840 8.840 8.233 0.607 19685 293 1 1 . 1 1 446 446 LYS N N 446 125.200 125.200 119.292 5.908 19685 294 1 1 . 1 1 446 446 LYS HA H 446 4.500 4.500 3.971 0.529 19685 295 1 1 . 1 1 446 446 LYS C C 446 176.100 176.100 176.180 -0.080 19685 296 1 1 . 1 1 446 446 LYS CA C 446 56.300 56.300 57.343 -1.043 19685 297 1 1 . 1 1 446 446 LYS CB C 446 32.200 32.200 32.181 0.019 19685 298 1 1 . 1 1 446 446 LYS H H 446 9.230 9.230 8.291 0.939 19685 299 1 1 . 1 1 447 447 CYS N N 447 113.000 113.000 116.992 -3.992 19685 300 1 1 . 1 1 447 447 CYS C C 447 172.500 172.500 173.808 -1.308 19685 301 1 1 . 1 1 447 447 CYS CA C 447 60.400 60.400 59.055 1.345 19685 302 1 1 . 1 1 447 447 CYS CB C 447 24.900 24.900 28.282 -3.382 19685 303 1 1 . 1 1 447 447 CYS H H 447 10.020 10.020 7.193 2.827 19685 304 1 1 . 1 1 448 448 PHE N N 448 115.200 115.200 117.102 -1.902 19685 305 1 1 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.531 0.809 19685 306 1 1 . 1 1 448 448 PHE C C 448 172.400 172.400 176.291 -3.891 19685 307 1 1 . 1 1 448 448 PHE CA C 448 54.700 54.700 57.023 -2.323 19685 308 1 1 . 1 1 448 448 PHE CB C 448 42.000 42.000 41.548 0.452 19685 309 1 1 . 1 1 448 448 PHE H H 448 7.810 7.810 8.178 -0.368 19685 310 1 1 . 1 1 449 449 GLY N N 449 107.700 107.700 106.959 0.741 19685 311 1 1 . 1 1 449 449 GLY C C 449 170.100 170.100 172.999 -2.899 19685 312 1 1 . 1 1 449 449 GLY CA C 449 45.200 45.200 45.456 -0.256 19685 313 1 1 . 1 1 449 449 GLY H H 449 9.310 9.310 8.452 0.858 19685 314 1 1 . 1 1 450 450 PHE N N 450 119.900 119.900 116.409 3.491 19685 315 1 1 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.367 0.063 19685 316 1 1 . 1 1 450 450 PHE C C 450 172.800 172.800 172.987 -0.187 19685 317 1 1 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.748 -1.748 19685 318 1 1 . 1 1 450 450 PHE CB C 450 43.600 43.600 41.237 2.362 19685 319 1 1 . 1 1 450 450 PHE H H 450 8.760 8.760 8.504 0.256 19685 320 1 1 . 1 1 451 451 VAL N N 451 123.800 123.800 118.341 5.459 19685 321 1 1 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.548 -0.258 19685 322 1 1 . 1 1 451 451 VAL C C 451 172.400 172.400 176.773 -4.373 19685 323 1 1 . 1 1 451 451 VAL CA C 451 59.800 59.800 61.393 -1.593 19685 324 1 1 . 1 1 451 451 VAL CB C 451 36.100 36.100 35.878 0.222 19685 325 1 1 . 1 1 451 451 VAL H H 451 7.930 7.930 8.388 -0.458 19685 326 1 1 . 1 1 452 452 SER N N 452 119.600 119.600 122.005 -2.405 19685 327 1 1 . 1 1 452 452 SER HA H 452 5.120 5.120 4.894 0.226 19685 328 1 1 . 1 1 452 452 SER C C 452 173.200 173.200 174.586 -1.386 19685 329 1 1 . 1 1 452 452 SER CA C 452 55.700 55.700 57.106 -1.406 19685 330 1 1 . 1 1 452 452 SER CB C 452 66.100 66.100 62.667 3.433 19685 331 1 1 . 1 1 452 452 SER H H 452 8.540 8.540 8.678 -0.138 19685 332 1 1 . 1 1 453 453 TYR N N 453 121.400 121.400 125.773 -4.373 19685 333 1 1 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.381 0.999 19685 334 1 1 . 1 1 453 453 TYR C C 453 173.600 173.600 176.629 -3.029 19685 335 1 1 . 1 1 453 453 TYR CA C 453 56.500 56.500 59.306 -2.806 19685 336 1 1 . 1 1 453 453 TYR CB C 453 42.200 42.200 39.046 3.154 19685 337 1 1 . 1 1 453 453 TYR H H 453 8.380 8.380 7.815 0.565 19685 338 1 1 . 1 1 454 454 ASP N N 454 113.300 113.300 125.488 -12.188 19685 339 1 1 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.343 0.147 19685 340 1 1 . 1 1 454 454 ASP C C 454 176.100 176.100 175.624 0.476 19685 341 1 1 . 1 1 454 454 ASP CA C 454 52.800 52.800 56.844 -4.044 19685 342 1 1 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.864 -1.464 19685 343 1 1 . 1 1 454 454 ASP H H 454 7.860 7.860 8.602 -0.742 19685 344 1 1 . 1 1 455 455 ASN N N 455 113.800 113.800 111.613 2.187 19685 345 1 1 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.061 -0.011 19685 346 1 1 . 1 1 455 455 ASN C C 455 173.100 173.100 173.643 -0.543 19685 347 1 1 . 1 1 455 455 ASN CA C 455 50.700 50.700 52.097 -1.397 19685 348 1 1 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.050 1.050 19685 349 1 1 . 1 1 455 455 ASN H H 455 7.200 7.200 8.303 -1.103 19685 350 1 1 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.277 -0.107 19685 351 1 1 . 1 1 456 456 PRO C C 456 177.300 177.300 177.611 -0.311 19685 352 1 1 . 1 1 456 456 PRO CA C 456 64.200 64.200 65.051 -0.851 19685 353 1 1 . 1 1 456 456 PRO CB C 456 32.300 32.300 32.166 0.134 19685 354 1 1 . 1 1 457 457 VAL N N 457 120.900 120.900 117.796 3.104 19685 355 1 1 . 1 1 457 457 VAL HA H 457 3.620 3.620 3.904 -0.284 19685 356 1 1 . 1 1 457 457 VAL C C 457 179.000 179.000 176.428 2.572 19685 357 1 1 . 1 1 457 457 VAL CA C 457 65.900 65.900 63.877 2.023 19685 358 1 1 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.845 -1.045 19685 359 1 1 . 1 1 457 457 VAL H H 457 8.120 8.120 8.240 -0.120 19685 360 1 1 . 1 1 458 458 SER N N 458 117.800 117.800 114.525 3.275 19685 361 1 1 . 1 1 458 458 SER HA H 458 3.940 3.940 4.525 -0.585 19685 362 1 1 . 1 1 458 458 SER C C 458 173.600 173.600 175.528 -1.928 19685 363 1 1 . 1 1 458 458 SER CA C 458 61.100 61.100 59.050 2.050 19685 364 1 1 . 1 1 458 458 SER CB C 458 62.400 62.400 64.133 -1.733 19685 365 1 1 . 1 1 458 458 SER H H 458 7.830 7.830 7.534 0.296 19685 366 1 1 . 1 1 459 459 ALA N N 459 120.000 120.000 126.319 -6.319 19685 367 1 1 . 1 1 459 459 ALA HA H 459 3.750 3.750 3.504 0.246 19685 368 1 1 . 1 1 459 459 ALA C C 459 178.100 178.100 177.975 0.125 19685 369 1 1 . 1 1 459 459 ALA CA C 459 54.500 54.500 54.003 0.497 19685 370 1 1 . 1 1 459 459 ALA CB C 459 17.900 17.900 17.860 0.040 19685 371 1 1 . 1 1 459 459 ALA H H 459 6.370 6.370 7.334 -0.964 19685 372 1 1 . 1 1 460 460 GLN N N 460 116.100 116.100 119.022 -2.922 19685 373 1 1 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.004 -0.174 19685 374 1 1 . 1 1 460 460 GLN C C 460 178.000 178.000 176.784 1.216 19685 375 1 1 . 1 1 460 460 GLN CA C 460 58.500 58.500 58.115 0.384 19685 376 1 1 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.574 -1.174 19685 377 1 1 . 1 1 460 460 GLN H H 460 7.710 7.710 8.128 -0.418 19685 378 1 1 . 1 1 461 461 ALA N N 461 122.800 122.800 119.218 3.582 19685 379 1 1 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.310 -0.350 19685 380 1 1 . 1 1 461 461 ALA C C 461 179.500 179.500 177.655 1.845 19685 381 1 1 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.389 2.111 19685 382 1 1 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.067 -1.567 19685 383 1 1 . 1 1 461 461 ALA H H 461 7.880 7.880 7.342 0.538 19685 384 1 1 . 1 1 462 462 ALA N N 462 121.400 121.400 120.637 0.763 19685 385 1 1 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.179 -0.779 19685 386 1 1 . 1 1 462 462 ALA C C 462 179.400 179.400 178.194 1.206 19685 387 1 1 . 1 1 462 462 ALA CA C 462 54.100 54.100 53.107 0.993 19685 388 1 1 . 1 1 462 462 ALA CB C 462 18.700 18.700 19.851 -1.151 19685 389 1 1 . 1 1 462 462 ALA H H 462 7.860 7.860 7.582 0.278 19685 390 1 1 . 1 1 463 463 ILE N N 463 118.600 118.600 117.877 0.723 19685 391 1 1 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.846 -0.606 19685 392 1 1 . 1 1 463 463 ILE C C 463 177.500 177.500 176.016 1.484 19685 393 1 1 . 1 1 463 463 ILE CA C 463 66.000 66.000 62.440 3.560 19685 394 1 1 . 1 1 463 463 ILE CB C 463 38.300 38.300 37.932 0.368 19685 395 1 1 . 1 1 463 463 ILE H H 463 8.090 8.090 7.908 0.182 19685 396 1 1 . 1 1 464 464 GLN N N 464 117.000 117.000 116.371 0.629 19685 397 1 1 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.378 -0.508 19685 398 1 1 . 1 1 464 464 GLN C C 464 177.700 177.700 175.002 2.698 19685 399 1 1 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.822 2.378 19685 400 1 1 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.664 -1.764 19685 401 1 1 . 1 1 464 464 GLN H H 464 7.780 7.780 7.872 -0.092 19685 402 1 1 . 1 1 465 465 ALA N N 465 117.200 117.200 121.108 -3.908 19685 403 1 1 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.534 -0.304 19685 404 1 1 . 1 1 465 465 ALA C C 465 179.200 179.200 176.543 2.657 19685 405 1 1 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.903 0.897 19685 406 1 1 . 1 1 465 465 ALA CB C 465 21.100 21.100 20.794 0.306 19685 407 1 1 . 1 1 465 465 ALA H H 465 7.540 7.540 7.275 0.265 19685 408 1 1 . 1 1 466 466 MET N N 466 110.800 110.800 116.582 -5.782 19685 409 1 1 . 1 1 466 466 MET HA H 466 4.820 4.820 4.611 0.209 19685 410 1 1 . 1 1 466 466 MET C C 466 177.600 177.600 174.741 2.859 19685 411 1 1 . 1 1 466 466 MET CA C 466 53.300 53.300 55.269 -1.969 19685 412 1 1 . 1 1 466 466 MET CB C 466 31.600 31.600 35.610 -4.010 19685 413 1 1 . 1 1 466 466 MET H H 466 8.230 8.230 7.620 0.610 19685 414 1 1 . 1 1 467 467 ASN N N 467 119.100 119.100 118.861 0.239 19685 415 1 1 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.588 -0.098 19685 416 1 1 . 1 1 467 467 ASN C C 467 176.300 176.300 176.454 -0.154 19685 417 1 1 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.667 1.533 19685 418 1 1 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.318 -0.118 19685 419 1 1 . 1 1 467 467 ASN H H 467 8.560 8.560 7.618 0.942 19685 420 1 1 . 1 1 468 468 GLY N N 468 117.900 117.900 112.949 4.951 19685 421 1 1 . 1 1 468 468 GLY C C 468 172.800 172.800 174.287 -1.487 19685 422 1 1 . 1 1 468 468 GLY CA C 468 45.300 45.300 45.671 -0.371 19685 423 1 1 . 1 1 468 468 GLY H H 468 8.930 8.930 8.561 0.369 19685 424 1 1 . 1 1 469 469 PHE N N 469 123.300 123.300 119.838 3.462 19685 425 1 1 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.499 -0.309 19685 426 1 1 . 1 1 469 469 PHE C C 469 174.400 174.400 175.008 -0.608 19685 427 1 1 . 1 1 469 469 PHE CA C 469 58.700 58.700 58.170 0.530 19685 428 1 1 . 1 1 469 469 PHE CB C 469 40.600 40.600 40.239 0.360 19685 429 1 1 . 1 1 469 469 PHE H H 469 7.950 7.950 7.667 0.283 19685 430 1 1 . 1 1 470 470 GLN N N 470 129.200 129.200 118.353 10.847 19685 431 1 1 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.187 0.403 19685 432 1 1 . 1 1 470 470 GLN C C 470 174.100 174.100 174.058 0.042 19685 433 1 1 . 1 1 470 470 GLN CA C 470 55.500 55.500 56.907 -1.407 19685 434 1 1 . 1 1 470 470 GLN CB C 470 28.800 28.800 28.181 0.619 19685 435 1 1 . 1 1 470 470 GLN H H 470 8.330 8.330 7.867 0.463 19685 436 1 1 . 1 1 471 471 ILE N N 471 126.300 126.300 119.299 7.001 19685 437 1 1 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.949 -0.779 19685 438 1 1 . 1 1 471 471 ILE C C 471 175.400 175.400 175.596 -0.196 19685 439 1 1 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.167 -0.567 19685 440 1 1 . 1 1 471 471 ILE CB C 471 39.100 39.100 40.655 -1.555 19685 441 1 1 . 1 1 471 471 ILE H H 471 8.440 8.440 8.641 -0.201 19685 442 1 1 . 1 1 472 472 GLY N N 472 117.500 117.500 116.926 0.574 19685 443 1 1 . 1 1 472 472 GLY C C 472 174.700 174.700 174.816 -0.116 19685 444 1 1 . 1 1 472 472 GLY CA C 472 46.500 46.500 46.688 -0.188 19685 445 1 1 . 1 1 472 472 GLY H H 472 8.980 8.980 8.646 0.334 19685 446 1 1 . 1 1 473 473 MET N N 473 124.100 124.100 121.060 3.040 19685 447 1 1 . 1 1 473 473 MET HA H 473 4.380 4.380 4.692 -0.312 19685 448 1 1 . 1 1 473 473 MET C C 473 175.700 175.700 176.008 -0.308 19685 449 1 1 . 1 1 473 473 MET CA C 473 55.000 55.000 55.481 -0.481 19685 450 1 1 . 1 1 473 473 MET CB C 473 32.900 32.900 33.183 -0.283 19685 451 1 1 . 1 1 473 473 MET H H 473 9.070 9.070 8.442 0.628 19685 452 1 1 . 1 1 474 474 LYS N N 474 118.700 118.700 119.329 -0.629 19685 453 1 1 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.826 -0.346 19685 454 1 1 . 1 1 474 474 LYS C C 474 174.300 174.300 174.383 -0.083 19685 455 1 1 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.992 -0.392 19685 456 1 1 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.542 -0.442 19685 457 1 1 . 1 1 474 474 LYS H H 474 7.770 7.770 8.072 -0.302 19685 458 1 1 . 1 1 475 475 ARG N N 475 119.600 119.600 118.619 0.981 19685 459 1 1 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.749 0.051 19685 460 1 1 . 1 1 475 475 ARG C C 475 175.700 175.700 174.094 1.606 19685 461 1 1 . 1 1 475 475 ARG CA C 475 54.000 54.000 54.746 -0.746 19685 462 1 1 . 1 1 475 475 ARG CB C 475 31.300 31.300 32.205 -0.905 19685 463 1 1 . 1 1 475 475 ARG H H 475 8.350 8.350 8.521 -0.171 19685 464 1 1 . 1 1 476 476 LEU N N 476 123.500 123.500 121.419 2.081 19685 465 1 1 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.382 0.048 19685 466 1 1 . 1 1 476 476 LEU C C 476 177.600 177.600 177.510 0.090 19685 467 1 1 . 1 1 476 476 LEU CA C 476 55.500 55.500 55.871 -0.371 19685 468 1 1 . 1 1 476 476 LEU CB C 476 42.800 42.800 42.746 0.054 19685 469 1 1 . 1 1 476 476 LEU H H 476 9.130 9.130 8.968 0.162 19685 470 1 1 . 1 1 477 477 LYS N N 477 123.200 123.200 120.142 3.058 19685 471 1 1 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.656 0.504 19685 472 1 1 . 1 1 477 477 LYS C C 477 174.100 174.100 175.384 -1.284 19685 473 1 1 . 1 1 477 477 LYS CA C 477 54.500 54.500 55.292 -0.792 19685 474 1 1 . 1 1 477 477 LYS CB C 477 34.900 34.900 32.968 1.931 19685 475 1 1 . 1 1 477 477 LYS H H 477 8.090 8.090 8.550 -0.460 19685 476 1 1 . 1 1 478 478 VAL N N 478 127.100 127.100 119.681 7.419 19685 477 1 1 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.168 0.732 19685 478 1 1 . 1 1 478 478 VAL C C 478 173.700 173.700 175.296 -1.596 19685 479 1 1 . 1 1 478 478 VAL CA C 478 61.000 61.000 62.472 -1.472 19685 480 1 1 . 1 1 478 478 VAL CB C 478 33.700 33.700 32.567 1.133 19685 481 1 1 . 1 1 478 478 VAL H H 478 8.820 8.820 7.839 0.981 19685 482 1 1 . 1 1 479 479 GLN N N 479 123.600 123.600 123.136 0.464 19685 483 1 1 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.771 0.039 19685 484 1 1 . 1 1 479 479 GLN C C 479 173.600 173.600 173.823 -0.223 19685 485 1 1 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.084 -0.884 19685 486 1 1 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.980 0.520 19685 487 1 1 . 1 1 479 479 GLN H H 479 9.130 9.130 8.406 0.724 19685 488 1 1 . 1 1 480 480 LEU N N 480 123.200 123.200 115.081 8.119 19685 489 1 1 . 1 1 480 480 LEU HA H 480 4.440 4.440 5.377 -0.937 19685 490 1 1 . 1 1 480 480 LEU C C 480 177.100 177.100 176.614 0.486 19685 491 1 1 . 1 1 480 480 LEU CA C 480 54.600 54.600 53.242 1.358 19685 492 1 1 . 1 1 480 480 LEU CB C 480 42.400 42.400 45.702 -3.302 19685 493 1 1 . 1 1 480 480 LEU H H 480 8.840 8.840 8.242 0.598 19685 494 1 1 . 1 1 481 481 LYS N N 481 124.500 124.500 122.062 2.438 19685 495 1 1 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.130 0.180 19685 496 1 1 . 1 1 481 481 LYS C C 481 175.200 175.200 175.018 0.182 19685 497 1 1 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.611 -0.911 19685 498 1 1 . 1 1 481 481 LYS CB C 481 33.100 33.100 30.674 2.426 19685 499 1 1 . 1 1 481 481 LYS H H 481 8.400 8.400 9.009 -0.609 19685 500 1 1 . 1 1 482 482 ARG N N 482 126.600 126.600 120.528 6.072 19685 501 1 1 . 1 1 482 482 ARG HA H 482 4.350 4.350 4.501 -0.151 19685 502 1 1 . 1 1 482 482 ARG C C 482 175.800 175.800 174.926 0.874 19685 503 1 1 . 1 1 482 482 ARG CA C 482 55.600 55.600 54.795 0.805 19685 504 1 1 . 1 1 482 482 ARG CB C 482 31.100 31.100 31.147 -0.047 19685 505 1 1 . 1 1 482 482 ARG H H 482 8.770 8.770 7.927 0.843 19685 506 1 1 . 1 1 483 483 SER N N 483 118.100 118.100 116.489 1.611 19685 507 1 1 . 1 1 483 483 SER HA H 483 4.400 4.400 4.216 0.184 19685 508 1 1 . 1 1 483 483 SER C C 483 174.200 174.200 174.378 -0.178 19685 509 1 1 . 1 1 483 483 SER CA C 483 58.000 58.000 58.864 -0.864 19685 510 1 1 . 1 1 483 483 SER CB C 483 63.500 63.500 62.693 0.807 19685 511 1 1 . 1 1 483 483 SER H H 483 8.610 8.610 8.539 0.071 19685 512 1 1 . 1 1 484 484 LYS N N 484 123.000 123.000 119.738 3.262 19685 513 1 1 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.334 -0.124 19685 514 1 1 . 1 1 484 484 LYS C C 484 175.900 175.900 176.730 -0.830 19685 515 1 1 . 1 1 484 484 LYS CA C 484 56.300 56.300 56.281 0.019 19685 516 1 1 . 1 1 484 484 LYS CB C 484 32.500 32.500 32.145 0.354 19685 517 1 1 . 1 1 484 484 LYS H H 484 8.560 8.560 8.118 0.442 19685 518 1 1 . 1 1 485 485 ASN N N 485 119.600 119.600 119.896 -0.296 19685 519 1 1 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.624 -0.024 19685 520 1 1 . 1 1 485 485 ASN C C 485 174.400 174.400 173.489 0.911 19685 521 1 1 . 1 1 485 485 ASN CA C 485 52.900 52.900 53.688 -0.788 19685 522 1 1 . 1 1 485 485 ASN CB C 485 38.400 38.400 39.483 -1.083 19685 523 1 1 . 1 1 485 485 ASN H H 485 8.560 8.560 7.401 1.159 19685 524 1 1 . 1 1 486 486 ASP N N 486 121.100 121.100 119.832 1.268 19685 525 1 1 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.790 -0.270 19685 526 1 1 . 1 1 486 486 ASP C C 486 175.700 175.700 175.157 0.543 19685 527 1 1 . 1 1 486 486 ASP CA C 486 54.000 54.000 53.477 0.522 19685 528 1 1 . 1 1 486 486 ASP CB C 486 40.800 40.800 42.914 -2.114 19685 529 1 1 . 1 1 486 486 ASP H H 486 8.250 8.250 8.342 -0.092 19685 530 1 1 . 1 1 487 487 SER N N 487 115.400 115.400 116.436 -1.036 19685 531 1 1 . 1 1 487 487 SER HA H 487 4.310 4.310 3.967 0.343 19685 532 1 1 . 1 1 487 487 SER C C 487 172.800 172.800 173.739 -0.939 19685 533 1 1 . 1 1 487 487 SER CA C 487 57.700 57.700 59.438 -1.738 19685 534 1 1 . 1 1 487 487 SER CB C 487 63.600 63.600 63.339 0.261 19685 535 1 1 . 1 1 487 487 SER H H 487 8.090 8.090 8.427 -0.337 19685 536 1 1 . 1 1 488 488 LYS N N 488 122.300 122.300 119.769 2.531 19685 537 1 1 . 1 1 488 488 LYS HA H 488 4.050 4.050 3.929 0.121 19685 538 1 1 . 1 1 488 488 LYS C C 488 174.500 174.500 174.054 0.446 19685 539 1 1 . 1 1 488 488 LYS CA C 488 54.000 54.000 55.866 -1.866 19685 540 1 1 . 1 1 488 488 LYS CB C 488 32.400 32.400 31.905 0.495 19685 541 1 1 . 1 1 488 488 LYS H H 488 8.090 8.090 8.414 -0.324 19685 542 1 1 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.127 0.153 19685 543 1 1 . 1 1 489 489 PRO C C 489 175.000 175.000 175.368 -0.368 19685 544 1 1 . 1 1 489 489 PRO CA C 489 63.200 63.200 62.793 0.407 19685 545 1 1 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.218 -1.118 19685 546 1 2 . 1 1 395 395 SER N N 395 115.500 115.500 116.139 -0.639 19685 547 1 2 . 1 1 395 395 SER HA H 395 4.300 4.300 4.766 -0.466 19685 548 1 2 . 1 1 395 395 SER C C 395 173.900 173.900 172.756 1.144 19685 549 1 2 . 1 1 395 395 SER CA C 395 57.900 57.900 57.419 0.481 19685 550 1 2 . 1 1 395 395 SER CB C 395 63.400 63.400 65.303 -1.903 19685 551 1 2 . 1 1 395 395 SER H H 395 8.200 8.200 8.187 0.013 19685 552 1 2 . 1 1 396 396 HIS N N 396 123.500 123.500 119.821 3.679 19685 553 1 2 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.862 -0.302 19685 554 1 2 . 1 1 396 396 HIS C C 396 174.100 174.100 174.134 -0.034 19685 555 1 2 . 1 1 396 396 HIS CA C 396 53.700 53.700 55.307 -1.607 19685 556 1 2 . 1 1 396 396 HIS CB C 396 32.200 32.200 32.458 -0.258 19685 557 1 2 . 1 1 396 396 HIS H H 396 8.120 8.120 8.542 -0.422 19685 558 1 2 . 1 1 397 397 MET N N 397 121.200 121.200 119.866 1.334 19685 559 1 2 . 1 1 397 397 MET HA H 397 4.320 4.320 4.593 -0.273 19685 560 1 2 . 1 1 397 397 MET C C 397 175.400 175.400 175.356 0.044 19685 561 1 2 . 1 1 397 397 MET CA C 397 55.000 55.000 55.559 -0.559 19685 562 1 2 . 1 1 397 397 MET CB C 397 32.500 32.500 33.432 -0.932 19685 563 1 2 . 1 1 397 397 MET H H 397 8.300 8.300 8.450 -0.150 19685 564 1 2 . 1 1 398 398 GLN N N 398 122.100 122.100 117.291 4.809 19685 565 1 2 . 1 1 398 398 GLN HA H 398 4.190 4.190 3.967 0.223 19685 566 1 2 . 1 1 398 398 GLN C C 398 174.800 174.800 175.129 -0.329 19685 567 1 2 . 1 1 398 398 GLN CA C 398 55.200 55.200 56.713 -1.513 19685 568 1 2 . 1 1 398 398 GLN CB C 398 28.900 28.900 27.105 1.795 19685 569 1 2 . 1 1 398 398 GLN H H 398 8.540 8.540 8.359 0.181 19685 570 1 2 . 1 1 399 399 LYS N N 399 123.000 123.000 118.892 4.108 19685 571 1 2 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.145 0.075 19685 572 1 2 . 1 1 399 399 LYS C C 399 174.800 174.800 176.509 -1.709 19685 573 1 2 . 1 1 399 399 LYS CA C 399 55.600 55.600 57.534 -1.934 19685 574 1 2 . 1 1 399 399 LYS CB C 399 33.000 33.000 32.520 0.479 19685 575 1 2 . 1 1 399 399 LYS H H 399 8.180 8.180 8.295 -0.115 19685 576 1 2 . 1 1 400 400 GLU N N 400 122.000 122.000 117.361 4.639 19685 577 1 2 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.478 -0.048 19685 578 1 2 . 1 1 400 400 GLU C C 400 176.400 176.400 176.040 0.360 19685 579 1 2 . 1 1 400 400 GLU CA C 400 55.400 55.400 55.258 0.142 19685 580 1 2 . 1 1 400 400 GLU CB C 400 31.400 31.400 29.151 2.249 19685 581 1 2 . 1 1 400 400 GLU H H 400 8.350 8.350 7.880 0.470 19685 582 1 2 . 1 1 401 401 GLY N N 401 109.500 109.500 109.619 -0.119 19685 583 1 2 . 1 1 401 401 GLY C C 401 171.500 171.500 172.662 -1.162 19685 584 1 2 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.460 -0.760 19685 585 1 2 . 1 1 401 401 GLY H H 401 9.050 9.050 7.555 1.495 19685 586 1 2 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.491 -0.071 19685 587 1 2 . 1 1 402 402 PRO C C 402 173.900 173.900 176.053 -2.153 19685 588 1 2 . 1 1 402 402 PRO CA C 402 61.900 61.900 64.032 -2.132 19685 589 1 2 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.050 0.150 19685 590 1 2 . 1 1 403 403 GLU N N 403 119.600 119.600 118.625 0.975 19685 591 1 2 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.387 -0.427 19685 592 1 2 . 1 1 403 403 GLU C C 403 177.300 177.300 175.955 1.345 19685 593 1 2 . 1 1 403 403 GLU CA C 403 58.100 58.100 56.740 1.360 19685 594 1 2 . 1 1 403 403 GLU CB C 403 29.000 29.000 31.095 -2.095 19685 595 1 2 . 1 1 403 403 GLU H H 403 8.420 8.420 7.927 0.493 19685 596 1 2 . 1 1 404 404 GLY N N 404 112.800 112.800 106.964 5.836 19685 597 1 2 . 1 1 404 404 GLY C C 404 173.300 173.300 174.284 -0.984 19685 598 1 2 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.225 -0.325 19685 599 1 2 . 1 1 404 404 GLY H H 404 8.500 8.500 8.367 0.133 19685 600 1 2 . 1 1 405 405 ALA N N 405 120.000 120.000 123.507 -3.507 19685 601 1 2 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.259 0.291 19685 602 1 2 . 1 1 405 405 ALA C C 405 174.100 174.100 175.985 -1.885 19685 603 1 2 . 1 1 405 405 ALA CA C 405 50.500 50.500 52.045 -1.545 19685 604 1 2 . 1 1 405 405 ALA CB C 405 20.800 20.800 16.900 3.900 19685 605 1 2 . 1 1 405 405 ALA H H 405 8.360 8.360 8.250 0.110 19685 606 1 2 . 1 1 406 406 ASN N N 406 115.500 115.500 117.236 -1.736 19685 607 1 2 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.041 0.149 19685 608 1 2 . 1 1 406 406 ASN C C 406 172.900 172.900 174.381 -1.481 19685 609 1 2 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.463 1.137 19685 610 1 2 . 1 1 406 406 ASN CB C 406 40.900 40.900 38.909 1.991 19685 611 1 2 . 1 1 406 406 ASN H H 406 7.690 7.690 8.210 -0.520 19685 612 1 2 . 1 1 407 407 LEU N N 407 123.400 123.400 120.562 2.838 19685 613 1 2 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.096 0.864 19685 614 1 2 . 1 1 407 407 LEU C C 407 174.900 174.900 176.462 -1.562 19685 615 1 2 . 1 1 407 407 LEU CA C 407 53.100 53.100 56.473 -3.373 19685 616 1 2 . 1 1 407 407 LEU CB C 407 45.400 45.400 40.945 4.455 19685 617 1 2 . 1 1 407 407 LEU H H 407 9.290 9.290 7.930 1.360 19685 618 1 2 . 1 1 408 408 PHE N N 408 118.700 118.700 122.913 -4.213 19685 619 1 2 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.871 0.429 19685 620 1 2 . 1 1 408 408 PHE C C 408 174.200 174.200 176.027 -1.827 19685 621 1 2 . 1 1 408 408 PHE CA C 408 56.300 56.300 56.917 -0.617 19685 622 1 2 . 1 1 408 408 PHE CB C 408 42.700 42.700 37.773 4.927 19685 623 1 2 . 1 1 408 408 PHE H H 408 9.150 9.150 8.094 1.056 19685 624 1 2 . 1 1 409 409 ILE N N 409 120.800 120.800 123.136 -2.336 19685 625 1 2 . 1 1 409 409 ILE HA H 409 4.970 4.970 3.962 1.008 19685 626 1 2 . 1 1 409 409 ILE C C 409 173.900 173.900 174.809 -0.909 19685 627 1 2 . 1 1 409 409 ILE CA C 409 59.000 59.000 62.667 -3.667 19685 628 1 2 . 1 1 409 409 ILE CB C 409 40.400 40.400 36.981 3.419 19685 629 1 2 . 1 1 409 409 ILE H H 409 8.380 8.380 7.534 0.846 19685 630 1 2 . 1 1 410 410 TYR N N 410 123.200 123.200 125.235 -2.035 19685 631 1 2 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.766 0.174 19685 632 1 2 . 1 1 410 410 TYR C C 410 174.300 174.300 174.595 -0.295 19685 633 1 2 . 1 1 410 410 TYR CA C 410 56.200 56.200 55.986 0.214 19685 634 1 2 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.263 1.537 19685 635 1 2 . 1 1 410 410 TYR H H 410 9.440 9.440 8.076 1.364 19685 636 1 2 . 1 1 411 411 HIS N N 411 112.100 112.100 114.937 -2.837 19685 637 1 2 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.106 0.344 19685 638 1 2 . 1 1 411 411 HIS C C 411 173.300 173.300 174.124 -0.824 19685 639 1 2 . 1 1 411 411 HIS CA C 411 55.900 55.900 56.152 -0.252 19685 640 1 2 . 1 1 411 411 HIS CB C 411 26.200 26.200 28.232 -2.032 19685 641 1 2 . 1 1 411 411 HIS H H 411 8.580 8.580 8.350 0.230 19685 642 1 2 . 1 1 412 412 LEU N N 412 115.100 115.100 121.388 -6.288 19685 643 1 2 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.216 -0.256 19685 644 1 2 . 1 1 412 412 LEU C C 412 175.100 175.100 174.770 0.330 19685 645 1 2 . 1 1 412 412 LEU CA C 412 52.400 52.400 54.775 -2.375 19685 646 1 2 . 1 1 412 412 LEU CB C 412 42.000 42.000 42.600 -0.600 19685 647 1 2 . 1 1 412 412 LEU H H 412 7.560 7.560 7.941 -0.381 19685 648 1 2 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.327 -0.057 19685 649 1 2 . 1 1 413 413 PRO C C 413 177.600 177.600 176.768 0.832 19685 650 1 2 . 1 1 413 413 PRO CA C 413 62.300 62.300 63.447 -1.147 19685 651 1 2 . 1 1 413 413 PRO CB C 413 32.200 32.200 31.998 0.202 19685 652 1 2 . 1 1 414 414 GLN N N 414 125.500 125.500 117.546 7.954 19685 653 1 2 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.270 -0.190 19685 654 1 2 . 1 1 414 414 GLN C C 414 175.400 175.400 175.672 -0.272 19685 655 1 2 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.388 -0.388 19685 656 1 2 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.802 -0.302 19685 657 1 2 . 1 1 414 414 GLN H H 414 9.170 9.170 8.479 0.691 19685 658 1 2 . 1 1 415 415 GLU N N 415 115.300 115.300 118.394 -3.094 19685 659 1 2 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.555 -0.295 19685 660 1 2 . 1 1 415 415 GLU C C 415 176.700 176.700 175.489 1.211 19685 661 1 2 . 1 1 415 415 GLU CA C 415 58.700 58.700 55.925 2.775 19685 662 1 2 . 1 1 415 415 GLU CB C 415 28.300 28.300 30.482 -2.182 19685 663 1 2 . 1 1 415 415 GLU H H 415 9.390 9.390 8.371 1.019 19685 664 1 2 . 1 1 416 416 PHE N N 416 121.700 121.700 118.282 3.418 19685 665 1 2 . 1 1 416 416 PHE HA H 416 4.610 4.610 4.913 -0.303 19685 666 1 2 . 1 1 416 416 PHE C C 416 176.400 176.400 175.550 0.850 19685 667 1 2 . 1 1 416 416 PHE CA C 416 57.400 57.400 55.972 1.428 19685 668 1 2 . 1 1 416 416 PHE CB C 416 38.700 38.700 41.299 -2.599 19685 669 1 2 . 1 1 416 416 PHE H H 416 7.610 7.610 7.370 0.240 19685 670 1 2 . 1 1 417 417 GLY N N 417 113.000 113.000 107.145 5.855 19685 671 1 2 . 1 1 417 417 GLY C C 417 174.300 174.300 172.745 1.555 19685 672 1 2 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.088 -3.188 19685 673 1 2 . 1 1 417 417 GLY H H 417 9.740 9.740 9.187 0.553 19685 674 1 2 . 1 1 418 418 ASP N N 418 121.500 121.500 118.375 3.125 19685 675 1 2 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.677 -0.737 19685 676 1 2 . 1 1 418 418 ASP C C 418 177.900 177.900 176.490 1.410 19685 677 1 2 . 1 1 418 418 ASP CA C 418 57.600 57.600 55.192 2.408 19685 678 1 2 . 1 1 418 418 ASP CB C 418 39.700 39.700 42.676 -2.977 19685 679 1 2 . 1 1 418 418 ASP H H 418 8.680 8.680 8.525 0.155 19685 680 1 2 . 1 1 419 419 GLN N N 419 116.400 116.400 119.353 -2.953 19685 681 1 2 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.342 -0.432 19685 682 1 2 . 1 1 419 419 GLN C C 419 177.600 177.600 175.566 2.034 19685 683 1 2 . 1 1 419 419 GLN CA C 419 58.000 58.000 57.681 0.319 19685 684 1 2 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.240 -0.840 19685 685 1 2 . 1 1 419 419 GLN H H 419 8.780 8.780 8.377 0.403 19685 686 1 2 . 1 1 420 420 ASP N N 420 117.500 117.500 117.251 0.249 19685 687 1 2 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.582 -0.572 19685 688 1 2 . 1 1 420 420 ASP C C 420 178.000 178.000 177.713 0.287 19685 689 1 2 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.912 2.788 19685 690 1 2 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.573 -0.773 19685 691 1 2 . 1 1 420 420 ASP H H 420 7.210 7.210 8.398 -1.188 19685 692 1 2 . 1 1 421 421 ILE N N 421 117.000 117.000 121.146 -4.146 19685 693 1 2 . 1 1 421 421 ILE HA H 421 4.080 4.080 3.941 0.139 19685 694 1 2 . 1 1 421 421 ILE C C 421 176.500 176.500 176.796 -0.296 19685 695 1 2 . 1 1 421 421 ILE CA C 421 64.000 64.000 64.200 -0.200 19685 696 1 2 . 1 1 421 421 ILE CB C 421 37.300 37.300 37.838 -0.538 19685 697 1 2 . 1 1 421 421 ILE H H 421 7.610 7.610 7.816 -0.206 19685 698 1 2 . 1 1 422 422 LEU N N 422 123.200 123.200 115.505 7.695 19685 699 1 2 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.163 -0.403 19685 700 1 2 . 1 1 422 422 LEU C C 422 177.800 177.800 176.881 0.919 19685 701 1 2 . 1 1 422 422 LEU CA C 422 58.600 58.600 56.216 2.384 19685 702 1 2 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.459 -0.259 19685 703 1 2 . 1 1 422 422 LEU H H 422 7.870 7.870 7.816 0.054 19685 704 1 2 . 1 1 423 423 GLN N N 423 115.600 115.600 115.677 -0.077 19685 705 1 2 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.388 -0.508 19685 706 1 2 . 1 1 423 423 GLN C C 423 177.800 177.800 175.582 2.218 19685 707 1 2 . 1 1 423 423 GLN CA C 423 58.600 58.600 55.951 2.649 19685 708 1 2 . 1 1 423 423 GLN CB C 423 27.900 27.900 30.019 -2.119 19685 709 1 2 . 1 1 423 423 GLN H H 423 7.860 7.860 7.806 0.054 19685 710 1 2 . 1 1 424 424 MET N N 424 115.500 115.500 118.679 -3.179 19685 711 1 2 . 1 1 424 424 MET HA H 424 3.910 3.910 4.352 -0.442 19685 712 1 2 . 1 1 424 424 MET C C 424 175.500 175.500 175.220 0.280 19685 713 1 2 . 1 1 424 424 MET CA C 424 57.800 57.800 55.927 1.873 19685 714 1 2 . 1 1 424 424 MET CB C 424 34.300 34.300 34.671 -0.371 19685 715 1 2 . 1 1 424 424 MET H H 424 7.560 7.560 7.816 -0.256 19685 716 1 2 . 1 1 425 425 PHE N N 425 112.300 112.300 117.252 -4.952 19685 717 1 2 . 1 1 425 425 PHE HA H 425 4.700 4.700 4.807 -0.107 19685 718 1 2 . 1 1 425 425 PHE C C 425 177.300 177.300 177.413 -0.113 19685 719 1 2 . 1 1 425 425 PHE CA C 425 59.900 59.900 57.561 2.339 19685 720 1 2 . 1 1 425 425 PHE CB C 425 38.500 38.500 39.828 -1.328 19685 721 1 2 . 1 1 425 425 PHE H H 425 7.680 7.680 8.344 -0.664 19685 722 1 2 . 1 1 426 426 MET N N 426 127.400 127.400 119.820 7.580 19685 723 1 2 . 1 1 426 426 MET HA H 426 4.630 4.630 4.565 0.065 19685 724 1 2 . 1 1 426 426 MET C C 426 173.800 173.800 175.533 -1.733 19685 725 1 2 . 1 1 426 426 MET CA C 426 59.100 59.100 58.293 0.807 19685 726 1 2 . 1 1 426 426 MET CB C 426 31.800 31.800 30.452 1.348 19685 727 1 2 . 1 1 426 426 MET H H 426 8.540 8.540 8.359 0.181 19685 728 1 2 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.195 -0.185 19685 729 1 2 . 1 1 427 427 PRO C C 427 176.800 176.800 176.009 0.791 19685 730 1 2 . 1 1 427 427 PRO CA C 427 65.200 65.200 63.939 1.261 19685 731 1 2 . 1 1 427 427 PRO CB C 427 30.600 30.600 31.049 -0.449 19685 732 1 2 . 1 1 428 428 PHE N N 428 110.000 110.000 119.407 -9.407 19685 733 1 2 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.643 -0.373 19685 734 1 2 . 1 1 428 428 PHE C C 428 174.600 174.600 176.324 -1.724 19685 735 1 2 . 1 1 428 428 PHE CA C 428 57.700 57.700 58.178 -0.478 19685 736 1 2 . 1 1 428 428 PHE CB C 428 38.000 38.000 39.458 -1.458 19685 737 1 2 . 1 1 428 428 PHE H H 428 6.560 6.560 7.263 -0.703 19685 738 1 2 . 1 1 429 429 GLY N N 429 105.500 105.500 106.430 -0.930 19685 739 1 2 . 1 1 429 429 GLY C C 429 170.100 170.100 172.311 -2.211 19685 740 1 2 . 1 1 429 429 GLY CA C 429 44.400 44.400 42.919 1.481 19685 741 1 2 . 1 1 429 429 GLY H H 429 7.650 7.650 7.754 -0.104 19685 742 1 2 . 1 1 430 430 ASN N N 430 117.400 117.400 116.909 0.491 19685 743 1 2 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.474 0.156 19685 744 1 2 . 1 1 430 430 ASN C C 430 173.200 173.200 176.871 -3.671 19685 745 1 2 . 1 1 430 430 ASN CA C 430 52.600 52.600 53.039 -0.439 19685 746 1 2 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.388 -2.188 19685 747 1 2 . 1 1 430 430 ASN H H 430 9.020 9.020 8.235 0.785 19685 748 1 2 . 1 1 431 431 VAL N N 431 128.000 128.000 122.955 5.045 19685 749 1 2 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.080 -0.330 19685 750 1 2 . 1 1 431 431 VAL C C 431 176.400 176.400 177.592 -1.192 19685 751 1 2 . 1 1 431 431 VAL CA C 431 61.800 61.800 64.601 -2.801 19685 752 1 2 . 1 1 431 431 VAL CB C 431 31.900 31.900 32.236 -0.336 19685 753 1 2 . 1 1 431 431 VAL H H 431 8.480 8.480 8.344 0.136 19685 754 1 2 . 1 1 432 432 ILE N N 432 128.000 128.000 116.405 11.595 19685 755 1 2 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.615 0.305 19685 756 1 2 . 1 1 432 432 ILE C C 432 176.100 176.100 176.103 -0.003 19685 757 1 2 . 1 1 432 432 ILE CA C 432 62.500 62.500 63.534 -1.034 19685 758 1 2 . 1 1 432 432 ILE CB C 432 37.400 37.400 37.212 0.188 19685 759 1 2 . 1 1 432 432 ILE H H 432 8.840 8.840 8.213 0.627 19685 760 1 2 . 1 1 433 433 SER N N 433 113.600 113.600 113.679 -0.079 19685 761 1 2 . 1 1 433 433 SER HA H 433 4.440 4.440 4.625 -0.185 19685 762 1 2 . 1 1 433 433 SER C C 433 171.000 171.000 172.242 -1.242 19685 763 1 2 . 1 1 433 433 SER CA C 433 57.300 57.300 57.832 -0.532 19685 764 1 2 . 1 1 433 433 SER CB C 433 65.200 65.200 66.245 -1.045 19685 765 1 2 . 1 1 433 433 SER H H 433 7.280 7.280 8.059 -0.779 19685 766 1 2 . 1 1 434 434 ALA N N 434 125.700 125.700 123.937 1.763 19685 767 1 2 . 1 1 434 434 ALA HA H 434 4.910 4.910 5.001 -0.091 19685 768 1 2 . 1 1 434 434 ALA C C 434 174.600 174.600 175.682 -1.082 19685 769 1 2 . 1 1 434 434 ALA CA C 434 51.000 51.000 50.345 0.655 19685 770 1 2 . 1 1 434 434 ALA CB C 434 21.200 21.200 22.715 -1.515 19685 771 1 2 . 1 1 434 434 ALA H H 434 8.270 8.270 8.278 -0.008 19685 772 1 2 . 1 1 435 435 LYS N N 435 120.900 120.900 121.623 -0.723 19685 773 1 2 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.511 -0.041 19685 774 1 2 . 1 1 435 435 LYS C C 435 173.800 173.800 174.209 -0.409 19685 775 1 2 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.391 -1.691 19685 776 1 2 . 1 1 435 435 LYS CB C 435 36.400 36.400 35.292 1.108 19685 777 1 2 . 1 1 435 435 LYS H H 435 8.490 8.490 8.161 0.329 19685 778 1 2 . 1 1 436 436 VAL N N 436 122.200 122.200 123.586 -1.386 19685 779 1 2 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.254 -0.334 19685 780 1 2 . 1 1 436 436 VAL C C 436 175.100 175.100 174.227 0.873 19685 781 1 2 . 1 1 436 436 VAL CA C 436 63.600 63.600 62.149 1.451 19685 782 1 2 . 1 1 436 436 VAL CB C 436 33.500 33.500 32.070 1.430 19685 783 1 2 . 1 1 436 436 VAL H H 436 8.390 8.390 8.583 -0.193 19685 784 1 2 . 1 1 437 437 PHE N N 437 125.900 125.900 121.636 4.264 19685 785 1 2 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.832 -0.432 19685 786 1 2 . 1 1 437 437 PHE C C 437 173.600 173.600 174.427 -0.827 19685 787 1 2 . 1 1 437 437 PHE CA C 437 57.700 57.700 56.495 1.205 19685 788 1 2 . 1 1 437 437 PHE CB C 437 39.000 39.000 42.905 -3.905 19685 789 1 2 . 1 1 437 437 PHE H H 437 8.250 8.250 7.661 0.589 19685 790 1 2 . 1 1 438 438 ILE N N 438 121.900 121.900 117.846 4.054 19685 791 1 2 . 1 1 438 438 ILE HA H 438 4.460 4.460 3.059 1.401 19685 792 1 2 . 1 1 438 438 ILE C C 438 175.700 175.700 174.117 1.583 19685 793 1 2 . 1 1 438 438 ILE CA C 438 58.300 58.300 62.520 -4.220 19685 794 1 2 . 1 1 438 438 ILE CB C 438 39.700 39.700 37.627 2.073 19685 795 1 2 . 1 1 438 438 ILE H H 438 8.520 8.520 6.989 1.531 19685 796 1 2 . 1 1 439 439 ASP N N 439 126.500 126.500 115.153 11.347 19685 797 1 2 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.723 -0.143 19685 798 1 2 . 1 1 439 439 ASP C C 439 176.300 176.300 176.703 -0.403 19685 799 1 2 . 1 1 439 439 ASP CA C 439 53.600 53.600 54.235 -0.635 19685 800 1 2 . 1 1 439 439 ASP CB C 439 42.300 42.300 40.568 1.732 19685 801 1 2 . 1 1 439 439 ASP H H 439 8.730 8.730 8.252 0.478 19685 802 1 2 . 1 1 440 440 LYS N N 440 127.300 127.300 118.291 9.009 19685 803 1 2 . 1 1 440 440 LYS HA H 440 4.070 4.070 4.279 -0.209 19685 804 1 2 . 1 1 440 440 LYS C C 440 176.900 176.900 176.945 -0.045 19685 805 1 2 . 1 1 440 440 LYS CA C 440 57.800 57.800 57.221 0.579 19685 806 1 2 . 1 1 440 440 LYS CB C 440 32.100 32.100 32.501 -0.401 19685 807 1 2 . 1 1 440 440 LYS H H 440 8.930 8.930 8.432 0.498 19685 808 1 2 . 1 1 441 441 GLN N N 441 117.400 117.400 115.105 2.295 19685 809 1 2 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.489 -0.259 19685 810 1 2 . 1 1 441 441 GLN C C 441 177.200 177.200 174.867 2.333 19685 811 1 2 . 1 1 441 441 GLN CA C 441 57.600 57.600 56.139 1.462 19685 812 1 2 . 1 1 441 441 GLN CB C 441 28.800 28.800 29.898 -1.099 19685 813 1 2 . 1 1 441 441 GLN H H 441 8.650 8.650 7.885 0.765 19685 814 1 2 . 1 1 442 442 THR N N 442 107.300 107.300 113.813 -6.513 19685 815 1 2 . 1 1 442 442 THR HA H 442 4.290 4.290 4.357 -0.067 19685 816 1 2 . 1 1 442 442 THR C C 442 175.100 175.100 174.462 0.638 19685 817 1 2 . 1 1 442 442 THR CA C 442 61.200 61.200 62.641 -1.441 19685 818 1 2 . 1 1 442 442 THR CB C 442 70.300 70.300 69.367 0.933 19685 819 1 2 . 1 1 442 442 THR H H 442 7.830 7.830 7.961 -0.131 19685 820 1 2 . 1 1 443 443 ASN N N 443 117.300 117.300 117.673 -0.373 19685 821 1 2 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.724 -0.424 19685 822 1 2 . 1 1 443 443 ASN C C 443 173.400 173.400 175.218 -1.818 19685 823 1 2 . 1 1 443 443 ASN CA C 443 54.300 54.300 53.143 1.157 19685 824 1 2 . 1 1 443 443 ASN CB C 443 37.600 37.600 40.653 -3.053 19685 825 1 2 . 1 1 443 443 ASN H H 443 8.470 8.470 7.575 0.895 19685 826 1 2 . 1 1 444 444 LEU N N 444 118.000 118.000 118.823 -0.823 19685 827 1 2 . 1 1 444 444 LEU HA H 444 4.560 4.560 3.951 0.609 19685 828 1 2 . 1 1 444 444 LEU C C 444 176.700 176.700 176.250 0.450 19685 829 1 2 . 1 1 444 444 LEU CA C 444 53.300 53.300 55.923 -2.623 19685 830 1 2 . 1 1 444 444 LEU CB C 444 43.500 43.500 41.304 2.196 19685 831 1 2 . 1 1 444 444 LEU H H 444 7.660 7.660 7.912 -0.252 19685 832 1 2 . 1 1 445 445 SER N N 445 115.500 115.500 114.617 0.883 19685 833 1 2 . 1 1 445 445 SER HA H 445 4.460 4.460 4.037 0.423 19685 834 1 2 . 1 1 445 445 SER C C 445 176.500 176.500 175.037 1.463 19685 835 1 2 . 1 1 445 445 SER CA C 445 57.900 57.900 58.315 -0.415 19685 836 1 2 . 1 1 445 445 SER CB C 445 63.500 63.500 63.376 0.124 19685 837 1 2 . 1 1 445 445 SER H H 445 8.840 8.840 8.509 0.331 19685 838 1 2 . 1 1 446 446 LYS N N 446 125.200 125.200 118.092 7.108 19685 839 1 2 . 1 1 446 446 LYS HA H 446 4.500 4.500 3.719 0.781 19685 840 1 2 . 1 1 446 446 LYS C C 446 176.100 176.100 174.131 1.969 19685 841 1 2 . 1 1 446 446 LYS CA C 446 56.300 56.300 57.498 -1.198 19685 842 1 2 . 1 1 446 446 LYS CB C 446 32.200 32.200 31.117 1.083 19685 843 1 2 . 1 1 446 446 LYS H H 446 9.230 9.230 8.684 0.546 19685 844 1 2 . 1 1 447 447 CYS N N 447 113.000 113.000 116.601 -3.601 19685 845 1 2 . 1 1 447 447 CYS C C 447 172.500 172.500 172.562 -0.062 19685 846 1 2 . 1 1 447 447 CYS CA C 447 60.400 60.400 57.597 2.803 19685 847 1 2 . 1 1 447 447 CYS CB C 447 24.900 24.900 30.883 -5.983 19685 848 1 2 . 1 1 447 447 CYS H H 447 10.020 10.020 7.159 2.861 19685 849 1 2 . 1 1 448 448 PHE N N 448 115.200 115.200 118.350 -3.150 19685 850 1 2 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.641 0.699 19685 851 1 2 . 1 1 448 448 PHE C C 448 172.400 172.400 175.218 -2.818 19685 852 1 2 . 1 1 448 448 PHE CA C 448 54.700 54.700 57.008 -2.308 19685 853 1 2 . 1 1 448 448 PHE CB C 448 42.000 42.000 41.998 0.002 19685 854 1 2 . 1 1 448 448 PHE H H 448 7.810 7.810 8.011 -0.201 19685 855 1 2 . 1 1 449 449 GLY N N 449 107.700 107.700 106.772 0.928 19685 856 1 2 . 1 1 449 449 GLY C C 449 170.100 170.100 172.681 -2.581 19685 857 1 2 . 1 1 449 449 GLY CA C 449 45.200 45.200 44.700 0.500 19685 858 1 2 . 1 1 449 449 GLY H H 449 9.310 9.310 8.343 0.967 19685 859 1 2 . 1 1 450 450 PHE N N 450 119.900 119.900 114.527 5.373 19685 860 1 2 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.228 0.202 19685 861 1 2 . 1 1 450 450 PHE C C 450 172.800 172.800 173.066 -0.266 19685 862 1 2 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.458 -1.458 19685 863 1 2 . 1 1 450 450 PHE CB C 450 43.600 43.600 41.048 2.552 19685 864 1 2 . 1 1 450 450 PHE H H 450 8.760 8.760 8.420 0.340 19685 865 1 2 . 1 1 451 451 VAL N N 451 123.800 123.800 117.666 6.134 19685 866 1 2 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.644 -0.354 19685 867 1 2 . 1 1 451 451 VAL C C 451 172.400 172.400 175.774 -3.374 19685 868 1 2 . 1 1 451 451 VAL CA C 451 59.800 59.800 60.798 -0.998 19685 869 1 2 . 1 1 451 451 VAL CB C 451 36.100 36.100 35.956 0.144 19685 870 1 2 . 1 1 451 451 VAL H H 451 7.930 7.930 8.272 -0.342 19685 871 1 2 . 1 1 452 452 SER N N 452 119.600 119.600 120.527 -0.927 19685 872 1 2 . 1 1 452 452 SER HA H 452 5.120 5.120 4.874 0.246 19685 873 1 2 . 1 1 452 452 SER C C 452 173.200 173.200 174.060 -0.860 19685 874 1 2 . 1 1 452 452 SER CA C 452 55.700 55.700 56.468 -0.768 19685 875 1 2 . 1 1 452 452 SER CB C 452 66.100 66.100 62.092 4.008 19685 876 1 2 . 1 1 452 452 SER H H 452 8.540 8.540 8.455 0.085 19685 877 1 2 . 1 1 453 453 TYR N N 453 121.400 121.400 122.946 -1.546 19685 878 1 2 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.675 0.705 19685 879 1 2 . 1 1 453 453 TYR C C 453 173.600 173.600 177.321 -3.721 19685 880 1 2 . 1 1 453 453 TYR CA C 453 56.500 56.500 59.342 -2.842 19685 881 1 2 . 1 1 453 453 TYR CB C 453 42.200 42.200 38.429 3.771 19685 882 1 2 . 1 1 453 453 TYR H H 453 8.380 8.380 7.677 0.703 19685 883 1 2 . 1 1 454 454 ASP N N 454 113.300 113.300 123.277 -9.977 19685 884 1 2 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.370 0.120 19685 885 1 2 . 1 1 454 454 ASP C C 454 176.100 176.100 175.248 0.852 19685 886 1 2 . 1 1 454 454 ASP CA C 454 52.800 52.800 56.018 -3.218 19685 887 1 2 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.528 -1.128 19685 888 1 2 . 1 1 454 454 ASP H H 454 7.860 7.860 8.393 -0.533 19685 889 1 2 . 1 1 455 455 ASN N N 455 113.800 113.800 112.645 1.155 19685 890 1 2 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.055 -0.005 19685 891 1 2 . 1 1 455 455 ASN C C 455 173.100 173.100 173.947 -0.847 19685 892 1 2 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.498 -0.798 19685 893 1 2 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.110 0.990 19685 894 1 2 . 1 1 455 455 ASN H H 455 7.200 7.200 7.875 -0.675 19685 895 1 2 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.594 -0.424 19685 896 1 2 . 1 1 456 456 PRO C C 456 177.300 177.300 177.271 0.029 19685 897 1 2 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.825 -0.625 19685 898 1 2 . 1 1 456 456 PRO CB C 456 32.300 32.300 31.952 0.348 19685 899 1 2 . 1 1 457 457 VAL N N 457 120.900 120.900 110.825 10.075 19685 900 1 2 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.358 -0.738 19685 901 1 2 . 1 1 457 457 VAL C C 457 179.000 179.000 176.108 2.892 19685 902 1 2 . 1 1 457 457 VAL CA C 457 65.900 65.900 62.975 2.925 19685 903 1 2 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.386 -0.586 19685 904 1 2 . 1 1 457 457 VAL H H 457 8.120 8.120 7.953 0.167 19685 905 1 2 . 1 1 458 458 SER N N 458 117.800 117.800 117.612 0.188 19685 906 1 2 . 1 1 458 458 SER HA H 458 3.940 3.940 4.523 -0.583 19685 907 1 2 . 1 1 458 458 SER C C 458 173.600 173.600 175.959 -2.359 19685 908 1 2 . 1 1 458 458 SER CA C 458 61.100 61.100 60.541 0.559 19685 909 1 2 . 1 1 458 458 SER CB C 458 62.400 62.400 63.791 -1.391 19685 910 1 2 . 1 1 458 458 SER H H 458 7.830 7.830 7.761 0.069 19685 911 1 2 . 1 1 459 459 ALA N N 459 120.000 120.000 124.611 -4.611 19685 912 1 2 . 1 1 459 459 ALA HA H 459 3.750 3.750 4.412 -0.662 19685 913 1 2 . 1 1 459 459 ALA C C 459 178.100 178.100 178.142 -0.042 19685 914 1 2 . 1 1 459 459 ALA CA C 459 54.500 54.500 53.869 0.631 19685 915 1 2 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.529 -0.629 19685 916 1 2 . 1 1 459 459 ALA H H 459 6.370 6.370 8.151 -1.781 19685 917 1 2 . 1 1 460 460 GLN N N 460 116.100 116.100 118.361 -2.261 19685 918 1 2 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.080 -0.250 19685 919 1 2 . 1 1 460 460 GLN C C 460 178.000 178.000 176.367 1.633 19685 920 1 2 . 1 1 460 460 GLN CA C 460 58.500 58.500 57.882 0.618 19685 921 1 2 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.142 -0.742 19685 922 1 2 . 1 1 460 460 GLN H H 460 7.710 7.710 8.717 -1.007 19685 923 1 2 . 1 1 461 461 ALA N N 461 122.800 122.800 119.892 2.908 19685 924 1 2 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.251 -0.291 19685 925 1 2 . 1 1 461 461 ALA C C 461 179.500 179.500 176.792 2.708 19685 926 1 2 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.141 2.359 19685 927 1 2 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.379 -1.879 19685 928 1 2 . 1 1 461 461 ALA H H 461 7.880 7.880 7.564 0.316 19685 929 1 2 . 1 1 462 462 ALA N N 462 121.400 121.400 119.497 1.903 19685 930 1 2 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.555 -1.155 19685 931 1 2 . 1 1 462 462 ALA C C 462 179.400 179.400 177.887 1.513 19685 932 1 2 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.968 1.132 19685 933 1 2 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.331 -1.631 19685 934 1 2 . 1 1 462 462 ALA H H 462 7.860 7.860 7.636 0.224 19685 935 1 2 . 1 1 463 463 ILE N N 463 118.600 118.600 117.908 0.692 19685 936 1 2 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.912 -0.672 19685 937 1 2 . 1 1 463 463 ILE C C 463 177.500 177.500 176.117 1.383 19685 938 1 2 . 1 1 463 463 ILE CA C 463 66.000 66.000 62.068 3.932 19685 939 1 2 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.034 0.266 19685 940 1 2 . 1 1 463 463 ILE H H 463 8.090 8.090 8.133 -0.043 19685 941 1 2 . 1 1 464 464 GLN N N 464 117.000 117.000 116.725 0.275 19685 942 1 2 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.399 -0.529 19685 943 1 2 . 1 1 464 464 GLN C C 464 177.700 177.700 175.107 2.593 19685 944 1 2 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.977 2.223 19685 945 1 2 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.577 -1.677 19685 946 1 2 . 1 1 464 464 GLN H H 464 7.780 7.780 8.113 -0.333 19685 947 1 2 . 1 1 465 465 ALA N N 465 117.200 117.200 120.588 -3.388 19685 948 1 2 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.492 -0.262 19685 949 1 2 . 1 1 465 465 ALA C C 465 179.200 179.200 176.384 2.816 19685 950 1 2 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.794 1.006 19685 951 1 2 . 1 1 465 465 ALA CB C 465 21.100 21.100 20.189 0.911 19685 952 1 2 . 1 1 465 465 ALA H H 465 7.540 7.540 7.314 0.226 19685 953 1 2 . 1 1 466 466 MET N N 466 110.800 110.800 117.360 -6.560 19685 954 1 2 . 1 1 466 466 MET HA H 466 4.820 4.820 4.525 0.295 19685 955 1 2 . 1 1 466 466 MET C C 466 177.600 177.600 175.122 2.478 19685 956 1 2 . 1 1 466 466 MET CA C 466 53.300 53.300 55.311 -2.011 19685 957 1 2 . 1 1 466 466 MET CB C 466 31.600 31.600 35.605 -4.005 19685 958 1 2 . 1 1 466 466 MET H H 466 8.230 8.230 7.718 0.512 19685 959 1 2 . 1 1 467 467 ASN N N 467 119.100 119.100 118.904 0.196 19685 960 1 2 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.769 -0.279 19685 961 1 2 . 1 1 467 467 ASN C C 467 176.300 176.300 176.858 -0.558 19685 962 1 2 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.228 1.972 19685 963 1 2 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.607 -0.407 19685 964 1 2 . 1 1 467 467 ASN H H 467 8.560 8.560 7.816 0.744 19685 965 1 2 . 1 1 468 468 GLY N N 468 117.900 117.900 114.035 3.865 19685 966 1 2 . 1 1 468 468 GLY C C 468 172.800 172.800 174.278 -1.478 19685 967 1 2 . 1 1 468 468 GLY CA C 468 45.300 45.300 46.071 -0.771 19685 968 1 2 . 1 1 468 468 GLY H H 468 8.930 8.930 9.107 -0.177 19685 969 1 2 . 1 1 469 469 PHE N N 469 123.300 123.300 119.952 3.348 19685 970 1 2 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.617 -0.427 19685 971 1 2 . 1 1 469 469 PHE C C 469 174.400 174.400 174.649 -0.249 19685 972 1 2 . 1 1 469 469 PHE CA C 469 58.700 58.700 57.960 0.740 19685 973 1 2 . 1 1 469 469 PHE CB C 469 40.600 40.600 40.106 0.494 19685 974 1 2 . 1 1 469 469 PHE H H 469 7.950 7.950 7.614 0.336 19685 975 1 2 . 1 1 470 470 GLN N N 470 129.200 129.200 118.734 10.466 19685 976 1 2 . 1 1 470 470 GLN HA H 470 4.590 4.590 3.974 0.616 19685 977 1 2 . 1 1 470 470 GLN C C 470 174.100 174.100 174.076 0.024 19685 978 1 2 . 1 1 470 470 GLN CA C 470 55.500 55.500 56.806 -1.306 19685 979 1 2 . 1 1 470 470 GLN CB C 470 28.800 28.800 28.297 0.503 19685 980 1 2 . 1 1 470 470 GLN H H 470 8.330 8.330 8.266 0.064 19685 981 1 2 . 1 1 471 471 ILE N N 471 126.300 126.300 124.068 2.232 19685 982 1 2 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.256 -0.086 19685 983 1 2 . 1 1 471 471 ILE C C 471 175.400 175.400 175.029 0.371 19685 984 1 2 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.404 -0.805 19685 985 1 2 . 1 1 471 471 ILE CB C 471 39.100 39.100 39.899 -0.799 19685 986 1 2 . 1 1 471 471 ILE H H 471 8.440 8.440 8.364 0.076 19685 987 1 2 . 1 1 472 472 GLY N N 472 117.500 117.500 116.210 1.290 19685 988 1 2 . 1 1 472 472 GLY C C 472 174.700 174.700 174.331 0.369 19685 989 1 2 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.428 1.072 19685 990 1 2 . 1 1 472 472 GLY H H 472 8.980 8.980 8.590 0.390 19685 991 1 2 . 1 1 473 473 MET N N 473 124.100 124.100 118.885 5.215 19685 992 1 2 . 1 1 473 473 MET HA H 473 4.380 4.380 4.499 -0.119 19685 993 1 2 . 1 1 473 473 MET C C 473 175.700 175.700 176.035 -0.335 19685 994 1 2 . 1 1 473 473 MET CA C 473 55.000 55.000 56.294 -1.294 19685 995 1 2 . 1 1 473 473 MET CB C 473 32.900 32.900 32.185 0.715 19685 996 1 2 . 1 1 473 473 MET H H 473 9.070 9.070 8.404 0.666 19685 997 1 2 . 1 1 474 474 LYS N N 474 118.700 118.700 118.328 0.372 19685 998 1 2 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.633 -0.153 19685 999 1 2 . 1 1 474 474 LYS C C 474 174.300 174.300 174.828 -0.528 19685 1000 1 2 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.522 0.078 19685 1001 1 2 . 1 1 474 474 LYS CB C 474 35.100 35.100 34.694 0.406 19685 1002 1 2 . 1 1 474 474 LYS H H 474 7.770 7.770 7.342 0.428 19685 1003 1 2 . 1 1 475 475 ARG N N 475 119.600 119.600 119.423 0.177 19685 1004 1 2 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.241 0.559 19685 1005 1 2 . 1 1 475 475 ARG C C 475 175.700 175.700 173.924 1.776 19685 1006 1 2 . 1 1 475 475 ARG CA C 475 54.000 54.000 56.333 -2.333 19685 1007 1 2 . 1 1 475 475 ARG CB C 475 31.300 31.300 30.474 0.826 19685 1008 1 2 . 1 1 475 475 ARG H H 475 8.350 8.350 8.452 -0.102 19685 1009 1 2 . 1 1 476 476 LEU N N 476 123.500 123.500 120.810 2.690 19685 1010 1 2 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.693 -0.263 19685 1011 1 2 . 1 1 476 476 LEU C C 476 177.600 177.600 174.910 2.690 19685 1012 1 2 . 1 1 476 476 LEU CA C 476 55.500 55.500 53.442 2.058 19685 1013 1 2 . 1 1 476 476 LEU CB C 476 42.800 42.800 45.282 -2.482 19685 1014 1 2 . 1 1 476 476 LEU H H 476 9.130 9.130 8.164 0.966 19685 1015 1 2 . 1 1 477 477 LYS N N 477 123.200 123.200 125.751 -2.551 19685 1016 1 2 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.929 0.231 19685 1017 1 2 . 1 1 477 477 LYS C C 477 174.100 174.100 173.995 0.105 19685 1018 1 2 . 1 1 477 477 LYS CA C 477 54.500 54.500 55.641 -1.141 19685 1019 1 2 . 1 1 477 477 LYS CB C 477 34.900 34.900 35.821 -0.921 19685 1020 1 2 . 1 1 477 477 LYS H H 477 8.090 8.090 8.469 -0.379 19685 1021 1 2 . 1 1 478 478 VAL N N 478 127.100 127.100 122.770 4.330 19685 1022 1 2 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.410 0.490 19685 1023 1 2 . 1 1 478 478 VAL C C 478 173.700 173.700 173.565 0.135 19685 1024 1 2 . 1 1 478 478 VAL CA C 478 61.000 61.000 61.505 -0.505 19685 1025 1 2 . 1 1 478 478 VAL CB C 478 33.700 33.700 34.851 -1.151 19685 1026 1 2 . 1 1 478 478 VAL H H 478 8.820 8.820 8.520 0.300 19685 1027 1 2 . 1 1 479 479 GLN N N 479 123.600 123.600 122.164 1.436 19685 1028 1 2 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.621 0.189 19685 1029 1 2 . 1 1 479 479 GLN C C 479 173.600 173.600 173.356 0.244 19685 1030 1 2 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.373 -1.173 19685 1031 1 2 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.880 0.620 19685 1032 1 2 . 1 1 479 479 GLN H H 479 9.130 9.130 8.350 0.780 19685 1033 1 2 . 1 1 480 480 LEU N N 480 123.200 123.200 120.777 2.423 19685 1034 1 2 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.750 -0.310 19685 1035 1 2 . 1 1 480 480 LEU C C 480 177.100 177.100 177.241 -0.141 19685 1036 1 2 . 1 1 480 480 LEU CA C 480 54.600 54.600 52.994 1.606 19685 1037 1 2 . 1 1 480 480 LEU CB C 480 42.400 42.400 42.539 -0.139 19685 1038 1 2 . 1 1 480 480 LEU H H 480 8.840 8.840 8.307 0.533 19685 1039 1 2 . 1 1 481 481 LYS N N 481 124.500 124.500 117.218 7.282 19685 1040 1 2 . 1 1 481 481 LYS HA H 481 4.310 4.310 3.910 0.400 19685 1041 1 2 . 1 1 481 481 LYS C C 481 175.200 175.200 177.282 -2.082 19685 1042 1 2 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.761 -1.062 19685 1043 1 2 . 1 1 481 481 LYS CB C 481 33.100 33.100 30.422 2.678 19685 1044 1 2 . 1 1 481 481 LYS H H 481 8.400 8.400 8.704 -0.303 19685 1045 1 2 . 1 1 482 482 ARG N N 482 126.600 126.600 117.328 9.272 19685 1046 1 2 . 1 1 482 482 ARG HA H 482 4.350 4.350 4.035 0.315 19685 1047 1 2 . 1 1 482 482 ARG C C 482 175.800 175.800 175.122 0.678 19685 1048 1 2 . 1 1 482 482 ARG CA C 482 55.600 55.600 57.078 -1.478 19685 1049 1 2 . 1 1 482 482 ARG CB C 482 31.100 31.100 29.148 1.952 19685 1050 1 2 . 1 1 482 482 ARG H H 482 8.770 8.770 7.777 0.993 19685 1051 1 2 . 1 1 483 483 SER N N 483 118.100 118.100 111.720 6.380 19685 1052 1 2 . 1 1 483 483 SER HA H 483 4.400 4.400 4.441 -0.041 19685 1053 1 2 . 1 1 483 483 SER C C 483 174.200 174.200 173.940 0.260 19685 1054 1 2 . 1 1 483 483 SER CA C 483 58.000 58.000 57.442 0.558 19685 1055 1 2 . 1 1 483 483 SER CB C 483 63.500 63.500 63.475 0.025 19685 1056 1 2 . 1 1 483 483 SER H H 483 8.610 8.610 7.007 1.603 19685 1057 1 2 . 1 1 484 484 LYS N N 484 123.000 123.000 120.183 2.817 19685 1058 1 2 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.332 -0.122 19685 1059 1 2 . 1 1 484 484 LYS C C 484 175.900 175.900 176.142 -0.242 19685 1060 1 2 . 1 1 484 484 LYS CA C 484 56.300 56.300 57.234 -0.934 19685 1061 1 2 . 1 1 484 484 LYS CB C 484 32.500 32.500 32.431 0.070 19685 1062 1 2 . 1 1 484 484 LYS H H 484 8.560 8.560 8.560 -0.000 19685 1063 1 2 . 1 1 485 485 ASN N N 485 119.600 119.600 118.214 1.386 19685 1064 1 2 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.801 -0.201 19685 1065 1 2 . 1 1 485 485 ASN C C 485 174.400 174.400 173.129 1.271 19685 1066 1 2 . 1 1 485 485 ASN CA C 485 52.900 52.900 52.282 0.618 19685 1067 1 2 . 1 1 485 485 ASN CB C 485 38.400 38.400 40.818 -2.418 19685 1068 1 2 . 1 1 485 485 ASN H H 485 8.560 8.560 7.544 1.016 19685 1069 1 2 . 1 1 486 486 ASP N N 486 121.100 121.100 120.086 1.014 19685 1070 1 2 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.579 -0.059 19685 1071 1 2 . 1 1 486 486 ASP C C 486 175.700 175.700 176.021 -0.321 19685 1072 1 2 . 1 1 486 486 ASP CA C 486 54.000 54.000 55.297 -1.297 19685 1073 1 2 . 1 1 486 486 ASP CB C 486 40.800 40.800 41.428 -0.628 19685 1074 1 2 . 1 1 486 486 ASP H H 486 8.250 8.250 8.593 -0.343 19685 1075 1 2 . 1 1 487 487 SER N N 487 115.400 115.400 118.665 -3.265 19685 1076 1 2 . 1 1 487 487 SER HA H 487 4.310 4.310 4.471 -0.161 19685 1077 1 2 . 1 1 487 487 SER C C 487 172.800 172.800 174.175 -1.375 19685 1078 1 2 . 1 1 487 487 SER CA C 487 57.700 57.700 57.714 -0.014 19685 1079 1 2 . 1 1 487 487 SER CB C 487 63.600 63.600 64.800 -1.200 19685 1080 1 2 . 1 1 487 487 SER H H 487 8.090 8.090 8.617 -0.527 19685 1081 1 2 . 1 1 488 488 LYS N N 488 122.300 122.300 122.605 -0.305 19685 1082 1 2 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.088 -0.038 19685 1083 1 2 . 1 1 488 488 LYS C C 488 174.500 174.500 174.580 -0.080 19685 1084 1 2 . 1 1 488 488 LYS CA C 488 54.000 54.000 56.697 -2.697 19685 1085 1 2 . 1 1 488 488 LYS CB C 488 32.400 32.400 31.765 0.635 19685 1086 1 2 . 1 1 488 488 LYS H H 488 8.090 8.090 8.223 -0.133 19685 1087 1 2 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.611 -0.331 19685 1088 1 2 . 1 1 489 489 PRO C C 489 175.000 175.000 175.926 -0.926 19685 1089 1 2 . 1 1 489 489 PRO CA C 489 63.200 63.200 63.251 -0.051 19685 1090 1 2 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.430 -1.330 19685 1091 1 3 . 1 1 395 395 SER N N 395 115.500 115.500 115.772 -0.272 19685 1092 1 3 . 1 1 395 395 SER HA H 395 4.300 4.300 5.019 -0.719 19685 1093 1 3 . 1 1 395 395 SER C C 395 173.900 173.900 172.571 1.329 19685 1094 1 3 . 1 1 395 395 SER CA C 395 57.900 57.900 57.044 0.856 19685 1095 1 3 . 1 1 395 395 SER CB C 395 63.400 63.400 65.641 -2.241 19685 1096 1 3 . 1 1 395 395 SER H H 395 8.200 8.200 8.581 -0.381 19685 1097 1 3 . 1 1 396 396 HIS N N 396 123.500 123.500 118.602 4.898 19685 1098 1 3 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.821 -0.261 19685 1099 1 3 . 1 1 396 396 HIS C C 396 174.100 174.100 173.860 0.240 19685 1100 1 3 . 1 1 396 396 HIS CA C 396 53.700 53.700 56.030 -2.330 19685 1101 1 3 . 1 1 396 396 HIS CB C 396 32.200 32.200 31.489 0.711 19685 1102 1 3 . 1 1 396 396 HIS H H 396 8.120 8.120 8.398 -0.278 19685 1103 1 3 . 1 1 397 397 MET N N 397 121.200 121.200 120.987 0.213 19685 1104 1 3 . 1 1 397 397 MET HA H 397 4.320 4.320 4.667 -0.347 19685 1105 1 3 . 1 1 397 397 MET C C 397 175.400 175.400 175.673 -0.273 19685 1106 1 3 . 1 1 397 397 MET CA C 397 55.000 55.000 54.900 0.100 19685 1107 1 3 . 1 1 397 397 MET CB C 397 32.500 32.500 34.233 -1.733 19685 1108 1 3 . 1 1 397 397 MET H H 397 8.300 8.300 8.182 0.118 19685 1109 1 3 . 1 1 398 398 GLN N N 398 122.100 122.100 121.226 0.874 19685 1110 1 3 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.030 0.160 19685 1111 1 3 . 1 1 398 398 GLN C C 398 174.800 174.800 174.625 0.175 19685 1112 1 3 . 1 1 398 398 GLN CA C 398 55.200 55.200 57.748 -2.548 19685 1113 1 3 . 1 1 398 398 GLN CB C 398 28.900 28.900 28.638 0.262 19685 1114 1 3 . 1 1 398 398 GLN H H 398 8.540 8.540 8.740 -0.200 19685 1115 1 3 . 1 1 399 399 LYS N N 399 123.000 123.000 120.959 2.041 19685 1116 1 3 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.439 -0.219 19685 1117 1 3 . 1 1 399 399 LYS C C 399 174.800 174.800 175.389 -0.589 19685 1118 1 3 . 1 1 399 399 LYS CA C 399 55.600 55.600 55.647 -0.047 19685 1119 1 3 . 1 1 399 399 LYS CB C 399 33.000 33.000 34.552 -1.552 19685 1120 1 3 . 1 1 399 399 LYS H H 399 8.180 8.180 8.348 -0.168 19685 1121 1 3 . 1 1 400 400 GLU N N 400 122.000 122.000 117.697 4.303 19685 1122 1 3 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.202 0.228 19685 1123 1 3 . 1 1 400 400 GLU C C 400 176.400 176.400 175.226 1.174 19685 1124 1 3 . 1 1 400 400 GLU CA C 400 55.400 55.400 57.257 -1.857 19685 1125 1 3 . 1 1 400 400 GLU CB C 400 31.400 31.400 28.315 3.085 19685 1126 1 3 . 1 1 400 400 GLU H H 400 8.350 8.350 8.543 -0.193 19685 1127 1 3 . 1 1 401 401 GLY N N 401 109.500 109.500 104.858 4.642 19685 1128 1 3 . 1 1 401 401 GLY C C 401 171.500 171.500 172.601 -1.101 19685 1129 1 3 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.385 -0.685 19685 1130 1 3 . 1 1 401 401 GLY H H 401 9.050 9.050 7.916 1.134 19685 1131 1 3 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.479 -0.059 19685 1132 1 3 . 1 1 402 402 PRO C C 402 173.900 173.900 176.628 -2.728 19685 1133 1 3 . 1 1 402 402 PRO CA C 402 61.900 61.900 64.117 -2.217 19685 1134 1 3 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.880 -0.680 19685 1135 1 3 . 1 1 403 403 GLU N N 403 119.600 119.600 117.112 2.488 19685 1136 1 3 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.424 -0.464 19685 1137 1 3 . 1 1 403 403 GLU C C 403 177.300 177.300 176.155 1.145 19685 1138 1 3 . 1 1 403 403 GLU CA C 403 58.100 58.100 56.672 1.428 19685 1139 1 3 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.759 -1.759 19685 1140 1 3 . 1 1 403 403 GLU H H 403 8.420 8.420 8.107 0.313 19685 1141 1 3 . 1 1 404 404 GLY N N 404 112.800 112.800 106.724 6.076 19685 1142 1 3 . 1 1 404 404 GLY C C 404 173.300 173.300 173.681 -0.381 19685 1143 1 3 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.521 -0.621 19685 1144 1 3 . 1 1 404 404 GLY H H 404 8.500 8.500 8.229 0.271 19685 1145 1 3 . 1 1 405 405 ALA N N 405 120.000 120.000 124.129 -4.129 19685 1146 1 3 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.126 0.424 19685 1147 1 3 . 1 1 405 405 ALA C C 405 174.100 174.100 175.320 -1.220 19685 1148 1 3 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.753 -1.253 19685 1149 1 3 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.095 3.705 19685 1150 1 3 . 1 1 405 405 ALA H H 405 8.360 8.360 8.290 0.070 19685 1151 1 3 . 1 1 406 406 ASN N N 406 115.500 115.500 118.328 -2.828 19685 1152 1 3 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.139 0.051 19685 1153 1 3 . 1 1 406 406 ASN C C 406 172.900 172.900 174.583 -1.683 19685 1154 1 3 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.214 1.386 19685 1155 1 3 . 1 1 406 406 ASN CB C 406 40.900 40.900 39.603 1.297 19685 1156 1 3 . 1 1 406 406 ASN H H 406 7.690 7.690 7.910 -0.220 19685 1157 1 3 . 1 1 407 407 LEU N N 407 123.400 123.400 124.245 -0.845 19685 1158 1 3 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.482 0.478 19685 1159 1 3 . 1 1 407 407 LEU C C 407 174.900 174.900 176.653 -1.753 19685 1160 1 3 . 1 1 407 407 LEU CA C 407 53.100 53.100 53.434 -0.334 19685 1161 1 3 . 1 1 407 407 LEU CB C 407 45.400 45.400 40.359 5.041 19685 1162 1 3 . 1 1 407 407 LEU H H 407 9.290 9.290 7.661 1.629 19685 1163 1 3 . 1 1 408 408 PHE N N 408 118.700 118.700 123.167 -4.467 19685 1164 1 3 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.527 0.773 19685 1165 1 3 . 1 1 408 408 PHE C C 408 174.200 174.200 175.712 -1.512 19685 1166 1 3 . 1 1 408 408 PHE CA C 408 56.300 56.300 59.733 -3.433 19685 1167 1 3 . 1 1 408 408 PHE CB C 408 42.700 42.700 37.588 5.112 19685 1168 1 3 . 1 1 408 408 PHE H H 408 9.150 9.150 7.402 1.748 19685 1169 1 3 . 1 1 409 409 ILE N N 409 120.800 120.800 118.004 2.796 19685 1170 1 3 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.759 0.211 19685 1171 1 3 . 1 1 409 409 ILE C C 409 173.900 173.900 174.587 -0.687 19685 1172 1 3 . 1 1 409 409 ILE CA C 409 59.000 59.000 60.274 -1.274 19685 1173 1 3 . 1 1 409 409 ILE CB C 409 40.400 40.400 40.887 -0.487 19685 1174 1 3 . 1 1 409 409 ILE H H 409 8.380 8.380 8.555 -0.175 19685 1175 1 3 . 1 1 410 410 TYR N N 410 123.200 123.200 122.550 0.650 19685 1176 1 3 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.891 0.049 19685 1177 1 3 . 1 1 410 410 TYR C C 410 174.300 174.300 174.256 0.044 19685 1178 1 3 . 1 1 410 410 TYR CA C 410 56.200 56.200 57.841 -1.641 19685 1179 1 3 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.110 1.690 19685 1180 1 3 . 1 1 410 410 TYR H H 410 9.440 9.440 8.684 0.756 19685 1181 1 3 . 1 1 411 411 HIS N N 411 112.100 112.100 119.331 -7.231 19685 1182 1 3 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.733 -0.283 19685 1183 1 3 . 1 1 411 411 HIS C C 411 173.300 173.300 174.905 -1.605 19685 1184 1 3 . 1 1 411 411 HIS CA C 411 55.900 55.900 54.322 1.577 19685 1185 1 3 . 1 1 411 411 HIS CB C 411 26.200 26.200 29.510 -3.310 19685 1186 1 3 . 1 1 411 411 HIS H H 411 8.580 8.580 7.904 0.676 19685 1187 1 3 . 1 1 412 412 LEU N N 412 115.100 115.100 115.319 -0.219 19685 1188 1 3 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.740 -0.780 19685 1189 1 3 . 1 1 412 412 LEU C C 412 175.100 175.100 174.994 0.106 19685 1190 1 3 . 1 1 412 412 LEU CA C 412 52.400 52.400 54.775 -2.375 19685 1191 1 3 . 1 1 412 412 LEU CB C 412 42.000 42.000 40.536 1.464 19685 1192 1 3 . 1 1 412 412 LEU H H 412 7.560 7.560 7.876 -0.316 19685 1193 1 3 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.465 -0.195 19685 1194 1 3 . 1 1 413 413 PRO C C 413 177.600 177.600 175.998 1.602 19685 1195 1 3 . 1 1 413 413 PRO CA C 413 62.300 62.300 62.477 -0.177 19685 1196 1 3 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.623 -0.423 19685 1197 1 3 . 1 1 414 414 GLN N N 414 125.500 125.500 122.775 2.725 19685 1198 1 3 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.347 -0.267 19685 1199 1 3 . 1 1 414 414 GLN C C 414 175.400 175.400 175.636 -0.236 19685 1200 1 3 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.270 -0.270 19685 1201 1 3 . 1 1 414 414 GLN CB C 414 28.500 28.500 30.864 -2.364 19685 1202 1 3 . 1 1 414 414 GLN H H 414 9.170 9.170 8.105 1.065 19685 1203 1 3 . 1 1 415 415 GLU N N 415 115.300 115.300 118.294 -2.994 19685 1204 1 3 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.492 -0.232 19685 1205 1 3 . 1 1 415 415 GLU C C 415 176.700 176.700 175.302 1.398 19685 1206 1 3 . 1 1 415 415 GLU CA C 415 58.700 58.700 56.633 2.067 19685 1207 1 3 . 1 1 415 415 GLU CB C 415 28.300 28.300 31.216 -2.916 19685 1208 1 3 . 1 1 415 415 GLU H H 415 9.390 9.390 8.597 0.793 19685 1209 1 3 . 1 1 416 416 PHE N N 416 121.700 121.700 113.478 8.222 19685 1210 1 3 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.476 -0.866 19685 1211 1 3 . 1 1 416 416 PHE C C 416 176.400 176.400 173.788 2.612 19685 1212 1 3 . 1 1 416 416 PHE CA C 416 57.400 57.400 55.800 1.600 19685 1213 1 3 . 1 1 416 416 PHE CB C 416 38.700 38.700 40.418 -1.718 19685 1214 1 3 . 1 1 416 416 PHE H H 416 7.610 7.610 7.306 0.304 19685 1215 1 3 . 1 1 417 417 GLY N N 417 113.000 113.000 108.091 4.909 19685 1216 1 3 . 1 1 417 417 GLY C C 417 174.300 174.300 173.403 0.897 19685 1217 1 3 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.565 -3.665 19685 1218 1 3 . 1 1 417 417 GLY H H 417 9.740 9.740 9.607 0.133 19685 1219 1 3 . 1 1 418 418 ASP N N 418 121.500 121.500 115.995 5.505 19685 1220 1 3 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.748 -0.808 19685 1221 1 3 . 1 1 418 418 ASP C C 418 177.900 177.900 176.954 0.946 19685 1222 1 3 . 1 1 418 418 ASP CA C 418 57.600 57.600 54.668 2.932 19685 1223 1 3 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.100 -1.400 19685 1224 1 3 . 1 1 418 418 ASP H H 418 8.680 8.680 7.725 0.955 19685 1225 1 3 . 1 1 419 419 GLN N N 419 116.400 116.400 119.561 -3.161 19685 1226 1 3 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.208 -0.298 19685 1227 1 3 . 1 1 419 419 GLN C C 419 177.600 177.600 175.548 2.052 19685 1228 1 3 . 1 1 419 419 GLN CA C 419 58.000 58.000 58.299 -0.299 19685 1229 1 3 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.900 -1.500 19685 1230 1 3 . 1 1 419 419 GLN H H 419 8.780 8.780 8.457 0.323 19685 1231 1 3 . 1 1 420 420 ASP N N 420 117.500 117.500 116.394 1.106 19685 1232 1 3 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.666 -0.656 19685 1233 1 3 . 1 1 420 420 ASP C C 420 178.000 178.000 177.430 0.570 19685 1234 1 3 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.517 3.183 19685 1235 1 3 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.411 -0.611 19685 1236 1 3 . 1 1 420 420 ASP H H 420 7.210 7.210 8.429 -1.219 19685 1237 1 3 . 1 1 421 421 ILE N N 421 117.000 117.000 121.234 -4.234 19685 1238 1 3 . 1 1 421 421 ILE HA H 421 4.080 4.080 4.017 0.063 19685 1239 1 3 . 1 1 421 421 ILE C C 421 176.500 176.500 176.170 0.330 19685 1240 1 3 . 1 1 421 421 ILE CA C 421 64.000 64.000 63.585 0.415 19685 1241 1 3 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.196 -0.896 19685 1242 1 3 . 1 1 421 421 ILE H H 421 7.610 7.610 7.910 -0.300 19685 1243 1 3 . 1 1 422 422 LEU N N 422 123.200 123.200 119.823 3.377 19685 1244 1 3 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.129 -0.369 19685 1245 1 3 . 1 1 422 422 LEU C C 422 177.800 177.800 176.784 1.016 19685 1246 1 3 . 1 1 422 422 LEU CA C 422 58.600 58.600 56.304 2.296 19685 1247 1 3 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.562 -0.362 19685 1248 1 3 . 1 1 422 422 LEU H H 422 7.870 7.870 8.150 -0.280 19685 1249 1 3 . 1 1 423 423 GLN N N 423 115.600 115.600 117.548 -1.948 19685 1250 1 3 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.294 -0.414 19685 1251 1 3 . 1 1 423 423 GLN C C 423 177.800 177.800 175.632 2.168 19685 1252 1 3 . 1 1 423 423 GLN CA C 423 58.600 58.600 55.793 2.807 19685 1253 1 3 . 1 1 423 423 GLN CB C 423 27.900 27.900 30.312 -2.412 19685 1254 1 3 . 1 1 423 423 GLN H H 423 7.860 7.860 7.690 0.170 19685 1255 1 3 . 1 1 424 424 MET N N 424 115.500 115.500 118.786 -3.286 19685 1256 1 3 . 1 1 424 424 MET HA H 424 3.910 3.910 4.218 -0.308 19685 1257 1 3 . 1 1 424 424 MET C C 424 175.500 175.500 175.302 0.198 19685 1258 1 3 . 1 1 424 424 MET CA C 424 57.800 57.800 55.937 1.863 19685 1259 1 3 . 1 1 424 424 MET CB C 424 34.300 34.300 34.089 0.211 19685 1260 1 3 . 1 1 424 424 MET H H 424 7.560 7.560 7.875 -0.315 19685 1261 1 3 . 1 1 425 425 PHE N N 425 112.300 112.300 115.837 -3.537 19685 1262 1 3 . 1 1 425 425 PHE HA H 425 4.700 4.700 4.588 0.112 19685 1263 1 3 . 1 1 425 425 PHE C C 425 177.300 177.300 176.942 0.358 19685 1264 1 3 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.221 1.679 19685 1265 1 3 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.095 -1.595 19685 1266 1 3 . 1 1 425 425 PHE H H 425 7.680 7.680 7.670 0.010 19685 1267 1 3 . 1 1 426 426 MET N N 426 127.400 127.400 119.326 8.074 19685 1268 1 3 . 1 1 426 426 MET HA H 426 4.630 4.630 4.227 0.403 19685 1269 1 3 . 1 1 426 426 MET C C 426 173.800 173.800 174.982 -1.182 19685 1270 1 3 . 1 1 426 426 MET CA C 426 59.100 59.100 59.140 -0.040 19685 1271 1 3 . 1 1 426 426 MET CB C 426 31.800 31.800 30.166 1.633 19685 1272 1 3 . 1 1 426 426 MET H H 426 8.540 8.540 8.423 0.117 19685 1273 1 3 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.201 -0.191 19685 1274 1 3 . 1 1 427 427 PRO C C 427 176.800 176.800 176.703 0.097 19685 1275 1 3 . 1 1 427 427 PRO CA C 427 65.200 65.200 63.849 1.351 19685 1276 1 3 . 1 1 427 427 PRO CB C 427 30.600 30.600 31.320 -0.720 19685 1277 1 3 . 1 1 428 428 PHE N N 428 110.000 110.000 119.586 -9.586 19685 1278 1 3 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.578 -0.308 19685 1279 1 3 . 1 1 428 428 PHE C C 428 174.600 174.600 176.974 -2.374 19685 1280 1 3 . 1 1 428 428 PHE CA C 428 57.700 57.700 59.242 -1.542 19685 1281 1 3 . 1 1 428 428 PHE CB C 428 38.000 38.000 39.880 -1.881 19685 1282 1 3 . 1 1 428 428 PHE H H 428 6.560 6.560 7.482 -0.922 19685 1283 1 3 . 1 1 429 429 GLY N N 429 105.500 105.500 104.578 0.922 19685 1284 1 3 . 1 1 429 429 GLY C C 429 170.100 170.100 171.348 -1.248 19685 1285 1 3 . 1 1 429 429 GLY CA C 429 44.400 44.400 44.541 -0.141 19685 1286 1 3 . 1 1 429 429 GLY H H 429 7.650 7.650 7.582 0.068 19685 1287 1 3 . 1 1 430 430 ASN N N 430 117.400 117.400 117.322 0.078 19685 1288 1 3 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.522 0.108 19685 1289 1 3 . 1 1 430 430 ASN C C 430 173.200 173.200 176.368 -3.168 19685 1290 1 3 . 1 1 430 430 ASN CA C 430 52.600 52.600 52.464 0.136 19685 1291 1 3 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.361 -2.160 19685 1292 1 3 . 1 1 430 430 ASN H H 430 9.020 9.020 8.083 0.937 19685 1293 1 3 . 1 1 431 431 VAL N N 431 128.000 128.000 124.224 3.776 19685 1294 1 3 . 1 1 431 431 VAL HA H 431 3.750 3.750 3.986 -0.236 19685 1295 1 3 . 1 1 431 431 VAL C C 431 176.400 176.400 177.008 -0.608 19685 1296 1 3 . 1 1 431 431 VAL CA C 431 61.800 61.800 63.306 -1.506 19685 1297 1 3 . 1 1 431 431 VAL CB C 431 31.900 31.900 32.071 -0.171 19685 1298 1 3 . 1 1 431 431 VAL H H 431 8.480 8.480 8.276 0.204 19685 1299 1 3 . 1 1 432 432 ILE N N 432 128.000 128.000 116.855 11.145 19685 1300 1 3 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.513 0.407 19685 1301 1 3 . 1 1 432 432 ILE C C 432 176.100 176.100 176.025 0.075 19685 1302 1 3 . 1 1 432 432 ILE CA C 432 62.500 62.500 63.652 -1.152 19685 1303 1 3 . 1 1 432 432 ILE CB C 432 37.400 37.400 36.778 0.622 19685 1304 1 3 . 1 1 432 432 ILE H H 432 8.840 8.840 8.526 0.314 19685 1305 1 3 . 1 1 433 433 SER N N 433 113.600 113.600 113.743 -0.143 19685 1306 1 3 . 1 1 433 433 SER HA H 433 4.440 4.440 4.569 -0.129 19685 1307 1 3 . 1 1 433 433 SER C C 433 171.000 171.000 171.950 -0.950 19685 1308 1 3 . 1 1 433 433 SER CA C 433 57.300 57.300 58.228 -0.928 19685 1309 1 3 . 1 1 433 433 SER CB C 433 65.200 65.200 66.100 -0.900 19685 1310 1 3 . 1 1 433 433 SER H H 433 7.280 7.280 7.929 -0.649 19685 1311 1 3 . 1 1 434 434 ALA N N 434 125.700 125.700 125.680 0.020 19685 1312 1 3 . 1 1 434 434 ALA HA H 434 4.910 4.910 4.534 0.377 19685 1313 1 3 . 1 1 434 434 ALA C C 434 174.600 174.600 175.329 -0.729 19685 1314 1 3 . 1 1 434 434 ALA CA C 434 51.000 51.000 50.876 0.124 19685 1315 1 3 . 1 1 434 434 ALA CB C 434 21.200 21.200 21.977 -0.777 19685 1316 1 3 . 1 1 434 434 ALA H H 434 8.270 8.270 8.387 -0.117 19685 1317 1 3 . 1 1 435 435 LYS N N 435 120.900 120.900 119.664 1.236 19685 1318 1 3 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.666 -0.196 19685 1319 1 3 . 1 1 435 435 LYS C C 435 173.800 173.800 174.314 -0.514 19685 1320 1 3 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.330 -1.630 19685 1321 1 3 . 1 1 435 435 LYS CB C 435 36.400 36.400 35.345 1.055 19685 1322 1 3 . 1 1 435 435 LYS H H 435 8.490 8.490 7.423 1.067 19685 1323 1 3 . 1 1 436 436 VAL N N 436 122.200 122.200 118.832 3.368 19685 1324 1 3 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.372 -0.452 19685 1325 1 3 . 1 1 436 436 VAL C C 436 175.100 175.100 175.531 -0.431 19685 1326 1 3 . 1 1 436 436 VAL CA C 436 63.600 63.600 61.876 1.724 19685 1327 1 3 . 1 1 436 436 VAL CB C 436 33.500 33.500 33.219 0.281 19685 1328 1 3 . 1 1 436 436 VAL H H 436 8.390 8.390 8.645 -0.255 19685 1329 1 3 . 1 1 437 437 PHE N N 437 125.900 125.900 119.644 6.256 19685 1330 1 3 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.213 0.187 19685 1331 1 3 . 1 1 437 437 PHE C C 437 173.600 173.600 174.644 -1.044 19685 1332 1 3 . 1 1 437 437 PHE CA C 437 57.700 57.700 58.911 -1.211 19685 1333 1 3 . 1 1 437 437 PHE CB C 437 39.000 39.000 37.650 1.350 19685 1334 1 3 . 1 1 437 437 PHE H H 437 8.250 8.250 8.351 -0.101 19685 1335 1 3 . 1 1 438 438 ILE N N 438 121.900 121.900 119.761 2.139 19685 1336 1 3 . 1 1 438 438 ILE HA H 438 4.460 4.460 4.170 0.290 19685 1337 1 3 . 1 1 438 438 ILE C C 438 175.700 175.700 174.623 1.077 19685 1338 1 3 . 1 1 438 438 ILE CA C 438 58.300 58.300 60.661 -2.361 19685 1339 1 3 . 1 1 438 438 ILE CB C 438 39.700 39.700 39.233 0.467 19685 1340 1 3 . 1 1 438 438 ILE H H 438 8.520 8.520 7.765 0.755 19685 1341 1 3 . 1 1 439 439 ASP N N 439 126.500 126.500 120.716 5.784 19685 1342 1 3 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.315 0.265 19685 1343 1 3 . 1 1 439 439 ASP C C 439 176.300 176.300 176.204 0.096 19685 1344 1 3 . 1 1 439 439 ASP CA C 439 53.600 53.600 55.448 -1.848 19685 1345 1 3 . 1 1 439 439 ASP CB C 439 42.300 42.300 39.383 2.917 19685 1346 1 3 . 1 1 439 439 ASP H H 439 8.730 8.730 8.323 0.407 19685 1347 1 3 . 1 1 440 440 LYS N N 440 127.300 127.300 115.948 11.352 19685 1348 1 3 . 1 1 440 440 LYS HA H 440 4.070 4.070 3.790 0.280 19685 1349 1 3 . 1 1 440 440 LYS C C 440 176.900 176.900 176.392 0.508 19685 1350 1 3 . 1 1 440 440 LYS CA C 440 57.800 57.800 59.613 -1.813 19685 1351 1 3 . 1 1 440 440 LYS CB C 440 32.100 32.100 31.148 0.952 19685 1352 1 3 . 1 1 440 440 LYS H H 440 8.930 8.930 9.251 -0.321 19685 1353 1 3 . 1 1 441 441 GLN N N 441 117.400 117.400 116.368 1.032 19685 1354 1 3 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.464 -0.234 19685 1355 1 3 . 1 1 441 441 GLN C C 441 177.200 177.200 176.314 0.886 19685 1356 1 3 . 1 1 441 441 GLN CA C 441 57.600 57.600 55.806 1.794 19685 1357 1 3 . 1 1 441 441 GLN CB C 441 28.800 28.800 30.844 -2.044 19685 1358 1 3 . 1 1 441 441 GLN H H 441 8.650 8.650 8.263 0.387 19685 1359 1 3 . 1 1 442 442 THR N N 442 107.300 107.300 116.766 -9.466 19685 1360 1 3 . 1 1 442 442 THR HA H 442 4.290 4.290 4.109 0.181 19685 1361 1 3 . 1 1 442 442 THR C C 442 175.100 175.100 174.745 0.355 19685 1362 1 3 . 1 1 442 442 THR CA C 442 61.200 61.200 64.433 -3.233 19685 1363 1 3 . 1 1 442 442 THR CB C 442 70.300 70.300 68.862 1.438 19685 1364 1 3 . 1 1 442 442 THR H H 442 7.830 7.830 7.683 0.147 19685 1365 1 3 . 1 1 443 443 ASN N N 443 117.300 117.300 117.549 -0.249 19685 1366 1 3 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.408 -0.108 19685 1367 1 3 . 1 1 443 443 ASN C C 443 173.400 173.400 175.404 -2.004 19685 1368 1 3 . 1 1 443 443 ASN CA C 443 54.300 54.300 53.814 0.486 19685 1369 1 3 . 1 1 443 443 ASN CB C 443 37.600 37.600 37.189 0.411 19685 1370 1 3 . 1 1 443 443 ASN H H 443 8.470 8.470 8.002 0.469 19685 1371 1 3 . 1 1 444 444 LEU N N 444 118.000 118.000 112.821 5.179 19685 1372 1 3 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.451 0.109 19685 1373 1 3 . 1 1 444 444 LEU C C 444 176.700 176.700 176.418 0.282 19685 1374 1 3 . 1 1 444 444 LEU CA C 444 53.300 53.300 56.225 -2.925 19685 1375 1 3 . 1 1 444 444 LEU CB C 444 43.500 43.500 41.729 1.771 19685 1376 1 3 . 1 1 444 444 LEU H H 444 7.660 7.660 7.456 0.204 19685 1377 1 3 . 1 1 445 445 SER N N 445 115.500 115.500 112.174 3.326 19685 1378 1 3 . 1 1 445 445 SER HA H 445 4.460 4.460 4.618 -0.158 19685 1379 1 3 . 1 1 445 445 SER C C 445 176.500 176.500 173.477 3.023 19685 1380 1 3 . 1 1 445 445 SER CA C 445 57.900 57.900 57.349 0.551 19685 1381 1 3 . 1 1 445 445 SER CB C 445 63.500 63.500 65.760 -2.260 19685 1382 1 3 . 1 1 445 445 SER H H 445 8.840 8.840 7.469 1.371 19685 1383 1 3 . 1 1 446 446 LYS N N 446 125.200 125.200 119.254 5.946 19685 1384 1 3 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.615 -0.115 19685 1385 1 3 . 1 1 446 446 LYS C C 446 176.100 176.100 176.047 0.053 19685 1386 1 3 . 1 1 446 446 LYS CA C 446 56.300 56.300 55.967 0.333 19685 1387 1 3 . 1 1 446 446 LYS CB C 446 32.200 32.200 32.790 -0.590 19685 1388 1 3 . 1 1 446 446 LYS H H 446 9.230 9.230 8.481 0.749 19685 1389 1 3 . 1 1 447 447 CYS N N 447 113.000 113.000 117.659 -4.659 19685 1390 1 3 . 1 1 447 447 CYS C C 447 172.500 172.500 174.114 -1.614 19685 1391 1 3 . 1 1 447 447 CYS CA C 447 60.400 60.400 56.251 4.149 19685 1392 1 3 . 1 1 447 447 CYS CB C 447 24.900 24.900 30.279 -5.379 19685 1393 1 3 . 1 1 447 447 CYS H H 447 10.020 10.020 7.581 2.439 19685 1394 1 3 . 1 1 448 448 PHE N N 448 115.200 115.200 117.561 -2.361 19685 1395 1 3 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.860 0.480 19685 1396 1 3 . 1 1 448 448 PHE C C 448 172.400 172.400 174.840 -2.440 19685 1397 1 3 . 1 1 448 448 PHE CA C 448 54.700 54.700 56.130 -1.430 19685 1398 1 3 . 1 1 448 448 PHE CB C 448 42.000 42.000 39.485 2.515 19685 1399 1 3 . 1 1 448 448 PHE H H 448 7.810 7.810 7.460 0.350 19685 1400 1 3 . 1 1 449 449 GLY N N 449 107.700 107.700 106.895 0.805 19685 1401 1 3 . 1 1 449 449 GLY C C 449 170.100 170.100 172.831 -2.731 19685 1402 1 3 . 1 1 449 449 GLY CA C 449 45.200 45.200 44.570 0.630 19685 1403 1 3 . 1 1 449 449 GLY H H 449 9.310 9.310 8.773 0.537 19685 1404 1 3 . 1 1 450 450 PHE N N 450 119.900 119.900 113.727 6.173 19685 1405 1 3 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.171 0.259 19685 1406 1 3 . 1 1 450 450 PHE C C 450 172.800 172.800 173.005 -0.205 19685 1407 1 3 . 1 1 450 450 PHE CA C 450 55.000 55.000 57.291 -2.291 19685 1408 1 3 . 1 1 450 450 PHE CB C 450 43.600 43.600 40.581 3.019 19685 1409 1 3 . 1 1 450 450 PHE H H 450 8.760 8.760 8.365 0.395 19685 1410 1 3 . 1 1 451 451 VAL N N 451 123.800 123.800 118.444 5.356 19685 1411 1 3 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.265 0.025 19685 1412 1 3 . 1 1 451 451 VAL C C 451 172.400 172.400 175.830 -3.430 19685 1413 1 3 . 1 1 451 451 VAL CA C 451 59.800 59.800 60.976 -1.176 19685 1414 1 3 . 1 1 451 451 VAL CB C 451 36.100 36.100 35.913 0.188 19685 1415 1 3 . 1 1 451 451 VAL H H 451 7.930 7.930 7.968 -0.038 19685 1416 1 3 . 1 1 452 452 SER N N 452 119.600 119.600 119.726 -0.126 19685 1417 1 3 . 1 1 452 452 SER HA H 452 5.120 5.120 4.908 0.212 19685 1418 1 3 . 1 1 452 452 SER C C 452 173.200 173.200 173.903 -0.703 19685 1419 1 3 . 1 1 452 452 SER CA C 452 55.700 55.700 57.518 -1.818 19685 1420 1 3 . 1 1 452 452 SER CB C 452 66.100 66.100 62.775 3.325 19685 1421 1 3 . 1 1 452 452 SER H H 452 8.540 8.540 8.764 -0.224 19685 1422 1 3 . 1 1 453 453 TYR N N 453 121.400 121.400 124.094 -2.694 19685 1423 1 3 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.498 0.882 19685 1424 1 3 . 1 1 453 453 TYR C C 453 173.600 173.600 176.752 -3.152 19685 1425 1 3 . 1 1 453 453 TYR CA C 453 56.500 56.500 59.067 -2.567 19685 1426 1 3 . 1 1 453 453 TYR CB C 453 42.200 42.200 39.463 2.737 19685 1427 1 3 . 1 1 453 453 TYR H H 453 8.380 8.380 7.342 1.038 19685 1428 1 3 . 1 1 454 454 ASP N N 454 113.300 113.300 123.703 -10.403 19685 1429 1 3 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.234 0.256 19685 1430 1 3 . 1 1 454 454 ASP C C 454 176.100 176.100 175.450 0.650 19685 1431 1 3 . 1 1 454 454 ASP CA C 454 52.800 52.800 57.020 -4.220 19685 1432 1 3 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.953 -1.553 19685 1433 1 3 . 1 1 454 454 ASP H H 454 7.860 7.860 8.168 -0.308 19685 1434 1 3 . 1 1 455 455 ASN N N 455 113.800 113.800 110.838 2.962 19685 1435 1 3 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.067 -0.017 19685 1436 1 3 . 1 1 455 455 ASN C C 455 173.100 173.100 173.618 -0.518 19685 1437 1 3 . 1 1 455 455 ASN CA C 455 50.700 50.700 52.170 -1.470 19685 1438 1 3 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.728 0.372 19685 1439 1 3 . 1 1 455 455 ASN H H 455 7.200 7.200 8.335 -1.135 19685 1440 1 3 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.294 -0.124 19685 1441 1 3 . 1 1 456 456 PRO C C 456 177.300 177.300 177.694 -0.394 19685 1442 1 3 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.843 -0.643 19685 1443 1 3 . 1 1 456 456 PRO CB C 456 32.300 32.300 32.046 0.254 19685 1444 1 3 . 1 1 457 457 VAL N N 457 120.900 120.900 111.520 9.380 19685 1445 1 3 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.130 -0.510 19685 1446 1 3 . 1 1 457 457 VAL C C 457 179.000 179.000 176.437 2.563 19685 1447 1 3 . 1 1 457 457 VAL CA C 457 65.900 65.900 64.174 1.726 19685 1448 1 3 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.294 -0.494 19685 1449 1 3 . 1 1 457 457 VAL H H 457 8.120 8.120 7.680 0.440 19685 1450 1 3 . 1 1 458 458 SER N N 458 117.800 117.800 115.668 2.132 19685 1451 1 3 . 1 1 458 458 SER HA H 458 3.940 3.940 4.593 -0.653 19685 1452 1 3 . 1 1 458 458 SER C C 458 173.600 173.600 175.656 -2.056 19685 1453 1 3 . 1 1 458 458 SER CA C 458 61.100 61.100 59.142 1.958 19685 1454 1 3 . 1 1 458 458 SER CB C 458 62.400 62.400 64.557 -2.157 19685 1455 1 3 . 1 1 458 458 SER H H 458 7.830 7.830 7.763 0.067 19685 1456 1 3 . 1 1 459 459 ALA N N 459 120.000 120.000 125.741 -5.741 19685 1457 1 3 . 1 1 459 459 ALA HA H 459 3.750 3.750 3.157 0.593 19685 1458 1 3 . 1 1 459 459 ALA C C 459 178.100 178.100 178.625 -0.525 19685 1459 1 3 . 1 1 459 459 ALA CA C 459 54.500 54.500 53.868 0.632 19685 1460 1 3 . 1 1 459 459 ALA CB C 459 17.900 17.900 17.841 0.059 19685 1461 1 3 . 1 1 459 459 ALA H H 459 6.370 6.370 7.624 -1.254 19685 1462 1 3 . 1 1 460 460 GLN N N 460 116.100 116.100 117.888 -1.788 19685 1463 1 3 . 1 1 460 460 GLN HA H 460 3.830 3.830 3.992 -0.162 19685 1464 1 3 . 1 1 460 460 GLN C C 460 178.000 178.000 177.114 0.886 19685 1465 1 3 . 1 1 460 460 GLN CA C 460 58.500 58.500 57.859 0.641 19685 1466 1 3 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.019 -0.619 19685 1467 1 3 . 1 1 460 460 GLN H H 460 7.710 7.710 8.028 -0.318 19685 1468 1 3 . 1 1 461 461 ALA N N 461 122.800 122.800 119.778 3.022 19685 1469 1 3 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.272 -0.312 19685 1470 1 3 . 1 1 461 461 ALA C C 461 179.500 179.500 176.705 2.795 19685 1471 1 3 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.014 2.486 19685 1472 1 3 . 1 1 461 461 ALA CB C 461 17.500 17.500 18.782 -1.282 19685 1473 1 3 . 1 1 461 461 ALA H H 461 7.880 7.880 7.626 0.254 19685 1474 1 3 . 1 1 462 462 ALA N N 462 121.400 121.400 118.241 3.159 19685 1475 1 3 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.423 -1.023 19685 1476 1 3 . 1 1 462 462 ALA C C 462 179.400 179.400 176.908 2.492 19685 1477 1 3 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.104 1.996 19685 1478 1 3 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.065 -1.365 19685 1479 1 3 . 1 1 462 462 ALA H H 462 7.860 7.860 7.615 0.245 19685 1480 1 3 . 1 1 463 463 ILE N N 463 118.600 118.600 117.330 1.270 19685 1481 1 3 . 1 1 463 463 ILE HA H 463 3.240 3.240 4.164 -0.924 19685 1482 1 3 . 1 1 463 463 ILE C C 463 177.500 177.500 176.707 0.793 19685 1483 1 3 . 1 1 463 463 ILE CA C 463 66.000 66.000 62.159 3.841 19685 1484 1 3 . 1 1 463 463 ILE CB C 463 38.300 38.300 39.582 -1.282 19685 1485 1 3 . 1 1 463 463 ILE H H 463 8.090 8.090 7.448 0.642 19685 1486 1 3 . 1 1 464 464 GLN N N 464 117.000 117.000 117.695 -0.695 19685 1487 1 3 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.337 -0.467 19685 1488 1 3 . 1 1 464 464 GLN C C 464 177.700 177.700 175.658 2.042 19685 1489 1 3 . 1 1 464 464 GLN CA C 464 58.200 58.200 56.436 1.764 19685 1490 1 3 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.690 -1.790 19685 1491 1 3 . 1 1 464 464 GLN H H 464 7.780 7.780 7.360 0.420 19685 1492 1 3 . 1 1 465 465 ALA N N 465 117.200 117.200 120.752 -3.552 19685 1493 1 3 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.486 -0.256 19685 1494 1 3 . 1 1 465 465 ALA C C 465 179.200 179.200 176.350 2.850 19685 1495 1 3 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.428 1.372 19685 1496 1 3 . 1 1 465 465 ALA CB C 465 21.100 21.100 19.474 1.627 19685 1497 1 3 . 1 1 465 465 ALA H H 465 7.540 7.540 8.033 -0.493 19685 1498 1 3 . 1 1 466 466 MET N N 466 110.800 110.800 116.216 -5.416 19685 1499 1 3 . 1 1 466 466 MET HA H 466 4.820 4.820 4.646 0.174 19685 1500 1 3 . 1 1 466 466 MET C C 466 177.600 177.600 176.099 1.501 19685 1501 1 3 . 1 1 466 466 MET CA C 466 53.300 53.300 55.797 -2.497 19685 1502 1 3 . 1 1 466 466 MET CB C 466 31.600 31.600 34.033 -2.433 19685 1503 1 3 . 1 1 466 466 MET H H 466 8.230 8.230 7.793 0.437 19685 1504 1 3 . 1 1 467 467 ASN N N 467 119.100 119.100 118.029 1.071 19685 1505 1 3 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.636 -0.146 19685 1506 1 3 . 1 1 467 467 ASN C C 467 176.300 176.300 175.652 0.648 19685 1507 1 3 . 1 1 467 467 ASN CA C 467 56.200 56.200 53.829 2.371 19685 1508 1 3 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.033 0.167 19685 1509 1 3 . 1 1 467 467 ASN H H 467 8.560 8.560 8.255 0.305 19685 1510 1 3 . 1 1 468 468 GLY N N 468 117.900 117.900 104.185 13.715 19685 1511 1 3 . 1 1 468 468 GLY C C 468 172.800 172.800 173.790 -0.990 19685 1512 1 3 . 1 1 468 468 GLY CA C 468 45.300 45.300 44.602 0.698 19685 1513 1 3 . 1 1 468 468 GLY H H 468 8.930 8.930 7.955 0.975 19685 1514 1 3 . 1 1 469 469 PHE N N 469 123.300 123.300 122.567 0.733 19685 1515 1 3 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.468 -0.278 19685 1516 1 3 . 1 1 469 469 PHE C C 469 174.400 174.400 175.616 -1.216 19685 1517 1 3 . 1 1 469 469 PHE CA C 469 58.700 58.700 58.739 -0.039 19685 1518 1 3 . 1 1 469 469 PHE CB C 469 40.600 40.600 40.562 0.038 19685 1519 1 3 . 1 1 469 469 PHE H H 469 7.950 7.950 7.644 0.306 19685 1520 1 3 . 1 1 470 470 GLN N N 470 129.200 129.200 118.407 10.793 19685 1521 1 3 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.043 0.547 19685 1522 1 3 . 1 1 470 470 GLN C C 470 174.100 174.100 173.855 0.245 19685 1523 1 3 . 1 1 470 470 GLN CA C 470 55.500 55.500 56.703 -1.203 19685 1524 1 3 . 1 1 470 470 GLN CB C 470 28.800 28.800 28.000 0.800 19685 1525 1 3 . 1 1 470 470 GLN H H 470 8.330 8.330 8.256 0.074 19685 1526 1 3 . 1 1 471 471 ILE N N 471 126.300 126.300 119.376 6.924 19685 1527 1 3 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.497 -0.327 19685 1528 1 3 . 1 1 471 471 ILE C C 471 175.400 175.400 175.229 0.171 19685 1529 1 3 . 1 1 471 471 ILE CA C 471 59.600 59.600 59.907 -0.308 19685 1530 1 3 . 1 1 471 471 ILE CB C 471 39.100 39.100 39.491 -0.391 19685 1531 1 3 . 1 1 471 471 ILE H H 471 8.440 8.440 8.757 -0.317 19685 1532 1 3 . 1 1 472 472 GLY N N 472 117.500 117.500 116.201 1.299 19685 1533 1 3 . 1 1 472 472 GLY C C 472 174.700 174.700 174.179 0.521 19685 1534 1 3 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.781 0.719 19685 1535 1 3 . 1 1 472 472 GLY H H 472 8.980 8.980 8.301 0.679 19685 1536 1 3 . 1 1 473 473 MET N N 473 124.100 124.100 120.250 3.850 19685 1537 1 3 . 1 1 473 473 MET HA H 473 4.380 4.380 4.569 -0.189 19685 1538 1 3 . 1 1 473 473 MET C C 473 175.700 175.700 175.759 -0.059 19685 1539 1 3 . 1 1 473 473 MET CA C 473 55.000 55.000 55.893 -0.893 19685 1540 1 3 . 1 1 473 473 MET CB C 473 32.900 32.900 32.413 0.486 19685 1541 1 3 . 1 1 473 473 MET H H 473 9.070 9.070 8.412 0.658 19685 1542 1 3 . 1 1 474 474 LYS N N 474 118.700 118.700 118.599 0.101 19685 1543 1 3 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.758 -0.278 19685 1544 1 3 . 1 1 474 474 LYS C C 474 174.300 174.300 174.344 -0.044 19685 1545 1 3 . 1 1 474 474 LYS CA C 474 54.600 54.600 55.025 -0.425 19685 1546 1 3 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.179 -0.079 19685 1547 1 3 . 1 1 474 474 LYS H H 474 7.770 7.770 7.665 0.105 19685 1548 1 3 . 1 1 475 475 ARG N N 475 119.600 119.600 118.442 1.158 19685 1549 1 3 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.705 0.095 19685 1550 1 3 . 1 1 475 475 ARG C C 475 175.700 175.700 174.010 1.690 19685 1551 1 3 . 1 1 475 475 ARG CA C 475 54.000 54.000 54.765 -0.765 19685 1552 1 3 . 1 1 475 475 ARG CB C 475 31.300 31.300 31.908 -0.608 19685 1553 1 3 . 1 1 475 475 ARG H H 475 8.350 8.350 8.424 -0.074 19685 1554 1 3 . 1 1 476 476 LEU N N 476 123.500 123.500 121.001 2.499 19685 1555 1 3 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.332 0.098 19685 1556 1 3 . 1 1 476 476 LEU C C 476 177.600 177.600 176.684 0.916 19685 1557 1 3 . 1 1 476 476 LEU CA C 476 55.500 55.500 55.236 0.264 19685 1558 1 3 . 1 1 476 476 LEU CB C 476 42.800 42.800 42.955 -0.155 19685 1559 1 3 . 1 1 476 476 LEU H H 476 9.130 9.130 8.940 0.190 19685 1560 1 3 . 1 1 477 477 LYS N N 477 123.200 123.200 119.940 3.260 19685 1561 1 3 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.549 0.611 19685 1562 1 3 . 1 1 477 477 LYS C C 477 174.100 174.100 175.825 -1.725 19685 1563 1 3 . 1 1 477 477 LYS CA C 477 54.500 54.500 55.004 -0.504 19685 1564 1 3 . 1 1 477 477 LYS CB C 477 34.900 34.900 32.674 2.226 19685 1565 1 3 . 1 1 477 477 LYS H H 477 8.090 8.090 8.553 -0.463 19685 1566 1 3 . 1 1 478 478 VAL N N 478 127.100 127.100 120.293 6.807 19685 1567 1 3 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.256 0.644 19685 1568 1 3 . 1 1 478 478 VAL C C 478 173.700 173.700 175.054 -1.354 19685 1569 1 3 . 1 1 478 478 VAL CA C 478 61.000 61.000 62.564 -1.564 19685 1570 1 3 . 1 1 478 478 VAL CB C 478 33.700 33.700 32.794 0.906 19685 1571 1 3 . 1 1 478 478 VAL H H 478 8.820 8.820 7.778 1.042 19685 1572 1 3 . 1 1 479 479 GLN N N 479 123.600 123.600 124.119 -0.519 19685 1573 1 3 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.474 0.336 19685 1574 1 3 . 1 1 479 479 GLN C C 479 173.600 173.600 173.972 -0.372 19685 1575 1 3 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.284 -1.084 19685 1576 1 3 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.345 1.155 19685 1577 1 3 . 1 1 479 479 GLN H H 479 9.130 9.130 8.335 0.795 19685 1578 1 3 . 1 1 480 480 LEU N N 480 123.200 123.200 123.301 -0.101 19685 1579 1 3 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.341 0.099 19685 1580 1 3 . 1 1 480 480 LEU C C 480 177.100 177.100 176.465 0.635 19685 1581 1 3 . 1 1 480 480 LEU CA C 480 54.600 54.600 54.438 0.162 19685 1582 1 3 . 1 1 480 480 LEU CB C 480 42.400 42.400 42.692 -0.292 19685 1583 1 3 . 1 1 480 480 LEU H H 480 8.840 8.840 8.450 0.390 19685 1584 1 3 . 1 1 481 481 LYS N N 481 124.500 124.500 125.048 -0.548 19685 1585 1 3 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.231 0.079 19685 1586 1 3 . 1 1 481 481 LYS C C 481 175.200 175.200 175.212 -0.012 19685 1587 1 3 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.467 -0.767 19685 1588 1 3 . 1 1 481 481 LYS CB C 481 33.100 33.100 30.911 2.189 19685 1589 1 3 . 1 1 481 481 LYS H H 481 8.400 8.400 8.491 -0.091 19685 1590 1 3 . 1 1 482 482 ARG N N 482 126.600 126.600 123.265 3.335 19685 1591 1 3 . 1 1 482 482 ARG HA H 482 4.350 4.350 4.605 -0.255 19685 1592 1 3 . 1 1 482 482 ARG C C 482 175.800 175.800 175.084 0.716 19685 1593 1 3 . 1 1 482 482 ARG CA C 482 55.600 55.600 54.576 1.024 19685 1594 1 3 . 1 1 482 482 ARG CB C 482 31.100 31.100 31.251 -0.151 19685 1595 1 3 . 1 1 482 482 ARG H H 482 8.770 8.770 8.609 0.161 19685 1596 1 3 . 1 1 483 483 SER N N 483 118.100 118.100 115.961 2.139 19685 1597 1 3 . 1 1 483 483 SER HA H 483 4.400 4.400 4.443 -0.043 19685 1598 1 3 . 1 1 483 483 SER C C 483 174.200 174.200 173.033 1.167 19685 1599 1 3 . 1 1 483 483 SER CA C 483 58.000 58.000 58.742 -0.742 19685 1600 1 3 . 1 1 483 483 SER CB C 483 63.500 63.500 63.737 -0.237 19685 1601 1 3 . 1 1 483 483 SER H H 483 8.610 8.610 8.258 0.352 19685 1602 1 3 . 1 1 484 484 LYS N N 484 123.000 123.000 120.919 2.081 19685 1603 1 3 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.569 -0.359 19685 1604 1 3 . 1 1 484 484 LYS C C 484 175.900 175.900 174.859 1.041 19685 1605 1 3 . 1 1 484 484 LYS CA C 484 56.300 56.300 55.208 1.092 19685 1606 1 3 . 1 1 484 484 LYS CB C 484 32.500 32.500 34.893 -2.393 19685 1607 1 3 . 1 1 484 484 LYS H H 484 8.560 8.560 8.411 0.149 19685 1608 1 3 . 1 1 485 485 ASN N N 485 119.600 119.600 119.278 0.322 19685 1609 1 3 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.876 -0.276 19685 1610 1 3 . 1 1 485 485 ASN C C 485 174.400 174.400 173.899 0.501 19685 1611 1 3 . 1 1 485 485 ASN CA C 485 52.900 52.900 52.093 0.807 19685 1612 1 3 . 1 1 485 485 ASN CB C 485 38.400 38.400 39.070 -0.670 19685 1613 1 3 . 1 1 485 485 ASN H H 485 8.560 8.560 8.520 0.040 19685 1614 1 3 . 1 1 486 486 ASP N N 486 121.100 121.100 120.276 0.824 19685 1615 1 3 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.517 0.003 19685 1616 1 3 . 1 1 486 486 ASP C C 486 175.700 175.700 175.191 0.509 19685 1617 1 3 . 1 1 486 486 ASP CA C 486 54.000 54.000 54.461 -0.461 19685 1618 1 3 . 1 1 486 486 ASP CB C 486 40.800 40.800 41.639 -0.839 19685 1619 1 3 . 1 1 486 486 ASP H H 486 8.250 8.250 8.298 -0.048 19685 1620 1 3 . 1 1 487 487 SER N N 487 115.400 115.400 115.069 0.331 19685 1621 1 3 . 1 1 487 487 SER HA H 487 4.310 4.310 4.434 -0.124 19685 1622 1 3 . 1 1 487 487 SER C C 487 172.800 172.800 173.275 -0.475 19685 1623 1 3 . 1 1 487 487 SER CA C 487 57.700 57.700 57.169 0.531 19685 1624 1 3 . 1 1 487 487 SER CB C 487 63.600 63.600 64.178 -0.578 19685 1625 1 3 . 1 1 487 487 SER H H 487 8.090 8.090 8.011 0.079 19685 1626 1 3 . 1 1 488 488 LYS N N 488 122.300 122.300 123.047 -0.747 19685 1627 1 3 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.391 -0.341 19685 1628 1 3 . 1 1 488 488 LYS C C 488 174.500 174.500 174.894 -0.394 19685 1629 1 3 . 1 1 488 488 LYS CA C 488 54.000 54.000 56.859 -2.860 19685 1630 1 3 . 1 1 488 488 LYS CB C 488 32.400 32.400 32.424 -0.024 19685 1631 1 3 . 1 1 488 488 LYS H H 488 8.090 8.090 8.798 -0.708 19685 1632 1 3 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.308 -0.028 19685 1633 1 3 . 1 1 489 489 PRO C C 489 175.000 175.000 175.370 -0.370 19685 1634 1 3 . 1 1 489 489 PRO CA C 489 63.200 63.200 63.299 -0.099 19685 1635 1 3 . 1 1 489 489 PRO CB C 489 31.100 31.100 31.800 -0.700 19685 1636 1 4 . 1 1 395 395 SER N N 395 115.500 115.500 115.510 -0.010 19685 1637 1 4 . 1 1 395 395 SER HA H 395 4.300 4.300 4.621 -0.321 19685 1638 1 4 . 1 1 395 395 SER C C 395 173.900 173.900 173.763 0.137 19685 1639 1 4 . 1 1 395 395 SER CA C 395 57.900 57.900 57.832 0.068 19685 1640 1 4 . 1 1 395 395 SER CB C 395 63.400 63.400 64.163 -0.763 19685 1641 1 4 . 1 1 395 395 SER H H 395 8.200 8.200 8.483 -0.283 19685 1642 1 4 . 1 1 396 396 HIS N N 396 123.500 123.500 117.666 5.834 19685 1643 1 4 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.155 0.405 19685 1644 1 4 . 1 1 396 396 HIS C C 396 174.100 174.100 174.377 -0.277 19685 1645 1 4 . 1 1 396 396 HIS CA C 396 53.700 53.700 57.531 -3.830 19685 1646 1 4 . 1 1 396 396 HIS CB C 396 32.200 32.200 29.901 2.299 19685 1647 1 4 . 1 1 396 396 HIS H H 396 8.120 8.120 8.230 -0.110 19685 1648 1 4 . 1 1 397 397 MET N N 397 121.200 121.200 119.828 1.372 19685 1649 1 4 . 1 1 397 397 MET HA H 397 4.320 4.320 4.578 -0.258 19685 1650 1 4 . 1 1 397 397 MET C C 397 175.400 175.400 177.848 -2.448 19685 1651 1 4 . 1 1 397 397 MET CA C 397 55.000 55.000 55.712 -0.712 19685 1652 1 4 . 1 1 397 397 MET CB C 397 32.500 32.500 34.119 -1.619 19685 1653 1 4 . 1 1 397 397 MET H H 397 8.300 8.300 8.985 -0.685 19685 1654 1 4 . 1 1 398 398 GLN N N 398 122.100 122.100 120.934 1.166 19685 1655 1 4 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.173 0.017 19685 1656 1 4 . 1 1 398 398 GLN C C 398 174.800 174.800 176.210 -1.410 19685 1657 1 4 . 1 1 398 398 GLN CA C 398 55.200 55.200 58.065 -2.865 19685 1658 1 4 . 1 1 398 398 GLN CB C 398 28.900 28.900 28.721 0.179 19685 1659 1 4 . 1 1 398 398 GLN H H 398 8.540 8.540 8.936 -0.396 19685 1660 1 4 . 1 1 399 399 LYS N N 399 123.000 123.000 117.049 5.951 19685 1661 1 4 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.413 -0.193 19685 1662 1 4 . 1 1 399 399 LYS C C 399 174.800 174.800 176.846 -2.046 19685 1663 1 4 . 1 1 399 399 LYS CA C 399 55.600 55.600 56.622 -1.022 19685 1664 1 4 . 1 1 399 399 LYS CB C 399 33.000 33.000 32.407 0.593 19685 1665 1 4 . 1 1 399 399 LYS H H 399 8.180 8.180 8.217 -0.037 19685 1666 1 4 . 1 1 400 400 GLU N N 400 122.000 122.000 118.690 3.310 19685 1667 1 4 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.703 -0.273 19685 1668 1 4 . 1 1 400 400 GLU C C 400 176.400 176.400 175.521 0.879 19685 1669 1 4 . 1 1 400 400 GLU CA C 400 55.400 55.400 55.482 -0.082 19685 1670 1 4 . 1 1 400 400 GLU CB C 400 31.400 31.400 31.325 0.075 19685 1671 1 4 . 1 1 400 400 GLU H H 400 8.350 8.350 7.671 0.679 19685 1672 1 4 . 1 1 401 401 GLY N N 401 109.500 109.500 108.467 1.033 19685 1673 1 4 . 1 1 401 401 GLY C C 401 171.500 171.500 172.469 -0.969 19685 1674 1 4 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.490 -0.790 19685 1675 1 4 . 1 1 401 401 GLY H H 401 9.050 9.050 7.495 1.555 19685 1676 1 4 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.635 -0.215 19685 1677 1 4 . 1 1 402 402 PRO C C 402 173.900 173.900 176.769 -2.869 19685 1678 1 4 . 1 1 402 402 PRO CA C 402 61.900 61.900 63.995 -2.095 19685 1679 1 4 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.947 -0.747 19685 1680 1 4 . 1 1 403 403 GLU N N 403 119.600 119.600 117.704 1.896 19685 1681 1 4 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.439 -0.479 19685 1682 1 4 . 1 1 403 403 GLU C C 403 177.300 177.300 175.437 1.863 19685 1683 1 4 . 1 1 403 403 GLU CA C 403 58.100 58.100 57.423 0.677 19685 1684 1 4 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.338 -1.338 19685 1685 1 4 . 1 1 403 403 GLU H H 403 8.420 8.420 8.593 -0.173 19685 1686 1 4 . 1 1 404 404 GLY N N 404 112.800 112.800 107.312 5.488 19685 1687 1 4 . 1 1 404 404 GLY C C 404 173.300 173.300 174.110 -0.810 19685 1688 1 4 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.420 -0.520 19685 1689 1 4 . 1 1 404 404 GLY H H 404 8.500 8.500 8.497 0.003 19685 1690 1 4 . 1 1 405 405 ALA N N 405 120.000 120.000 124.716 -4.716 19685 1691 1 4 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.361 0.189 19685 1692 1 4 . 1 1 405 405 ALA C C 405 174.100 174.100 176.111 -2.011 19685 1693 1 4 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.629 -1.129 19685 1694 1 4 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.235 3.565 19685 1695 1 4 . 1 1 405 405 ALA H H 405 8.360 8.360 8.194 0.166 19685 1696 1 4 . 1 1 406 406 ASN N N 406 115.500 115.500 118.224 -2.724 19685 1697 1 4 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.039 0.151 19685 1698 1 4 . 1 1 406 406 ASN C C 406 172.900 172.900 174.444 -1.544 19685 1699 1 4 . 1 1 406 406 ASN CA C 406 52.600 52.600 53.230 -0.630 19685 1700 1 4 . 1 1 406 406 ASN CB C 406 40.900 40.900 39.903 0.997 19685 1701 1 4 . 1 1 406 406 ASN H H 406 7.690 7.690 8.127 -0.437 19685 1702 1 4 . 1 1 407 407 LEU N N 407 123.400 123.400 121.510 1.890 19685 1703 1 4 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.232 0.728 19685 1704 1 4 . 1 1 407 407 LEU C C 407 174.900 174.900 176.299 -1.399 19685 1705 1 4 . 1 1 407 407 LEU CA C 407 53.100 53.100 55.727 -2.627 19685 1706 1 4 . 1 1 407 407 LEU CB C 407 45.400 45.400 42.504 2.896 19685 1707 1 4 . 1 1 407 407 LEU H H 407 9.290 9.290 7.650 1.640 19685 1708 1 4 . 1 1 408 408 PHE N N 408 118.700 118.700 115.984 2.716 19685 1709 1 4 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.384 0.916 19685 1710 1 4 . 1 1 408 408 PHE C C 408 174.200 174.200 173.352 0.848 19685 1711 1 4 . 1 1 408 408 PHE CA C 408 56.300 56.300 58.437 -2.137 19685 1712 1 4 . 1 1 408 408 PHE CB C 408 42.700 42.700 37.592 5.108 19685 1713 1 4 . 1 1 408 408 PHE H H 408 9.150 9.150 8.164 0.986 19685 1714 1 4 . 1 1 409 409 ILE N N 409 120.800 120.800 125.425 -4.625 19685 1715 1 4 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.432 0.538 19685 1716 1 4 . 1 1 409 409 ILE C C 409 173.900 173.900 174.800 -0.900 19685 1717 1 4 . 1 1 409 409 ILE CA C 409 59.000 59.000 60.293 -1.293 19685 1718 1 4 . 1 1 409 409 ILE CB C 409 40.400 40.400 40.522 -0.122 19685 1719 1 4 . 1 1 409 409 ILE H H 409 8.380 8.380 8.611 -0.231 19685 1720 1 4 . 1 1 410 410 TYR N N 410 123.200 123.200 123.622 -0.422 19685 1721 1 4 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.790 0.150 19685 1722 1 4 . 1 1 410 410 TYR C C 410 174.300 174.300 174.151 0.149 19685 1723 1 4 . 1 1 410 410 TYR CA C 410 56.200 56.200 56.790 -0.590 19685 1724 1 4 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.379 1.421 19685 1725 1 4 . 1 1 410 410 TYR H H 410 9.440 9.440 8.512 0.928 19685 1726 1 4 . 1 1 411 411 HIS N N 411 112.100 112.100 120.247 -8.147 19685 1727 1 4 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.520 -0.070 19685 1728 1 4 . 1 1 411 411 HIS C C 411 173.300 173.300 175.251 -1.951 19685 1729 1 4 . 1 1 411 411 HIS CA C 411 55.900 55.900 55.400 0.500 19685 1730 1 4 . 1 1 411 411 HIS CB C 411 26.200 26.200 28.780 -2.580 19685 1731 1 4 . 1 1 411 411 HIS H H 411 8.580 8.580 8.223 0.357 19685 1732 1 4 . 1 1 412 412 LEU N N 412 115.100 115.100 117.807 -2.707 19685 1733 1 4 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.358 -0.398 19685 1734 1 4 . 1 1 412 412 LEU C C 412 175.100 175.100 175.712 -0.612 19685 1735 1 4 . 1 1 412 412 LEU CA C 412 52.400 52.400 53.207 -0.807 19685 1736 1 4 . 1 1 412 412 LEU CB C 412 42.000 42.000 40.248 1.752 19685 1737 1 4 . 1 1 412 412 LEU H H 412 7.560 7.560 7.508 0.052 19685 1738 1 4 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.315 -0.045 19685 1739 1 4 . 1 1 413 413 PRO C C 413 177.600 177.600 176.183 1.417 19685 1740 1 4 . 1 1 413 413 PRO CA C 413 62.300 62.300 62.759 -0.459 19685 1741 1 4 . 1 1 413 413 PRO CB C 413 32.200 32.200 31.915 0.286 19685 1742 1 4 . 1 1 414 414 GLN N N 414 125.500 125.500 117.315 8.185 19685 1743 1 4 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.401 -0.321 19685 1744 1 4 . 1 1 414 414 GLN C C 414 175.400 175.400 175.742 -0.342 19685 1745 1 4 . 1 1 414 414 GLN CA C 414 57.000 57.000 54.958 2.042 19685 1746 1 4 . 1 1 414 414 GLN CB C 414 28.500 28.500 30.327 -1.827 19685 1747 1 4 . 1 1 414 414 GLN H H 414 9.170 9.170 8.049 1.121 19685 1748 1 4 . 1 1 415 415 GLU N N 415 115.300 115.300 118.730 -3.430 19685 1749 1 4 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.084 0.176 19685 1750 1 4 . 1 1 415 415 GLU C C 415 176.700 176.700 174.837 1.863 19685 1751 1 4 . 1 1 415 415 GLU CA C 415 58.700 58.700 57.190 1.510 19685 1752 1 4 . 1 1 415 415 GLU CB C 415 28.300 28.300 29.464 -1.164 19685 1753 1 4 . 1 1 415 415 GLU H H 415 9.390 9.390 9.073 0.317 19685 1754 1 4 . 1 1 416 416 PHE N N 416 121.700 121.700 115.348 6.352 19685 1755 1 4 . 1 1 416 416 PHE HA H 416 4.610 4.610 4.944 -0.334 19685 1756 1 4 . 1 1 416 416 PHE C C 416 176.400 176.400 175.559 0.841 19685 1757 1 4 . 1 1 416 416 PHE CA C 416 57.400 57.400 56.631 0.769 19685 1758 1 4 . 1 1 416 416 PHE CB C 416 38.700 38.700 41.961 -3.261 19685 1759 1 4 . 1 1 416 416 PHE H H 416 7.610 7.610 7.752 -0.142 19685 1760 1 4 . 1 1 417 417 GLY N N 417 113.000 113.000 108.185 4.815 19685 1761 1 4 . 1 1 417 417 GLY C C 417 174.300 174.300 172.826 1.474 19685 1762 1 4 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.253 -3.353 19685 1763 1 4 . 1 1 417 417 GLY H H 417 9.740 9.740 9.396 0.344 19685 1764 1 4 . 1 1 418 418 ASP N N 418 121.500 121.500 118.278 3.222 19685 1765 1 4 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.691 -0.751 19685 1766 1 4 . 1 1 418 418 ASP C C 418 177.900 177.900 176.695 1.205 19685 1767 1 4 . 1 1 418 418 ASP CA C 418 57.600 57.600 54.649 2.951 19685 1768 1 4 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.763 -2.063 19685 1769 1 4 . 1 1 418 418 ASP H H 418 8.680 8.680 8.265 0.415 19685 1770 1 4 . 1 1 419 419 GLN N N 419 116.400 116.400 121.270 -4.870 19685 1771 1 4 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.175 -0.265 19685 1772 1 4 . 1 1 419 419 GLN C C 419 177.600 177.600 175.382 2.218 19685 1773 1 4 . 1 1 419 419 GLN CA C 419 58.000 58.000 58.342 -0.342 19685 1774 1 4 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.678 -1.278 19685 1775 1 4 . 1 1 419 419 GLN H H 419 8.780 8.780 8.314 0.466 19685 1776 1 4 . 1 1 420 420 ASP N N 420 117.500 117.500 114.892 2.608 19685 1777 1 4 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.558 -0.548 19685 1778 1 4 . 1 1 420 420 ASP C C 420 178.000 178.000 176.808 1.192 19685 1779 1 4 . 1 1 420 420 ASP CA C 420 56.700 56.700 54.113 2.587 19685 1780 1 4 . 1 1 420 420 ASP CB C 420 39.800 39.800 39.715 0.084 19685 1781 1 4 . 1 1 420 420 ASP H H 420 7.210 7.210 8.086 -0.876 19685 1782 1 4 . 1 1 421 421 ILE N N 421 117.000 117.000 120.168 -3.168 19685 1783 1 4 . 1 1 421 421 ILE HA H 421 4.080 4.080 4.160 -0.080 19685 1784 1 4 . 1 1 421 421 ILE C C 421 176.500 176.500 177.099 -0.599 19685 1785 1 4 . 1 1 421 421 ILE CA C 421 64.000 64.000 63.341 0.659 19685 1786 1 4 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.272 -0.972 19685 1787 1 4 . 1 1 421 421 ILE H H 421 7.610 7.610 7.754 -0.144 19685 1788 1 4 . 1 1 422 422 LEU N N 422 123.200 123.200 119.693 3.507 19685 1789 1 4 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.107 -0.347 19685 1790 1 4 . 1 1 422 422 LEU C C 422 177.800 177.800 178.531 -0.731 19685 1791 1 4 . 1 1 422 422 LEU CA C 422 58.600 58.600 57.876 0.724 19685 1792 1 4 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.211 -0.011 19685 1793 1 4 . 1 1 422 422 LEU H H 422 7.870 7.870 7.809 0.061 19685 1794 1 4 . 1 1 423 423 GLN N N 423 115.600 115.600 117.260 -1.660 19685 1795 1 4 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.193 -0.313 19685 1796 1 4 . 1 1 423 423 GLN C C 423 177.800 177.800 176.455 1.345 19685 1797 1 4 . 1 1 423 423 GLN CA C 423 58.600 58.600 58.017 0.582 19685 1798 1 4 . 1 1 423 423 GLN CB C 423 27.900 27.900 28.481 -0.581 19685 1799 1 4 . 1 1 423 423 GLN H H 423 7.860 7.860 7.552 0.308 19685 1800 1 4 . 1 1 424 424 MET N N 424 115.500 115.500 117.584 -2.084 19685 1801 1 4 . 1 1 424 424 MET HA H 424 3.910 3.910 4.688 -0.778 19685 1802 1 4 . 1 1 424 424 MET C C 424 175.500 175.500 175.113 0.387 19685 1803 1 4 . 1 1 424 424 MET CA C 424 57.800 57.800 55.584 2.216 19685 1804 1 4 . 1 1 424 424 MET CB C 424 34.300 34.300 34.571 -0.271 19685 1805 1 4 . 1 1 424 424 MET H H 424 7.560 7.560 7.881 -0.321 19685 1806 1 4 . 1 1 425 425 PHE N N 425 112.300 112.300 116.045 -3.745 19685 1807 1 4 . 1 1 425 425 PHE HA H 425 4.700 4.700 5.147 -0.447 19685 1808 1 4 . 1 1 425 425 PHE C C 425 177.300 177.300 176.707 0.593 19685 1809 1 4 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.325 1.575 19685 1810 1 4 . 1 1 425 425 PHE CB C 425 38.500 38.500 41.888 -3.388 19685 1811 1 4 . 1 1 425 425 PHE H H 425 7.680 7.680 7.868 -0.188 19685 1812 1 4 . 1 1 426 426 MET N N 426 127.400 127.400 119.974 7.426 19685 1813 1 4 . 1 1 426 426 MET HA H 426 4.630 4.630 4.328 0.302 19685 1814 1 4 . 1 1 426 426 MET C C 426 173.800 173.800 175.225 -1.425 19685 1815 1 4 . 1 1 426 426 MET CA C 426 59.100 59.100 60.320 -1.220 19685 1816 1 4 . 1 1 426 426 MET CB C 426 31.800 31.800 30.173 1.627 19685 1817 1 4 . 1 1 426 426 MET H H 426 8.540 8.540 8.248 0.292 19685 1818 1 4 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.297 -0.287 19685 1819 1 4 . 1 1 427 427 PRO C C 427 176.800 176.800 176.703 0.097 19685 1820 1 4 . 1 1 427 427 PRO CA C 427 65.200 65.200 64.190 1.010 19685 1821 1 4 . 1 1 427 427 PRO CB C 427 30.600 30.600 30.956 -0.356 19685 1822 1 4 . 1 1 428 428 PHE N N 428 110.000 110.000 118.427 -8.427 19685 1823 1 4 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.610 -0.340 19685 1824 1 4 . 1 1 428 428 PHE C C 428 174.600 174.600 176.969 -2.369 19685 1825 1 4 . 1 1 428 428 PHE CA C 428 57.700 57.700 59.599 -1.899 19685 1826 1 4 . 1 1 428 428 PHE CB C 428 38.000 38.000 39.504 -1.504 19685 1827 1 4 . 1 1 428 428 PHE H H 428 6.560 6.560 7.420 -0.860 19685 1828 1 4 . 1 1 429 429 GLY N N 429 105.500 105.500 103.294 2.206 19685 1829 1 4 . 1 1 429 429 GLY C C 429 170.100 170.100 173.051 -2.951 19685 1830 1 4 . 1 1 429 429 GLY CA C 429 44.400 44.400 43.550 0.850 19685 1831 1 4 . 1 1 429 429 GLY H H 429 7.650 7.650 7.088 0.562 19685 1832 1 4 . 1 1 430 430 ASN N N 430 117.400 117.400 116.883 0.517 19685 1833 1 4 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.416 0.214 19685 1834 1 4 . 1 1 430 430 ASN C C 430 173.200 173.200 174.590 -1.390 19685 1835 1 4 . 1 1 430 430 ASN CA C 430 52.600 52.600 52.859 -0.259 19685 1836 1 4 . 1 1 430 430 ASN CB C 430 37.200 37.200 38.189 -0.989 19685 1837 1 4 . 1 1 430 430 ASN H H 430 9.020 9.020 7.542 1.478 19685 1838 1 4 . 1 1 431 431 VAL N N 431 128.000 128.000 119.031 8.969 19685 1839 1 4 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.390 -0.640 19685 1840 1 4 . 1 1 431 431 VAL C C 431 176.400 176.400 176.525 -0.125 19685 1841 1 4 . 1 1 431 431 VAL CA C 431 61.800 61.800 63.134 -1.334 19685 1842 1 4 . 1 1 431 431 VAL CB C 431 31.900 31.900 32.717 -0.817 19685 1843 1 4 . 1 1 431 431 VAL H H 431 8.480 8.480 8.078 0.402 19685 1844 1 4 . 1 1 432 432 ILE N N 432 128.000 128.000 117.492 10.508 19685 1845 1 4 . 1 1 432 432 ILE HA H 432 3.920 3.920 4.533 -0.613 19685 1846 1 4 . 1 1 432 432 ILE C C 432 176.100 176.100 174.909 1.191 19685 1847 1 4 . 1 1 432 432 ILE CA C 432 62.500 62.500 60.591 1.909 19685 1848 1 4 . 1 1 432 432 ILE CB C 432 37.400 37.400 38.100 -0.700 19685 1849 1 4 . 1 1 432 432 ILE H H 432 8.840 8.840 8.473 0.367 19685 1850 1 4 . 1 1 433 433 SER N N 433 113.600 113.600 115.527 -1.927 19685 1851 1 4 . 1 1 433 433 SER HA H 433 4.440 4.440 4.554 -0.114 19685 1852 1 4 . 1 1 433 433 SER C C 433 171.000 171.000 172.620 -1.620 19685 1853 1 4 . 1 1 433 433 SER CA C 433 57.300 57.300 58.134 -0.834 19685 1854 1 4 . 1 1 433 433 SER CB C 433 65.200 65.200 64.887 0.313 19685 1855 1 4 . 1 1 433 433 SER H H 433 7.280 7.280 7.505 -0.225 19685 1856 1 4 . 1 1 434 434 ALA N N 434 125.700 125.700 127.696 -1.996 19685 1857 1 4 . 1 1 434 434 ALA HA H 434 4.910 4.910 4.829 0.081 19685 1858 1 4 . 1 1 434 434 ALA C C 434 174.600 174.600 175.798 -1.198 19685 1859 1 4 . 1 1 434 434 ALA CA C 434 51.000 51.000 51.223 -0.223 19685 1860 1 4 . 1 1 434 434 ALA CB C 434 21.200 21.200 19.956 1.244 19685 1861 1 4 . 1 1 434 434 ALA H H 434 8.270 8.270 8.436 -0.166 19685 1862 1 4 . 1 1 435 435 LYS N N 435 120.900 120.900 119.045 1.855 19685 1863 1 4 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.089 0.381 19685 1864 1 4 . 1 1 435 435 LYS C C 435 173.800 173.800 175.556 -1.756 19685 1865 1 4 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.709 -2.009 19685 1866 1 4 . 1 1 435 435 LYS CB C 435 36.400 36.400 32.742 3.658 19685 1867 1 4 . 1 1 435 435 LYS H H 435 8.490 8.490 7.183 1.307 19685 1868 1 4 . 1 1 436 436 VAL N N 436 122.200 122.200 119.039 3.161 19685 1869 1 4 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.275 -0.355 19685 1870 1 4 . 1 1 436 436 VAL C C 436 175.100 175.100 174.557 0.543 19685 1871 1 4 . 1 1 436 436 VAL CA C 436 63.600 63.600 61.802 1.798 19685 1872 1 4 . 1 1 436 436 VAL CB C 436 33.500 33.500 31.936 1.564 19685 1873 1 4 . 1 1 436 436 VAL H H 436 8.390 8.390 8.391 -0.001 19685 1874 1 4 . 1 1 437 437 PHE N N 437 125.900 125.900 120.884 5.016 19685 1875 1 4 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.689 -0.289 19685 1876 1 4 . 1 1 437 437 PHE C C 437 173.600 173.600 175.093 -1.493 19685 1877 1 4 . 1 1 437 437 PHE CA C 437 57.700 57.700 56.223 1.477 19685 1878 1 4 . 1 1 437 437 PHE CB C 437 39.000 39.000 41.836 -2.836 19685 1879 1 4 . 1 1 437 437 PHE H H 437 8.250 8.250 7.442 0.808 19685 1880 1 4 . 1 1 438 438 ILE N N 438 121.900 121.900 122.489 -0.589 19685 1881 1 4 . 1 1 438 438 ILE HA H 438 4.460 4.460 3.642 0.818 19685 1882 1 4 . 1 1 438 438 ILE C C 438 175.700 175.700 174.622 1.078 19685 1883 1 4 . 1 1 438 438 ILE CA C 438 58.300 58.300 61.164 -2.864 19685 1884 1 4 . 1 1 438 438 ILE CB C 438 39.700 39.700 35.751 3.949 19685 1885 1 4 . 1 1 438 438 ILE H H 438 8.520 8.520 6.961 1.559 19685 1886 1 4 . 1 1 439 439 ASP N N 439 126.500 126.500 121.049 5.451 19685 1887 1 4 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.195 0.385 19685 1888 1 4 . 1 1 439 439 ASP C C 439 176.300 176.300 175.366 0.934 19685 1889 1 4 . 1 1 439 439 ASP CA C 439 53.600 53.600 55.376 -1.776 19685 1890 1 4 . 1 1 439 439 ASP CB C 439 42.300 42.300 39.498 2.803 19685 1891 1 4 . 1 1 439 439 ASP H H 439 8.730 8.730 8.389 0.341 19685 1892 1 4 . 1 1 440 440 LYS N N 440 127.300 127.300 113.138 14.162 19685 1893 1 4 . 1 1 440 440 LYS HA H 440 4.070 4.070 3.981 0.089 19685 1894 1 4 . 1 1 440 440 LYS C C 440 176.900 176.900 176.239 0.661 19685 1895 1 4 . 1 1 440 440 LYS CA C 440 57.800 57.800 58.441 -0.641 19685 1896 1 4 . 1 1 440 440 LYS CB C 440 32.100 32.100 31.287 0.813 19685 1897 1 4 . 1 1 440 440 LYS H H 440 8.930 8.930 8.495 0.435 19685 1898 1 4 . 1 1 441 441 GLN N N 441 117.400 117.400 111.511 5.889 19685 1899 1 4 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.416 -0.186 19685 1900 1 4 . 1 1 441 441 GLN C C 441 177.200 177.200 176.367 0.833 19685 1901 1 4 . 1 1 441 441 GLN CA C 441 57.600 57.600 55.803 1.797 19685 1902 1 4 . 1 1 441 441 GLN CB C 441 28.800 28.800 30.062 -1.262 19685 1903 1 4 . 1 1 441 441 GLN H H 441 8.650 8.650 7.564 1.086 19685 1904 1 4 . 1 1 442 442 THR N N 442 107.300 107.300 116.174 -8.874 19685 1905 1 4 . 1 1 442 442 THR HA H 442 4.290 4.290 4.222 0.068 19685 1906 1 4 . 1 1 442 442 THR C C 442 175.100 175.100 174.595 0.505 19685 1907 1 4 . 1 1 442 442 THR CA C 442 61.200 61.200 64.466 -3.266 19685 1908 1 4 . 1 1 442 442 THR CB C 442 70.300 70.300 68.752 1.548 19685 1909 1 4 . 1 1 442 442 THR H H 442 7.830 7.830 7.650 0.180 19685 1910 1 4 . 1 1 443 443 ASN N N 443 117.300 117.300 116.302 0.998 19685 1911 1 4 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.197 0.103 19685 1912 1 4 . 1 1 443 443 ASN C C 443 173.400 173.400 174.573 -1.173 19685 1913 1 4 . 1 1 443 443 ASN CA C 443 54.300 54.300 54.008 0.292 19685 1914 1 4 . 1 1 443 443 ASN CB C 443 37.600 37.600 36.827 0.773 19685 1915 1 4 . 1 1 443 443 ASN H H 443 8.470 8.470 7.983 0.487 19685 1916 1 4 . 1 1 444 444 LEU N N 444 118.000 118.000 113.902 4.098 19685 1917 1 4 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.398 0.162 19685 1918 1 4 . 1 1 444 444 LEU C C 444 176.700 176.700 177.502 -0.802 19685 1919 1 4 . 1 1 444 444 LEU CA C 444 53.300 53.300 54.954 -1.654 19685 1920 1 4 . 1 1 444 444 LEU CB C 444 43.500 43.500 42.082 1.418 19685 1921 1 4 . 1 1 444 444 LEU H H 444 7.660 7.660 7.116 0.544 19685 1922 1 4 . 1 1 445 445 SER N N 445 115.500 115.500 117.670 -2.170 19685 1923 1 4 . 1 1 445 445 SER HA H 445 4.460 4.460 4.441 0.019 19685 1924 1 4 . 1 1 445 445 SER C C 445 176.500 176.500 174.771 1.729 19685 1925 1 4 . 1 1 445 445 SER CA C 445 57.900 57.900 58.983 -1.083 19685 1926 1 4 . 1 1 445 445 SER CB C 445 63.500 63.500 63.560 -0.060 19685 1927 1 4 . 1 1 445 445 SER H H 445 8.840 8.840 8.468 0.372 19685 1928 1 4 . 1 1 446 446 LYS N N 446 125.200 125.200 123.575 1.625 19685 1929 1 4 . 1 1 446 446 LYS HA H 446 4.500 4.500 3.966 0.534 19685 1930 1 4 . 1 1 446 446 LYS C C 446 176.100 176.100 174.211 1.889 19685 1931 1 4 . 1 1 446 446 LYS CA C 446 56.300 56.300 57.700 -1.399 19685 1932 1 4 . 1 1 446 446 LYS CB C 446 32.200 32.200 32.889 -0.689 19685 1933 1 4 . 1 1 446 446 LYS H H 446 9.230 9.230 8.736 0.494 19685 1934 1 4 . 1 1 447 447 CYS N N 447 113.000 113.000 116.465 -3.465 19685 1935 1 4 . 1 1 447 447 CYS C C 447 172.500 172.500 173.271 -0.771 19685 1936 1 4 . 1 1 447 447 CYS CA C 447 60.400 60.400 56.798 3.602 19685 1937 1 4 . 1 1 447 447 CYS CB C 447 24.900 24.900 29.625 -4.724 19685 1938 1 4 . 1 1 447 447 CYS H H 447 10.020 10.020 8.215 1.805 19685 1939 1 4 . 1 1 448 448 PHE N N 448 115.200 115.200 120.113 -4.913 19685 1940 1 4 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.691 0.649 19685 1941 1 4 . 1 1 448 448 PHE C C 448 172.400 172.400 172.994 -0.594 19685 1942 1 4 . 1 1 448 448 PHE CA C 448 54.700 54.700 56.453 -1.753 19685 1943 1 4 . 1 1 448 448 PHE CB C 448 42.000 42.000 39.906 2.094 19685 1944 1 4 . 1 1 448 448 PHE H H 448 7.810 7.810 7.793 0.017 19685 1945 1 4 . 1 1 449 449 GLY N N 449 107.700 107.700 105.575 2.125 19685 1946 1 4 . 1 1 449 449 GLY C C 449 170.100 170.100 172.848 -2.748 19685 1947 1 4 . 1 1 449 449 GLY CA C 449 45.200 45.200 43.385 1.815 19685 1948 1 4 . 1 1 449 449 GLY H H 449 9.310 9.310 8.400 0.910 19685 1949 1 4 . 1 1 450 450 PHE N N 450 119.900 119.900 114.868 5.032 19685 1950 1 4 . 1 1 450 450 PHE HA H 450 5.430 5.430 4.902 0.528 19685 1951 1 4 . 1 1 450 450 PHE C C 450 172.800 172.800 173.125 -0.325 19685 1952 1 4 . 1 1 450 450 PHE CA C 450 55.000 55.000 57.163 -2.163 19685 1953 1 4 . 1 1 450 450 PHE CB C 450 43.600 43.600 40.669 2.932 19685 1954 1 4 . 1 1 450 450 PHE H H 450 8.760 8.760 8.039 0.721 19685 1955 1 4 . 1 1 451 451 VAL N N 451 123.800 123.800 118.654 5.146 19685 1956 1 4 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.458 -0.168 19685 1957 1 4 . 1 1 451 451 VAL C C 451 172.400 172.400 175.432 -3.032 19685 1958 1 4 . 1 1 451 451 VAL CA C 451 59.800 59.800 61.467 -1.667 19685 1959 1 4 . 1 1 451 451 VAL CB C 451 36.100 36.100 35.551 0.549 19685 1960 1 4 . 1 1 451 451 VAL H H 451 7.930 7.930 8.379 -0.449 19685 1961 1 4 . 1 1 452 452 SER N N 452 119.600 119.600 124.294 -4.694 19685 1962 1 4 . 1 1 452 452 SER HA H 452 5.120 5.120 5.138 -0.018 19685 1963 1 4 . 1 1 452 452 SER C C 452 173.200 173.200 174.120 -0.920 19685 1964 1 4 . 1 1 452 452 SER CA C 452 55.700 55.700 57.335 -1.635 19685 1965 1 4 . 1 1 452 452 SER CB C 452 66.100 66.100 62.886 3.214 19685 1966 1 4 . 1 1 452 452 SER H H 452 8.540 8.540 8.989 -0.449 19685 1967 1 4 . 1 1 453 453 TYR N N 453 121.400 121.400 125.298 -3.898 19685 1968 1 4 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.335 1.045 19685 1969 1 4 . 1 1 453 453 TYR C C 453 173.600 173.600 176.397 -2.797 19685 1970 1 4 . 1 1 453 453 TYR CA C 453 56.500 56.500 58.262 -1.762 19685 1971 1 4 . 1 1 453 453 TYR CB C 453 42.200 42.200 38.712 3.488 19685 1972 1 4 . 1 1 453 453 TYR H H 453 8.380 8.380 7.865 0.515 19685 1973 1 4 . 1 1 454 454 ASP N N 454 113.300 113.300 121.325 -8.025 19685 1974 1 4 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.598 -0.108 19685 1975 1 4 . 1 1 454 454 ASP C C 454 176.100 176.100 175.732 0.368 19685 1976 1 4 . 1 1 454 454 ASP CA C 454 52.800 52.800 55.324 -2.524 19685 1977 1 4 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.652 -1.252 19685 1978 1 4 . 1 1 454 454 ASP H H 454 7.860 7.860 8.755 -0.895 19685 1979 1 4 . 1 1 455 455 ASN N N 455 113.800 113.800 114.625 -0.825 19685 1980 1 4 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.156 -0.106 19685 1981 1 4 . 1 1 455 455 ASN C C 455 173.100 173.100 173.360 -0.260 19685 1982 1 4 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.463 -0.763 19685 1983 1 4 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.831 0.269 19685 1984 1 4 . 1 1 455 455 ASN H H 455 7.200 7.200 7.589 -0.389 19685 1985 1 4 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.645 -0.475 19685 1986 1 4 . 1 1 456 456 PRO C C 456 177.300 177.300 177.769 -0.469 19685 1987 1 4 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.839 -0.639 19685 1988 1 4 . 1 1 456 456 PRO CB C 456 32.300 32.300 32.274 0.026 19685 1989 1 4 . 1 1 457 457 VAL N N 457 120.900 120.900 117.380 3.520 19685 1990 1 4 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.108 -0.488 19685 1991 1 4 . 1 1 457 457 VAL C C 457 179.000 179.000 177.052 1.948 19685 1992 1 4 . 1 1 457 457 VAL CA C 457 65.900 65.900 63.907 1.993 19685 1993 1 4 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.860 -1.060 19685 1994 1 4 . 1 1 457 457 VAL H H 457 8.120 8.120 7.927 0.193 19685 1995 1 4 . 1 1 458 458 SER N N 458 117.800 117.800 114.260 3.540 19685 1996 1 4 . 1 1 458 458 SER HA H 458 3.940 3.940 4.398 -0.458 19685 1997 1 4 . 1 1 458 458 SER C C 458 173.600 173.600 175.875 -2.275 19685 1998 1 4 . 1 1 458 458 SER CA C 458 61.100 61.100 60.294 0.806 19685 1999 1 4 . 1 1 458 458 SER CB C 458 62.400 62.400 63.275 -0.875 19685 2000 1 4 . 1 1 458 458 SER H H 458 7.830 7.830 7.800 0.030 19685 2001 1 4 . 1 1 459 459 ALA N N 459 120.000 120.000 125.165 -5.165 19685 2002 1 4 . 1 1 459 459 ALA HA H 459 3.750 3.750 4.495 -0.746 19685 2003 1 4 . 1 1 459 459 ALA C C 459 178.100 178.100 178.475 -0.375 19685 2004 1 4 . 1 1 459 459 ALA CA C 459 54.500 54.500 54.340 0.160 19685 2005 1 4 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.330 -0.430 19685 2006 1 4 . 1 1 459 459 ALA H H 459 6.370 6.370 8.484 -2.114 19685 2007 1 4 . 1 1 460 460 GLN N N 460 116.100 116.100 118.999 -2.899 19685 2008 1 4 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.141 -0.311 19685 2009 1 4 . 1 1 460 460 GLN C C 460 178.000 178.000 176.311 1.689 19685 2010 1 4 . 1 1 460 460 GLN CA C 460 58.500 58.500 57.822 0.678 19685 2011 1 4 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.593 -1.194 19685 2012 1 4 . 1 1 460 460 GLN H H 460 7.710 7.710 8.609 -0.899 19685 2013 1 4 . 1 1 461 461 ALA N N 461 122.800 122.800 119.759 3.041 19685 2014 1 4 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.439 -0.479 19685 2015 1 4 . 1 1 461 461 ALA C C 461 179.500 179.500 176.817 2.683 19685 2016 1 4 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.368 2.132 19685 2017 1 4 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.596 -2.095 19685 2018 1 4 . 1 1 461 461 ALA H H 461 7.880 7.880 7.582 0.298 19685 2019 1 4 . 1 1 462 462 ALA N N 462 121.400 121.400 119.869 1.531 19685 2020 1 4 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.634 -1.234 19685 2021 1 4 . 1 1 462 462 ALA C C 462 179.400 179.400 177.733 1.667 19685 2022 1 4 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.785 1.315 19685 2023 1 4 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.252 -1.552 19685 2024 1 4 . 1 1 462 462 ALA H H 462 7.860 7.860 7.704 0.156 19685 2025 1 4 . 1 1 463 463 ILE N N 463 118.600 118.600 118.433 0.167 19685 2026 1 4 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.854 -0.614 19685 2027 1 4 . 1 1 463 463 ILE C C 463 177.500 177.500 176.415 1.085 19685 2028 1 4 . 1 1 463 463 ILE CA C 463 66.000 66.000 62.253 3.747 19685 2029 1 4 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.006 0.294 19685 2030 1 4 . 1 1 463 463 ILE H H 463 8.090 8.090 8.272 -0.182 19685 2031 1 4 . 1 1 464 464 GLN N N 464 117.000 117.000 117.122 -0.122 19685 2032 1 4 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.316 -0.446 19685 2033 1 4 . 1 1 464 464 GLN C C 464 177.700 177.700 175.524 2.176 19685 2034 1 4 . 1 1 464 464 GLN CA C 464 58.200 58.200 56.015 2.185 19685 2035 1 4 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.090 -1.190 19685 2036 1 4 . 1 1 464 464 GLN H H 464 7.780 7.780 8.163 -0.383 19685 2037 1 4 . 1 1 465 465 ALA N N 465 117.200 117.200 120.851 -3.651 19685 2038 1 4 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.307 -0.077 19685 2039 1 4 . 1 1 465 465 ALA C C 465 179.200 179.200 176.842 2.358 19685 2040 1 4 . 1 1 465 465 ALA CA C 465 53.800 53.800 53.152 0.648 19685 2041 1 4 . 1 1 465 465 ALA CB C 465 21.100 21.100 20.376 0.724 19685 2042 1 4 . 1 1 465 465 ALA H H 465 7.540 7.540 7.418 0.122 19685 2043 1 4 . 1 1 466 466 MET N N 466 110.800 110.800 115.486 -4.686 19685 2044 1 4 . 1 1 466 466 MET HA H 466 4.820 4.820 4.514 0.306 19685 2045 1 4 . 1 1 466 466 MET C C 466 177.600 177.600 174.975 2.625 19685 2046 1 4 . 1 1 466 466 MET CA C 466 53.300 53.300 55.359 -2.059 19685 2047 1 4 . 1 1 466 466 MET CB C 466 31.600 31.600 35.331 -3.731 19685 2048 1 4 . 1 1 466 466 MET H H 466 8.230 8.230 7.533 0.697 19685 2049 1 4 . 1 1 467 467 ASN N N 467 119.100 119.100 118.915 0.185 19685 2050 1 4 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.610 -0.120 19685 2051 1 4 . 1 1 467 467 ASN C C 467 176.300 176.300 177.072 -0.772 19685 2052 1 4 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.331 1.869 19685 2053 1 4 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.667 -0.467 19685 2054 1 4 . 1 1 467 467 ASN H H 467 8.560 8.560 7.824 0.736 19685 2055 1 4 . 1 1 468 468 GLY N N 468 117.900 117.900 113.162 4.738 19685 2056 1 4 . 1 1 468 468 GLY C C 468 172.800 172.800 173.460 -0.660 19685 2057 1 4 . 1 1 468 468 GLY CA C 468 45.300 45.300 45.755 -0.455 19685 2058 1 4 . 1 1 468 468 GLY H H 468 8.930 8.930 8.279 0.651 19685 2059 1 4 . 1 1 469 469 PHE N N 469 123.300 123.300 120.103 3.197 19685 2060 1 4 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.700 -0.510 19685 2061 1 4 . 1 1 469 469 PHE C C 469 174.400 174.400 173.690 0.710 19685 2062 1 4 . 1 1 469 469 PHE CA C 469 58.700 58.700 56.466 2.234 19685 2063 1 4 . 1 1 469 469 PHE CB C 469 40.600 40.600 41.230 -0.630 19685 2064 1 4 . 1 1 469 469 PHE H H 469 7.950 7.950 7.645 0.305 19685 2065 1 4 . 1 1 470 470 GLN N N 470 129.200 129.200 125.592 3.608 19685 2066 1 4 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.268 0.322 19685 2067 1 4 . 1 1 470 470 GLN C C 470 174.100 174.100 174.599 -0.499 19685 2068 1 4 . 1 1 470 470 GLN CA C 470 55.500 55.500 55.568 -0.068 19685 2069 1 4 . 1 1 470 470 GLN CB C 470 28.800 28.800 29.156 -0.356 19685 2070 1 4 . 1 1 470 470 GLN H H 470 8.330 8.330 8.124 0.206 19685 2071 1 4 . 1 1 471 471 ILE N N 471 126.300 126.300 125.673 0.627 19685 2072 1 4 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.195 -0.025 19685 2073 1 4 . 1 1 471 471 ILE C C 471 175.400 175.400 175.124 0.276 19685 2074 1 4 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.679 -1.079 19685 2075 1 4 . 1 1 471 471 ILE CB C 471 39.100 39.100 40.142 -1.042 19685 2076 1 4 . 1 1 471 471 ILE H H 471 8.440 8.440 8.756 -0.316 19685 2077 1 4 . 1 1 472 472 GLY N N 472 117.500 117.500 116.649 0.851 19685 2078 1 4 . 1 1 472 472 GLY C C 472 174.700 174.700 174.689 0.011 19685 2079 1 4 . 1 1 472 472 GLY CA C 472 46.500 46.500 46.494 0.006 19685 2080 1 4 . 1 1 472 472 GLY H H 472 8.980 8.980 8.521 0.459 19685 2081 1 4 . 1 1 473 473 MET N N 473 124.100 124.100 120.387 3.713 19685 2082 1 4 . 1 1 473 473 MET HA H 473 4.380 4.380 4.673 -0.293 19685 2083 1 4 . 1 1 473 473 MET C C 473 175.700 175.700 175.468 0.232 19685 2084 1 4 . 1 1 473 473 MET CA C 473 55.000 55.000 55.655 -0.655 19685 2085 1 4 . 1 1 473 473 MET CB C 473 32.900 32.900 33.209 -0.309 19685 2086 1 4 . 1 1 473 473 MET H H 473 9.070 9.070 8.422 0.648 19685 2087 1 4 . 1 1 474 474 LYS N N 474 118.700 118.700 120.569 -1.869 19685 2088 1 4 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.646 -0.166 19685 2089 1 4 . 1 1 474 474 LYS C C 474 174.300 174.300 176.361 -2.061 19685 2090 1 4 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.440 0.160 19685 2091 1 4 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.129 -0.029 19685 2092 1 4 . 1 1 474 474 LYS H H 474 7.770 7.770 8.030 -0.260 19685 2093 1 4 . 1 1 475 475 ARG N N 475 119.600 119.600 119.964 -0.364 19685 2094 1 4 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.327 0.473 19685 2095 1 4 . 1 1 475 475 ARG C C 475 175.700 175.700 175.433 0.267 19685 2096 1 4 . 1 1 475 475 ARG CA C 475 54.000 54.000 56.064 -2.064 19685 2097 1 4 . 1 1 475 475 ARG CB C 475 31.300 31.300 30.816 0.484 19685 2098 1 4 . 1 1 475 475 ARG H H 475 8.350 8.350 8.742 -0.392 19685 2099 1 4 . 1 1 476 476 LEU N N 476 123.500 123.500 120.355 3.145 19685 2100 1 4 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.094 0.336 19685 2101 1 4 . 1 1 476 476 LEU C C 476 177.600 177.600 174.690 2.910 19685 2102 1 4 . 1 1 476 476 LEU CA C 476 55.500 55.500 55.871 -0.371 19685 2103 1 4 . 1 1 476 476 LEU CB C 476 42.800 42.800 41.852 0.948 19685 2104 1 4 . 1 1 476 476 LEU H H 476 9.130 9.130 8.005 1.125 19685 2105 1 4 . 1 1 477 477 LYS N N 477 123.200 123.200 125.198 -1.998 19685 2106 1 4 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.642 0.518 19685 2107 1 4 . 1 1 477 477 LYS C C 477 174.100 174.100 174.555 -0.455 19685 2108 1 4 . 1 1 477 477 LYS CA C 477 54.500 54.500 54.914 -0.414 19685 2109 1 4 . 1 1 477 477 LYS CB C 477 34.900 34.900 34.919 -0.019 19685 2110 1 4 . 1 1 477 477 LYS H H 477 8.090 8.090 8.371 -0.281 19685 2111 1 4 . 1 1 478 478 VAL N N 478 127.100 127.100 122.568 4.532 19685 2112 1 4 . 1 1 478 478 VAL HA H 478 4.900 4.900 5.275 -0.375 19685 2113 1 4 . 1 1 478 478 VAL C C 478 173.700 173.700 174.001 -0.301 19685 2114 1 4 . 1 1 478 478 VAL CA C 478 61.000 61.000 59.946 1.054 19685 2115 1 4 . 1 1 478 478 VAL CB C 478 33.700 33.700 35.044 -1.344 19685 2116 1 4 . 1 1 478 478 VAL H H 478 8.820 8.820 8.482 0.338 19685 2117 1 4 . 1 1 479 479 GLN N N 479 123.600 123.600 127.368 -3.768 19685 2118 1 4 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.561 0.249 19685 2119 1 4 . 1 1 479 479 GLN C C 479 173.600 173.600 173.655 -0.055 19685 2120 1 4 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.772 -1.572 19685 2121 1 4 . 1 1 479 479 GLN CB C 479 33.500 33.500 33.298 0.202 19685 2122 1 4 . 1 1 479 479 GLN H H 479 9.130 9.130 9.082 0.048 19685 2123 1 4 . 1 1 480 480 LEU N N 480 123.200 123.200 124.845 -1.645 19685 2124 1 4 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.351 0.089 19685 2125 1 4 . 1 1 480 480 LEU C C 480 177.100 177.100 177.409 -0.309 19685 2126 1 4 . 1 1 480 480 LEU CA C 480 54.600 54.600 55.655 -1.055 19685 2127 1 4 . 1 1 480 480 LEU CB C 480 42.400 42.400 42.513 -0.113 19685 2128 1 4 . 1 1 480 480 LEU H H 480 8.840 8.840 8.546 0.294 19685 2129 1 4 . 1 1 481 481 LYS N N 481 124.500 124.500 123.532 0.968 19685 2130 1 4 . 1 1 481 481 LYS HA H 481 4.310 4.310 3.809 0.501 19685 2131 1 4 . 1 1 481 481 LYS C C 481 175.200 175.200 176.369 -1.169 19685 2132 1 4 . 1 1 481 481 LYS CA C 481 56.700 56.700 58.359 -1.659 19685 2133 1 4 . 1 1 481 481 LYS CB C 481 33.100 33.100 31.824 1.276 19685 2134 1 4 . 1 1 481 481 LYS H H 481 8.400 8.400 8.356 0.044 19685 2135 1 4 . 1 1 482 482 ARG N N 482 126.600 126.600 118.978 7.622 19685 2136 1 4 . 1 1 482 482 ARG HA H 482 4.350 4.350 3.951 0.399 19685 2137 1 4 . 1 1 482 482 ARG C C 482 175.800 175.800 175.387 0.413 19685 2138 1 4 . 1 1 482 482 ARG CA C 482 55.600 55.600 57.059 -1.459 19685 2139 1 4 . 1 1 482 482 ARG CB C 482 31.100 31.100 29.099 2.001 19685 2140 1 4 . 1 1 482 482 ARG H H 482 8.770 8.770 8.056 0.714 19685 2141 1 4 . 1 1 483 483 SER N N 483 118.100 118.100 116.667 1.433 19685 2142 1 4 . 1 1 483 483 SER HA H 483 4.400 4.400 4.375 0.025 19685 2143 1 4 . 1 1 483 483 SER C C 483 174.200 174.200 173.282 0.918 19685 2144 1 4 . 1 1 483 483 SER CA C 483 58.000 58.000 57.902 0.098 19685 2145 1 4 . 1 1 483 483 SER CB C 483 63.500 63.500 64.919 -1.419 19685 2146 1 4 . 1 1 483 483 SER H H 483 8.610 8.610 8.366 0.244 19685 2147 1 4 . 1 1 484 484 LYS N N 484 123.000 123.000 120.497 2.503 19685 2148 1 4 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.223 -0.013 19685 2149 1 4 . 1 1 484 484 LYS C C 484 175.900 175.900 174.682 1.218 19685 2150 1 4 . 1 1 484 484 LYS CA C 484 56.300 56.300 55.603 0.697 19685 2151 1 4 . 1 1 484 484 LYS CB C 484 32.500 32.500 33.131 -0.631 19685 2152 1 4 . 1 1 484 484 LYS H H 484 8.560 8.560 8.425 0.135 19685 2153 1 4 . 1 1 485 485 ASN N N 485 119.600 119.600 117.202 2.398 19685 2154 1 4 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.876 -0.276 19685 2155 1 4 . 1 1 485 485 ASN C C 485 174.400 174.400 172.715 1.685 19685 2156 1 4 . 1 1 485 485 ASN CA C 485 52.900 52.900 52.793 0.107 19685 2157 1 4 . 1 1 485 485 ASN CB C 485 38.400 38.400 39.984 -1.584 19685 2158 1 4 . 1 1 485 485 ASN H H 485 8.560 8.560 7.661 0.899 19685 2159 1 4 . 1 1 486 486 ASP N N 486 121.100 121.100 119.562 1.538 19685 2160 1 4 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.881 -0.361 19685 2161 1 4 . 1 1 486 486 ASP C C 486 175.700 175.700 174.914 0.786 19685 2162 1 4 . 1 1 486 486 ASP CA C 486 54.000 54.000 52.633 1.367 19685 2163 1 4 . 1 1 486 486 ASP CB C 486 40.800 40.800 43.826 -3.026 19685 2164 1 4 . 1 1 486 486 ASP H H 486 8.250 8.250 8.069 0.181 19685 2165 1 4 . 1 1 487 487 SER N N 487 115.400 115.400 115.104 0.296 19685 2166 1 4 . 1 1 487 487 SER HA H 487 4.310 4.310 4.377 -0.067 19685 2167 1 4 . 1 1 487 487 SER C C 487 172.800 172.800 174.273 -1.473 19685 2168 1 4 . 1 1 487 487 SER CA C 487 57.700 57.700 58.543 -0.843 19685 2169 1 4 . 1 1 487 487 SER CB C 487 63.600 63.600 64.051 -0.451 19685 2170 1 4 . 1 1 487 487 SER H H 487 8.090 8.090 8.291 -0.201 19685 2171 1 4 . 1 1 488 488 LYS N N 488 122.300 122.300 120.644 1.656 19685 2172 1 4 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.416 -0.366 19685 2173 1 4 . 1 1 488 488 LYS C C 488 174.500 174.500 176.036 -1.536 19685 2174 1 4 . 1 1 488 488 LYS CA C 488 54.000 54.000 54.728 -0.728 19685 2175 1 4 . 1 1 488 488 LYS CB C 488 32.400 32.400 31.702 0.698 19685 2176 1 4 . 1 1 488 488 LYS H H 488 8.090 8.090 8.448 -0.358 19685 2177 1 4 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.306 -0.026 19685 2178 1 4 . 1 1 489 489 PRO C C 489 175.000 175.000 175.402 -0.402 19685 2179 1 4 . 1 1 489 489 PRO CA C 489 63.200 63.200 63.636 -0.436 19685 2180 1 4 . 1 1 489 489 PRO CB C 489 31.100 31.100 31.749 -0.649 19685 2181 1 5 . 1 1 395 395 SER N N 395 115.500 115.500 115.444 0.056 19685 2182 1 5 . 1 1 395 395 SER HA H 395 4.300 4.300 4.636 -0.336 19685 2183 1 5 . 1 1 395 395 SER C C 395 173.900 173.900 174.935 -1.035 19685 2184 1 5 . 1 1 395 395 SER CA C 395 57.900 57.900 58.481 -0.581 19685 2185 1 5 . 1 1 395 395 SER CB C 395 63.400 63.400 63.684 -0.284 19685 2186 1 5 . 1 1 395 395 SER H H 395 8.200 8.200 8.766 -0.566 19685 2187 1 5 . 1 1 396 396 HIS N N 396 123.500 123.500 119.804 3.696 19685 2188 1 5 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.733 -0.173 19685 2189 1 5 . 1 1 396 396 HIS C C 396 174.100 174.100 173.175 0.925 19685 2190 1 5 . 1 1 396 396 HIS CA C 396 53.700 53.700 55.771 -2.071 19685 2191 1 5 . 1 1 396 396 HIS CB C 396 32.200 32.200 31.631 0.569 19685 2192 1 5 . 1 1 396 396 HIS H H 396 8.120 8.120 7.737 0.383 19685 2193 1 5 . 1 1 397 397 MET N N 397 121.200 121.200 121.051 0.149 19685 2194 1 5 . 1 1 397 397 MET HA H 397 4.320 4.320 4.487 -0.167 19685 2195 1 5 . 1 1 397 397 MET C C 397 175.400 175.400 174.674 0.726 19685 2196 1 5 . 1 1 397 397 MET CA C 397 55.000 55.000 54.532 0.468 19685 2197 1 5 . 1 1 397 397 MET CB C 397 32.500 32.500 34.381 -1.881 19685 2198 1 5 . 1 1 397 397 MET H H 397 8.300 8.300 7.572 0.728 19685 2199 1 5 . 1 1 398 398 GLN N N 398 122.100 122.100 118.920 3.180 19685 2200 1 5 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.105 0.085 19685 2201 1 5 . 1 1 398 398 GLN C C 398 174.800 174.800 175.164 -0.364 19685 2202 1 5 . 1 1 398 398 GLN CA C 398 55.200 55.200 56.201 -1.001 19685 2203 1 5 . 1 1 398 398 GLN CB C 398 28.900 28.900 28.439 0.462 19685 2204 1 5 . 1 1 398 398 GLN H H 398 8.540 8.540 8.359 0.181 19685 2205 1 5 . 1 1 399 399 LYS N N 399 123.000 123.000 119.213 3.787 19685 2206 1 5 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.529 -0.309 19685 2207 1 5 . 1 1 399 399 LYS C C 399 174.800 174.800 176.390 -1.590 19685 2208 1 5 . 1 1 399 399 LYS CA C 399 55.600 55.600 56.312 -0.713 19685 2209 1 5 . 1 1 399 399 LYS CB C 399 33.000 33.000 33.413 -0.413 19685 2210 1 5 . 1 1 399 399 LYS H H 399 8.180 8.180 8.574 -0.394 19685 2211 1 5 . 1 1 400 400 GLU N N 400 122.000 122.000 119.946 2.054 19685 2212 1 5 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.267 0.163 19685 2213 1 5 . 1 1 400 400 GLU C C 400 176.400 176.400 177.145 -0.745 19685 2214 1 5 . 1 1 400 400 GLU CA C 400 55.400 55.400 56.024 -0.624 19685 2215 1 5 . 1 1 400 400 GLU CB C 400 31.400 31.400 30.489 0.911 19685 2216 1 5 . 1 1 400 400 GLU H H 400 8.350 8.350 8.143 0.207 19685 2217 1 5 . 1 1 401 401 GLY N N 401 109.500 109.500 107.947 1.553 19685 2218 1 5 . 1 1 401 401 GLY C C 401 171.500 171.500 173.835 -2.335 19685 2219 1 5 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.149 -0.449 19685 2220 1 5 . 1 1 401 401 GLY H H 401 9.050 9.050 8.044 1.006 19685 2221 1 5 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.471 -0.051 19685 2222 1 5 . 1 1 402 402 PRO C C 402 173.900 173.900 176.144 -2.244 19685 2223 1 5 . 1 1 402 402 PRO CA C 402 61.900 61.900 62.614 -0.714 19685 2224 1 5 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.110 0.090 19685 2225 1 5 . 1 1 403 403 GLU N N 403 119.600 119.600 117.308 2.292 19685 2226 1 5 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.135 -0.175 19685 2227 1 5 . 1 1 403 403 GLU C C 403 177.300 177.300 176.808 0.492 19685 2228 1 5 . 1 1 403 403 GLU CA C 403 58.100 58.100 56.995 1.105 19685 2229 1 5 . 1 1 403 403 GLU CB C 403 29.000 29.000 29.539 -0.539 19685 2230 1 5 . 1 1 403 403 GLU H H 403 8.420 8.420 7.796 0.624 19685 2231 1 5 . 1 1 404 404 GLY N N 404 112.800 112.800 109.287 3.513 19685 2232 1 5 . 1 1 404 404 GLY C C 404 173.300 173.300 173.350 -0.050 19685 2233 1 5 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.533 -0.633 19685 2234 1 5 . 1 1 404 404 GLY H H 404 8.500 8.500 8.421 0.079 19685 2235 1 5 . 1 1 405 405 ALA N N 405 120.000 120.000 120.972 -0.972 19685 2236 1 5 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.487 0.063 19685 2237 1 5 . 1 1 405 405 ALA C C 405 174.100 174.100 174.885 -0.785 19685 2238 1 5 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.626 -1.126 19685 2239 1 5 . 1 1 405 405 ALA CB C 405 20.800 20.800 19.155 1.645 19685 2240 1 5 . 1 1 405 405 ALA H H 405 8.360 8.360 7.792 0.568 19685 2241 1 5 . 1 1 406 406 ASN N N 406 115.500 115.500 118.037 -2.537 19685 2242 1 5 . 1 1 406 406 ASN HA H 406 5.190 5.190 4.998 0.192 19685 2243 1 5 . 1 1 406 406 ASN C C 406 172.900 172.900 174.869 -1.969 19685 2244 1 5 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.805 0.795 19685 2245 1 5 . 1 1 406 406 ASN CB C 406 40.900 40.900 39.264 1.636 19685 2246 1 5 . 1 1 406 406 ASN H H 406 7.690 7.690 8.082 -0.392 19685 2247 1 5 . 1 1 407 407 LEU N N 407 123.400 123.400 121.186 2.214 19685 2248 1 5 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.024 0.936 19685 2249 1 5 . 1 1 407 407 LEU C C 407 174.900 174.900 176.030 -1.130 19685 2250 1 5 . 1 1 407 407 LEU CA C 407 53.100 53.100 56.019 -2.919 19685 2251 1 5 . 1 1 407 407 LEU CB C 407 45.400 45.400 42.220 3.180 19685 2252 1 5 . 1 1 407 407 LEU H H 407 9.290 9.290 8.019 1.271 19685 2253 1 5 . 1 1 408 408 PHE N N 408 118.700 118.700 121.619 -2.919 19685 2254 1 5 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.702 0.598 19685 2255 1 5 . 1 1 408 408 PHE C C 408 174.200 174.200 175.304 -1.104 19685 2256 1 5 . 1 1 408 408 PHE CA C 408 56.300 56.300 56.749 -0.449 19685 2257 1 5 . 1 1 408 408 PHE CB C 408 42.700 42.700 38.350 4.350 19685 2258 1 5 . 1 1 408 408 PHE H H 408 9.150 9.150 8.542 0.608 19685 2259 1 5 . 1 1 409 409 ILE N N 409 120.800 120.800 121.633 -0.833 19685 2260 1 5 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.020 0.950 19685 2261 1 5 . 1 1 409 409 ILE C C 409 173.900 173.900 175.120 -1.220 19685 2262 1 5 . 1 1 409 409 ILE CA C 409 59.000 59.000 61.843 -2.843 19685 2263 1 5 . 1 1 409 409 ILE CB C 409 40.400 40.400 37.779 2.621 19685 2264 1 5 . 1 1 409 409 ILE H H 409 8.380 8.380 7.525 0.855 19685 2265 1 5 . 1 1 410 410 TYR N N 410 123.200 123.200 122.289 0.911 19685 2266 1 5 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.796 0.144 19685 2267 1 5 . 1 1 410 410 TYR C C 410 174.300 174.300 175.196 -0.896 19685 2268 1 5 . 1 1 410 410 TYR CA C 410 56.200 56.200 57.653 -1.453 19685 2269 1 5 . 1 1 410 410 TYR CB C 410 40.800 40.800 38.965 1.835 19685 2270 1 5 . 1 1 410 410 TYR H H 410 9.440 9.440 8.687 0.753 19685 2271 1 5 . 1 1 411 411 HIS N N 411 112.100 112.100 121.767 -9.667 19685 2272 1 5 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.471 -0.021 19685 2273 1 5 . 1 1 411 411 HIS C C 411 173.300 173.300 174.928 -1.628 19685 2274 1 5 . 1 1 411 411 HIS CA C 411 55.900 55.900 55.592 0.308 19685 2275 1 5 . 1 1 411 411 HIS CB C 411 26.200 26.200 28.127 -1.927 19685 2276 1 5 . 1 1 411 411 HIS H H 411 8.580 8.580 8.344 0.236 19685 2277 1 5 . 1 1 412 412 LEU N N 412 115.100 115.100 124.774 -9.674 19685 2278 1 5 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.218 -0.258 19685 2279 1 5 . 1 1 412 412 LEU C C 412 175.100 175.100 175.422 -0.322 19685 2280 1 5 . 1 1 412 412 LEU CA C 412 52.400 52.400 53.850 -1.450 19685 2281 1 5 . 1 1 412 412 LEU CB C 412 42.000 42.000 42.693 -0.693 19685 2282 1 5 . 1 1 412 412 LEU H H 412 7.560 7.560 7.483 0.077 19685 2283 1 5 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.619 -0.349 19685 2284 1 5 . 1 1 413 413 PRO C C 413 177.600 177.600 177.717 -0.117 19685 2285 1 5 . 1 1 413 413 PRO CA C 413 62.300 62.300 62.425 -0.125 19685 2286 1 5 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.741 -0.541 19685 2287 1 5 . 1 1 414 414 GLN N N 414 125.500 125.500 116.492 9.008 19685 2288 1 5 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.353 -0.273 19685 2289 1 5 . 1 1 414 414 GLN C C 414 175.400 175.400 176.082 -0.682 19685 2290 1 5 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.380 -0.381 19685 2291 1 5 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.384 0.116 19685 2292 1 5 . 1 1 414 414 GLN H H 414 9.170 9.170 8.727 0.443 19685 2293 1 5 . 1 1 415 415 GLU N N 415 115.300 115.300 119.050 -3.750 19685 2294 1 5 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.504 -0.244 19685 2295 1 5 . 1 1 415 415 GLU C C 415 176.700 176.700 174.818 1.882 19685 2296 1 5 . 1 1 415 415 GLU CA C 415 58.700 58.700 55.803 2.897 19685 2297 1 5 . 1 1 415 415 GLU CB C 415 28.300 28.300 30.726 -2.426 19685 2298 1 5 . 1 1 415 415 GLU H H 415 9.390 9.390 8.572 0.818 19685 2299 1 5 . 1 1 416 416 PHE N N 416 121.700 121.700 117.292 4.408 19685 2300 1 5 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.095 -0.485 19685 2301 1 5 . 1 1 416 416 PHE C C 416 176.400 176.400 175.021 1.379 19685 2302 1 5 . 1 1 416 416 PHE CA C 416 57.400 57.400 57.323 0.077 19685 2303 1 5 . 1 1 416 416 PHE CB C 416 38.700 38.700 43.059 -4.359 19685 2304 1 5 . 1 1 416 416 PHE H H 416 7.610 7.610 7.617 -0.007 19685 2305 1 5 . 1 1 417 417 GLY N N 417 113.000 113.000 108.315 4.685 19685 2306 1 5 . 1 1 417 417 GLY C C 417 174.300 174.300 172.824 1.476 19685 2307 1 5 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.157 -3.257 19685 2308 1 5 . 1 1 417 417 GLY H H 417 9.740 9.740 9.631 0.109 19685 2309 1 5 . 1 1 418 418 ASP N N 418 121.500 121.500 115.895 5.605 19685 2310 1 5 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.746 -0.806 19685 2311 1 5 . 1 1 418 418 ASP C C 418 177.900 177.900 177.522 0.378 19685 2312 1 5 . 1 1 418 418 ASP CA C 418 57.600 57.600 54.867 2.732 19685 2313 1 5 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.075 -1.375 19685 2314 1 5 . 1 1 418 418 ASP H H 418 8.680 8.680 8.139 0.541 19685 2315 1 5 . 1 1 419 419 GLN N N 419 116.400 116.400 119.628 -3.228 19685 2316 1 5 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.250 -0.340 19685 2317 1 5 . 1 1 419 419 GLN C C 419 177.600 177.600 175.684 1.916 19685 2318 1 5 . 1 1 419 419 GLN CA C 419 58.000 58.000 58.231 -0.231 19685 2319 1 5 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.663 -1.263 19685 2320 1 5 . 1 1 419 419 GLN H H 419 8.780 8.780 8.578 0.202 19685 2321 1 5 . 1 1 420 420 ASP N N 420 117.500 117.500 116.298 1.202 19685 2322 1 5 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.757 -0.747 19685 2323 1 5 . 1 1 420 420 ASP C C 420 178.000 178.000 177.747 0.253 19685 2324 1 5 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.844 2.856 19685 2325 1 5 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.501 -0.701 19685 2326 1 5 . 1 1 420 420 ASP H H 420 7.210 7.210 8.431 -1.221 19685 2327 1 5 . 1 1 421 421 ILE N N 421 117.000 117.000 120.813 -3.813 19685 2328 1 5 . 1 1 421 421 ILE HA H 421 4.080 4.080 4.058 0.022 19685 2329 1 5 . 1 1 421 421 ILE C C 421 176.500 176.500 176.447 0.053 19685 2330 1 5 . 1 1 421 421 ILE CA C 421 64.000 64.000 63.566 0.434 19685 2331 1 5 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.080 -0.780 19685 2332 1 5 . 1 1 421 421 ILE H H 421 7.610 7.610 7.893 -0.283 19685 2333 1 5 . 1 1 422 422 LEU N N 422 123.200 123.200 118.309 4.891 19685 2334 1 5 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.204 -0.444 19685 2335 1 5 . 1 1 422 422 LEU C C 422 177.800 177.800 176.845 0.955 19685 2336 1 5 . 1 1 422 422 LEU CA C 422 58.600 58.600 56.093 2.506 19685 2337 1 5 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.524 -0.324 19685 2338 1 5 . 1 1 422 422 LEU H H 422 7.870 7.870 7.962 -0.092 19685 2339 1 5 . 1 1 423 423 GLN N N 423 115.600 115.600 116.084 -0.484 19685 2340 1 5 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.498 -0.618 19685 2341 1 5 . 1 1 423 423 GLN C C 423 177.800 177.800 175.832 1.968 19685 2342 1 5 . 1 1 423 423 GLN CA C 423 58.600 58.600 56.026 2.574 19685 2343 1 5 . 1 1 423 423 GLN CB C 423 27.900 27.900 30.002 -2.102 19685 2344 1 5 . 1 1 423 423 GLN H H 423 7.860 7.860 7.822 0.038 19685 2345 1 5 . 1 1 424 424 MET N N 424 115.500 115.500 117.834 -2.334 19685 2346 1 5 . 1 1 424 424 MET HA H 424 3.910 3.910 4.494 -0.584 19685 2347 1 5 . 1 1 424 424 MET C C 424 175.500 175.500 175.069 0.431 19685 2348 1 5 . 1 1 424 424 MET CA C 424 57.800 57.800 55.902 1.898 19685 2349 1 5 . 1 1 424 424 MET CB C 424 34.300 34.300 34.725 -0.425 19685 2350 1 5 . 1 1 424 424 MET H H 424 7.560 7.560 7.917 -0.357 19685 2351 1 5 . 1 1 425 425 PHE N N 425 112.300 112.300 118.072 -5.772 19685 2352 1 5 . 1 1 425 425 PHE HA H 425 4.700 4.700 4.905 -0.205 19685 2353 1 5 . 1 1 425 425 PHE C C 425 177.300 177.300 176.548 0.752 19685 2354 1 5 . 1 1 425 425 PHE CA C 425 59.900 59.900 57.936 1.964 19685 2355 1 5 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.009 -1.509 19685 2356 1 5 . 1 1 425 425 PHE H H 425 7.680 7.680 7.847 -0.167 19685 2357 1 5 . 1 1 426 426 MET N N 426 127.400 127.400 119.230 8.170 19685 2358 1 5 . 1 1 426 426 MET HA H 426 4.630 4.630 4.329 0.301 19685 2359 1 5 . 1 1 426 426 MET C C 426 173.800 173.800 175.789 -1.989 19685 2360 1 5 . 1 1 426 426 MET CA C 426 59.100 59.100 59.482 -0.382 19685 2361 1 5 . 1 1 426 426 MET CB C 426 31.800 31.800 30.309 1.490 19685 2362 1 5 . 1 1 426 426 MET H H 426 8.540 8.540 8.350 0.190 19685 2363 1 5 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.250 -0.240 19685 2364 1 5 . 1 1 427 427 PRO C C 427 176.800 176.800 176.825 -0.025 19685 2365 1 5 . 1 1 427 427 PRO CA C 427 65.200 65.200 64.181 1.019 19685 2366 1 5 . 1 1 427 427 PRO CB C 427 30.600 30.600 30.740 -0.140 19685 2367 1 5 . 1 1 428 428 PHE N N 428 110.000 110.000 117.693 -7.693 19685 2368 1 5 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.635 -0.365 19685 2369 1 5 . 1 1 428 428 PHE C C 428 174.600 174.600 175.851 -1.251 19685 2370 1 5 . 1 1 428 428 PHE CA C 428 57.700 57.700 59.123 -1.423 19685 2371 1 5 . 1 1 428 428 PHE CB C 428 38.000 38.000 40.450 -2.450 19685 2372 1 5 . 1 1 428 428 PHE H H 428 6.560 6.560 7.276 -0.716 19685 2373 1 5 . 1 1 429 429 GLY N N 429 105.500 105.500 102.755 2.745 19685 2374 1 5 . 1 1 429 429 GLY C C 429 170.100 170.100 172.489 -2.389 19685 2375 1 5 . 1 1 429 429 GLY CA C 429 44.400 44.400 44.279 0.121 19685 2376 1 5 . 1 1 429 429 GLY H H 429 7.650 7.650 7.410 0.240 19685 2377 1 5 . 1 1 430 430 ASN N N 430 117.400 117.400 116.303 1.097 19685 2378 1 5 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.269 0.361 19685 2379 1 5 . 1 1 430 430 ASN C C 430 173.200 173.200 174.657 -1.457 19685 2380 1 5 . 1 1 430 430 ASN CA C 430 52.600 52.600 54.330 -1.730 19685 2381 1 5 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.163 -1.963 19685 2382 1 5 . 1 1 430 430 ASN H H 430 9.020 9.020 7.556 1.464 19685 2383 1 5 . 1 1 431 431 VAL N N 431 128.000 128.000 119.166 8.834 19685 2384 1 5 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.352 -0.602 19685 2385 1 5 . 1 1 431 431 VAL C C 431 176.400 176.400 177.543 -1.143 19685 2386 1 5 . 1 1 431 431 VAL CA C 431 61.800 61.800 63.463 -1.663 19685 2387 1 5 . 1 1 431 431 VAL CB C 431 31.900 31.900 32.825 -0.925 19685 2388 1 5 . 1 1 431 431 VAL H H 431 8.480 8.480 8.684 -0.204 19685 2389 1 5 . 1 1 432 432 ILE N N 432 128.000 128.000 115.607 12.393 19685 2390 1 5 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.668 0.252 19685 2391 1 5 . 1 1 432 432 ILE C C 432 176.100 176.100 175.653 0.447 19685 2392 1 5 . 1 1 432 432 ILE CA C 432 62.500 62.500 64.022 -1.522 19685 2393 1 5 . 1 1 432 432 ILE CB C 432 37.400 37.400 36.794 0.606 19685 2394 1 5 . 1 1 432 432 ILE H H 432 8.840 8.840 8.166 0.674 19685 2395 1 5 . 1 1 433 433 SER N N 433 113.600 113.600 114.395 -0.795 19685 2396 1 5 . 1 1 433 433 SER HA H 433 4.440 4.440 4.719 -0.279 19685 2397 1 5 . 1 1 433 433 SER C C 433 171.000 171.000 172.102 -1.102 19685 2398 1 5 . 1 1 433 433 SER CA C 433 57.300 57.300 57.836 -0.536 19685 2399 1 5 . 1 1 433 433 SER CB C 433 65.200 65.200 66.499 -1.300 19685 2400 1 5 . 1 1 433 433 SER H H 433 7.280 7.280 8.129 -0.849 19685 2401 1 5 . 1 1 434 434 ALA N N 434 125.700 125.700 124.275 1.425 19685 2402 1 5 . 1 1 434 434 ALA HA H 434 4.910 4.910 5.201 -0.291 19685 2403 1 5 . 1 1 434 434 ALA C C 434 174.600 174.600 176.349 -1.749 19685 2404 1 5 . 1 1 434 434 ALA CA C 434 51.000 51.000 51.464 -0.464 19685 2405 1 5 . 1 1 434 434 ALA CB C 434 21.200 21.200 22.013 -0.813 19685 2406 1 5 . 1 1 434 434 ALA H H 434 8.270 8.270 8.269 0.001 19685 2407 1 5 . 1 1 435 435 LYS N N 435 120.900 120.900 120.912 -0.012 19685 2408 1 5 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.691 -0.221 19685 2409 1 5 . 1 1 435 435 LYS C C 435 173.800 173.800 177.304 -3.504 19685 2410 1 5 . 1 1 435 435 LYS CA C 435 53.700 53.700 56.130 -2.429 19685 2411 1 5 . 1 1 435 435 LYS CB C 435 36.400 36.400 35.924 0.476 19685 2412 1 5 . 1 1 435 435 LYS H H 435 8.490 8.490 8.262 0.228 19685 2413 1 5 . 1 1 436 436 VAL N N 436 122.200 122.200 117.159 5.041 19685 2414 1 5 . 1 1 436 436 VAL HA H 436 3.920 3.920 3.366 0.554 19685 2415 1 5 . 1 1 436 436 VAL C C 436 175.100 175.100 173.513 1.587 19685 2416 1 5 . 1 1 436 436 VAL CA C 436 63.600 63.600 63.950 -0.350 19685 2417 1 5 . 1 1 436 436 VAL CB C 436 33.500 33.500 30.370 3.130 19685 2418 1 5 . 1 1 436 436 VAL H H 436 8.390 8.390 8.239 0.151 19685 2419 1 5 . 1 1 437 437 PHE N N 437 125.900 125.900 114.525 11.375 19685 2420 1 5 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.653 -0.253 19685 2421 1 5 . 1 1 437 437 PHE C C 437 173.600 173.600 176.597 -2.997 19685 2422 1 5 . 1 1 437 437 PHE CA C 437 57.700 57.700 56.355 1.345 19685 2423 1 5 . 1 1 437 437 PHE CB C 437 39.000 39.000 41.307 -2.307 19685 2424 1 5 . 1 1 437 437 PHE H H 437 8.250 8.250 7.345 0.905 19685 2425 1 5 . 1 1 438 438 ILE N N 438 121.900 121.900 123.725 -1.825 19685 2426 1 5 . 1 1 438 438 ILE HA H 438 4.460 4.460 3.985 0.475 19685 2427 1 5 . 1 1 438 438 ILE C C 438 175.700 175.700 176.046 -0.346 19685 2428 1 5 . 1 1 438 438 ILE CA C 438 58.300 58.300 61.293 -2.993 19685 2429 1 5 . 1 1 438 438 ILE CB C 438 39.700 39.700 36.674 3.026 19685 2430 1 5 . 1 1 438 438 ILE H H 438 8.520 8.520 8.659 -0.139 19685 2431 1 5 . 1 1 439 439 ASP N N 439 126.500 126.500 119.606 6.894 19685 2432 1 5 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.305 0.275 19685 2433 1 5 . 1 1 439 439 ASP C C 439 176.300 176.300 176.080 0.220 19685 2434 1 5 . 1 1 439 439 ASP CA C 439 53.600 53.600 55.585 -1.985 19685 2435 1 5 . 1 1 439 439 ASP CB C 439 42.300 42.300 39.999 2.300 19685 2436 1 5 . 1 1 439 439 ASP H H 439 8.730 8.730 8.097 0.633 19685 2437 1 5 . 1 1 440 440 LYS N N 440 127.300 127.300 113.573 13.727 19685 2438 1 5 . 1 1 440 440 LYS HA H 440 4.070 4.070 3.884 0.186 19685 2439 1 5 . 1 1 440 440 LYS C C 440 176.900 176.900 176.061 0.839 19685 2440 1 5 . 1 1 440 440 LYS CA C 440 57.800 57.800 58.701 -0.901 19685 2441 1 5 . 1 1 440 440 LYS CB C 440 32.100 32.100 30.837 1.263 19685 2442 1 5 . 1 1 440 440 LYS H H 440 8.930 8.930 8.777 0.153 19685 2443 1 5 . 1 1 441 441 GLN N N 441 117.400 117.400 113.565 3.835 19685 2444 1 5 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.431 -0.201 19685 2445 1 5 . 1 1 441 441 GLN C C 441 177.200 177.200 176.641 0.559 19685 2446 1 5 . 1 1 441 441 GLN CA C 441 57.600 57.600 56.023 1.577 19685 2447 1 5 . 1 1 441 441 GLN CB C 441 28.800 28.800 30.046 -1.246 19685 2448 1 5 . 1 1 441 441 GLN H H 441 8.650 8.650 8.016 0.634 19685 2449 1 5 . 1 1 442 442 THR N N 442 107.300 107.300 116.918 -9.618 19685 2450 1 5 . 1 1 442 442 THR HA H 442 4.290 4.290 4.262 0.028 19685 2451 1 5 . 1 1 442 442 THR C C 442 175.100 175.100 174.390 0.710 19685 2452 1 5 . 1 1 442 442 THR CA C 442 61.200 61.200 63.811 -2.611 19685 2453 1 5 . 1 1 442 442 THR CB C 442 70.300 70.300 68.703 1.597 19685 2454 1 5 . 1 1 442 442 THR H H 442 7.830 7.830 7.701 0.129 19685 2455 1 5 . 1 1 443 443 ASN N N 443 117.300 117.300 117.726 -0.426 19685 2456 1 5 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.388 -0.088 19685 2457 1 5 . 1 1 443 443 ASN C C 443 173.400 173.400 174.280 -0.880 19685 2458 1 5 . 1 1 443 443 ASN CA C 443 54.300 54.300 53.887 0.413 19685 2459 1 5 . 1 1 443 443 ASN CB C 443 37.600 37.600 37.036 0.564 19685 2460 1 5 . 1 1 443 443 ASN H H 443 8.470 8.470 8.135 0.335 19685 2461 1 5 . 1 1 444 444 LEU N N 444 118.000 118.000 117.157 0.843 19685 2462 1 5 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.457 0.103 19685 2463 1 5 . 1 1 444 444 LEU C C 444 176.700 176.700 176.505 0.195 19685 2464 1 5 . 1 1 444 444 LEU CA C 444 53.300 53.300 53.786 -0.486 19685 2465 1 5 . 1 1 444 444 LEU CB C 444 43.500 43.500 42.830 0.670 19685 2466 1 5 . 1 1 444 444 LEU H H 444 7.660 7.660 7.245 0.415 19685 2467 1 5 . 1 1 445 445 SER N N 445 115.500 115.500 112.286 3.214 19685 2468 1 5 . 1 1 445 445 SER HA H 445 4.460 4.460 4.145 0.315 19685 2469 1 5 . 1 1 445 445 SER C C 445 176.500 176.500 174.762 1.738 19685 2470 1 5 . 1 1 445 445 SER CA C 445 57.900 57.900 58.659 -0.759 19685 2471 1 5 . 1 1 445 445 SER CB C 445 63.500 63.500 63.569 -0.069 19685 2472 1 5 . 1 1 445 445 SER H H 445 8.840 8.840 8.059 0.781 19685 2473 1 5 . 1 1 446 446 LYS N N 446 125.200 125.200 122.877 2.323 19685 2474 1 5 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.044 0.456 19685 2475 1 5 . 1 1 446 446 LYS C C 446 176.100 176.100 176.095 0.005 19685 2476 1 5 . 1 1 446 446 LYS CA C 446 56.300 56.300 58.256 -1.956 19685 2477 1 5 . 1 1 446 446 LYS CB C 446 32.200 32.200 32.894 -0.694 19685 2478 1 5 . 1 1 446 446 LYS H H 446 9.230 9.230 7.904 1.326 19685 2479 1 5 . 1 1 447 447 CYS N N 447 113.000 113.000 116.642 -3.642 19685 2480 1 5 . 1 1 447 447 CYS C C 447 172.500 172.500 173.129 -0.629 19685 2481 1 5 . 1 1 447 447 CYS CA C 447 60.400 60.400 57.923 2.477 19685 2482 1 5 . 1 1 447 447 CYS CB C 447 24.900 24.900 30.534 -5.634 19685 2483 1 5 . 1 1 447 447 CYS H H 447 10.020 10.020 7.403 2.617 19685 2484 1 5 . 1 1 448 448 PHE N N 448 115.200 115.200 115.840 -0.640 19685 2485 1 5 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.027 1.313 19685 2486 1 5 . 1 1 448 448 PHE C C 448 172.400 172.400 173.351 -0.951 19685 2487 1 5 . 1 1 448 448 PHE CA C 448 54.700 54.700 58.601 -3.901 19685 2488 1 5 . 1 1 448 448 PHE CB C 448 42.000 42.000 37.652 4.348 19685 2489 1 5 . 1 1 448 448 PHE H H 448 7.810 7.810 8.514 -0.704 19685 2490 1 5 . 1 1 449 449 GLY N N 449 107.700 107.700 106.321 1.379 19685 2491 1 5 . 1 1 449 449 GLY C C 449 170.100 170.100 172.097 -1.997 19685 2492 1 5 . 1 1 449 449 GLY CA C 449 45.200 45.200 43.920 1.280 19685 2493 1 5 . 1 1 449 449 GLY H H 449 9.310 9.310 8.212 1.098 19685 2494 1 5 . 1 1 450 450 PHE N N 450 119.900 119.900 113.775 6.125 19685 2495 1 5 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.110 0.320 19685 2496 1 5 . 1 1 450 450 PHE C C 450 172.800 172.800 172.979 -0.179 19685 2497 1 5 . 1 1 450 450 PHE CA C 450 55.000 55.000 54.871 0.129 19685 2498 1 5 . 1 1 450 450 PHE CB C 450 43.600 43.600 40.089 3.511 19685 2499 1 5 . 1 1 450 450 PHE H H 450 8.760 8.760 8.189 0.571 19685 2500 1 5 . 1 1 451 451 VAL N N 451 123.800 123.800 117.883 5.917 19685 2501 1 5 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.613 -0.323 19685 2502 1 5 . 1 1 451 451 VAL C C 451 172.400 172.400 176.145 -3.745 19685 2503 1 5 . 1 1 451 451 VAL CA C 451 59.800 59.800 60.976 -1.176 19685 2504 1 5 . 1 1 451 451 VAL CB C 451 36.100 36.100 36.000 0.100 19685 2505 1 5 . 1 1 451 451 VAL H H 451 7.930 7.930 7.989 -0.059 19685 2506 1 5 . 1 1 452 452 SER N N 452 119.600 119.600 121.863 -2.263 19685 2507 1 5 . 1 1 452 452 SER HA H 452 5.120 5.120 4.476 0.644 19685 2508 1 5 . 1 1 452 452 SER C C 452 173.200 173.200 174.107 -0.907 19685 2509 1 5 . 1 1 452 452 SER CA C 452 55.700 55.700 57.617 -1.917 19685 2510 1 5 . 1 1 452 452 SER CB C 452 66.100 66.100 62.577 3.523 19685 2511 1 5 . 1 1 452 452 SER H H 452 8.540 8.540 8.318 0.222 19685 2512 1 5 . 1 1 453 453 TYR N N 453 121.400 121.400 123.672 -2.272 19685 2513 1 5 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.511 0.869 19685 2514 1 5 . 1 1 453 453 TYR C C 453 173.600 173.600 176.754 -3.154 19685 2515 1 5 . 1 1 453 453 TYR CA C 453 56.500 56.500 59.193 -2.693 19685 2516 1 5 . 1 1 453 453 TYR CB C 453 42.200 42.200 38.449 3.751 19685 2517 1 5 . 1 1 453 453 TYR H H 453 8.380 8.380 7.853 0.527 19685 2518 1 5 . 1 1 454 454 ASP N N 454 113.300 113.300 123.288 -9.988 19685 2519 1 5 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.434 0.056 19685 2520 1 5 . 1 1 454 454 ASP C C 454 176.100 176.100 175.602 0.498 19685 2521 1 5 . 1 1 454 454 ASP CA C 454 52.800 52.800 55.735 -2.935 19685 2522 1 5 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.682 -1.282 19685 2523 1 5 . 1 1 454 454 ASP H H 454 7.860 7.860 8.462 -0.602 19685 2524 1 5 . 1 1 455 455 ASN N N 455 113.800 113.800 113.578 0.222 19685 2525 1 5 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.111 -0.060 19685 2526 1 5 . 1 1 455 455 ASN C C 455 173.100 173.100 173.314 -0.214 19685 2527 1 5 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.356 -0.656 19685 2528 1 5 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.758 0.341 19685 2529 1 5 . 1 1 455 455 ASN H H 455 7.200 7.200 7.785 -0.585 19685 2530 1 5 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.603 -0.433 19685 2531 1 5 . 1 1 456 456 PRO C C 456 177.300 177.300 177.322 -0.022 19685 2532 1 5 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.645 -0.445 19685 2533 1 5 . 1 1 456 456 PRO CB C 456 32.300 32.300 32.330 -0.030 19685 2534 1 5 . 1 1 457 457 VAL N N 457 120.900 120.900 115.833 5.067 19685 2535 1 5 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.261 -0.641 19685 2536 1 5 . 1 1 457 457 VAL C C 457 179.000 179.000 176.246 2.754 19685 2537 1 5 . 1 1 457 457 VAL CA C 457 65.900 65.900 62.286 3.614 19685 2538 1 5 . 1 1 457 457 VAL CB C 457 30.800 30.800 32.595 -1.795 19685 2539 1 5 . 1 1 457 457 VAL H H 457 8.120 8.120 7.904 0.216 19685 2540 1 5 . 1 1 458 458 SER N N 458 117.800 117.800 116.211 1.589 19685 2541 1 5 . 1 1 458 458 SER HA H 458 3.940 3.940 4.553 -0.613 19685 2542 1 5 . 1 1 458 458 SER C C 458 173.600 173.600 175.428 -1.828 19685 2543 1 5 . 1 1 458 458 SER CA C 458 61.100 61.100 60.365 0.735 19685 2544 1 5 . 1 1 458 458 SER CB C 458 62.400 62.400 64.194 -1.794 19685 2545 1 5 . 1 1 458 458 SER H H 458 7.830 7.830 7.610 0.220 19685 2546 1 5 . 1 1 459 459 ALA N N 459 120.000 120.000 124.945 -4.945 19685 2547 1 5 . 1 1 459 459 ALA HA H 459 3.750 3.750 4.006 -0.256 19685 2548 1 5 . 1 1 459 459 ALA C C 459 178.100 178.100 177.736 0.364 19685 2549 1 5 . 1 1 459 459 ALA CA C 459 54.500 54.500 54.175 0.326 19685 2550 1 5 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.568 -0.668 19685 2551 1 5 . 1 1 459 459 ALA H H 459 6.370 6.370 7.754 -1.384 19685 2552 1 5 . 1 1 460 460 GLN N N 460 116.100 116.100 118.540 -2.440 19685 2553 1 5 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.022 -0.192 19685 2554 1 5 . 1 1 460 460 GLN C C 460 178.000 178.000 176.305 1.695 19685 2555 1 5 . 1 1 460 460 GLN CA C 460 58.500 58.500 58.066 0.434 19685 2556 1 5 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.523 -1.123 19685 2557 1 5 . 1 1 460 460 GLN H H 460 7.710 7.710 8.623 -0.913 19685 2558 1 5 . 1 1 461 461 ALA N N 461 122.800 122.800 117.483 5.317 19685 2559 1 5 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.315 -0.355 19685 2560 1 5 . 1 1 461 461 ALA C C 461 179.500 179.500 176.961 2.539 19685 2561 1 5 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.095 2.405 19685 2562 1 5 . 1 1 461 461 ALA CB C 461 17.500 17.500 18.924 -1.423 19685 2563 1 5 . 1 1 461 461 ALA H H 461 7.880 7.880 7.345 0.535 19685 2564 1 5 . 1 1 462 462 ALA N N 462 121.400 121.400 119.928 1.472 19685 2565 1 5 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.519 -1.119 19685 2566 1 5 . 1 1 462 462 ALA C C 462 179.400 179.400 178.589 0.811 19685 2567 1 5 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.501 1.599 19685 2568 1 5 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.474 -1.774 19685 2569 1 5 . 1 1 462 462 ALA H H 462 7.860 7.860 7.352 0.508 19685 2570 1 5 . 1 1 463 463 ILE N N 463 118.600 118.600 120.549 -1.949 19685 2571 1 5 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.773 -0.533 19685 2572 1 5 . 1 1 463 463 ILE C C 463 177.500 177.500 176.819 0.681 19685 2573 1 5 . 1 1 463 463 ILE CA C 463 66.000 66.000 63.062 2.938 19685 2574 1 5 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.121 0.179 19685 2575 1 5 . 1 1 463 463 ILE H H 463 8.090 8.090 8.478 -0.388 19685 2576 1 5 . 1 1 464 464 GLN N N 464 117.000 117.000 117.733 -0.733 19685 2577 1 5 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.170 -0.300 19685 2578 1 5 . 1 1 464 464 GLN C C 464 177.700 177.700 175.490 2.210 19685 2579 1 5 . 1 1 464 464 GLN CA C 464 58.200 58.200 56.858 1.342 19685 2580 1 5 . 1 1 464 464 GLN CB C 464 27.900 27.900 28.339 -0.439 19685 2581 1 5 . 1 1 464 464 GLN H H 464 7.780 7.780 8.141 -0.361 19685 2582 1 5 . 1 1 465 465 ALA N N 465 117.200 117.200 120.248 -3.048 19685 2583 1 5 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.199 0.031 19685 2584 1 5 . 1 1 465 465 ALA C C 465 179.200 179.200 176.657 2.543 19685 2585 1 5 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.906 0.894 19685 2586 1 5 . 1 1 465 465 ALA CB C 465 21.100 21.100 19.920 1.180 19685 2587 1 5 . 1 1 465 465 ALA H H 465 7.540 7.540 7.418 0.122 19685 2588 1 5 . 1 1 466 466 MET N N 466 110.800 110.800 116.388 -5.588 19685 2589 1 5 . 1 1 466 466 MET HA H 466 4.820 4.820 4.795 0.025 19685 2590 1 5 . 1 1 466 466 MET C C 466 177.600 177.600 175.620 1.980 19685 2591 1 5 . 1 1 466 466 MET CA C 466 53.300 53.300 55.140 -1.840 19685 2592 1 5 . 1 1 466 466 MET CB C 466 31.600 31.600 35.247 -3.647 19685 2593 1 5 . 1 1 466 466 MET H H 466 8.230 8.230 7.677 0.553 19685 2594 1 5 . 1 1 467 467 ASN N N 467 119.100 119.100 118.991 0.109 19685 2595 1 5 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.454 0.036 19685 2596 1 5 . 1 1 467 467 ASN C C 467 176.300 176.300 176.951 -0.651 19685 2597 1 5 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.779 1.421 19685 2598 1 5 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.573 -0.373 19685 2599 1 5 . 1 1 467 467 ASN H H 467 8.560 8.560 7.897 0.663 19685 2600 1 5 . 1 1 468 468 GLY N N 468 117.900 117.900 113.013 4.887 19685 2601 1 5 . 1 1 468 468 GLY C C 468 172.800 172.800 173.756 -0.956 19685 2602 1 5 . 1 1 468 468 GLY CA C 468 45.300 45.300 45.632 -0.332 19685 2603 1 5 . 1 1 468 468 GLY H H 468 8.930 8.930 8.560 0.370 19685 2604 1 5 . 1 1 469 469 PHE N N 469 123.300 123.300 121.975 1.325 19685 2605 1 5 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.732 -0.542 19685 2606 1 5 . 1 1 469 469 PHE C C 469 174.400 174.400 174.209 0.191 19685 2607 1 5 . 1 1 469 469 PHE CA C 469 58.700 58.700 55.108 3.592 19685 2608 1 5 . 1 1 469 469 PHE CB C 469 40.600 40.600 40.300 0.300 19685 2609 1 5 . 1 1 469 469 PHE H H 469 7.950 7.950 7.800 0.150 19685 2610 1 5 . 1 1 470 470 GLN N N 470 129.200 129.200 126.922 2.278 19685 2611 1 5 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.227 0.363 19685 2612 1 5 . 1 1 470 470 GLN C C 470 174.100 174.100 174.790 -0.690 19685 2613 1 5 . 1 1 470 470 GLN CA C 470 55.500 55.500 56.842 -1.342 19685 2614 1 5 . 1 1 470 470 GLN CB C 470 28.800 28.800 29.065 -0.265 19685 2615 1 5 . 1 1 470 470 GLN H H 470 8.330 8.330 8.779 -0.449 19685 2616 1 5 . 1 1 471 471 ILE N N 471 126.300 126.300 122.646 3.654 19685 2617 1 5 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.222 -0.052 19685 2618 1 5 . 1 1 471 471 ILE C C 471 175.400 175.400 175.668 -0.268 19685 2619 1 5 . 1 1 471 471 ILE CA C 471 59.600 59.600 61.513 -1.913 19685 2620 1 5 . 1 1 471 471 ILE CB C 471 39.100 39.100 40.861 -1.760 19685 2621 1 5 . 1 1 471 471 ILE H H 471 8.440 8.440 8.379 0.061 19685 2622 1 5 . 1 1 472 472 GLY N N 472 117.500 117.500 107.983 9.517 19685 2623 1 5 . 1 1 472 472 GLY C C 472 174.700 174.700 173.310 1.390 19685 2624 1 5 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.411 1.089 19685 2625 1 5 . 1 1 472 472 GLY H H 472 8.980 8.980 7.722 1.258 19685 2626 1 5 . 1 1 473 473 MET N N 473 124.100 124.100 117.260 6.840 19685 2627 1 5 . 1 1 473 473 MET HA H 473 4.380 4.380 4.014 0.366 19685 2628 1 5 . 1 1 473 473 MET C C 473 175.700 175.700 174.160 1.540 19685 2629 1 5 . 1 1 473 473 MET CA C 473 55.000 55.000 57.094 -2.094 19685 2630 1 5 . 1 1 473 473 MET CB C 473 32.900 32.900 31.865 1.035 19685 2631 1 5 . 1 1 473 473 MET H H 473 9.070 9.070 8.415 0.655 19685 2632 1 5 . 1 1 474 474 LYS N N 474 118.700 118.700 113.282 5.418 19685 2633 1 5 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.509 -0.029 19685 2634 1 5 . 1 1 474 474 LYS C C 474 174.300 174.300 174.280 0.020 19685 2635 1 5 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.869 -0.269 19685 2636 1 5 . 1 1 474 474 LYS CB C 474 35.100 35.100 34.726 0.374 19685 2637 1 5 . 1 1 474 474 LYS H H 474 7.770 7.770 7.218 0.552 19685 2638 1 5 . 1 1 475 475 ARG N N 475 119.600 119.600 119.307 0.293 19685 2639 1 5 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.865 -0.065 19685 2640 1 5 . 1 1 475 475 ARG C C 475 175.700 175.700 174.250 1.450 19685 2641 1 5 . 1 1 475 475 ARG CA C 475 54.000 54.000 54.108 -0.108 19685 2642 1 5 . 1 1 475 475 ARG CB C 475 31.300 31.300 32.721 -1.421 19685 2643 1 5 . 1 1 475 475 ARG H H 475 8.350 8.350 8.451 -0.101 19685 2644 1 5 . 1 1 476 476 LEU N N 476 123.500 123.500 121.423 2.077 19685 2645 1 5 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.506 -0.076 19685 2646 1 5 . 1 1 476 476 LEU C C 476 177.600 177.600 176.469 1.131 19685 2647 1 5 . 1 1 476 476 LEU CA C 476 55.500 55.500 54.311 1.189 19685 2648 1 5 . 1 1 476 476 LEU CB C 476 42.800 42.800 43.022 -0.222 19685 2649 1 5 . 1 1 476 476 LEU H H 476 9.130 9.130 8.491 0.639 19685 2650 1 5 . 1 1 477 477 LYS N N 477 123.200 123.200 120.700 2.500 19685 2651 1 5 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.474 0.686 19685 2652 1 5 . 1 1 477 477 LYS C C 477 174.100 174.100 174.502 -0.402 19685 2653 1 5 . 1 1 477 477 LYS CA C 477 54.500 54.500 55.386 -0.886 19685 2654 1 5 . 1 1 477 477 LYS CB C 477 34.900 34.900 33.991 0.909 19685 2655 1 5 . 1 1 477 477 LYS H H 477 8.090 8.090 8.107 -0.017 19685 2656 1 5 . 1 1 478 478 VAL N N 478 127.100 127.100 123.264 3.836 19685 2657 1 5 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.127 0.773 19685 2658 1 5 . 1 1 478 478 VAL C C 478 173.700 173.700 173.886 -0.186 19685 2659 1 5 . 1 1 478 478 VAL CA C 478 61.000 61.000 61.854 -0.854 19685 2660 1 5 . 1 1 478 478 VAL CB C 478 33.700 33.700 34.964 -1.264 19685 2661 1 5 . 1 1 478 478 VAL H H 478 8.820 8.820 8.409 0.411 19685 2662 1 5 . 1 1 479 479 GLN N N 479 123.600 123.600 121.090 2.510 19685 2663 1 5 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.465 0.345 19685 2664 1 5 . 1 1 479 479 GLN C C 479 173.600 173.600 174.015 -0.415 19685 2665 1 5 . 1 1 479 479 GLN CA C 479 53.200 53.200 56.257 -3.057 19685 2666 1 5 . 1 1 479 479 GLN CB C 479 33.500 33.500 30.275 3.225 19685 2667 1 5 . 1 1 479 479 GLN H H 479 9.130 9.130 8.407 0.723 19685 2668 1 5 . 1 1 480 480 LEU N N 480 123.200 123.200 116.429 6.771 19685 2669 1 5 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.499 -0.059 19685 2670 1 5 . 1 1 480 480 LEU C C 480 177.100 177.100 175.412 1.688 19685 2671 1 5 . 1 1 480 480 LEU CA C 480 54.600 54.600 54.609 -0.009 19685 2672 1 5 . 1 1 480 480 LEU CB C 480 42.400 42.400 44.440 -2.040 19685 2673 1 5 . 1 1 480 480 LEU H H 480 8.840 8.840 7.775 1.065 19685 2674 1 5 . 1 1 481 481 LYS N N 481 124.500 124.500 119.484 5.016 19685 2675 1 5 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.560 -0.250 19685 2676 1 5 . 1 1 481 481 LYS C C 481 175.200 175.200 176.778 -1.578 19685 2677 1 5 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.366 -0.666 19685 2678 1 5 . 1 1 481 481 LYS CB C 481 33.100 33.100 32.304 0.796 19685 2679 1 5 . 1 1 481 481 LYS H H 481 8.400 8.400 8.474 -0.074 19685 2680 1 5 . 1 1 482 482 ARG N N 482 126.600 126.600 117.253 9.347 19685 2681 1 5 . 1 1 482 482 ARG HA H 482 4.350 4.350 3.823 0.527 19685 2682 1 5 . 1 1 482 482 ARG C C 482 175.800 175.800 176.075 -0.275 19685 2683 1 5 . 1 1 482 482 ARG CA C 482 55.600 55.600 57.589 -1.989 19685 2684 1 5 . 1 1 482 482 ARG CB C 482 31.100 31.100 27.588 3.511 19685 2685 1 5 . 1 1 482 482 ARG H H 482 8.770 8.770 7.975 0.795 19685 2686 1 5 . 1 1 483 483 SER N N 483 118.100 118.100 118.072 0.028 19685 2687 1 5 . 1 1 483 483 SER HA H 483 4.400 4.400 4.563 -0.163 19685 2688 1 5 . 1 1 483 483 SER C C 483 174.200 174.200 174.074 0.126 19685 2689 1 5 . 1 1 483 483 SER CA C 483 58.000 58.000 58.425 -0.425 19685 2690 1 5 . 1 1 483 483 SER CB C 483 63.500 63.500 63.123 0.377 19685 2691 1 5 . 1 1 483 483 SER H H 483 8.610 8.610 8.294 0.316 19685 2692 1 5 . 1 1 484 484 LYS N N 484 123.000 123.000 118.756 4.244 19685 2693 1 5 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.148 0.062 19685 2694 1 5 . 1 1 484 484 LYS C C 484 175.900 175.900 175.515 0.385 19685 2695 1 5 . 1 1 484 484 LYS CA C 484 56.300 56.300 57.130 -0.831 19685 2696 1 5 . 1 1 484 484 LYS CB C 484 32.500 32.500 31.005 1.495 19685 2697 1 5 . 1 1 484 484 LYS H H 484 8.560 8.560 7.804 0.756 19685 2698 1 5 . 1 1 485 485 ASN N N 485 119.600 119.600 117.019 2.581 19685 2699 1 5 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.690 -0.090 19685 2700 1 5 . 1 1 485 485 ASN C C 485 174.400 174.400 175.620 -1.220 19685 2701 1 5 . 1 1 485 485 ASN CA C 485 52.900 52.900 53.421 -0.521 19685 2702 1 5 . 1 1 485 485 ASN CB C 485 38.400 38.400 39.785 -1.385 19685 2703 1 5 . 1 1 485 485 ASN H H 485 8.560 8.560 8.426 0.134 19685 2704 1 5 . 1 1 486 486 ASP N N 486 121.100 121.100 120.634 0.466 19685 2705 1 5 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.914 -0.394 19685 2706 1 5 . 1 1 486 486 ASP C C 486 175.700 175.700 175.519 0.181 19685 2707 1 5 . 1 1 486 486 ASP CA C 486 54.000 54.000 54.236 -0.236 19685 2708 1 5 . 1 1 486 486 ASP CB C 486 40.800 40.800 41.762 -0.962 19685 2709 1 5 . 1 1 486 486 ASP H H 486 8.250 8.250 8.682 -0.432 19685 2710 1 5 . 1 1 487 487 SER N N 487 115.400 115.400 114.097 1.303 19685 2711 1 5 . 1 1 487 487 SER HA H 487 4.310 4.310 4.039 0.271 19685 2712 1 5 . 1 1 487 487 SER C C 487 172.800 172.800 173.713 -0.913 19685 2713 1 5 . 1 1 487 487 SER CA C 487 57.700 57.700 59.469 -1.769 19685 2714 1 5 . 1 1 487 487 SER CB C 487 63.600 63.600 61.914 1.686 19685 2715 1 5 . 1 1 487 487 SER H H 487 8.090 8.090 8.413 -0.323 19685 2716 1 5 . 1 1 488 488 LYS N N 488 122.300 122.300 119.915 2.385 19685 2717 1 5 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.229 -0.179 19685 2718 1 5 . 1 1 488 488 LYS C C 488 174.500 174.500 175.336 -0.836 19685 2719 1 5 . 1 1 488 488 LYS CA C 488 54.000 54.000 55.562 -1.562 19685 2720 1 5 . 1 1 488 488 LYS CB C 488 32.400 32.400 32.370 0.031 19685 2721 1 5 . 1 1 488 488 LYS H H 488 8.090 8.090 7.983 0.107 19685 2722 1 5 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.530 -0.250 19685 2723 1 5 . 1 1 489 489 PRO C C 489 175.000 175.000 175.532 -0.532 19685 2724 1 5 . 1 1 489 489 PRO CA C 489 63.200 63.200 63.184 0.017 19685 2725 1 5 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.243 -1.143 19685 2726 1 6 . 1 1 395 395 SER N N 395 115.500 115.500 113.675 1.825 19685 2727 1 6 . 1 1 395 395 SER HA H 395 4.300 4.300 4.835 -0.535 19685 2728 1 6 . 1 1 395 395 SER C C 395 173.900 173.900 174.199 -0.299 19685 2729 1 6 . 1 1 395 395 SER CA C 395 57.900 57.900 57.689 0.211 19685 2730 1 6 . 1 1 395 395 SER CB C 395 63.400 63.400 64.813 -1.413 19685 2731 1 6 . 1 1 395 395 SER H H 395 8.200 8.200 8.761 -0.561 19685 2732 1 6 . 1 1 396 396 HIS N N 396 123.500 123.500 122.748 0.752 19685 2733 1 6 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.653 -0.093 19685 2734 1 6 . 1 1 396 396 HIS C C 396 174.100 174.100 173.978 0.122 19685 2735 1 6 . 1 1 396 396 HIS CA C 396 53.700 53.700 56.437 -2.737 19685 2736 1 6 . 1 1 396 396 HIS CB C 396 32.200 32.200 30.357 1.843 19685 2737 1 6 . 1 1 396 396 HIS H H 396 8.120 8.120 8.725 -0.605 19685 2738 1 6 . 1 1 397 397 MET N N 397 121.200 121.200 114.760 6.440 19685 2739 1 6 . 1 1 397 397 MET HA H 397 4.320 4.320 4.640 -0.320 19685 2740 1 6 . 1 1 397 397 MET C C 397 175.400 175.400 173.985 1.415 19685 2741 1 6 . 1 1 397 397 MET CA C 397 55.000 55.000 54.839 0.161 19685 2742 1 6 . 1 1 397 397 MET CB C 397 32.500 32.500 35.290 -2.790 19685 2743 1 6 . 1 1 397 397 MET H H 397 8.300 8.300 7.333 0.967 19685 2744 1 6 . 1 1 398 398 GLN N N 398 122.100 122.100 119.101 2.999 19685 2745 1 6 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.792 -0.602 19685 2746 1 6 . 1 1 398 398 GLN C C 398 174.800 174.800 174.344 0.456 19685 2747 1 6 . 1 1 398 398 GLN CA C 398 55.200 55.200 55.324 -0.124 19685 2748 1 6 . 1 1 398 398 GLN CB C 398 28.900 28.900 31.466 -2.566 19685 2749 1 6 . 1 1 398 398 GLN H H 398 8.540 8.540 8.359 0.181 19685 2750 1 6 . 1 1 399 399 LYS N N 399 123.000 123.000 120.442 2.558 19685 2751 1 6 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.638 -0.418 19685 2752 1 6 . 1 1 399 399 LYS C C 399 174.800 174.800 175.677 -0.877 19685 2753 1 6 . 1 1 399 399 LYS CA C 399 55.600 55.600 55.265 0.335 19685 2754 1 6 . 1 1 399 399 LYS CB C 399 33.000 33.000 35.058 -2.058 19685 2755 1 6 . 1 1 399 399 LYS H H 399 8.180 8.180 8.402 -0.222 19685 2756 1 6 . 1 1 400 400 GLU N N 400 122.000 122.000 118.223 3.777 19685 2757 1 6 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.053 0.377 19685 2758 1 6 . 1 1 400 400 GLU C C 400 176.400 176.400 175.927 0.473 19685 2759 1 6 . 1 1 400 400 GLU CA C 400 55.400 55.400 57.004 -1.604 19685 2760 1 6 . 1 1 400 400 GLU CB C 400 31.400 31.400 29.462 1.938 19685 2761 1 6 . 1 1 400 400 GLU H H 400 8.350 8.350 8.325 0.025 19685 2762 1 6 . 1 1 401 401 GLY N N 401 109.500 109.500 108.115 1.385 19685 2763 1 6 . 1 1 401 401 GLY C C 401 171.500 171.500 174.188 -2.688 19685 2764 1 6 . 1 1 401 401 GLY CA C 401 43.700 43.700 42.893 0.807 19685 2765 1 6 . 1 1 401 401 GLY H H 401 9.050 9.050 8.721 0.329 19685 2766 1 6 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.461 -0.041 19685 2767 1 6 . 1 1 402 402 PRO C C 402 173.900 173.900 176.726 -2.826 19685 2768 1 6 . 1 1 402 402 PRO CA C 402 61.900 61.900 64.301 -2.401 19685 2769 1 6 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.392 -0.192 19685 2770 1 6 . 1 1 403 403 GLU N N 403 119.600 119.600 116.923 2.677 19685 2771 1 6 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.384 -0.424 19685 2772 1 6 . 1 1 403 403 GLU C C 403 177.300 177.300 175.841 1.459 19685 2773 1 6 . 1 1 403 403 GLU CA C 403 58.100 58.100 57.251 0.849 19685 2774 1 6 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.451 -1.451 19685 2775 1 6 . 1 1 403 403 GLU H H 403 8.420 8.420 8.132 0.288 19685 2776 1 6 . 1 1 404 404 GLY N N 404 112.800 112.800 107.167 5.633 19685 2777 1 6 . 1 1 404 404 GLY C C 404 173.300 173.300 173.780 -0.480 19685 2778 1 6 . 1 1 404 404 GLY CA C 404 44.900 44.900 46.033 -1.133 19685 2779 1 6 . 1 1 404 404 GLY H H 404 8.500 8.500 8.268 0.232 19685 2780 1 6 . 1 1 405 405 ALA N N 405 120.000 120.000 124.932 -4.932 19685 2781 1 6 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.245 0.305 19685 2782 1 6 . 1 1 405 405 ALA C C 405 174.100 174.100 175.640 -1.540 19685 2783 1 6 . 1 1 405 405 ALA CA C 405 50.500 50.500 52.005 -1.505 19685 2784 1 6 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.043 3.757 19685 2785 1 6 . 1 1 405 405 ALA H H 405 8.360 8.360 8.324 0.036 19685 2786 1 6 . 1 1 406 406 ASN N N 406 115.500 115.500 118.047 -2.547 19685 2787 1 6 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.268 -0.078 19685 2788 1 6 . 1 1 406 406 ASN C C 406 172.900 172.900 174.602 -1.702 19685 2789 1 6 . 1 1 406 406 ASN CA C 406 52.600 52.600 52.338 0.262 19685 2790 1 6 . 1 1 406 406 ASN CB C 406 40.900 40.900 39.588 1.312 19685 2791 1 6 . 1 1 406 406 ASN H H 406 7.690 7.690 8.147 -0.457 19685 2792 1 6 . 1 1 407 407 LEU N N 407 123.400 123.400 122.216 1.184 19685 2793 1 6 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.345 0.615 19685 2794 1 6 . 1 1 407 407 LEU C C 407 174.900 174.900 176.304 -1.404 19685 2795 1 6 . 1 1 407 407 LEU CA C 407 53.100 53.100 55.534 -2.434 19685 2796 1 6 . 1 1 407 407 LEU CB C 407 45.400 45.400 42.776 2.624 19685 2797 1 6 . 1 1 407 407 LEU H H 407 9.290 9.290 7.382 1.908 19685 2798 1 6 . 1 1 408 408 PHE N N 408 118.700 118.700 112.513 6.187 19685 2799 1 6 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.499 0.801 19685 2800 1 6 . 1 1 408 408 PHE C C 408 174.200 174.200 174.617 -0.417 19685 2801 1 6 . 1 1 408 408 PHE CA C 408 56.300 56.300 59.224 -2.924 19685 2802 1 6 . 1 1 408 408 PHE CB C 408 42.700 42.700 36.949 5.751 19685 2803 1 6 . 1 1 408 408 PHE H H 408 9.150 9.150 7.554 1.596 19685 2804 1 6 . 1 1 409 409 ILE N N 409 120.800 120.800 121.755 -0.955 19685 2805 1 6 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.585 0.385 19685 2806 1 6 . 1 1 409 409 ILE C C 409 173.900 173.900 174.562 -0.662 19685 2807 1 6 . 1 1 409 409 ILE CA C 409 59.000 59.000 61.096 -2.096 19685 2808 1 6 . 1 1 409 409 ILE CB C 409 40.400 40.400 41.089 -0.689 19685 2809 1 6 . 1 1 409 409 ILE H H 409 8.380 8.380 8.721 -0.341 19685 2810 1 6 . 1 1 410 410 TYR N N 410 123.200 123.200 122.995 0.205 19685 2811 1 6 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.759 0.181 19685 2812 1 6 . 1 1 410 410 TYR C C 410 174.300 174.300 174.232 0.068 19685 2813 1 6 . 1 1 410 410 TYR CA C 410 56.200 56.200 56.716 -0.516 19685 2814 1 6 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.704 1.096 19685 2815 1 6 . 1 1 410 410 TYR H H 410 9.440 9.440 8.581 0.859 19685 2816 1 6 . 1 1 411 411 HIS N N 411 112.100 112.100 119.335 -7.235 19685 2817 1 6 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.563 -0.113 19685 2818 1 6 . 1 1 411 411 HIS C C 411 173.300 173.300 174.882 -1.582 19685 2819 1 6 . 1 1 411 411 HIS CA C 411 55.900 55.900 56.373 -0.473 19685 2820 1 6 . 1 1 411 411 HIS CB C 411 26.200 26.200 29.618 -3.418 19685 2821 1 6 . 1 1 411 411 HIS H H 411 8.580 8.580 8.132 0.448 19685 2822 1 6 . 1 1 412 412 LEU N N 412 115.100 115.100 118.214 -3.114 19685 2823 1 6 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.441 -0.481 19685 2824 1 6 . 1 1 412 412 LEU C C 412 175.100 175.100 175.018 0.082 19685 2825 1 6 . 1 1 412 412 LEU CA C 412 52.400 52.400 52.863 -0.463 19685 2826 1 6 . 1 1 412 412 LEU CB C 412 42.000 42.000 41.104 0.896 19685 2827 1 6 . 1 1 412 412 LEU H H 412 7.560 7.560 7.550 0.010 19685 2828 1 6 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.149 0.121 19685 2829 1 6 . 1 1 413 413 PRO C C 413 177.600 177.600 177.401 0.199 19685 2830 1 6 . 1 1 413 413 PRO CA C 413 62.300 62.300 63.150 -0.850 19685 2831 1 6 . 1 1 413 413 PRO CB C 413 32.200 32.200 31.944 0.256 19685 2832 1 6 . 1 1 414 414 GLN N N 414 125.500 125.500 118.544 6.956 19685 2833 1 6 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.199 -0.119 19685 2834 1 6 . 1 1 414 414 GLN C C 414 175.400 175.400 176.135 -0.735 19685 2835 1 6 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.837 -0.837 19685 2836 1 6 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.476 0.024 19685 2837 1 6 . 1 1 414 414 GLN H H 414 9.170 9.170 8.761 0.409 19685 2838 1 6 . 1 1 415 415 GLU N N 415 115.300 115.300 117.072 -1.772 19685 2839 1 6 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.457 -0.197 19685 2840 1 6 . 1 1 415 415 GLU C C 415 176.700 176.700 176.117 0.583 19685 2841 1 6 . 1 1 415 415 GLU CA C 415 58.700 58.700 56.303 2.397 19685 2842 1 6 . 1 1 415 415 GLU CB C 415 28.300 28.300 30.344 -2.044 19685 2843 1 6 . 1 1 415 415 GLU H H 415 9.390 9.390 8.232 1.158 19685 2844 1 6 . 1 1 416 416 PHE N N 416 121.700 121.700 119.881 1.819 19685 2845 1 6 . 1 1 416 416 PHE HA H 416 4.610 4.610 4.871 -0.261 19685 2846 1 6 . 1 1 416 416 PHE C C 416 176.400 176.400 176.991 -0.591 19685 2847 1 6 . 1 1 416 416 PHE CA C 416 57.400 57.400 57.273 0.127 19685 2848 1 6 . 1 1 416 416 PHE CB C 416 38.700 38.700 40.375 -1.675 19685 2849 1 6 . 1 1 416 416 PHE H H 416 7.610 7.610 7.599 0.011 19685 2850 1 6 . 1 1 417 417 GLY N N 417 113.000 113.000 107.799 5.201 19685 2851 1 6 . 1 1 417 417 GLY C C 417 174.300 174.300 173.845 0.455 19685 2852 1 6 . 1 1 417 417 GLY CA C 417 42.900 42.900 47.080 -4.179 19685 2853 1 6 . 1 1 417 417 GLY H H 417 9.740 9.740 8.006 1.734 19685 2854 1 6 . 1 1 418 418 ASP N N 418 121.500 121.500 120.267 1.233 19685 2855 1 6 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.663 -0.723 19685 2856 1 6 . 1 1 418 418 ASP C C 418 177.900 177.900 175.752 2.148 19685 2857 1 6 . 1 1 418 418 ASP CA C 418 57.600 57.600 53.848 3.752 19685 2858 1 6 . 1 1 418 418 ASP CB C 418 39.700 39.700 42.256 -2.556 19685 2859 1 6 . 1 1 418 418 ASP H H 418 8.680 8.680 8.690 -0.010 19685 2860 1 6 . 1 1 419 419 GLN N N 419 116.400 116.400 116.888 -0.488 19685 2861 1 6 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.491 -0.581 19685 2862 1 6 . 1 1 419 419 GLN C C 419 177.600 177.600 175.583 2.017 19685 2863 1 6 . 1 1 419 419 GLN CA C 419 58.000 58.000 56.379 1.621 19685 2864 1 6 . 1 1 419 419 GLN CB C 419 27.400 27.400 29.340 -1.940 19685 2865 1 6 . 1 1 419 419 GLN H H 419 8.780 8.780 8.004 0.776 19685 2866 1 6 . 1 1 420 420 ASP N N 420 117.500 117.500 119.233 -1.733 19685 2867 1 6 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.675 -0.665 19685 2868 1 6 . 1 1 420 420 ASP C C 420 178.000 178.000 177.365 0.635 19685 2869 1 6 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.828 2.872 19685 2870 1 6 . 1 1 420 420 ASP CB C 420 39.800 39.800 42.023 -2.224 19685 2871 1 6 . 1 1 420 420 ASP H H 420 7.210 7.210 8.020 -0.810 19685 2872 1 6 . 1 1 421 421 ILE N N 421 117.000 117.000 123.039 -6.039 19685 2873 1 6 . 1 1 421 421 ILE HA H 421 4.080 4.080 3.934 0.146 19685 2874 1 6 . 1 1 421 421 ILE C C 421 176.500 176.500 175.568 0.932 19685 2875 1 6 . 1 1 421 421 ILE CA C 421 64.000 64.000 64.349 -0.349 19685 2876 1 6 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.111 -0.811 19685 2877 1 6 . 1 1 421 421 ILE H H 421 7.610 7.610 7.673 -0.063 19685 2878 1 6 . 1 1 422 422 LEU N N 422 123.200 123.200 117.822 5.378 19685 2879 1 6 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.201 -0.441 19685 2880 1 6 . 1 1 422 422 LEU C C 422 177.800 177.800 176.639 1.161 19685 2881 1 6 . 1 1 422 422 LEU CA C 422 58.600 58.600 56.062 2.538 19685 2882 1 6 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.704 -0.504 19685 2883 1 6 . 1 1 422 422 LEU H H 422 7.870 7.870 8.223 -0.353 19685 2884 1 6 . 1 1 423 423 GLN N N 423 115.600 115.600 117.537 -1.937 19685 2885 1 6 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.381 -0.501 19685 2886 1 6 . 1 1 423 423 GLN C C 423 177.800 177.800 175.592 2.208 19685 2887 1 6 . 1 1 423 423 GLN CA C 423 58.600 58.600 55.596 3.004 19685 2888 1 6 . 1 1 423 423 GLN CB C 423 27.900 27.900 30.169 -2.269 19685 2889 1 6 . 1 1 423 423 GLN H H 423 7.860 7.860 7.916 -0.056 19685 2890 1 6 . 1 1 424 424 MET N N 424 115.500 115.500 118.016 -2.516 19685 2891 1 6 . 1 1 424 424 MET HA H 424 3.910 3.910 4.558 -0.648 19685 2892 1 6 . 1 1 424 424 MET C C 424 175.500 175.500 175.244 0.256 19685 2893 1 6 . 1 1 424 424 MET CA C 424 57.800 57.800 55.983 1.817 19685 2894 1 6 . 1 1 424 424 MET CB C 424 34.300 34.300 34.309 -0.009 19685 2895 1 6 . 1 1 424 424 MET H H 424 7.560 7.560 7.948 -0.388 19685 2896 1 6 . 1 1 425 425 PHE N N 425 112.300 112.300 118.744 -6.444 19685 2897 1 6 . 1 1 425 425 PHE HA H 425 4.700 4.700 5.011 -0.311 19685 2898 1 6 . 1 1 425 425 PHE C C 425 177.300 177.300 177.297 0.003 19685 2899 1 6 . 1 1 425 425 PHE CA C 425 59.900 59.900 59.445 0.455 19685 2900 1 6 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.009 -1.509 19685 2901 1 6 . 1 1 425 425 PHE H H 425 7.680 7.680 8.017 -0.337 19685 2902 1 6 . 1 1 426 426 MET N N 426 127.400 127.400 117.925 9.475 19685 2903 1 6 . 1 1 426 426 MET HA H 426 4.630 4.630 4.274 0.356 19685 2904 1 6 . 1 1 426 426 MET C C 426 173.800 173.800 175.505 -1.705 19685 2905 1 6 . 1 1 426 426 MET CA C 426 59.100 59.100 60.263 -1.163 19685 2906 1 6 . 1 1 426 426 MET CB C 426 31.800 31.800 30.290 1.510 19685 2907 1 6 . 1 1 426 426 MET H H 426 8.540 8.540 8.555 -0.015 19685 2908 1 6 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.182 -0.172 19685 2909 1 6 . 1 1 427 427 PRO C C 427 176.800 176.800 176.713 0.087 19685 2910 1 6 . 1 1 427 427 PRO CA C 427 65.200 65.200 64.617 0.583 19685 2911 1 6 . 1 1 427 427 PRO CB C 427 30.600 30.600 30.686 -0.086 19685 2912 1 6 . 1 1 428 428 PHE N N 428 110.000 110.000 116.973 -6.973 19685 2913 1 6 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.494 -0.224 19685 2914 1 6 . 1 1 428 428 PHE C C 428 174.600 174.600 174.949 -0.349 19685 2915 1 6 . 1 1 428 428 PHE CA C 428 57.700 57.700 59.048 -1.348 19685 2916 1 6 . 1 1 428 428 PHE CB C 428 38.000 38.000 39.759 -1.759 19685 2917 1 6 . 1 1 428 428 PHE H H 428 6.560 6.560 7.426 -0.866 19685 2918 1 6 . 1 1 429 429 GLY N N 429 105.500 105.500 101.738 3.762 19685 2919 1 6 . 1 1 429 429 GLY C C 429 170.100 170.100 172.772 -2.672 19685 2920 1 6 . 1 1 429 429 GLY CA C 429 44.400 44.400 43.904 0.496 19685 2921 1 6 . 1 1 429 429 GLY H H 429 7.650 7.650 6.963 0.687 19685 2922 1 6 . 1 1 430 430 ASN N N 430 117.400 117.400 116.879 0.521 19685 2923 1 6 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.345 0.285 19685 2924 1 6 . 1 1 430 430 ASN C C 430 173.200 173.200 172.754 0.446 19685 2925 1 6 . 1 1 430 430 ASN CA C 430 52.600 52.600 55.123 -2.523 19685 2926 1 6 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.186 -1.986 19685 2927 1 6 . 1 1 430 430 ASN H H 430 9.020 9.020 8.477 0.543 19685 2928 1 6 . 1 1 431 431 VAL N N 431 128.000 128.000 115.080 12.920 19685 2929 1 6 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.631 -0.881 19685 2930 1 6 . 1 1 431 431 VAL C C 431 176.400 176.400 174.990 1.410 19685 2931 1 6 . 1 1 431 431 VAL CA C 431 61.800 61.800 61.306 0.494 19685 2932 1 6 . 1 1 431 431 VAL CB C 431 31.900 31.900 34.193 -2.293 19685 2933 1 6 . 1 1 431 431 VAL H H 431 8.480 8.480 8.285 0.195 19685 2934 1 6 . 1 1 432 432 ILE N N 432 128.000 128.000 117.065 10.935 19685 2935 1 6 . 1 1 432 432 ILE HA H 432 3.920 3.920 4.502 -0.582 19685 2936 1 6 . 1 1 432 432 ILE C C 432 176.100 176.100 174.619 1.481 19685 2937 1 6 . 1 1 432 432 ILE CA C 432 62.500 62.500 60.648 1.852 19685 2938 1 6 . 1 1 432 432 ILE CB C 432 37.400 37.400 39.289 -1.889 19685 2939 1 6 . 1 1 432 432 ILE H H 432 8.840 8.840 8.241 0.599 19685 2940 1 6 . 1 1 433 433 SER N N 433 113.600 113.600 114.986 -1.386 19685 2941 1 6 . 1 1 433 433 SER HA H 433 4.440 4.440 4.451 -0.011 19685 2942 1 6 . 1 1 433 433 SER C C 433 171.000 171.000 173.400 -2.400 19685 2943 1 6 . 1 1 433 433 SER CA C 433 57.300 57.300 58.692 -1.392 19685 2944 1 6 . 1 1 433 433 SER CB C 433 65.200 65.200 64.089 1.111 19685 2945 1 6 . 1 1 433 433 SER H H 433 7.280 7.280 7.541 -0.261 19685 2946 1 6 . 1 1 434 434 ALA N N 434 125.700 125.700 123.420 2.280 19685 2947 1 6 . 1 1 434 434 ALA HA H 434 4.910 4.910 3.860 1.050 19685 2948 1 6 . 1 1 434 434 ALA C C 434 174.600 174.600 175.943 -1.343 19685 2949 1 6 . 1 1 434 434 ALA CA C 434 51.000 51.000 52.637 -1.637 19685 2950 1 6 . 1 1 434 434 ALA CB C 434 21.200 21.200 16.928 4.272 19685 2951 1 6 . 1 1 434 434 ALA H H 434 8.270 8.270 8.097 0.173 19685 2952 1 6 . 1 1 435 435 LYS N N 435 120.900 120.900 116.344 4.556 19685 2953 1 6 . 1 1 435 435 LYS HA H 435 4.470 4.470 3.518 0.952 19685 2954 1 6 . 1 1 435 435 LYS C C 435 173.800 173.800 175.202 -1.402 19685 2955 1 6 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.757 -2.057 19685 2956 1 6 . 1 1 435 435 LYS CB C 435 36.400 36.400 32.578 3.821 19685 2957 1 6 . 1 1 435 435 LYS H H 435 8.490 8.490 6.530 1.960 19685 2958 1 6 . 1 1 436 436 VAL N N 436 122.200 122.200 119.192 3.008 19685 2959 1 6 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.223 -0.303 19685 2960 1 6 . 1 1 436 436 VAL C C 436 175.100 175.100 175.561 -0.461 19685 2961 1 6 . 1 1 436 436 VAL CA C 436 63.600 63.600 61.925 1.675 19685 2962 1 6 . 1 1 436 436 VAL CB C 436 33.500 33.500 32.185 1.315 19685 2963 1 6 . 1 1 436 436 VAL H H 436 8.390 8.390 7.807 0.583 19685 2964 1 6 . 1 1 437 437 PHE N N 437 125.900 125.900 119.244 6.656 19685 2965 1 6 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.404 -0.004 19685 2966 1 6 . 1 1 437 437 PHE C C 437 173.600 173.600 176.561 -2.961 19685 2967 1 6 . 1 1 437 437 PHE CA C 437 57.700 57.700 57.822 -0.122 19685 2968 1 6 . 1 1 437 437 PHE CB C 437 39.000 39.000 37.531 1.469 19685 2969 1 6 . 1 1 437 437 PHE H H 437 8.250 8.250 7.781 0.469 19685 2970 1 6 . 1 1 438 438 ILE N N 438 121.900 121.900 119.665 2.235 19685 2971 1 6 . 1 1 438 438 ILE HA H 438 4.460 4.460 4.133 0.327 19685 2972 1 6 . 1 1 438 438 ILE C C 438 175.700 175.700 176.571 -0.871 19685 2973 1 6 . 1 1 438 438 ILE CA C 438 58.300 58.300 61.950 -3.650 19685 2974 1 6 . 1 1 438 438 ILE CB C 438 39.700 39.700 38.136 1.565 19685 2975 1 6 . 1 1 438 438 ILE H H 438 8.520 8.520 7.524 0.996 19685 2976 1 6 . 1 1 439 439 ASP N N 439 126.500 126.500 119.640 6.860 19685 2977 1 6 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.312 0.268 19685 2978 1 6 . 1 1 439 439 ASP C C 439 176.300 176.300 175.926 0.374 19685 2979 1 6 . 1 1 439 439 ASP CA C 439 53.600 53.600 55.648 -2.048 19685 2980 1 6 . 1 1 439 439 ASP CB C 439 42.300 42.300 39.726 2.574 19685 2981 1 6 . 1 1 439 439 ASP H H 439 8.730 8.730 7.945 0.785 19685 2982 1 6 . 1 1 440 440 LYS N N 440 127.300 127.300 114.684 12.616 19685 2983 1 6 . 1 1 440 440 LYS HA H 440 4.070 4.070 3.926 0.144 19685 2984 1 6 . 1 1 440 440 LYS C C 440 176.900 176.900 176.430 0.470 19685 2985 1 6 . 1 1 440 440 LYS CA C 440 57.800 57.800 59.268 -1.468 19685 2986 1 6 . 1 1 440 440 LYS CB C 440 32.100 32.100 31.208 0.892 19685 2987 1 6 . 1 1 440 440 LYS H H 440 8.930 8.930 8.858 0.072 19685 2988 1 6 . 1 1 441 441 GLN N N 441 117.400 117.400 115.111 2.289 19685 2989 1 6 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.517 -0.287 19685 2990 1 6 . 1 1 441 441 GLN C C 441 177.200 177.200 176.218 0.982 19685 2991 1 6 . 1 1 441 441 GLN CA C 441 57.600 57.600 55.836 1.764 19685 2992 1 6 . 1 1 441 441 GLN CB C 441 28.800 28.800 31.039 -2.239 19685 2993 1 6 . 1 1 441 441 GLN H H 441 8.650 8.650 8.240 0.410 19685 2994 1 6 . 1 1 442 442 THR N N 442 107.300 107.300 115.826 -8.526 19685 2995 1 6 . 1 1 442 442 THR HA H 442 4.290 4.290 4.246 0.044 19685 2996 1 6 . 1 1 442 442 THR C C 442 175.100 175.100 174.384 0.716 19685 2997 1 6 . 1 1 442 442 THR CA C 442 61.200 61.200 63.906 -2.706 19685 2998 1 6 . 1 1 442 442 THR CB C 442 70.300 70.300 68.817 1.483 19685 2999 1 6 . 1 1 442 442 THR H H 442 7.830 7.830 7.848 -0.018 19685 3000 1 6 . 1 1 443 443 ASN N N 443 117.300 117.300 115.688 1.612 19685 3001 1 6 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.334 -0.034 19685 3002 1 6 . 1 1 443 443 ASN C C 443 173.400 173.400 174.212 -0.812 19685 3003 1 6 . 1 1 443 443 ASN CA C 443 54.300 54.300 54.143 0.157 19685 3004 1 6 . 1 1 443 443 ASN CB C 443 37.600 37.600 36.482 1.118 19685 3005 1 6 . 1 1 443 443 ASN H H 443 8.470 8.470 8.027 0.443 19685 3006 1 6 . 1 1 444 444 LEU N N 444 118.000 118.000 119.553 -1.553 19685 3007 1 6 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.487 0.073 19685 3008 1 6 . 1 1 444 444 LEU C C 444 176.700 176.700 177.996 -1.296 19685 3009 1 6 . 1 1 444 444 LEU CA C 444 53.300 53.300 54.993 -1.693 19685 3010 1 6 . 1 1 444 444 LEU CB C 444 43.500 43.500 43.102 0.398 19685 3011 1 6 . 1 1 444 444 LEU H H 444 7.660 7.660 7.390 0.270 19685 3012 1 6 . 1 1 445 445 SER N N 445 115.500 115.500 113.829 1.671 19685 3013 1 6 . 1 1 445 445 SER HA H 445 4.460 4.460 4.134 0.326 19685 3014 1 6 . 1 1 445 445 SER C C 445 176.500 176.500 174.040 2.460 19685 3015 1 6 . 1 1 445 445 SER CA C 445 57.900 57.900 59.738 -1.838 19685 3016 1 6 . 1 1 445 445 SER CB C 445 63.500 63.500 63.212 0.288 19685 3017 1 6 . 1 1 445 445 SER H H 445 8.840 8.840 8.527 0.313 19685 3018 1 6 . 1 1 446 446 LYS N N 446 125.200 125.200 118.664 6.536 19685 3019 1 6 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.236 0.264 19685 3020 1 6 . 1 1 446 446 LYS C C 446 176.100 176.100 176.779 -0.679 19685 3021 1 6 . 1 1 446 446 LYS CA C 446 56.300 56.300 56.523 -0.223 19685 3022 1 6 . 1 1 446 446 LYS CB C 446 32.200 32.200 33.412 -1.212 19685 3023 1 6 . 1 1 446 446 LYS H H 446 9.230 9.230 8.314 0.916 19685 3024 1 6 . 1 1 447 447 CYS N N 447 113.000 113.000 120.299 -7.299 19685 3025 1 6 . 1 1 447 447 CYS C C 447 172.500 172.500 174.423 -1.923 19685 3026 1 6 . 1 1 447 447 CYS CA C 447 60.400 60.400 60.872 -0.472 19685 3027 1 6 . 1 1 447 447 CYS CB C 447 24.900 24.900 26.358 -1.458 19685 3028 1 6 . 1 1 447 447 CYS H H 447 10.020 10.020 7.629 2.391 19685 3029 1 6 . 1 1 448 448 PHE N N 448 115.200 115.200 120.361 -5.161 19685 3030 1 6 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.098 1.242 19685 3031 1 6 . 1 1 448 448 PHE C C 448 172.400 172.400 175.140 -2.740 19685 3032 1 6 . 1 1 448 448 PHE CA C 448 54.700 54.700 58.645 -3.945 19685 3033 1 6 . 1 1 448 448 PHE CB C 448 42.000 42.000 38.239 3.761 19685 3034 1 6 . 1 1 448 448 PHE H H 448 7.810 7.810 7.943 -0.133 19685 3035 1 6 . 1 1 449 449 GLY N N 449 107.700 107.700 106.007 1.693 19685 3036 1 6 . 1 1 449 449 GLY C C 449 170.100 170.100 173.050 -2.950 19685 3037 1 6 . 1 1 449 449 GLY CA C 449 45.200 45.200 44.648 0.552 19685 3038 1 6 . 1 1 449 449 GLY H H 449 9.310 9.310 8.569 0.741 19685 3039 1 6 . 1 1 450 450 PHE N N 450 119.900 119.900 114.912 4.988 19685 3040 1 6 . 1 1 450 450 PHE HA H 450 5.430 5.430 4.743 0.687 19685 3041 1 6 . 1 1 450 450 PHE C C 450 172.800 172.800 173.081 -0.281 19685 3042 1 6 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.948 -1.948 19685 3043 1 6 . 1 1 450 450 PHE CB C 450 43.600 43.600 40.322 3.278 19685 3044 1 6 . 1 1 450 450 PHE H H 450 8.760 8.760 8.482 0.278 19685 3045 1 6 . 1 1 451 451 VAL N N 451 123.800 123.800 118.279 5.521 19685 3046 1 6 . 1 1 451 451 VAL HA H 451 4.290 4.290 3.986 0.304 19685 3047 1 6 . 1 1 451 451 VAL C C 451 172.400 172.400 174.635 -2.235 19685 3048 1 6 . 1 1 451 451 VAL CA C 451 59.800 59.800 60.971 -1.171 19685 3049 1 6 . 1 1 451 451 VAL CB C 451 36.100 36.100 35.815 0.285 19685 3050 1 6 . 1 1 451 451 VAL H H 451 7.930 7.930 8.146 -0.216 19685 3051 1 6 . 1 1 452 452 SER N N 452 119.600 119.600 120.432 -0.832 19685 3052 1 6 . 1 1 452 452 SER HA H 452 5.120 5.120 5.080 0.040 19685 3053 1 6 . 1 1 452 452 SER C C 452 173.200 173.200 174.091 -0.891 19685 3054 1 6 . 1 1 452 452 SER CA C 452 55.700 55.700 56.792 -1.092 19685 3055 1 6 . 1 1 452 452 SER CB C 452 66.100 66.100 62.461 3.639 19685 3056 1 6 . 1 1 452 452 SER H H 452 8.540 8.540 8.480 0.060 19685 3057 1 6 . 1 1 453 453 TYR N N 453 121.400 121.400 123.823 -2.423 19685 3058 1 6 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.663 0.717 19685 3059 1 6 . 1 1 453 453 TYR C C 453 173.600 173.600 177.274 -3.674 19685 3060 1 6 . 1 1 453 453 TYR CA C 453 56.500 56.500 57.491 -0.991 19685 3061 1 6 . 1 1 453 453 TYR CB C 453 42.200 42.200 38.597 3.603 19685 3062 1 6 . 1 1 453 453 TYR H H 453 8.380 8.380 7.669 0.711 19685 3063 1 6 . 1 1 454 454 ASP N N 454 113.300 113.300 121.271 -7.971 19685 3064 1 6 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.516 -0.026 19685 3065 1 6 . 1 1 454 454 ASP C C 454 176.100 176.100 175.445 0.655 19685 3066 1 6 . 1 1 454 454 ASP CA C 454 52.800 52.800 55.592 -2.792 19685 3067 1 6 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.593 -1.193 19685 3068 1 6 . 1 1 454 454 ASP H H 454 7.860 7.860 8.825 -0.965 19685 3069 1 6 . 1 1 455 455 ASN N N 455 113.800 113.800 113.918 -0.118 19685 3070 1 6 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.134 -0.084 19685 3071 1 6 . 1 1 455 455 ASN C C 455 173.100 173.100 173.442 -0.342 19685 3072 1 6 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.413 -0.713 19685 3073 1 6 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.889 0.211 19685 3074 1 6 . 1 1 455 455 ASN H H 455 7.200 7.200 7.848 -0.648 19685 3075 1 6 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.662 -0.492 19685 3076 1 6 . 1 1 456 456 PRO C C 456 177.300 177.300 177.853 -0.553 19685 3077 1 6 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.795 -0.595 19685 3078 1 6 . 1 1 456 456 PRO CB C 456 32.300 32.300 32.269 0.031 19685 3079 1 6 . 1 1 457 457 VAL N N 457 120.900 120.900 117.337 3.563 19685 3080 1 6 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.080 -0.460 19685 3081 1 6 . 1 1 457 457 VAL C C 457 179.000 179.000 176.926 2.074 19685 3082 1 6 . 1 1 457 457 VAL CA C 457 65.900 65.900 63.933 1.967 19685 3083 1 6 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.741 -0.941 19685 3084 1 6 . 1 1 457 457 VAL H H 457 8.120 8.120 7.963 0.157 19685 3085 1 6 . 1 1 458 458 SER N N 458 117.800 117.800 114.762 3.038 19685 3086 1 6 . 1 1 458 458 SER HA H 458 3.940 3.940 4.447 -0.507 19685 3087 1 6 . 1 1 458 458 SER C C 458 173.600 173.600 174.936 -1.336 19685 3088 1 6 . 1 1 458 458 SER CA C 458 61.100 61.100 60.645 0.455 19685 3089 1 6 . 1 1 458 458 SER CB C 458 62.400 62.400 63.630 -1.230 19685 3090 1 6 . 1 1 458 458 SER H H 458 7.830 7.830 7.523 0.307 19685 3091 1 6 . 1 1 459 459 ALA N N 459 120.000 120.000 124.455 -4.455 19685 3092 1 6 . 1 1 459 459 ALA HA H 459 3.750 3.750 4.459 -0.709 19685 3093 1 6 . 1 1 459 459 ALA C C 459 178.100 178.100 177.876 0.224 19685 3094 1 6 . 1 1 459 459 ALA CA C 459 54.500 54.500 54.319 0.181 19685 3095 1 6 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.884 -0.984 19685 3096 1 6 . 1 1 459 459 ALA H H 459 6.370 6.370 8.350 -1.980 19685 3097 1 6 . 1 1 460 460 GLN N N 460 116.100 116.100 119.658 -3.558 19685 3098 1 6 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.093 -0.263 19685 3099 1 6 . 1 1 460 460 GLN C C 460 178.000 178.000 176.669 1.331 19685 3100 1 6 . 1 1 460 460 GLN CA C 460 58.500 58.500 58.417 0.083 19685 3101 1 6 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.540 -1.140 19685 3102 1 6 . 1 1 460 460 GLN H H 460 7.710 7.710 8.335 -0.625 19685 3103 1 6 . 1 1 461 461 ALA N N 461 122.800 122.800 118.318 4.482 19685 3104 1 6 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.456 -0.496 19685 3105 1 6 . 1 1 461 461 ALA C C 461 179.500 179.500 177.236 2.264 19685 3106 1 6 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.353 2.147 19685 3107 1 6 . 1 1 461 461 ALA CB C 461 17.500 17.500 18.887 -1.387 19685 3108 1 6 . 1 1 461 461 ALA H H 461 7.880 7.880 7.976 -0.096 19685 3109 1 6 . 1 1 462 462 ALA N N 462 121.400 121.400 120.293 1.107 19685 3110 1 6 . 1 1 462 462 ALA HA H 462 2.400 2.400 4.084 -1.684 19685 3111 1 6 . 1 1 462 462 ALA C C 462 179.400 179.400 178.331 1.069 19685 3112 1 6 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.700 1.400 19685 3113 1 6 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.365 -1.665 19685 3114 1 6 . 1 1 462 462 ALA H H 462 7.860 7.860 7.797 0.063 19685 3115 1 6 . 1 1 463 463 ILE N N 463 118.600 118.600 118.579 0.021 19685 3116 1 6 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.858 -0.618 19685 3117 1 6 . 1 1 463 463 ILE C C 463 177.500 177.500 176.599 0.901 19685 3118 1 6 . 1 1 463 463 ILE CA C 463 66.000 66.000 62.984 3.015 19685 3119 1 6 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.245 0.055 19685 3120 1 6 . 1 1 463 463 ILE H H 463 8.090 8.090 8.316 -0.226 19685 3121 1 6 . 1 1 464 464 GLN N N 464 117.000 117.000 116.958 0.042 19685 3122 1 6 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.389 -0.519 19685 3123 1 6 . 1 1 464 464 GLN C C 464 177.700 177.700 175.044 2.656 19685 3124 1 6 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.874 2.326 19685 3125 1 6 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.656 -1.756 19685 3126 1 6 . 1 1 464 464 GLN H H 464 7.780 7.780 8.291 -0.511 19685 3127 1 6 . 1 1 465 465 ALA N N 465 117.200 117.200 121.459 -4.259 19685 3128 1 6 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.405 -0.175 19685 3129 1 6 . 1 1 465 465 ALA C C 465 179.200 179.200 176.296 2.904 19685 3130 1 6 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.871 0.929 19685 3131 1 6 . 1 1 465 465 ALA CB C 465 21.100 21.100 20.566 0.534 19685 3132 1 6 . 1 1 465 465 ALA H H 465 7.540 7.540 7.525 0.015 19685 3133 1 6 . 1 1 466 466 MET N N 466 110.800 110.800 116.720 -5.920 19685 3134 1 6 . 1 1 466 466 MET HA H 466 4.820 4.820 4.512 0.308 19685 3135 1 6 . 1 1 466 466 MET C C 466 177.600 177.600 174.681 2.919 19685 3136 1 6 . 1 1 466 466 MET CA C 466 53.300 53.300 55.766 -2.466 19685 3137 1 6 . 1 1 466 466 MET CB C 466 31.600 31.600 35.218 -3.618 19685 3138 1 6 . 1 1 466 466 MET H H 466 8.230 8.230 7.629 0.601 19685 3139 1 6 . 1 1 467 467 ASN N N 467 119.100 119.100 119.012 0.088 19685 3140 1 6 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.654 -0.164 19685 3141 1 6 . 1 1 467 467 ASN C C 467 176.300 176.300 176.960 -0.660 19685 3142 1 6 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.534 1.666 19685 3143 1 6 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.633 -0.432 19685 3144 1 6 . 1 1 467 467 ASN H H 467 8.560 8.560 7.638 0.922 19685 3145 1 6 . 1 1 468 468 GLY N N 468 117.900 117.900 113.170 4.730 19685 3146 1 6 . 1 1 468 468 GLY C C 468 172.800 172.800 173.499 -0.699 19685 3147 1 6 . 1 1 468 468 GLY CA C 468 45.300 45.300 45.560 -0.260 19685 3148 1 6 . 1 1 468 468 GLY H H 468 8.930 8.930 8.986 -0.056 19685 3149 1 6 . 1 1 469 469 PHE N N 469 123.300 123.300 119.264 4.036 19685 3150 1 6 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.861 -0.671 19685 3151 1 6 . 1 1 469 469 PHE C C 469 174.400 174.400 173.338 1.062 19685 3152 1 6 . 1 1 469 469 PHE CA C 469 58.700 58.700 55.475 3.225 19685 3153 1 6 . 1 1 469 469 PHE CB C 469 40.600 40.600 41.802 -1.202 19685 3154 1 6 . 1 1 469 469 PHE H H 469 7.950 7.950 7.685 0.265 19685 3155 1 6 . 1 1 470 470 GLN N N 470 129.200 129.200 122.972 6.228 19685 3156 1 6 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.289 0.301 19685 3157 1 6 . 1 1 470 470 GLN C C 470 174.100 174.100 174.230 -0.130 19685 3158 1 6 . 1 1 470 470 GLN CA C 470 55.500 55.500 53.936 1.564 19685 3159 1 6 . 1 1 470 470 GLN CB C 470 28.800 28.800 29.782 -0.982 19685 3160 1 6 . 1 1 470 470 GLN H H 470 8.330 8.330 7.754 0.576 19685 3161 1 6 . 1 1 471 471 ILE N N 471 126.300 126.300 123.835 2.465 19685 3162 1 6 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.150 0.020 19685 3163 1 6 . 1 1 471 471 ILE C C 471 175.400 175.400 174.404 0.996 19685 3164 1 6 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.284 -0.684 19685 3165 1 6 . 1 1 471 471 ILE CB C 471 39.100 39.100 38.178 0.922 19685 3166 1 6 . 1 1 471 471 ILE H H 471 8.440 8.440 8.312 0.128 19685 3167 1 6 . 1 1 472 472 GLY N N 472 117.500 117.500 109.704 7.796 19685 3168 1 6 . 1 1 472 472 GLY C C 472 174.700 174.700 174.951 -0.251 19685 3169 1 6 . 1 1 472 472 GLY CA C 472 46.500 46.500 44.752 1.748 19685 3170 1 6 . 1 1 472 472 GLY H H 472 8.980 8.980 8.179 0.801 19685 3171 1 6 . 1 1 473 473 MET N N 473 124.100 124.100 117.641 6.459 19685 3172 1 6 . 1 1 473 473 MET HA H 473 4.380 4.380 4.032 0.348 19685 3173 1 6 . 1 1 473 473 MET C C 473 175.700 175.700 175.038 0.662 19685 3174 1 6 . 1 1 473 473 MET CA C 473 55.000 55.000 56.352 -1.352 19685 3175 1 6 . 1 1 473 473 MET CB C 473 32.900 32.900 31.316 1.584 19685 3176 1 6 . 1 1 473 473 MET H H 473 9.070 9.070 8.368 0.702 19685 3177 1 6 . 1 1 474 474 LYS N N 474 118.700 118.700 116.047 2.653 19685 3178 1 6 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.615 -0.135 19685 3179 1 6 . 1 1 474 474 LYS C C 474 174.300 174.300 176.255 -1.955 19685 3180 1 6 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.653 -0.053 19685 3181 1 6 . 1 1 474 474 LYS CB C 474 35.100 35.100 34.654 0.446 19685 3182 1 6 . 1 1 474 474 LYS H H 474 7.770 7.770 7.606 0.164 19685 3183 1 6 . 1 1 475 475 ARG N N 475 119.600 119.600 117.312 2.288 19685 3184 1 6 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.553 0.247 19685 3185 1 6 . 1 1 475 475 ARG C C 475 175.700 175.700 174.968 0.732 19685 3186 1 6 . 1 1 475 475 ARG CA C 475 54.000 54.000 55.340 -1.340 19685 3187 1 6 . 1 1 475 475 ARG CB C 475 31.300 31.300 32.506 -1.206 19685 3188 1 6 . 1 1 475 475 ARG H H 475 8.350 8.350 8.393 -0.043 19685 3189 1 6 . 1 1 476 476 LEU N N 476 123.500 123.500 120.761 2.739 19685 3190 1 6 . 1 1 476 476 LEU HA H 476 4.430 4.430 3.941 0.489 19685 3191 1 6 . 1 1 476 476 LEU C C 476 177.600 177.600 176.084 1.516 19685 3192 1 6 . 1 1 476 476 LEU CA C 476 55.500 55.500 55.688 -0.188 19685 3193 1 6 . 1 1 476 476 LEU CB C 476 42.800 42.800 40.449 2.351 19685 3194 1 6 . 1 1 476 476 LEU H H 476 9.130 9.130 7.547 1.583 19685 3195 1 6 . 1 1 477 477 LYS N N 477 123.200 123.200 121.752 1.448 19685 3196 1 6 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.469 0.691 19685 3197 1 6 . 1 1 477 477 LYS C C 477 174.100 174.100 175.799 -1.699 19685 3198 1 6 . 1 1 477 477 LYS CA C 477 54.500 54.500 54.933 -0.433 19685 3199 1 6 . 1 1 477 477 LYS CB C 477 34.900 34.900 32.445 2.455 19685 3200 1 6 . 1 1 477 477 LYS H H 477 8.090 8.090 8.408 -0.318 19685 3201 1 6 . 1 1 478 478 VAL N N 478 127.100 127.100 120.221 6.879 19685 3202 1 6 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.513 0.387 19685 3203 1 6 . 1 1 478 478 VAL C C 478 173.700 173.700 175.960 -2.260 19685 3204 1 6 . 1 1 478 478 VAL CA C 478 61.000 61.000 62.776 -1.776 19685 3205 1 6 . 1 1 478 478 VAL CB C 478 33.700 33.700 32.130 1.570 19685 3206 1 6 . 1 1 478 478 VAL H H 478 8.820 8.820 7.639 1.181 19685 3207 1 6 . 1 1 479 479 GLN N N 479 123.600 123.600 127.083 -3.483 19685 3208 1 6 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.587 0.223 19685 3209 1 6 . 1 1 479 479 GLN C C 479 173.600 173.600 174.113 -0.513 19685 3210 1 6 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.404 -1.204 19685 3211 1 6 . 1 1 479 479 GLN CB C 479 33.500 33.500 31.721 1.778 19685 3212 1 6 . 1 1 479 479 GLN H H 479 9.130 9.130 8.472 0.658 19685 3213 1 6 . 1 1 480 480 LEU N N 480 123.200 123.200 122.011 1.189 19685 3214 1 6 . 1 1 480 480 LEU HA H 480 4.440 4.440 5.097 -0.657 19685 3215 1 6 . 1 1 480 480 LEU C C 480 177.100 177.100 177.403 -0.303 19685 3216 1 6 . 1 1 480 480 LEU CA C 480 54.600 54.600 54.986 -0.386 19685 3217 1 6 . 1 1 480 480 LEU CB C 480 42.400 42.400 43.016 -0.616 19685 3218 1 6 . 1 1 480 480 LEU H H 480 8.840 8.840 8.407 0.433 19685 3219 1 6 . 1 1 481 481 LYS N N 481 124.500 124.500 122.559 1.941 19685 3220 1 6 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.178 0.132 19685 3221 1 6 . 1 1 481 481 LYS C C 481 175.200 175.200 178.383 -3.183 19685 3222 1 6 . 1 1 481 481 LYS CA C 481 56.700 56.700 59.252 -2.552 19685 3223 1 6 . 1 1 481 481 LYS CB C 481 33.100 33.100 31.479 1.621 19685 3224 1 6 . 1 1 481 481 LYS H H 481 8.400 8.400 9.217 -0.817 19685 3225 1 6 . 1 1 482 482 ARG N N 482 126.600 126.600 118.216 8.384 19685 3226 1 6 . 1 1 482 482 ARG HA H 482 4.350 4.350 4.027 0.323 19685 3227 1 6 . 1 1 482 482 ARG C C 482 175.800 175.800 176.979 -1.179 19685 3228 1 6 . 1 1 482 482 ARG CA C 482 55.600 55.600 58.801 -3.201 19685 3229 1 6 . 1 1 482 482 ARG CB C 482 31.100 31.100 28.529 2.571 19685 3230 1 6 . 1 1 482 482 ARG H H 482 8.770 8.770 8.381 0.389 19685 3231 1 6 . 1 1 483 483 SER N N 483 118.100 118.100 114.941 3.159 19685 3232 1 6 . 1 1 483 483 SER HA H 483 4.400 4.400 4.550 -0.150 19685 3233 1 6 . 1 1 483 483 SER C C 483 174.200 174.200 173.083 1.117 19685 3234 1 6 . 1 1 483 483 SER CA C 483 58.000 58.000 58.012 -0.012 19685 3235 1 6 . 1 1 483 483 SER CB C 483 63.500 63.500 65.690 -2.190 19685 3236 1 6 . 1 1 483 483 SER H H 483 8.610 8.610 8.261 0.349 19685 3237 1 6 . 1 1 484 484 LYS N N 484 123.000 123.000 120.745 2.255 19685 3238 1 6 . 1 1 484 484 LYS HA H 484 4.210 4.210 3.945 0.265 19685 3239 1 6 . 1 1 484 484 LYS C C 484 175.900 175.900 174.137 1.763 19685 3240 1 6 . 1 1 484 484 LYS CA C 484 56.300 56.300 57.421 -1.121 19685 3241 1 6 . 1 1 484 484 LYS CB C 484 32.500 32.500 32.899 -0.399 19685 3242 1 6 . 1 1 484 484 LYS H H 484 8.560 8.560 8.004 0.556 19685 3243 1 6 . 1 1 485 485 ASN N N 485 119.600 119.600 118.880 0.720 19685 3244 1 6 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.806 -0.206 19685 3245 1 6 . 1 1 485 485 ASN C C 485 174.400 174.400 173.200 1.200 19685 3246 1 6 . 1 1 485 485 ASN CA C 485 52.900 52.900 53.108 -0.208 19685 3247 1 6 . 1 1 485 485 ASN CB C 485 38.400 38.400 40.273 -1.873 19685 3248 1 6 . 1 1 485 485 ASN H H 485 8.560 8.560 8.438 0.122 19685 3249 1 6 . 1 1 486 486 ASP N N 486 121.100 121.100 123.086 -1.986 19685 3250 1 6 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.700 -0.180 19685 3251 1 6 . 1 1 486 486 ASP C C 486 175.700 175.700 175.355 0.345 19685 3252 1 6 . 1 1 486 486 ASP CA C 486 54.000 54.000 53.239 0.761 19685 3253 1 6 . 1 1 486 486 ASP CB C 486 40.800 40.800 42.187 -1.387 19685 3254 1 6 . 1 1 486 486 ASP H H 486 8.250 8.250 8.603 -0.353 19685 3255 1 6 . 1 1 487 487 SER N N 487 115.400 115.400 115.605 -0.205 19685 3256 1 6 . 1 1 487 487 SER HA H 487 4.310 4.310 4.579 -0.269 19685 3257 1 6 . 1 1 487 487 SER C C 487 172.800 172.800 173.749 -0.949 19685 3258 1 6 . 1 1 487 487 SER CA C 487 57.700 57.700 57.810 -0.110 19685 3259 1 6 . 1 1 487 487 SER CB C 487 63.600 63.600 63.904 -0.304 19685 3260 1 6 . 1 1 487 487 SER H H 487 8.090 8.090 8.324 -0.234 19685 3261 1 6 . 1 1 488 488 LYS N N 488 122.300 122.300 122.230 0.070 19685 3262 1 6 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.652 -0.602 19685 3263 1 6 . 1 1 488 488 LYS C C 488 174.500 174.500 174.965 -0.465 19685 3264 1 6 . 1 1 488 488 LYS CA C 488 54.000 54.000 53.423 0.577 19685 3265 1 6 . 1 1 488 488 LYS CB C 488 32.400 32.400 32.147 0.253 19685 3266 1 6 . 1 1 488 488 LYS H H 488 8.090 8.090 8.274 -0.184 19685 3267 1 6 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.321 -0.041 19685 3268 1 6 . 1 1 489 489 PRO C C 489 175.000 175.000 175.794 -0.794 19685 3269 1 6 . 1 1 489 489 PRO CA C 489 63.200 63.200 63.096 0.104 19685 3270 1 6 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.069 -0.969 19685 3271 1 7 . 1 1 395 395 SER N N 395 115.500 115.500 116.225 -0.725 19685 3272 1 7 . 1 1 395 395 SER HA H 395 4.300 4.300 4.919 -0.619 19685 3273 1 7 . 1 1 395 395 SER C C 395 173.900 173.900 173.552 0.348 19685 3274 1 7 . 1 1 395 395 SER CA C 395 57.900 57.900 58.200 -0.300 19685 3275 1 7 . 1 1 395 395 SER CB C 395 63.400 63.400 63.938 -0.538 19685 3276 1 7 . 1 1 395 395 SER H H 395 8.200 8.200 8.802 -0.602 19685 3277 1 7 . 1 1 396 396 HIS N N 396 123.500 123.500 120.467 3.033 19685 3278 1 7 . 1 1 396 396 HIS HA H 396 4.560 4.560 5.003 -0.443 19685 3279 1 7 . 1 1 396 396 HIS C C 396 174.100 174.100 173.269 0.831 19685 3280 1 7 . 1 1 396 396 HIS CA C 396 53.700 53.700 55.266 -1.566 19685 3281 1 7 . 1 1 396 396 HIS CB C 396 32.200 32.200 32.022 0.178 19685 3282 1 7 . 1 1 396 396 HIS H H 396 8.120 8.120 8.757 -0.637 19685 3283 1 7 . 1 1 397 397 MET N N 397 121.200 121.200 122.340 -1.140 19685 3284 1 7 . 1 1 397 397 MET HA H 397 4.320 4.320 4.473 -0.153 19685 3285 1 7 . 1 1 397 397 MET C C 397 175.400 175.400 173.516 1.884 19685 3286 1 7 . 1 1 397 397 MET CA C 397 55.000 55.000 54.410 0.590 19685 3287 1 7 . 1 1 397 397 MET CB C 397 32.500 32.500 35.586 -3.086 19685 3288 1 7 . 1 1 397 397 MET H H 397 8.300 8.300 7.632 0.668 19685 3289 1 7 . 1 1 398 398 GLN N N 398 122.100 122.100 122.095 0.005 19685 3290 1 7 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.378 -0.188 19685 3291 1 7 . 1 1 398 398 GLN C C 398 174.800 174.800 174.712 0.088 19685 3292 1 7 . 1 1 398 398 GLN CA C 398 55.200 55.200 55.832 -0.632 19685 3293 1 7 . 1 1 398 398 GLN CB C 398 28.900 28.900 29.803 -0.903 19685 3294 1 7 . 1 1 398 398 GLN H H 398 8.540 8.540 8.457 0.083 19685 3295 1 7 . 1 1 399 399 LYS N N 399 123.000 123.000 122.019 0.981 19685 3296 1 7 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.571 -0.351 19685 3297 1 7 . 1 1 399 399 LYS C C 399 174.800 174.800 175.692 -0.892 19685 3298 1 7 . 1 1 399 399 LYS CA C 399 55.600 55.600 55.223 0.377 19685 3299 1 7 . 1 1 399 399 LYS CB C 399 33.000 33.000 35.132 -2.132 19685 3300 1 7 . 1 1 399 399 LYS H H 399 8.180 8.180 8.182 -0.002 19685 3301 1 7 . 1 1 400 400 GLU N N 400 122.000 122.000 115.756 6.244 19685 3302 1 7 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.097 0.333 19685 3303 1 7 . 1 1 400 400 GLU C C 400 176.400 176.400 176.459 -0.059 19685 3304 1 7 . 1 1 400 400 GLU CA C 400 55.400 55.400 57.419 -2.019 19685 3305 1 7 . 1 1 400 400 GLU CB C 400 31.400 31.400 28.902 2.498 19685 3306 1 7 . 1 1 400 400 GLU H H 400 8.350 8.350 8.667 -0.317 19685 3307 1 7 . 1 1 401 401 GLY N N 401 109.500 109.500 107.453 2.047 19685 3308 1 7 . 1 1 401 401 GLY C C 401 171.500 171.500 172.792 -1.292 19685 3309 1 7 . 1 1 401 401 GLY CA C 401 43.700 43.700 45.047 -1.347 19685 3310 1 7 . 1 1 401 401 GLY H H 401 9.050 9.050 7.923 1.127 19685 3311 1 7 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.490 -0.070 19685 3312 1 7 . 1 1 402 402 PRO C C 402 173.900 173.900 176.419 -2.519 19685 3313 1 7 . 1 1 402 402 PRO CA C 402 61.900 61.900 64.158 -2.258 19685 3314 1 7 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.902 -0.702 19685 3315 1 7 . 1 1 403 403 GLU N N 403 119.600 119.600 117.291 2.309 19685 3316 1 7 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.356 -0.396 19685 3317 1 7 . 1 1 403 403 GLU C C 403 177.300 177.300 176.935 0.365 19685 3318 1 7 . 1 1 403 403 GLU CA C 403 58.100 58.100 56.578 1.522 19685 3319 1 7 . 1 1 403 403 GLU CB C 403 29.000 29.000 31.087 -2.087 19685 3320 1 7 . 1 1 403 403 GLU H H 403 8.420 8.420 7.825 0.595 19685 3321 1 7 . 1 1 404 404 GLY N N 404 112.800 112.800 113.883 -1.083 19685 3322 1 7 . 1 1 404 404 GLY C C 404 173.300 173.300 174.857 -1.557 19685 3323 1 7 . 1 1 404 404 GLY CA C 404 44.900 44.900 46.796 -1.896 19685 3324 1 7 . 1 1 404 404 GLY H H 404 8.500 8.500 9.022 -0.522 19685 3325 1 7 . 1 1 405 405 ALA N N 405 120.000 120.000 124.977 -4.977 19685 3326 1 7 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.460 0.090 19685 3327 1 7 . 1 1 405 405 ALA C C 405 174.100 174.100 175.751 -1.651 19685 3328 1 7 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.863 -1.363 19685 3329 1 7 . 1 1 405 405 ALA CB C 405 20.800 20.800 18.035 2.765 19685 3330 1 7 . 1 1 405 405 ALA H H 405 8.360 8.360 7.895 0.465 19685 3331 1 7 . 1 1 406 406 ASN N N 406 115.500 115.500 115.848 -0.348 19685 3332 1 7 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.094 0.096 19685 3333 1 7 . 1 1 406 406 ASN C C 406 172.900 172.900 175.131 -2.231 19685 3334 1 7 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.907 0.693 19685 3335 1 7 . 1 1 406 406 ASN CB C 406 40.900 40.900 38.921 1.979 19685 3336 1 7 . 1 1 406 406 ASN H H 406 7.690 7.690 7.860 -0.170 19685 3337 1 7 . 1 1 407 407 LEU N N 407 123.400 123.400 121.078 2.322 19685 3338 1 7 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.365 0.595 19685 3339 1 7 . 1 1 407 407 LEU C C 407 174.900 174.900 177.085 -2.185 19685 3340 1 7 . 1 1 407 407 LEU CA C 407 53.100 53.100 56.743 -3.643 19685 3341 1 7 . 1 1 407 407 LEU CB C 407 45.400 45.400 41.824 3.576 19685 3342 1 7 . 1 1 407 407 LEU H H 407 9.290 9.290 7.731 1.559 19685 3343 1 7 . 1 1 408 408 PHE N N 408 118.700 118.700 122.272 -3.572 19685 3344 1 7 . 1 1 408 408 PHE HA H 408 5.300 5.300 5.030 0.270 19685 3345 1 7 . 1 1 408 408 PHE C C 408 174.200 174.200 175.979 -1.779 19685 3346 1 7 . 1 1 408 408 PHE CA C 408 56.300 56.300 57.148 -0.848 19685 3347 1 7 . 1 1 408 408 PHE CB C 408 42.700 42.700 37.606 5.094 19685 3348 1 7 . 1 1 408 408 PHE H H 408 9.150 9.150 8.681 0.469 19685 3349 1 7 . 1 1 409 409 ILE N N 409 120.800 120.800 122.469 -1.669 19685 3350 1 7 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.746 0.224 19685 3351 1 7 . 1 1 409 409 ILE C C 409 173.900 173.900 174.920 -1.020 19685 3352 1 7 . 1 1 409 409 ILE CA C 409 59.000 59.000 61.438 -2.438 19685 3353 1 7 . 1 1 409 409 ILE CB C 409 40.400 40.400 38.337 2.063 19685 3354 1 7 . 1 1 409 409 ILE H H 409 8.380 8.380 7.845 0.535 19685 3355 1 7 . 1 1 410 410 TYR N N 410 123.200 123.200 123.111 0.089 19685 3356 1 7 . 1 1 410 410 TYR HA H 410 4.940 4.940 5.055 -0.115 19685 3357 1 7 . 1 1 410 410 TYR C C 410 174.300 174.300 174.459 -0.159 19685 3358 1 7 . 1 1 410 410 TYR CA C 410 56.200 56.200 56.539 -0.339 19685 3359 1 7 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.557 1.243 19685 3360 1 7 . 1 1 410 410 TYR H H 410 9.440 9.440 7.726 1.714 19685 3361 1 7 . 1 1 411 411 HIS N N 411 112.100 112.100 115.843 -3.743 19685 3362 1 7 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.279 0.171 19685 3363 1 7 . 1 1 411 411 HIS C C 411 173.300 173.300 174.862 -1.562 19685 3364 1 7 . 1 1 411 411 HIS CA C 411 55.900 55.900 55.932 -0.032 19685 3365 1 7 . 1 1 411 411 HIS CB C 411 26.200 26.200 28.916 -2.716 19685 3366 1 7 . 1 1 411 411 HIS H H 411 8.580 8.580 9.006 -0.426 19685 3367 1 7 . 1 1 412 412 LEU N N 412 115.100 115.100 115.835 -0.735 19685 3368 1 7 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.484 -0.524 19685 3369 1 7 . 1 1 412 412 LEU C C 412 175.100 175.100 175.549 -0.449 19685 3370 1 7 . 1 1 412 412 LEU CA C 412 52.400 52.400 53.954 -1.554 19685 3371 1 7 . 1 1 412 412 LEU CB C 412 42.000 42.000 41.797 0.203 19685 3372 1 7 . 1 1 412 412 LEU H H 412 7.560 7.560 7.771 -0.211 19685 3373 1 7 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.410 -0.140 19685 3374 1 7 . 1 1 413 413 PRO C C 413 177.600 177.600 177.390 0.210 19685 3375 1 7 . 1 1 413 413 PRO CA C 413 62.300 62.300 62.336 -0.036 19685 3376 1 7 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.479 -0.279 19685 3377 1 7 . 1 1 414 414 GLN N N 414 125.500 125.500 116.921 8.579 19685 3378 1 7 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.208 -0.128 19685 3379 1 7 . 1 1 414 414 GLN C C 414 175.400 175.400 176.166 -0.766 19685 3380 1 7 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.671 -0.671 19685 3381 1 7 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.724 -0.225 19685 3382 1 7 . 1 1 414 414 GLN H H 414 9.170 9.170 8.543 0.627 19685 3383 1 7 . 1 1 415 415 GLU N N 415 115.300 115.300 118.335 -3.035 19685 3384 1 7 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.485 -0.225 19685 3385 1 7 . 1 1 415 415 GLU C C 415 176.700 176.700 176.214 0.486 19685 3386 1 7 . 1 1 415 415 GLU CA C 415 58.700 58.700 56.190 2.510 19685 3387 1 7 . 1 1 415 415 GLU CB C 415 28.300 28.300 30.109 -1.809 19685 3388 1 7 . 1 1 415 415 GLU H H 415 9.390 9.390 8.308 1.082 19685 3389 1 7 . 1 1 416 416 PHE N N 416 121.700 121.700 118.209 3.491 19685 3390 1 7 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.027 -0.417 19685 3391 1 7 . 1 1 416 416 PHE C C 416 176.400 176.400 176.369 0.031 19685 3392 1 7 . 1 1 416 416 PHE CA C 416 57.400 57.400 55.897 1.503 19685 3393 1 7 . 1 1 416 416 PHE CB C 416 38.700 38.700 41.382 -2.682 19685 3394 1 7 . 1 1 416 416 PHE H H 416 7.610 7.610 7.301 0.309 19685 3395 1 7 . 1 1 417 417 GLY N N 417 113.000 113.000 105.468 7.532 19685 3396 1 7 . 1 1 417 417 GLY C C 417 174.300 174.300 173.204 1.096 19685 3397 1 7 . 1 1 417 417 GLY CA C 417 42.900 42.900 45.243 -2.343 19685 3398 1 7 . 1 1 417 417 GLY H H 417 9.740 9.740 7.742 1.998 19685 3399 1 7 . 1 1 418 418 ASP N N 418 121.500 121.500 118.156 3.344 19685 3400 1 7 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.427 -0.487 19685 3401 1 7 . 1 1 418 418 ASP C C 418 177.900 177.900 175.619 2.281 19685 3402 1 7 . 1 1 418 418 ASP CA C 418 57.600 57.600 55.205 2.395 19685 3403 1 7 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.240 -1.540 19685 3404 1 7 . 1 1 418 418 ASP H H 418 8.680 8.680 8.432 0.248 19685 3405 1 7 . 1 1 419 419 GLN N N 419 116.400 116.400 118.552 -2.152 19685 3406 1 7 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.358 -0.448 19685 3407 1 7 . 1 1 419 419 GLN C C 419 177.600 177.600 175.718 1.882 19685 3408 1 7 . 1 1 419 419 GLN CA C 419 58.000 58.000 56.472 1.528 19685 3409 1 7 . 1 1 419 419 GLN CB C 419 27.400 27.400 29.624 -2.224 19685 3410 1 7 . 1 1 419 419 GLN H H 419 8.780 8.780 7.909 0.871 19685 3411 1 7 . 1 1 420 420 ASP N N 420 117.500 117.500 118.184 -0.684 19685 3412 1 7 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.606 -0.596 19685 3413 1 7 . 1 1 420 420 ASP C C 420 178.000 178.000 177.061 0.939 19685 3414 1 7 . 1 1 420 420 ASP CA C 420 56.700 56.700 54.733 1.967 19685 3415 1 7 . 1 1 420 420 ASP CB C 420 39.800 39.800 41.461 -1.661 19685 3416 1 7 . 1 1 420 420 ASP H H 420 7.210 7.210 8.118 -0.908 19685 3417 1 7 . 1 1 421 421 ILE N N 421 117.000 117.000 121.223 -4.223 19685 3418 1 7 . 1 1 421 421 ILE HA H 421 4.080 4.080 3.671 0.409 19685 3419 1 7 . 1 1 421 421 ILE C C 421 176.500 176.500 177.386 -0.886 19685 3420 1 7 . 1 1 421 421 ILE CA C 421 64.000 64.000 65.099 -1.099 19685 3421 1 7 . 1 1 421 421 ILE CB C 421 37.300 37.300 37.884 -0.584 19685 3422 1 7 . 1 1 421 421 ILE H H 421 7.610 7.610 8.237 -0.627 19685 3423 1 7 . 1 1 422 422 LEU N N 422 123.200 123.200 118.184 5.016 19685 3424 1 7 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.025 -0.265 19685 3425 1 7 . 1 1 422 422 LEU C C 422 177.800 177.800 177.508 0.292 19685 3426 1 7 . 1 1 422 422 LEU CA C 422 58.600 58.600 57.189 1.411 19685 3427 1 7 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.645 -0.445 19685 3428 1 7 . 1 1 422 422 LEU H H 422 7.870 7.870 8.147 -0.277 19685 3429 1 7 . 1 1 423 423 GLN N N 423 115.600 115.600 117.508 -1.908 19685 3430 1 7 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.324 -0.444 19685 3431 1 7 . 1 1 423 423 GLN C C 423 177.800 177.800 176.099 1.701 19685 3432 1 7 . 1 1 423 423 GLN CA C 423 58.600 58.600 56.456 2.144 19685 3433 1 7 . 1 1 423 423 GLN CB C 423 27.900 27.900 30.464 -2.564 19685 3434 1 7 . 1 1 423 423 GLN H H 423 7.860 7.860 7.756 0.104 19685 3435 1 7 . 1 1 424 424 MET N N 424 115.500 115.500 116.593 -1.093 19685 3436 1 7 . 1 1 424 424 MET HA H 424 3.910 3.910 4.499 -0.589 19685 3437 1 7 . 1 1 424 424 MET C C 424 175.500 175.500 176.612 -1.112 19685 3438 1 7 . 1 1 424 424 MET CA C 424 57.800 57.800 55.384 2.416 19685 3439 1 7 . 1 1 424 424 MET CB C 424 34.300 34.300 34.963 -0.663 19685 3440 1 7 . 1 1 424 424 MET H H 424 7.560 7.560 7.698 -0.138 19685 3441 1 7 . 1 1 425 425 PHE N N 425 112.300 112.300 119.464 -7.164 19685 3442 1 7 . 1 1 425 425 PHE HA H 425 4.700 4.700 5.034 -0.334 19685 3443 1 7 . 1 1 425 425 PHE C C 425 177.300 177.300 177.256 0.044 19685 3444 1 7 . 1 1 425 425 PHE CA C 425 59.900 59.900 59.296 0.604 19685 3445 1 7 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.157 -1.657 19685 3446 1 7 . 1 1 425 425 PHE H H 425 7.680 7.680 8.605 -0.925 19685 3447 1 7 . 1 1 426 426 MET N N 426 127.400 127.400 119.923 7.477 19685 3448 1 7 . 1 1 426 426 MET HA H 426 4.630 4.630 4.402 0.228 19685 3449 1 7 . 1 1 426 426 MET C C 426 173.800 173.800 175.424 -1.624 19685 3450 1 7 . 1 1 426 426 MET CA C 426 59.100 59.100 59.231 -0.131 19685 3451 1 7 . 1 1 426 426 MET CB C 426 31.800 31.800 30.201 1.599 19685 3452 1 7 . 1 1 426 426 MET H H 426 8.540 8.540 8.016 0.524 19685 3453 1 7 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.171 -0.161 19685 3454 1 7 . 1 1 427 427 PRO C C 427 176.800 176.800 175.914 0.886 19685 3455 1 7 . 1 1 427 427 PRO CA C 427 65.200 65.200 63.902 1.298 19685 3456 1 7 . 1 1 427 427 PRO CB C 427 30.600 30.600 31.144 -0.544 19685 3457 1 7 . 1 1 428 428 PHE N N 428 110.000 110.000 117.093 -7.093 19685 3458 1 7 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.697 -0.427 19685 3459 1 7 . 1 1 428 428 PHE C C 428 174.600 174.600 175.345 -0.745 19685 3460 1 7 . 1 1 428 428 PHE CA C 428 57.700 57.700 58.858 -1.159 19685 3461 1 7 . 1 1 428 428 PHE CB C 428 38.000 38.000 41.591 -3.591 19685 3462 1 7 . 1 1 428 428 PHE H H 428 6.560 6.560 7.730 -1.170 19685 3463 1 7 . 1 1 429 429 GLY N N 429 105.500 105.500 104.320 1.180 19685 3464 1 7 . 1 1 429 429 GLY C C 429 170.100 170.100 171.663 -1.563 19685 3465 1 7 . 1 1 429 429 GLY CA C 429 44.400 44.400 44.538 -0.138 19685 3466 1 7 . 1 1 429 429 GLY H H 429 7.650 7.650 7.623 0.027 19685 3467 1 7 . 1 1 430 430 ASN N N 430 117.400 117.400 117.671 -0.271 19685 3468 1 7 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.558 0.072 19685 3469 1 7 . 1 1 430 430 ASN C C 430 173.200 173.200 175.668 -2.468 19685 3470 1 7 . 1 1 430 430 ASN CA C 430 52.600 52.600 53.021 -0.421 19685 3471 1 7 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.693 -2.493 19685 3472 1 7 . 1 1 430 430 ASN H H 430 9.020 9.020 7.861 1.159 19685 3473 1 7 . 1 1 431 431 VAL N N 431 128.000 128.000 117.577 10.423 19685 3474 1 7 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.409 -0.659 19685 3475 1 7 . 1 1 431 431 VAL C C 431 176.400 176.400 175.507 0.893 19685 3476 1 7 . 1 1 431 431 VAL CA C 431 61.800 61.800 60.756 1.044 19685 3477 1 7 . 1 1 431 431 VAL CB C 431 31.900 31.900 30.826 1.074 19685 3478 1 7 . 1 1 431 431 VAL H H 431 8.480 8.480 8.525 -0.045 19685 3479 1 7 . 1 1 432 432 ILE N N 432 128.000 128.000 121.513 6.487 19685 3480 1 7 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.781 0.139 19685 3481 1 7 . 1 1 432 432 ILE C C 432 176.100 176.100 175.883 0.217 19685 3482 1 7 . 1 1 432 432 ILE CA C 432 62.500 62.500 63.869 -1.369 19685 3483 1 7 . 1 1 432 432 ILE CB C 432 37.400 37.400 38.109 -0.709 19685 3484 1 7 . 1 1 432 432 ILE H H 432 8.840 8.840 7.629 1.211 19685 3485 1 7 . 1 1 433 433 SER N N 433 113.600 113.600 111.772 1.828 19685 3486 1 7 . 1 1 433 433 SER HA H 433 4.440 4.440 4.529 -0.089 19685 3487 1 7 . 1 1 433 433 SER C C 433 171.000 171.000 172.705 -1.705 19685 3488 1 7 . 1 1 433 433 SER CA C 433 57.300 57.300 58.001 -0.701 19685 3489 1 7 . 1 1 433 433 SER CB C 433 65.200 65.200 65.996 -0.796 19685 3490 1 7 . 1 1 433 433 SER H H 433 7.280 7.280 7.456 -0.176 19685 3491 1 7 . 1 1 434 434 ALA N N 434 125.700 125.700 124.703 0.997 19685 3492 1 7 . 1 1 434 434 ALA HA H 434 4.910 4.910 5.036 -0.126 19685 3493 1 7 . 1 1 434 434 ALA C C 434 174.600 174.600 176.304 -1.704 19685 3494 1 7 . 1 1 434 434 ALA CA C 434 51.000 51.000 50.461 0.539 19685 3495 1 7 . 1 1 434 434 ALA CB C 434 21.200 21.200 22.299 -1.099 19685 3496 1 7 . 1 1 434 434 ALA H H 434 8.270 8.270 8.308 -0.038 19685 3497 1 7 . 1 1 435 435 LYS N N 435 120.900 120.900 119.864 1.036 19685 3498 1 7 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.496 -0.026 19685 3499 1 7 . 1 1 435 435 LYS C C 435 173.800 173.800 176.876 -3.076 19685 3500 1 7 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.442 -1.742 19685 3501 1 7 . 1 1 435 435 LYS CB C 435 36.400 36.400 35.891 0.509 19685 3502 1 7 . 1 1 435 435 LYS H H 435 8.490 8.490 7.870 0.620 19685 3503 1 7 . 1 1 436 436 VAL N N 436 122.200 122.200 118.255 3.945 19685 3504 1 7 . 1 1 436 436 VAL HA H 436 3.920 3.920 3.718 0.202 19685 3505 1 7 . 1 1 436 436 VAL C C 436 175.100 175.100 174.934 0.166 19685 3506 1 7 . 1 1 436 436 VAL CA C 436 63.600 63.600 63.377 0.223 19685 3507 1 7 . 1 1 436 436 VAL CB C 436 33.500 33.500 30.837 2.663 19685 3508 1 7 . 1 1 436 436 VAL H H 436 8.390 8.390 8.347 0.043 19685 3509 1 7 . 1 1 437 437 PHE N N 437 125.900 125.900 110.047 15.853 19685 3510 1 7 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.155 0.245 19685 3511 1 7 . 1 1 437 437 PHE C C 437 173.600 173.600 174.212 -0.612 19685 3512 1 7 . 1 1 437 437 PHE CA C 437 57.700 57.700 58.639 -0.939 19685 3513 1 7 . 1 1 437 437 PHE CB C 437 39.000 39.000 36.751 2.249 19685 3514 1 7 . 1 1 437 437 PHE H H 437 8.250 8.250 7.942 0.308 19685 3515 1 7 . 1 1 438 438 ILE N N 438 121.900 121.900 118.571 3.329 19685 3516 1 7 . 1 1 438 438 ILE HA H 438 4.460 4.460 4.240 0.220 19685 3517 1 7 . 1 1 438 438 ILE C C 438 175.700 175.700 174.834 0.866 19685 3518 1 7 . 1 1 438 438 ILE CA C 438 58.300 58.300 59.257 -0.957 19685 3519 1 7 . 1 1 438 438 ILE CB C 438 39.700 39.700 40.762 -1.062 19685 3520 1 7 . 1 1 438 438 ILE H H 438 8.520 8.520 7.168 1.352 19685 3521 1 7 . 1 1 439 439 ASP N N 439 126.500 126.500 127.223 -0.723 19685 3522 1 7 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.714 -0.134 19685 3523 1 7 . 1 1 439 439 ASP C C 439 176.300 176.300 176.013 0.287 19685 3524 1 7 . 1 1 439 439 ASP CA C 439 53.600 53.600 52.452 1.148 19685 3525 1 7 . 1 1 439 439 ASP CB C 439 42.300 42.300 39.021 3.279 19685 3526 1 7 . 1 1 439 439 ASP H H 439 8.730 8.730 8.787 -0.057 19685 3527 1 7 . 1 1 440 440 LYS N N 440 127.300 127.300 118.347 8.953 19685 3528 1 7 . 1 1 440 440 LYS HA H 440 4.070 4.070 3.847 0.223 19685 3529 1 7 . 1 1 440 440 LYS C C 440 176.900 176.900 176.541 0.359 19685 3530 1 7 . 1 1 440 440 LYS CA C 440 57.800 57.800 59.252 -1.452 19685 3531 1 7 . 1 1 440 440 LYS CB C 440 32.100 32.100 31.006 1.094 19685 3532 1 7 . 1 1 440 440 LYS H H 440 8.930 8.930 7.790 1.140 19685 3533 1 7 . 1 1 441 441 GLN N N 441 117.400 117.400 115.875 1.525 19685 3534 1 7 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.505 -0.275 19685 3535 1 7 . 1 1 441 441 GLN C C 441 177.200 177.200 176.217 0.983 19685 3536 1 7 . 1 1 441 441 GLN CA C 441 57.600 57.600 55.762 1.838 19685 3537 1 7 . 1 1 441 441 GLN CB C 441 28.800 28.800 30.649 -1.849 19685 3538 1 7 . 1 1 441 441 GLN H H 441 8.650 8.650 8.199 0.451 19685 3539 1 7 . 1 1 442 442 THR N N 442 107.300 107.300 117.202 -9.902 19685 3540 1 7 . 1 1 442 442 THR HA H 442 4.290 4.290 4.284 0.006 19685 3541 1 7 . 1 1 442 442 THR C C 442 175.100 175.100 174.172 0.928 19685 3542 1 7 . 1 1 442 442 THR CA C 442 61.200 61.200 63.916 -2.716 19685 3543 1 7 . 1 1 442 442 THR CB C 442 70.300 70.300 69.014 1.286 19685 3544 1 7 . 1 1 442 442 THR H H 442 7.830 7.830 7.693 0.137 19685 3545 1 7 . 1 1 443 443 ASN N N 443 117.300 117.300 116.348 0.952 19685 3546 1 7 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.521 -0.221 19685 3547 1 7 . 1 1 443 443 ASN C C 443 173.400 173.400 174.530 -1.130 19685 3548 1 7 . 1 1 443 443 ASN CA C 443 54.300 54.300 53.819 0.481 19685 3549 1 7 . 1 1 443 443 ASN CB C 443 37.600 37.600 36.961 0.639 19685 3550 1 7 . 1 1 443 443 ASN H H 443 8.470 8.470 8.190 0.280 19685 3551 1 7 . 1 1 444 444 LEU N N 444 118.000 118.000 116.200 1.800 19685 3552 1 7 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.595 -0.035 19685 3553 1 7 . 1 1 444 444 LEU C C 444 176.700 176.700 177.571 -0.871 19685 3554 1 7 . 1 1 444 444 LEU CA C 444 53.300 53.300 54.208 -0.908 19685 3555 1 7 . 1 1 444 444 LEU CB C 444 43.500 43.500 43.285 0.215 19685 3556 1 7 . 1 1 444 444 LEU H H 444 7.660 7.660 7.532 0.128 19685 3557 1 7 . 1 1 445 445 SER N N 445 115.500 115.500 115.326 0.174 19685 3558 1 7 . 1 1 445 445 SER HA H 445 4.460 4.460 4.263 0.197 19685 3559 1 7 . 1 1 445 445 SER C C 445 176.500 176.500 174.365 2.135 19685 3560 1 7 . 1 1 445 445 SER CA C 445 57.900 57.900 59.135 -1.235 19685 3561 1 7 . 1 1 445 445 SER CB C 445 63.500 63.500 63.397 0.103 19685 3562 1 7 . 1 1 445 445 SER H H 445 8.840 8.840 8.584 0.256 19685 3563 1 7 . 1 1 446 446 LYS N N 446 125.200 125.200 121.744 3.456 19685 3564 1 7 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.508 -0.008 19685 3565 1 7 . 1 1 446 446 LYS C C 446 176.100 176.100 175.845 0.255 19685 3566 1 7 . 1 1 446 446 LYS CA C 446 56.300 56.300 55.924 0.376 19685 3567 1 7 . 1 1 446 446 LYS CB C 446 32.200 32.200 32.739 -0.539 19685 3568 1 7 . 1 1 446 446 LYS H H 446 9.230 9.230 8.403 0.827 19685 3569 1 7 . 1 1 447 447 CYS N N 447 113.000 113.000 119.430 -6.430 19685 3570 1 7 . 1 1 447 447 CYS C C 447 172.500 172.500 173.117 -0.617 19685 3571 1 7 . 1 1 447 447 CYS CA C 447 60.400 60.400 58.991 1.409 19685 3572 1 7 . 1 1 447 447 CYS CB C 447 24.900 24.900 28.520 -3.620 19685 3573 1 7 . 1 1 447 447 CYS H H 447 10.020 10.020 7.712 2.308 19685 3574 1 7 . 1 1 448 448 PHE N N 448 115.200 115.200 116.415 -1.215 19685 3575 1 7 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.373 0.967 19685 3576 1 7 . 1 1 448 448 PHE C C 448 172.400 172.400 174.543 -2.143 19685 3577 1 7 . 1 1 448 448 PHE CA C 448 54.700 54.700 56.137 -1.437 19685 3578 1 7 . 1 1 448 448 PHE CB C 448 42.000 42.000 40.157 1.843 19685 3579 1 7 . 1 1 448 448 PHE H H 448 7.810 7.810 7.540 0.270 19685 3580 1 7 . 1 1 449 449 GLY N N 449 107.700 107.700 107.344 0.356 19685 3581 1 7 . 1 1 449 449 GLY C C 449 170.100 170.100 172.687 -2.587 19685 3582 1 7 . 1 1 449 449 GLY CA C 449 45.200 45.200 44.147 1.053 19685 3583 1 7 . 1 1 449 449 GLY H H 449 9.310 9.310 8.832 0.478 19685 3584 1 7 . 1 1 450 450 PHE N N 450 119.900 119.900 113.537 6.363 19685 3585 1 7 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.198 0.232 19685 3586 1 7 . 1 1 450 450 PHE C C 450 172.800 172.800 173.202 -0.402 19685 3587 1 7 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.748 -1.748 19685 3588 1 7 . 1 1 450 450 PHE CB C 450 43.600 43.600 41.291 2.309 19685 3589 1 7 . 1 1 450 450 PHE H H 450 8.760 8.760 7.876 0.884 19685 3590 1 7 . 1 1 451 451 VAL N N 451 123.800 123.800 118.048 5.752 19685 3591 1 7 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.874 -0.584 19685 3592 1 7 . 1 1 451 451 VAL C C 451 172.400 172.400 175.871 -3.471 19685 3593 1 7 . 1 1 451 451 VAL CA C 451 59.800 59.800 60.765 -0.965 19685 3594 1 7 . 1 1 451 451 VAL CB C 451 36.100 36.100 36.521 -0.421 19685 3595 1 7 . 1 1 451 451 VAL H H 451 7.930 7.930 8.356 -0.426 19685 3596 1 7 . 1 1 452 452 SER N N 452 119.600 119.600 120.668 -1.068 19685 3597 1 7 . 1 1 452 452 SER HA H 452 5.120 5.120 5.206 -0.086 19685 3598 1 7 . 1 1 452 452 SER C C 452 173.200 173.200 175.023 -1.823 19685 3599 1 7 . 1 1 452 452 SER CA C 452 55.700 55.700 57.612 -1.912 19685 3600 1 7 . 1 1 452 452 SER CB C 452 66.100 66.100 62.852 3.248 19685 3601 1 7 . 1 1 452 452 SER H H 452 8.540 8.540 8.725 -0.185 19685 3602 1 7 . 1 1 453 453 TYR N N 453 121.400 121.400 127.741 -6.341 19685 3603 1 7 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.791 0.589 19685 3604 1 7 . 1 1 453 453 TYR C C 453 173.600 173.600 176.753 -3.153 19685 3605 1 7 . 1 1 453 453 TYR CA C 453 56.500 56.500 58.024 -1.524 19685 3606 1 7 . 1 1 453 453 TYR CB C 453 42.200 42.200 37.070 5.130 19685 3607 1 7 . 1 1 453 453 TYR H H 453 8.380 8.380 8.581 -0.201 19685 3608 1 7 . 1 1 454 454 ASP N N 454 113.300 113.300 119.142 -5.842 19685 3609 1 7 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.338 0.152 19685 3610 1 7 . 1 1 454 454 ASP C C 454 176.100 176.100 174.903 1.197 19685 3611 1 7 . 1 1 454 454 ASP CA C 454 52.800 52.800 56.645 -3.845 19685 3612 1 7 . 1 1 454 454 ASP CB C 454 40.400 40.400 40.830 -0.430 19685 3613 1 7 . 1 1 454 454 ASP H H 454 7.860 7.860 8.210 -0.350 19685 3614 1 7 . 1 1 455 455 ASN N N 455 113.800 113.800 113.862 -0.062 19685 3615 1 7 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.109 -0.059 19685 3616 1 7 . 1 1 455 455 ASN C C 455 173.100 173.100 174.039 -0.939 19685 3617 1 7 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.893 -1.193 19685 3618 1 7 . 1 1 455 455 ASN CB C 455 41.100 41.100 39.492 1.608 19685 3619 1 7 . 1 1 455 455 ASN H H 455 7.200 7.200 8.341 -1.141 19685 3620 1 7 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.463 -0.293 19685 3621 1 7 . 1 1 456 456 PRO C C 456 177.300 177.300 177.324 -0.024 19685 3622 1 7 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.985 -0.785 19685 3623 1 7 . 1 1 456 456 PRO CB C 456 32.300 32.300 32.141 0.159 19685 3624 1 7 . 1 1 457 457 VAL N N 457 120.900 120.900 117.042 3.858 19685 3625 1 7 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.112 -0.492 19685 3626 1 7 . 1 1 457 457 VAL C C 457 179.000 179.000 176.967 2.033 19685 3627 1 7 . 1 1 457 457 VAL CA C 457 65.900 65.900 64.291 1.609 19685 3628 1 7 . 1 1 457 457 VAL CB C 457 30.800 30.800 30.843 -0.043 19685 3629 1 7 . 1 1 457 457 VAL H H 457 8.120 8.120 7.922 0.198 19685 3630 1 7 . 1 1 458 458 SER N N 458 117.800 117.800 115.791 2.009 19685 3631 1 7 . 1 1 458 458 SER HA H 458 3.940 3.940 4.613 -0.673 19685 3632 1 7 . 1 1 458 458 SER C C 458 173.600 173.600 175.474 -1.874 19685 3633 1 7 . 1 1 458 458 SER CA C 458 61.100 61.100 59.992 1.108 19685 3634 1 7 . 1 1 458 458 SER CB C 458 62.400 62.400 64.025 -1.625 19685 3635 1 7 . 1 1 458 458 SER H H 458 7.830 7.830 7.698 0.132 19685 3636 1 7 . 1 1 459 459 ALA N N 459 120.000 120.000 125.378 -5.378 19685 3637 1 7 . 1 1 459 459 ALA HA H 459 3.750 3.750 3.985 -0.235 19685 3638 1 7 . 1 1 459 459 ALA C C 459 178.100 178.100 177.895 0.205 19685 3639 1 7 . 1 1 459 459 ALA CA C 459 54.500 54.500 54.063 0.437 19685 3640 1 7 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.476 -0.576 19685 3641 1 7 . 1 1 459 459 ALA H H 459 6.370 6.370 7.788 -1.418 19685 3642 1 7 . 1 1 460 460 GLN N N 460 116.100 116.100 118.165 -2.065 19685 3643 1 7 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.097 -0.267 19685 3644 1 7 . 1 1 460 460 GLN C C 460 178.000 178.000 176.516 1.484 19685 3645 1 7 . 1 1 460 460 GLN CA C 460 58.500 58.500 57.852 0.648 19685 3646 1 7 . 1 1 460 460 GLN CB C 460 27.400 27.400 27.952 -0.552 19685 3647 1 7 . 1 1 460 460 GLN H H 460 7.710 7.710 8.331 -0.621 19685 3648 1 7 . 1 1 461 461 ALA N N 461 122.800 122.800 120.047 2.753 19685 3649 1 7 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.391 -0.431 19685 3650 1 7 . 1 1 461 461 ALA C C 461 179.500 179.500 177.443 2.057 19685 3651 1 7 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.287 2.213 19685 3652 1 7 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.184 -1.684 19685 3653 1 7 . 1 1 461 461 ALA H H 461 7.880 7.880 7.544 0.336 19685 3654 1 7 . 1 1 462 462 ALA N N 462 121.400 121.400 119.498 1.902 19685 3655 1 7 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.883 -1.483 19685 3656 1 7 . 1 1 462 462 ALA C C 462 179.400 179.400 177.804 1.596 19685 3657 1 7 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.577 1.523 19685 3658 1 7 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.666 -1.966 19685 3659 1 7 . 1 1 462 462 ALA H H 462 7.860 7.860 7.684 0.176 19685 3660 1 7 . 1 1 463 463 ILE N N 463 118.600 118.600 118.819 -0.219 19685 3661 1 7 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.866 -0.626 19685 3662 1 7 . 1 1 463 463 ILE C C 463 177.500 177.500 176.350 1.150 19685 3663 1 7 . 1 1 463 463 ILE CA C 463 66.000 66.000 62.566 3.434 19685 3664 1 7 . 1 1 463 463 ILE CB C 463 38.300 38.300 37.939 0.361 19685 3665 1 7 . 1 1 463 463 ILE H H 463 8.090 8.090 8.039 0.051 19685 3666 1 7 . 1 1 464 464 GLN N N 464 117.000 117.000 117.014 -0.014 19685 3667 1 7 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.318 -0.448 19685 3668 1 7 . 1 1 464 464 GLN C C 464 177.700 177.700 175.274 2.426 19685 3669 1 7 . 1 1 464 464 GLN CA C 464 58.200 58.200 56.023 2.177 19685 3670 1 7 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.259 -1.359 19685 3671 1 7 . 1 1 464 464 GLN H H 464 7.780 7.780 8.127 -0.347 19685 3672 1 7 . 1 1 465 465 ALA N N 465 117.200 117.200 120.196 -2.996 19685 3673 1 7 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.195 0.035 19685 3674 1 7 . 1 1 465 465 ALA C C 465 179.200 179.200 176.831 2.369 19685 3675 1 7 . 1 1 465 465 ALA CA C 465 53.800 53.800 53.263 0.537 19685 3676 1 7 . 1 1 465 465 ALA CB C 465 21.100 21.100 19.990 1.110 19685 3677 1 7 . 1 1 465 465 ALA H H 465 7.540 7.540 7.500 0.040 19685 3678 1 7 . 1 1 466 466 MET N N 466 110.800 110.800 116.674 -5.874 19685 3679 1 7 . 1 1 466 466 MET HA H 466 4.820 4.820 4.752 0.068 19685 3680 1 7 . 1 1 466 466 MET C C 466 177.600 177.600 175.653 1.947 19685 3681 1 7 . 1 1 466 466 MET CA C 466 53.300 53.300 55.098 -1.798 19685 3682 1 7 . 1 1 466 466 MET CB C 466 31.600 31.600 34.865 -3.265 19685 3683 1 7 . 1 1 466 466 MET H H 466 8.230 8.230 7.914 0.316 19685 3684 1 7 . 1 1 467 467 ASN N N 467 119.100 119.100 118.064 1.036 19685 3685 1 7 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.540 -0.050 19685 3686 1 7 . 1 1 467 467 ASN C C 467 176.300 176.300 176.307 -0.007 19685 3687 1 7 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.274 1.926 19685 3688 1 7 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.691 -0.491 19685 3689 1 7 . 1 1 467 467 ASN H H 467 8.560 8.560 7.440 1.120 19685 3690 1 7 . 1 1 468 468 GLY N N 468 117.900 117.900 112.689 5.211 19685 3691 1 7 . 1 1 468 468 GLY C C 468 172.800 172.800 173.608 -0.808 19685 3692 1 7 . 1 1 468 468 GLY CA C 468 45.300 45.300 45.737 -0.437 19685 3693 1 7 . 1 1 468 468 GLY H H 468 8.930 8.930 8.251 0.679 19685 3694 1 7 . 1 1 469 469 PHE N N 469 123.300 123.300 120.082 3.218 19685 3695 1 7 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.721 -0.531 19685 3696 1 7 . 1 1 469 469 PHE C C 469 174.400 174.400 173.654 0.746 19685 3697 1 7 . 1 1 469 469 PHE CA C 469 58.700 58.700 56.029 2.671 19685 3698 1 7 . 1 1 469 469 PHE CB C 469 40.600 40.600 41.755 -1.155 19685 3699 1 7 . 1 1 469 469 PHE H H 469 7.950 7.950 7.642 0.308 19685 3700 1 7 . 1 1 470 470 GLN N N 470 129.200 129.200 125.289 3.911 19685 3701 1 7 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.357 0.233 19685 3702 1 7 . 1 1 470 470 GLN C C 470 174.100 174.100 174.425 -0.325 19685 3703 1 7 . 1 1 470 470 GLN CA C 470 55.500 55.500 55.004 0.496 19685 3704 1 7 . 1 1 470 470 GLN CB C 470 28.800 28.800 29.087 -0.287 19685 3705 1 7 . 1 1 470 470 GLN H H 470 8.330 8.330 8.054 0.276 19685 3706 1 7 . 1 1 471 471 ILE N N 471 126.300 126.300 125.125 1.175 19685 3707 1 7 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.115 0.055 19685 3708 1 7 . 1 1 471 471 ILE C C 471 175.400 175.400 175.019 0.381 19685 3709 1 7 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.727 -1.127 19685 3710 1 7 . 1 1 471 471 ILE CB C 471 39.100 39.100 41.705 -2.605 19685 3711 1 7 . 1 1 471 471 ILE H H 471 8.440 8.440 8.451 -0.011 19685 3712 1 7 . 1 1 472 472 GLY N N 472 117.500 117.500 117.578 -0.078 19685 3713 1 7 . 1 1 472 472 GLY C C 472 174.700 174.700 175.255 -0.555 19685 3714 1 7 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.747 0.753 19685 3715 1 7 . 1 1 472 472 GLY H H 472 8.980 8.980 8.693 0.287 19685 3716 1 7 . 1 1 473 473 MET N N 473 124.100 124.100 113.921 10.179 19685 3717 1 7 . 1 1 473 473 MET HA H 473 4.380 4.380 4.021 0.359 19685 3718 1 7 . 1 1 473 473 MET C C 473 175.700 175.700 175.461 0.239 19685 3719 1 7 . 1 1 473 473 MET CA C 473 55.000 55.000 56.641 -1.641 19685 3720 1 7 . 1 1 473 473 MET CB C 473 32.900 32.900 30.142 2.759 19685 3721 1 7 . 1 1 473 473 MET H H 473 9.070 9.070 8.426 0.644 19685 3722 1 7 . 1 1 474 474 LYS N N 474 118.700 118.700 117.929 0.771 19685 3723 1 7 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.667 -0.187 19685 3724 1 7 . 1 1 474 474 LYS C C 474 174.300 174.300 175.875 -1.575 19685 3725 1 7 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.453 0.147 19685 3726 1 7 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.682 -0.582 19685 3727 1 7 . 1 1 474 474 LYS H H 474 7.770 7.770 7.557 0.213 19685 3728 1 7 . 1 1 475 475 ARG N N 475 119.600 119.600 118.292 1.308 19685 3729 1 7 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.502 0.298 19685 3730 1 7 . 1 1 475 475 ARG C C 475 175.700 175.700 175.516 0.184 19685 3731 1 7 . 1 1 475 475 ARG CA C 475 54.000 54.000 55.463 -1.463 19685 3732 1 7 . 1 1 475 475 ARG CB C 475 31.300 31.300 31.535 -0.235 19685 3733 1 7 . 1 1 475 475 ARG H H 475 8.350 8.350 8.683 -0.333 19685 3734 1 7 . 1 1 476 476 LEU N N 476 123.500 123.500 118.705 4.795 19685 3735 1 7 . 1 1 476 476 LEU HA H 476 4.430 4.430 3.920 0.510 19685 3736 1 7 . 1 1 476 476 LEU C C 476 177.600 177.600 175.699 1.901 19685 3737 1 7 . 1 1 476 476 LEU CA C 476 55.500 55.500 56.411 -0.911 19685 3738 1 7 . 1 1 476 476 LEU CB C 476 42.800 42.800 41.453 1.347 19685 3739 1 7 . 1 1 476 476 LEU H H 476 9.130 9.130 7.726 1.404 19685 3740 1 7 . 1 1 477 477 LYS N N 477 123.200 123.200 120.258 2.942 19685 3741 1 7 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.747 0.413 19685 3742 1 7 . 1 1 477 477 LYS C C 477 174.100 174.100 173.853 0.247 19685 3743 1 7 . 1 1 477 477 LYS CA C 477 54.500 54.500 55.803 -1.303 19685 3744 1 7 . 1 1 477 477 LYS CB C 477 34.900 34.900 35.414 -0.514 19685 3745 1 7 . 1 1 477 477 LYS H H 477 8.090 8.090 8.260 -0.170 19685 3746 1 7 . 1 1 478 478 VAL N N 478 127.100 127.100 124.036 3.064 19685 3747 1 7 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.687 0.213 19685 3748 1 7 . 1 1 478 478 VAL C C 478 173.700 173.700 173.304 0.396 19685 3749 1 7 . 1 1 478 478 VAL CA C 478 61.000 61.000 61.021 -0.021 19685 3750 1 7 . 1 1 478 478 VAL CB C 478 33.700 33.700 34.119 -0.419 19685 3751 1 7 . 1 1 478 478 VAL H H 478 8.820 8.820 8.023 0.797 19685 3752 1 7 . 1 1 479 479 GLN N N 479 123.600 123.600 123.588 0.012 19685 3753 1 7 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.810 -0.000 19685 3754 1 7 . 1 1 479 479 GLN C C 479 173.600 173.600 173.335 0.265 19685 3755 1 7 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.444 -1.244 19685 3756 1 7 . 1 1 479 479 GLN CB C 479 33.500 33.500 33.099 0.401 19685 3757 1 7 . 1 1 479 479 GLN H H 479 9.130 9.130 8.408 0.722 19685 3758 1 7 . 1 1 480 480 LEU N N 480 123.200 123.200 113.349 9.851 19685 3759 1 7 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.997 -0.557 19685 3760 1 7 . 1 1 480 480 LEU C C 480 177.100 177.100 175.777 1.323 19685 3761 1 7 . 1 1 480 480 LEU CA C 480 54.600 54.600 54.001 0.599 19685 3762 1 7 . 1 1 480 480 LEU CB C 480 42.400 42.400 45.861 -3.462 19685 3763 1 7 . 1 1 480 480 LEU H H 480 8.840 8.840 7.967 0.873 19685 3764 1 7 . 1 1 481 481 LYS N N 481 124.500 124.500 122.707 1.793 19685 3765 1 7 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.095 0.215 19685 3766 1 7 . 1 1 481 481 LYS C C 481 175.200 175.200 175.126 0.074 19685 3767 1 7 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.722 -1.022 19685 3768 1 7 . 1 1 481 481 LYS CB C 481 33.100 33.100 30.651 2.449 19685 3769 1 7 . 1 1 481 481 LYS H H 481 8.400 8.400 9.174 -0.774 19685 3770 1 7 . 1 1 482 482 ARG N N 482 126.600 126.600 119.502 7.098 19685 3771 1 7 . 1 1 482 482 ARG HA H 482 4.350 4.350 4.446 -0.096 19685 3772 1 7 . 1 1 482 482 ARG C C 482 175.800 175.800 175.194 0.606 19685 3773 1 7 . 1 1 482 482 ARG CA C 482 55.600 55.600 56.216 -0.616 19685 3774 1 7 . 1 1 482 482 ARG CB C 482 31.100 31.100 31.114 -0.014 19685 3775 1 7 . 1 1 482 482 ARG H H 482 8.770 8.770 9.035 -0.265 19685 3776 1 7 . 1 1 483 483 SER N N 483 118.100 118.100 115.369 2.731 19685 3777 1 7 . 1 1 483 483 SER HA H 483 4.400 4.400 4.774 -0.374 19685 3778 1 7 . 1 1 483 483 SER C C 483 174.200 174.200 173.073 1.127 19685 3779 1 7 . 1 1 483 483 SER CA C 483 58.000 58.000 58.226 -0.226 19685 3780 1 7 . 1 1 483 483 SER CB C 483 63.500 63.500 64.912 -1.412 19685 3781 1 7 . 1 1 483 483 SER H H 483 8.610 8.610 8.210 0.400 19685 3782 1 7 . 1 1 484 484 LYS N N 484 123.000 123.000 119.769 3.231 19685 3783 1 7 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.553 -0.343 19685 3784 1 7 . 1 1 484 484 LYS C C 484 175.900 175.900 175.237 0.663 19685 3785 1 7 . 1 1 484 484 LYS CA C 484 56.300 56.300 55.632 0.668 19685 3786 1 7 . 1 1 484 484 LYS CB C 484 32.500 32.500 34.480 -1.980 19685 3787 1 7 . 1 1 484 484 LYS H H 484 8.560 8.560 8.389 0.171 19685 3788 1 7 . 1 1 485 485 ASN N N 485 119.600 119.600 118.151 1.449 19685 3789 1 7 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.906 -0.306 19685 3790 1 7 . 1 1 485 485 ASN C C 485 174.400 174.400 173.558 0.842 19685 3791 1 7 . 1 1 485 485 ASN CA C 485 52.900 52.900 52.179 0.721 19685 3792 1 7 . 1 1 485 485 ASN CB C 485 38.400 38.400 39.730 -1.330 19685 3793 1 7 . 1 1 485 485 ASN H H 485 8.560 8.560 8.318 0.242 19685 3794 1 7 . 1 1 486 486 ASP N N 486 121.100 121.100 119.030 2.070 19685 3795 1 7 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.802 -0.282 19685 3796 1 7 . 1 1 486 486 ASP C C 486 175.700 175.700 175.351 0.349 19685 3797 1 7 . 1 1 486 486 ASP CA C 486 54.000 54.000 53.199 0.801 19685 3798 1 7 . 1 1 486 486 ASP CB C 486 40.800 40.800 43.454 -2.654 19685 3799 1 7 . 1 1 486 486 ASP H H 486 8.250 8.250 8.161 0.089 19685 3800 1 7 . 1 1 487 487 SER N N 487 115.400 115.400 115.301 0.099 19685 3801 1 7 . 1 1 487 487 SER HA H 487 4.310 4.310 4.381 -0.071 19685 3802 1 7 . 1 1 487 487 SER C C 487 172.800 172.800 174.466 -1.666 19685 3803 1 7 . 1 1 487 487 SER CA C 487 57.700 57.700 58.025 -0.325 19685 3804 1 7 . 1 1 487 487 SER CB C 487 63.600 63.600 64.195 -0.595 19685 3805 1 7 . 1 1 487 487 SER H H 487 8.090 8.090 8.172 -0.082 19685 3806 1 7 . 1 1 488 488 LYS N N 488 122.300 122.300 119.357 2.943 19685 3807 1 7 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.235 -0.185 19685 3808 1 7 . 1 1 488 488 LYS C C 488 174.500 174.500 174.699 -0.199 19685 3809 1 7 . 1 1 488 488 LYS CA C 488 54.000 54.000 56.159 -2.159 19685 3810 1 7 . 1 1 488 488 LYS CB C 488 32.400 32.400 31.114 1.286 19685 3811 1 7 . 1 1 488 488 LYS H H 488 8.090 8.090 8.565 -0.475 19685 3812 1 7 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.295 -0.015 19685 3813 1 7 . 1 1 489 489 PRO C C 489 175.000 175.000 176.158 -1.158 19685 3814 1 7 . 1 1 489 489 PRO CA C 489 63.200 63.200 62.917 0.283 19685 3815 1 7 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.442 -1.342 19685 3816 1 8 . 1 1 395 395 SER N N 395 115.500 115.500 114.621 0.879 19685 3817 1 8 . 1 1 395 395 SER HA H 395 4.300 4.300 4.809 -0.509 19685 3818 1 8 . 1 1 395 395 SER C C 395 173.900 173.900 173.042 0.858 19685 3819 1 8 . 1 1 395 395 SER CA C 395 57.900 57.900 58.057 -0.157 19685 3820 1 8 . 1 1 395 395 SER CB C 395 63.400 63.400 64.299 -0.899 19685 3821 1 8 . 1 1 395 395 SER H H 395 8.200 8.200 8.457 -0.257 19685 3822 1 8 . 1 1 396 396 HIS N N 396 123.500 123.500 123.655 -0.155 19685 3823 1 8 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.858 -0.298 19685 3824 1 8 . 1 1 396 396 HIS C C 396 174.100 174.100 174.289 -0.189 19685 3825 1 8 . 1 1 396 396 HIS CA C 396 53.700 53.700 56.202 -2.502 19685 3826 1 8 . 1 1 396 396 HIS CB C 396 32.200 32.200 30.587 1.613 19685 3827 1 8 . 1 1 396 396 HIS H H 396 8.120 8.120 8.719 -0.599 19685 3828 1 8 . 1 1 397 397 MET N N 397 121.200 121.200 119.596 1.604 19685 3829 1 8 . 1 1 397 397 MET HA H 397 4.320 4.320 4.699 -0.379 19685 3830 1 8 . 1 1 397 397 MET C C 397 175.400 175.400 176.108 -0.708 19685 3831 1 8 . 1 1 397 397 MET CA C 397 55.000 55.000 54.904 0.096 19685 3832 1 8 . 1 1 397 397 MET CB C 397 32.500 32.500 33.742 -1.242 19685 3833 1 8 . 1 1 397 397 MET H H 397 8.300 8.300 7.827 0.473 19685 3834 1 8 . 1 1 398 398 GLN N N 398 122.100 122.100 121.049 1.051 19685 3835 1 8 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.150 0.040 19685 3836 1 8 . 1 1 398 398 GLN C C 398 174.800 174.800 175.959 -1.159 19685 3837 1 8 . 1 1 398 398 GLN CA C 398 55.200 55.200 57.557 -2.357 19685 3838 1 8 . 1 1 398 398 GLN CB C 398 28.900 28.900 28.460 0.440 19685 3839 1 8 . 1 1 398 398 GLN H H 398 8.540 8.540 8.095 0.445 19685 3840 1 8 . 1 1 399 399 LYS N N 399 123.000 123.000 116.685 6.315 19685 3841 1 8 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.407 -0.187 19685 3842 1 8 . 1 1 399 399 LYS C C 399 174.800 174.800 175.658 -0.858 19685 3843 1 8 . 1 1 399 399 LYS CA C 399 55.600 55.600 55.951 -0.351 19685 3844 1 8 . 1 1 399 399 LYS CB C 399 33.000 33.000 32.478 0.522 19685 3845 1 8 . 1 1 399 399 LYS H H 399 8.180 8.180 8.206 -0.026 19685 3846 1 8 . 1 1 400 400 GLU N N 400 122.000 122.000 118.700 3.300 19685 3847 1 8 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.836 -0.406 19685 3848 1 8 . 1 1 400 400 GLU C C 400 176.400 176.400 175.785 0.615 19685 3849 1 8 . 1 1 400 400 GLU CA C 400 55.400 55.400 54.594 0.806 19685 3850 1 8 . 1 1 400 400 GLU CB C 400 31.400 31.400 34.005 -2.605 19685 3851 1 8 . 1 1 400 400 GLU H H 400 8.350 8.350 7.676 0.674 19685 3852 1 8 . 1 1 401 401 GLY N N 401 109.500 109.500 107.929 1.571 19685 3853 1 8 . 1 1 401 401 GLY C C 401 171.500 171.500 174.078 -2.578 19685 3854 1 8 . 1 1 401 401 GLY CA C 401 43.700 43.700 43.419 0.281 19685 3855 1 8 . 1 1 401 401 GLY H H 401 9.050 9.050 8.650 0.400 19685 3856 1 8 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.515 -0.095 19685 3857 1 8 . 1 1 402 402 PRO C C 402 173.900 173.900 176.504 -2.604 19685 3858 1 8 . 1 1 402 402 PRO CA C 402 61.900 61.900 64.180 -2.280 19685 3859 1 8 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.404 -0.204 19685 3860 1 8 . 1 1 403 403 GLU N N 403 119.600 119.600 117.900 1.700 19685 3861 1 8 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.281 -0.321 19685 3862 1 8 . 1 1 403 403 GLU C C 403 177.300 177.300 175.321 1.979 19685 3863 1 8 . 1 1 403 403 GLU CA C 403 58.100 58.100 57.889 0.211 19685 3864 1 8 . 1 1 403 403 GLU CB C 403 29.000 29.000 29.871 -0.871 19685 3865 1 8 . 1 1 403 403 GLU H H 403 8.420 8.420 8.376 0.044 19685 3866 1 8 . 1 1 404 404 GLY N N 404 112.800 112.800 107.368 5.432 19685 3867 1 8 . 1 1 404 404 GLY C C 404 173.300 173.300 173.681 -0.381 19685 3868 1 8 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.679 -0.779 19685 3869 1 8 . 1 1 404 404 GLY H H 404 8.500 8.500 8.516 -0.016 19685 3870 1 8 . 1 1 405 405 ALA N N 405 120.000 120.000 124.458 -4.458 19685 3871 1 8 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.280 0.270 19685 3872 1 8 . 1 1 405 405 ALA C C 405 174.100 174.100 175.760 -1.660 19685 3873 1 8 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.664 -1.164 19685 3874 1 8 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.034 3.766 19685 3875 1 8 . 1 1 405 405 ALA H H 405 8.360 8.360 8.233 0.127 19685 3876 1 8 . 1 1 406 406 ASN N N 406 115.500 115.500 118.112 -2.612 19685 3877 1 8 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.446 -0.256 19685 3878 1 8 . 1 1 406 406 ASN C C 406 172.900 172.900 174.000 -1.100 19685 3879 1 8 . 1 1 406 406 ASN CA C 406 52.600 52.600 52.537 0.063 19685 3880 1 8 . 1 1 406 406 ASN CB C 406 40.900 40.900 40.803 0.097 19685 3881 1 8 . 1 1 406 406 ASN H H 406 7.690 7.690 8.123 -0.433 19685 3882 1 8 . 1 1 407 407 LEU N N 407 123.400 123.400 123.860 -0.460 19685 3883 1 8 . 1 1 407 407 LEU HA H 407 4.960 4.960 5.201 -0.241 19685 3884 1 8 . 1 1 407 407 LEU C C 407 174.900 174.900 176.842 -1.942 19685 3885 1 8 . 1 1 407 407 LEU CA C 407 53.100 53.100 53.717 -0.617 19685 3886 1 8 . 1 1 407 407 LEU CB C 407 45.400 45.400 42.099 3.301 19685 3887 1 8 . 1 1 407 407 LEU H H 407 9.290 9.290 8.422 0.868 19685 3888 1 8 . 1 1 408 408 PHE N N 408 118.700 118.700 121.581 -2.881 19685 3889 1 8 . 1 1 408 408 PHE HA H 408 5.300 5.300 5.329 -0.029 19685 3890 1 8 . 1 1 408 408 PHE C C 408 174.200 174.200 174.500 -0.300 19685 3891 1 8 . 1 1 408 408 PHE CA C 408 56.300 56.300 55.499 0.801 19685 3892 1 8 . 1 1 408 408 PHE CB C 408 42.700 42.700 39.617 3.083 19685 3893 1 8 . 1 1 408 408 PHE H H 408 9.150 9.150 7.556 1.594 19685 3894 1 8 . 1 1 409 409 ILE N N 409 120.800 120.800 120.297 0.503 19685 3895 1 8 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.742 0.228 19685 3896 1 8 . 1 1 409 409 ILE C C 409 173.900 173.900 175.114 -1.214 19685 3897 1 8 . 1 1 409 409 ILE CA C 409 59.000 59.000 60.678 -1.677 19685 3898 1 8 . 1 1 409 409 ILE CB C 409 40.400 40.400 40.351 0.049 19685 3899 1 8 . 1 1 409 409 ILE H H 409 8.380 8.380 8.909 -0.529 19685 3900 1 8 . 1 1 410 410 TYR N N 410 123.200 123.200 124.508 -1.308 19685 3901 1 8 . 1 1 410 410 TYR HA H 410 4.940 4.940 5.048 -0.108 19685 3902 1 8 . 1 1 410 410 TYR C C 410 174.300 174.300 177.783 -3.483 19685 3903 1 8 . 1 1 410 410 TYR CA C 410 56.200 56.200 58.630 -2.430 19685 3904 1 8 . 1 1 410 410 TYR CB C 410 40.800 40.800 40.314 0.486 19685 3905 1 8 . 1 1 410 410 TYR H H 410 9.440 9.440 9.233 0.207 19685 3906 1 8 . 1 1 411 411 HIS N N 411 112.100 112.100 119.396 -7.296 19685 3907 1 8 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.778 -0.328 19685 3908 1 8 . 1 1 411 411 HIS C C 411 173.300 173.300 174.414 -1.114 19685 3909 1 8 . 1 1 411 411 HIS CA C 411 55.900 55.900 54.477 1.423 19685 3910 1 8 . 1 1 411 411 HIS CB C 411 26.200 26.200 27.308 -1.109 19685 3911 1 8 . 1 1 411 411 HIS H H 411 8.580 8.580 8.634 -0.054 19685 3912 1 8 . 1 1 412 412 LEU N N 412 115.100 115.100 124.400 -9.300 19685 3913 1 8 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.385 -0.425 19685 3914 1 8 . 1 1 412 412 LEU C C 412 175.100 175.100 175.607 -0.507 19685 3915 1 8 . 1 1 412 412 LEU CA C 412 52.400 52.400 53.917 -1.517 19685 3916 1 8 . 1 1 412 412 LEU CB C 412 42.000 42.000 42.807 -0.807 19685 3917 1 8 . 1 1 412 412 LEU H H 412 7.560 7.560 7.661 -0.101 19685 3918 1 8 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.679 -0.409 19685 3919 1 8 . 1 1 413 413 PRO C C 413 177.600 177.600 176.993 0.607 19685 3920 1 8 . 1 1 413 413 PRO CA C 413 62.300 62.300 62.827 -0.527 19685 3921 1 8 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.796 -0.596 19685 3922 1 8 . 1 1 414 414 GLN N N 414 125.500 125.500 115.472 10.028 19685 3923 1 8 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.416 -0.336 19685 3924 1 8 . 1 1 414 414 GLN C C 414 175.400 175.400 175.548 -0.148 19685 3925 1 8 . 1 1 414 414 GLN CA C 414 57.000 57.000 56.875 0.125 19685 3926 1 8 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.997 -0.496 19685 3927 1 8 . 1 1 414 414 GLN H H 414 9.170 9.170 8.554 0.616 19685 3928 1 8 . 1 1 415 415 GLU N N 415 115.300 115.300 117.231 -1.931 19685 3929 1 8 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.439 -0.179 19685 3930 1 8 . 1 1 415 415 GLU C C 415 176.700 176.700 174.760 1.940 19685 3931 1 8 . 1 1 415 415 GLU CA C 415 58.700 58.700 55.577 3.123 19685 3932 1 8 . 1 1 415 415 GLU CB C 415 28.300 28.300 30.019 -1.719 19685 3933 1 8 . 1 1 415 415 GLU H H 415 9.390 9.390 8.388 1.002 19685 3934 1 8 . 1 1 416 416 PHE N N 416 121.700 121.700 117.770 3.930 19685 3935 1 8 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.047 -0.437 19685 3936 1 8 . 1 1 416 416 PHE C C 416 176.400 176.400 174.855 1.545 19685 3937 1 8 . 1 1 416 416 PHE CA C 416 57.400 57.400 57.033 0.367 19685 3938 1 8 . 1 1 416 416 PHE CB C 416 38.700 38.700 43.071 -4.371 19685 3939 1 8 . 1 1 416 416 PHE H H 416 7.610 7.610 7.445 0.165 19685 3940 1 8 . 1 1 417 417 GLY N N 417 113.000 113.000 107.721 5.279 19685 3941 1 8 . 1 1 417 417 GLY C C 417 174.300 174.300 172.900 1.400 19685 3942 1 8 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.147 -3.247 19685 3943 1 8 . 1 1 417 417 GLY H H 417 9.740 9.740 9.748 -0.008 19685 3944 1 8 . 1 1 418 418 ASP N N 418 121.500 121.500 117.333 4.167 19685 3945 1 8 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.675 -0.735 19685 3946 1 8 . 1 1 418 418 ASP C C 418 177.900 177.900 176.360 1.540 19685 3947 1 8 . 1 1 418 418 ASP CA C 418 57.600 57.600 55.268 2.332 19685 3948 1 8 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.980 -2.280 19685 3949 1 8 . 1 1 418 418 ASP H H 418 8.680 8.680 8.368 0.312 19685 3950 1 8 . 1 1 419 419 GLN N N 419 116.400 116.400 118.475 -2.075 19685 3951 1 8 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.290 -0.380 19685 3952 1 8 . 1 1 419 419 GLN C C 419 177.600 177.600 175.500 2.100 19685 3953 1 8 . 1 1 419 419 GLN CA C 419 58.000 58.000 57.667 0.333 19685 3954 1 8 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.509 -1.109 19685 3955 1 8 . 1 1 419 419 GLN H H 419 8.780 8.780 8.446 0.334 19685 3956 1 8 . 1 1 420 420 ASP N N 420 117.500 117.500 116.694 0.806 19685 3957 1 8 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.733 -0.723 19685 3958 1 8 . 1 1 420 420 ASP C C 420 178.000 178.000 177.631 0.369 19685 3959 1 8 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.645 3.054 19685 3960 1 8 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.798 -0.998 19685 3961 1 8 . 1 1 420 420 ASP H H 420 7.210 7.210 8.449 -1.239 19685 3962 1 8 . 1 1 421 421 ILE N N 421 117.000 117.000 121.625 -4.625 19685 3963 1 8 . 1 1 421 421 ILE HA H 421 4.080 4.080 3.979 0.101 19685 3964 1 8 . 1 1 421 421 ILE C C 421 176.500 176.500 176.711 -0.211 19685 3965 1 8 . 1 1 421 421 ILE CA C 421 64.000 64.000 64.098 -0.098 19685 3966 1 8 . 1 1 421 421 ILE CB C 421 37.300 37.300 37.842 -0.542 19685 3967 1 8 . 1 1 421 421 ILE H H 421 7.610 7.610 7.799 -0.189 19685 3968 1 8 . 1 1 422 422 LEU N N 422 123.200 123.200 117.155 6.045 19685 3969 1 8 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.102 -0.342 19685 3970 1 8 . 1 1 422 422 LEU C C 422 177.800 177.800 176.735 1.065 19685 3971 1 8 . 1 1 422 422 LEU CA C 422 58.600 58.600 56.482 2.118 19685 3972 1 8 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.580 -0.380 19685 3973 1 8 . 1 1 422 422 LEU H H 422 7.870 7.870 7.613 0.257 19685 3974 1 8 . 1 1 423 423 GLN N N 423 115.600 115.600 115.205 0.395 19685 3975 1 8 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.460 -0.580 19685 3976 1 8 . 1 1 423 423 GLN C C 423 177.800 177.800 175.435 2.365 19685 3977 1 8 . 1 1 423 423 GLN CA C 423 58.600 58.600 55.873 2.727 19685 3978 1 8 . 1 1 423 423 GLN CB C 423 27.900 27.900 29.610 -1.710 19685 3979 1 8 . 1 1 423 423 GLN H H 423 7.860 7.860 7.649 0.211 19685 3980 1 8 . 1 1 424 424 MET N N 424 115.500 115.500 118.325 -2.825 19685 3981 1 8 . 1 1 424 424 MET HA H 424 3.910 3.910 4.445 -0.535 19685 3982 1 8 . 1 1 424 424 MET C C 424 175.500 175.500 174.742 0.758 19685 3983 1 8 . 1 1 424 424 MET CA C 424 57.800 57.800 55.826 1.974 19685 3984 1 8 . 1 1 424 424 MET CB C 424 34.300 34.300 34.435 -0.135 19685 3985 1 8 . 1 1 424 424 MET H H 424 7.560 7.560 8.059 -0.499 19685 3986 1 8 . 1 1 425 425 PHE N N 425 112.300 112.300 115.589 -3.289 19685 3987 1 8 . 1 1 425 425 PHE HA H 425 4.700 4.700 4.775 -0.075 19685 3988 1 8 . 1 1 425 425 PHE C C 425 177.300 177.300 176.931 0.369 19685 3989 1 8 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.895 1.005 19685 3990 1 8 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.741 -2.241 19685 3991 1 8 . 1 1 425 425 PHE H H 425 7.680 7.680 8.566 -0.886 19685 3992 1 8 . 1 1 426 426 MET N N 426 127.400 127.400 117.395 10.005 19685 3993 1 8 . 1 1 426 426 MET HA H 426 4.630 4.630 4.499 0.131 19685 3994 1 8 . 1 1 426 426 MET C C 426 173.800 173.800 175.237 -1.437 19685 3995 1 8 . 1 1 426 426 MET CA C 426 59.100 59.100 55.768 3.332 19685 3996 1 8 . 1 1 426 426 MET CB C 426 31.800 31.800 30.198 1.602 19685 3997 1 8 . 1 1 426 426 MET H H 426 8.540 8.540 7.979 0.561 19685 3998 1 8 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.388 -0.378 19685 3999 1 8 . 1 1 427 427 PRO C C 427 176.800 176.800 176.301 0.499 19685 4000 1 8 . 1 1 427 427 PRO CA C 427 65.200 65.200 63.852 1.348 19685 4001 1 8 . 1 1 427 427 PRO CB C 427 30.600 30.600 31.126 -0.526 19685 4002 1 8 . 1 1 428 428 PHE N N 428 110.000 110.000 117.756 -7.756 19685 4003 1 8 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.666 -0.396 19685 4004 1 8 . 1 1 428 428 PHE C C 428 174.600 174.600 176.470 -1.870 19685 4005 1 8 . 1 1 428 428 PHE CA C 428 57.700 57.700 58.358 -0.658 19685 4006 1 8 . 1 1 428 428 PHE CB C 428 38.000 38.000 40.333 -2.333 19685 4007 1 8 . 1 1 428 428 PHE H H 428 6.560 6.560 7.299 -0.739 19685 4008 1 8 . 1 1 429 429 GLY N N 429 105.500 105.500 105.959 -0.459 19685 4009 1 8 . 1 1 429 429 GLY C C 429 170.100 170.100 172.867 -2.767 19685 4010 1 8 . 1 1 429 429 GLY CA C 429 44.400 44.400 45.093 -0.693 19685 4011 1 8 . 1 1 429 429 GLY H H 429 7.650 7.650 7.698 -0.048 19685 4012 1 8 . 1 1 430 430 ASN N N 430 117.400 117.400 116.287 1.113 19685 4013 1 8 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.272 0.358 19685 4014 1 8 . 1 1 430 430 ASN C C 430 173.200 173.200 173.086 0.114 19685 4015 1 8 . 1 1 430 430 ASN CA C 430 52.600 52.600 53.873 -1.273 19685 4016 1 8 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.108 -1.908 19685 4017 1 8 . 1 1 430 430 ASN H H 430 9.020 9.020 7.454 1.566 19685 4018 1 8 . 1 1 431 431 VAL N N 431 128.000 128.000 115.625 12.375 19685 4019 1 8 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.312 -0.562 19685 4020 1 8 . 1 1 431 431 VAL C C 431 176.400 176.400 174.163 2.237 19685 4021 1 8 . 1 1 431 431 VAL CA C 431 61.800 61.800 60.416 1.384 19685 4022 1 8 . 1 1 431 431 VAL CB C 431 31.900 31.900 35.254 -3.354 19685 4023 1 8 . 1 1 431 431 VAL H H 431 8.480 8.480 8.144 0.336 19685 4024 1 8 . 1 1 432 432 ILE N N 432 128.000 128.000 117.965 10.035 19685 4025 1 8 . 1 1 432 432 ILE HA H 432 3.920 3.920 4.370 -0.450 19685 4026 1 8 . 1 1 432 432 ILE C C 432 176.100 176.100 176.313 -0.213 19685 4027 1 8 . 1 1 432 432 ILE CA C 432 62.500 62.500 61.910 0.590 19685 4028 1 8 . 1 1 432 432 ILE CB C 432 37.400 37.400 39.158 -1.758 19685 4029 1 8 . 1 1 432 432 ILE H H 432 8.840 8.840 7.867 0.973 19685 4030 1 8 . 1 1 433 433 SER N N 433 113.600 113.600 114.819 -1.219 19685 4031 1 8 . 1 1 433 433 SER HA H 433 4.440 4.440 4.425 0.015 19685 4032 1 8 . 1 1 433 433 SER C C 433 171.000 171.000 173.350 -2.350 19685 4033 1 8 . 1 1 433 433 SER CA C 433 57.300 57.300 57.990 -0.690 19685 4034 1 8 . 1 1 433 433 SER CB C 433 65.200 65.200 63.976 1.224 19685 4035 1 8 . 1 1 433 433 SER H H 433 7.280 7.280 7.726 -0.446 19685 4036 1 8 . 1 1 434 434 ALA N N 434 125.700 125.700 123.530 2.170 19685 4037 1 8 . 1 1 434 434 ALA HA H 434 4.910 4.910 3.885 1.025 19685 4038 1 8 . 1 1 434 434 ALA C C 434 174.600 174.600 175.768 -1.168 19685 4039 1 8 . 1 1 434 434 ALA CA C 434 51.000 51.000 52.849 -1.849 19685 4040 1 8 . 1 1 434 434 ALA CB C 434 21.200 21.200 18.693 2.507 19685 4041 1 8 . 1 1 434 434 ALA H H 434 8.270 8.270 7.926 0.344 19685 4042 1 8 . 1 1 435 435 LYS N N 435 120.900 120.900 122.138 -1.238 19685 4043 1 8 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.488 -0.018 19685 4044 1 8 . 1 1 435 435 LYS C C 435 173.800 173.800 174.667 -0.867 19685 4045 1 8 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.401 -1.701 19685 4046 1 8 . 1 1 435 435 LYS CB C 435 36.400 36.400 36.448 -0.048 19685 4047 1 8 . 1 1 435 435 LYS H H 435 8.490 8.490 8.083 0.407 19685 4048 1 8 . 1 1 436 436 VAL N N 436 122.200 122.200 120.618 1.582 19685 4049 1 8 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.258 -0.338 19685 4050 1 8 . 1 1 436 436 VAL C C 436 175.100 175.100 174.906 0.194 19685 4051 1 8 . 1 1 436 436 VAL CA C 436 63.600 63.600 61.123 2.477 19685 4052 1 8 . 1 1 436 436 VAL CB C 436 33.500 33.500 31.922 1.578 19685 4053 1 8 . 1 1 436 436 VAL H H 436 8.390 8.390 8.438 -0.048 19685 4054 1 8 . 1 1 437 437 PHE N N 437 125.900 125.900 117.063 8.837 19685 4055 1 8 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.144 0.256 19685 4056 1 8 . 1 1 437 437 PHE C C 437 173.600 173.600 175.550 -1.950 19685 4057 1 8 . 1 1 437 437 PHE CA C 437 57.700 57.700 58.636 -0.937 19685 4058 1 8 . 1 1 437 437 PHE CB C 437 39.000 39.000 37.869 1.131 19685 4059 1 8 . 1 1 437 437 PHE H H 437 8.250 8.250 7.650 0.600 19685 4060 1 8 . 1 1 438 438 ILE N N 438 121.900 121.900 117.481 4.419 19685 4061 1 8 . 1 1 438 438 ILE HA H 438 4.460 4.460 3.731 0.729 19685 4062 1 8 . 1 1 438 438 ILE C C 438 175.700 175.700 175.447 0.253 19685 4063 1 8 . 1 1 438 438 ILE CA C 438 58.300 58.300 62.911 -4.611 19685 4064 1 8 . 1 1 438 438 ILE CB C 438 39.700 39.700 37.492 2.208 19685 4065 1 8 . 1 1 438 438 ILE H H 438 8.520 8.520 8.669 -0.149 19685 4066 1 8 . 1 1 439 439 ASP N N 439 126.500 126.500 117.174 9.326 19685 4067 1 8 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.228 0.352 19685 4068 1 8 . 1 1 439 439 ASP C C 439 176.300 176.300 176.294 0.006 19685 4069 1 8 . 1 1 439 439 ASP CA C 439 53.600 53.600 55.531 -1.931 19685 4070 1 8 . 1 1 439 439 ASP CB C 439 42.300 42.300 40.022 2.278 19685 4071 1 8 . 1 1 439 439 ASP H H 439 8.730 8.730 8.553 0.177 19685 4072 1 8 . 1 1 440 440 LYS N N 440 127.300 127.300 114.262 13.038 19685 4073 1 8 . 1 1 440 440 LYS HA H 440 4.070 4.070 3.756 0.314 19685 4074 1 8 . 1 1 440 440 LYS C C 440 176.900 176.900 176.304 0.596 19685 4075 1 8 . 1 1 440 440 LYS CA C 440 57.800 57.800 58.585 -0.785 19685 4076 1 8 . 1 1 440 440 LYS CB C 440 32.100 32.100 31.003 1.097 19685 4077 1 8 . 1 1 440 440 LYS H H 440 8.930 8.930 7.957 0.973 19685 4078 1 8 . 1 1 441 441 GLN N N 441 117.400 117.400 115.700 1.700 19685 4079 1 8 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.359 -0.129 19685 4080 1 8 . 1 1 441 441 GLN C C 441 177.200 177.200 176.316 0.884 19685 4081 1 8 . 1 1 441 441 GLN CA C 441 57.600 57.600 55.847 1.753 19685 4082 1 8 . 1 1 441 441 GLN CB C 441 28.800 28.800 30.590 -1.790 19685 4083 1 8 . 1 1 441 441 GLN H H 441 8.650 8.650 7.471 1.179 19685 4084 1 8 . 1 1 442 442 THR N N 442 107.300 107.300 112.727 -5.427 19685 4085 1 8 . 1 1 442 442 THR HA H 442 4.290 4.290 4.262 0.028 19685 4086 1 8 . 1 1 442 442 THR C C 442 175.100 175.100 175.417 -0.317 19685 4087 1 8 . 1 1 442 442 THR CA C 442 61.200 61.200 62.772 -1.571 19685 4088 1 8 . 1 1 442 442 THR CB C 442 70.300 70.300 69.139 1.161 19685 4089 1 8 . 1 1 442 442 THR H H 442 7.830 7.830 8.040 -0.210 19685 4090 1 8 . 1 1 443 443 ASN N N 443 117.300 117.300 118.379 -1.079 19685 4091 1 8 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.428 -0.128 19685 4092 1 8 . 1 1 443 443 ASN C C 443 173.400 173.400 174.403 -1.003 19685 4093 1 8 . 1 1 443 443 ASN CA C 443 54.300 54.300 53.874 0.426 19685 4094 1 8 . 1 1 443 443 ASN CB C 443 37.600 37.600 37.315 0.285 19685 4095 1 8 . 1 1 443 443 ASN H H 443 8.470 8.470 8.006 0.464 19685 4096 1 8 . 1 1 444 444 LEU N N 444 118.000 118.000 118.772 -0.772 19685 4097 1 8 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.322 0.238 19685 4098 1 8 . 1 1 444 444 LEU C C 444 176.700 176.700 176.065 0.635 19685 4099 1 8 . 1 1 444 444 LEU CA C 444 53.300 53.300 55.342 -2.042 19685 4100 1 8 . 1 1 444 444 LEU CB C 444 43.500 43.500 42.997 0.503 19685 4101 1 8 . 1 1 444 444 LEU H H 444 7.660 7.660 7.689 -0.029 19685 4102 1 8 . 1 1 445 445 SER N N 445 115.500 115.500 113.722 1.778 19685 4103 1 8 . 1 1 445 445 SER HA H 445 4.460 4.460 4.773 -0.313 19685 4104 1 8 . 1 1 445 445 SER C C 445 176.500 176.500 173.310 3.190 19685 4105 1 8 . 1 1 445 445 SER CA C 445 57.900 57.900 57.114 0.786 19685 4106 1 8 . 1 1 445 445 SER CB C 445 63.500 63.500 65.227 -1.727 19685 4107 1 8 . 1 1 445 445 SER H H 445 8.840 8.840 8.228 0.612 19685 4108 1 8 . 1 1 446 446 LYS N N 446 125.200 125.200 122.579 2.621 19685 4109 1 8 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.010 0.490 19685 4110 1 8 . 1 1 446 446 LYS C C 446 176.100 176.100 174.431 1.669 19685 4111 1 8 . 1 1 446 446 LYS CA C 446 56.300 56.300 56.647 -0.347 19685 4112 1 8 . 1 1 446 446 LYS CB C 446 32.200 32.200 33.261 -1.061 19685 4113 1 8 . 1 1 446 446 LYS H H 446 9.230 9.230 7.692 1.538 19685 4114 1 8 . 1 1 447 447 CYS N N 447 113.000 113.000 112.808 0.192 19685 4115 1 8 . 1 1 447 447 CYS C C 447 172.500 172.500 172.868 -0.368 19685 4116 1 8 . 1 1 447 447 CYS CA C 447 60.400 60.400 59.293 1.107 19685 4117 1 8 . 1 1 447 447 CYS CB C 447 24.900 24.900 25.607 -0.707 19685 4118 1 8 . 1 1 447 447 CYS H H 447 10.020 10.020 6.584 3.436 19685 4119 1 8 . 1 1 448 448 PHE N N 448 115.200 115.200 113.520 1.680 19685 4120 1 8 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.816 0.524 19685 4121 1 8 . 1 1 448 448 PHE C C 448 172.400 172.400 174.303 -1.903 19685 4122 1 8 . 1 1 448 448 PHE CA C 448 54.700 54.700 55.791 -1.091 19685 4123 1 8 . 1 1 448 448 PHE CB C 448 42.000 42.000 39.998 2.002 19685 4124 1 8 . 1 1 448 448 PHE H H 448 7.810 7.810 6.660 1.150 19685 4125 1 8 . 1 1 449 449 GLY N N 449 107.700 107.700 107.276 0.424 19685 4126 1 8 . 1 1 449 449 GLY C C 449 170.100 170.100 172.515 -2.415 19685 4127 1 8 . 1 1 449 449 GLY CA C 449 45.200 45.200 43.538 1.662 19685 4128 1 8 . 1 1 449 449 GLY H H 449 9.310 9.310 8.990 0.320 19685 4129 1 8 . 1 1 450 450 PHE N N 450 119.900 119.900 114.562 5.338 19685 4130 1 8 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.344 0.086 19685 4131 1 8 . 1 1 450 450 PHE C C 450 172.800 172.800 172.909 -0.109 19685 4132 1 8 . 1 1 450 450 PHE CA C 450 55.000 55.000 57.117 -2.117 19685 4133 1 8 . 1 1 450 450 PHE CB C 450 43.600 43.600 40.548 3.052 19685 4134 1 8 . 1 1 450 450 PHE H H 450 8.760 8.760 8.748 0.012 19685 4135 1 8 . 1 1 451 451 VAL N N 451 123.800 123.800 119.333 4.467 19685 4136 1 8 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.112 0.178 19685 4137 1 8 . 1 1 451 451 VAL C C 451 172.400 172.400 175.987 -3.587 19685 4138 1 8 . 1 1 451 451 VAL CA C 451 59.800 59.800 60.906 -1.106 19685 4139 1 8 . 1 1 451 451 VAL CB C 451 36.100 36.100 34.966 1.134 19685 4140 1 8 . 1 1 451 451 VAL H H 451 7.930 7.930 8.705 -0.775 19685 4141 1 8 . 1 1 452 452 SER N N 452 119.600 119.600 124.447 -4.847 19685 4142 1 8 . 1 1 452 452 SER HA H 452 5.120 5.120 4.849 0.271 19685 4143 1 8 . 1 1 452 452 SER C C 452 173.200 173.200 173.994 -0.794 19685 4144 1 8 . 1 1 452 452 SER CA C 452 55.700 55.700 58.065 -2.365 19685 4145 1 8 . 1 1 452 452 SER CB C 452 66.100 66.100 61.984 4.115 19685 4146 1 8 . 1 1 452 452 SER H H 452 8.540 8.540 8.685 -0.145 19685 4147 1 8 . 1 1 453 453 TYR N N 453 121.400 121.400 124.878 -3.478 19685 4148 1 8 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.364 1.016 19685 4149 1 8 . 1 1 453 453 TYR C C 453 173.600 173.600 176.783 -3.183 19685 4150 1 8 . 1 1 453 453 TYR CA C 453 56.500 56.500 60.356 -3.856 19685 4151 1 8 . 1 1 453 453 TYR CB C 453 42.200 42.200 39.783 2.417 19685 4152 1 8 . 1 1 453 453 TYR H H 453 8.380 8.380 7.996 0.384 19685 4153 1 8 . 1 1 454 454 ASP N N 454 113.300 113.300 124.533 -11.233 19685 4154 1 8 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.317 0.173 19685 4155 1 8 . 1 1 454 454 ASP C C 454 176.100 176.100 175.537 0.563 19685 4156 1 8 . 1 1 454 454 ASP CA C 454 52.800 52.800 56.830 -4.030 19685 4157 1 8 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.645 -1.245 19685 4158 1 8 . 1 1 454 454 ASP H H 454 7.860 7.860 8.158 -0.298 19685 4159 1 8 . 1 1 455 455 ASN N N 455 113.800 113.800 112.412 1.388 19685 4160 1 8 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.014 0.036 19685 4161 1 8 . 1 1 455 455 ASN C C 455 173.100 173.100 173.949 -0.849 19685 4162 1 8 . 1 1 455 455 ASN CA C 455 50.700 50.700 52.301 -1.601 19685 4163 1 8 . 1 1 455 455 ASN CB C 455 41.100 41.100 39.739 1.361 19685 4164 1 8 . 1 1 455 455 ASN H H 455 7.200 7.200 8.400 -1.200 19685 4165 1 8 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.400 -0.230 19685 4166 1 8 . 1 1 456 456 PRO C C 456 177.300 177.300 176.775 0.525 19685 4167 1 8 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.772 -0.572 19685 4168 1 8 . 1 1 456 456 PRO CB C 456 32.300 32.300 31.934 0.366 19685 4169 1 8 . 1 1 457 457 VAL N N 457 120.900 120.900 109.200 11.700 19685 4170 1 8 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.392 -0.772 19685 4171 1 8 . 1 1 457 457 VAL C C 457 179.000 179.000 175.962 3.038 19685 4172 1 8 . 1 1 457 457 VAL CA C 457 65.900 65.900 62.349 3.551 19685 4173 1 8 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.384 -0.584 19685 4174 1 8 . 1 1 457 457 VAL H H 457 8.120 8.120 7.655 0.465 19685 4175 1 8 . 1 1 458 458 SER N N 458 117.800 117.800 116.239 1.561 19685 4176 1 8 . 1 1 458 458 SER HA H 458 3.940 3.940 4.646 -0.706 19685 4177 1 8 . 1 1 458 458 SER C C 458 173.600 173.600 174.927 -1.327 19685 4178 1 8 . 1 1 458 458 SER CA C 458 61.100 61.100 59.251 1.849 19685 4179 1 8 . 1 1 458 458 SER CB C 458 62.400 62.400 65.266 -2.866 19685 4180 1 8 . 1 1 458 458 SER H H 458 7.830 7.830 7.728 0.102 19685 4181 1 8 . 1 1 459 459 ALA N N 459 120.000 120.000 124.328 -4.328 19685 4182 1 8 . 1 1 459 459 ALA HA H 459 3.750 3.750 3.170 0.580 19685 4183 1 8 . 1 1 459 459 ALA C C 459 178.100 178.100 177.974 0.126 19685 4184 1 8 . 1 1 459 459 ALA CA C 459 54.500 54.500 53.670 0.830 19685 4185 1 8 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.053 -0.153 19685 4186 1 8 . 1 1 459 459 ALA H H 459 6.370 6.370 7.482 -1.112 19685 4187 1 8 . 1 1 460 460 GLN N N 460 116.100 116.100 116.771 -0.671 19685 4188 1 8 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.008 -0.178 19685 4189 1 8 . 1 1 460 460 GLN C C 460 178.000 178.000 176.630 1.370 19685 4190 1 8 . 1 1 460 460 GLN CA C 460 58.500 58.500 57.776 0.724 19685 4191 1 8 . 1 1 460 460 GLN CB C 460 27.400 27.400 27.794 -0.394 19685 4192 1 8 . 1 1 460 460 GLN H H 460 7.710 7.710 8.537 -0.827 19685 4193 1 8 . 1 1 461 461 ALA N N 461 122.800 122.800 118.698 4.102 19685 4194 1 8 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.310 -0.350 19685 4195 1 8 . 1 1 461 461 ALA C C 461 179.500 179.500 177.313 2.187 19685 4196 1 8 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.843 1.657 19685 4197 1 8 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.086 -1.586 19685 4198 1 8 . 1 1 461 461 ALA H H 461 7.880 7.880 7.440 0.440 19685 4199 1 8 . 1 1 462 462 ALA N N 462 121.400 121.400 119.291 2.109 19685 4200 1 8 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.755 -1.355 19685 4201 1 8 . 1 1 462 462 ALA C C 462 179.400 179.400 177.731 1.669 19685 4202 1 8 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.742 1.358 19685 4203 1 8 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.566 -1.865 19685 4204 1 8 . 1 1 462 462 ALA H H 462 7.860 7.860 7.469 0.391 19685 4205 1 8 . 1 1 463 463 ILE N N 463 118.600 118.600 117.912 0.688 19685 4206 1 8 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.859 -0.619 19685 4207 1 8 . 1 1 463 463 ILE C C 463 177.500 177.500 175.920 1.580 19685 4208 1 8 . 1 1 463 463 ILE CA C 463 66.000 66.000 61.815 4.185 19685 4209 1 8 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.041 0.259 19685 4210 1 8 . 1 1 463 463 ILE H H 463 8.090 8.090 7.791 0.299 19685 4211 1 8 . 1 1 464 464 GLN N N 464 117.000 117.000 115.862 1.138 19685 4212 1 8 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.340 -0.470 19685 4213 1 8 . 1 1 464 464 GLN C C 464 177.700 177.700 175.122 2.578 19685 4214 1 8 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.276 2.924 19685 4215 1 8 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.131 -1.231 19685 4216 1 8 . 1 1 464 464 GLN H H 464 7.780 7.780 8.031 -0.251 19685 4217 1 8 . 1 1 465 465 ALA N N 465 117.200 117.200 119.521 -2.321 19685 4218 1 8 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.345 -0.115 19685 4219 1 8 . 1 1 465 465 ALA C C 465 179.200 179.200 176.537 2.663 19685 4220 1 8 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.666 1.134 19685 4221 1 8 . 1 1 465 465 ALA CB C 465 21.100 21.100 19.580 1.520 19685 4222 1 8 . 1 1 465 465 ALA H H 465 7.540 7.540 7.066 0.474 19685 4223 1 8 . 1 1 466 466 MET N N 466 110.800 110.800 117.524 -6.724 19685 4224 1 8 . 1 1 466 466 MET HA H 466 4.820 4.820 4.733 0.087 19685 4225 1 8 . 1 1 466 466 MET C C 466 177.600 177.600 176.749 0.851 19685 4226 1 8 . 1 1 466 466 MET CA C 466 53.300 53.300 56.489 -3.189 19685 4227 1 8 . 1 1 466 466 MET CB C 466 31.600 31.600 34.434 -2.833 19685 4228 1 8 . 1 1 466 466 MET H H 466 8.230 8.230 7.725 0.505 19685 4229 1 8 . 1 1 467 467 ASN N N 467 119.100 119.100 120.313 -1.213 19685 4230 1 8 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.604 -0.114 19685 4231 1 8 . 1 1 467 467 ASN C C 467 176.300 176.300 175.604 0.696 19685 4232 1 8 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.431 1.769 19685 4233 1 8 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.912 -0.712 19685 4234 1 8 . 1 1 467 467 ASN H H 467 8.560 8.560 7.999 0.561 19685 4235 1 8 . 1 1 468 468 GLY N N 468 117.900 117.900 104.639 13.261 19685 4236 1 8 . 1 1 468 468 GLY C C 468 172.800 172.800 173.580 -0.780 19685 4237 1 8 . 1 1 468 468 GLY CA C 468 45.300 45.300 44.476 0.824 19685 4238 1 8 . 1 1 468 468 GLY H H 468 8.930 8.930 8.230 0.700 19685 4239 1 8 . 1 1 469 469 PHE N N 469 123.300 123.300 120.428 2.872 19685 4240 1 8 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.708 -0.518 19685 4241 1 8 . 1 1 469 469 PHE C C 469 174.400 174.400 173.612 0.788 19685 4242 1 8 . 1 1 469 469 PHE CA C 469 58.700 58.700 57.052 1.648 19685 4243 1 8 . 1 1 469 469 PHE CB C 469 40.600 40.600 41.757 -1.157 19685 4244 1 8 . 1 1 469 469 PHE H H 469 7.950 7.950 7.435 0.515 19685 4245 1 8 . 1 1 470 470 GLN N N 470 129.200 129.200 125.264 3.936 19685 4246 1 8 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.196 0.394 19685 4247 1 8 . 1 1 470 470 GLN C C 470 174.100 174.100 174.266 -0.166 19685 4248 1 8 . 1 1 470 470 GLN CA C 470 55.500 55.500 55.395 0.105 19685 4249 1 8 . 1 1 470 470 GLN CB C 470 28.800 28.800 29.570 -0.770 19685 4250 1 8 . 1 1 470 470 GLN H H 470 8.330 8.330 8.190 0.140 19685 4251 1 8 . 1 1 471 471 ILE N N 471 126.300 126.300 124.333 1.967 19685 4252 1 8 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.139 0.031 19685 4253 1 8 . 1 1 471 471 ILE C C 471 175.400 175.400 175.114 0.286 19685 4254 1 8 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.421 -0.821 19685 4255 1 8 . 1 1 471 471 ILE CB C 471 39.100 39.100 40.378 -1.278 19685 4256 1 8 . 1 1 471 471 ILE H H 471 8.440 8.440 8.449 -0.009 19685 4257 1 8 . 1 1 472 472 GLY N N 472 117.500 117.500 116.786 0.714 19685 4258 1 8 . 1 1 472 472 GLY C C 472 174.700 174.700 174.353 0.347 19685 4259 1 8 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.934 0.566 19685 4260 1 8 . 1 1 472 472 GLY H H 472 8.980 8.980 8.616 0.364 19685 4261 1 8 . 1 1 473 473 MET N N 473 124.100 124.100 120.483 3.617 19685 4262 1 8 . 1 1 473 473 MET HA H 473 4.380 4.380 4.575 -0.195 19685 4263 1 8 . 1 1 473 473 MET C C 473 175.700 175.700 175.319 0.381 19685 4264 1 8 . 1 1 473 473 MET CA C 473 55.000 55.000 56.081 -1.081 19685 4265 1 8 . 1 1 473 473 MET CB C 473 32.900 32.900 32.474 0.426 19685 4266 1 8 . 1 1 473 473 MET H H 473 9.070 9.070 8.120 0.950 19685 4267 1 8 . 1 1 474 474 LYS N N 474 118.700 118.700 118.058 0.642 19685 4268 1 8 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.622 -0.141 19685 4269 1 8 . 1 1 474 474 LYS C C 474 174.300 174.300 176.297 -1.997 19685 4270 1 8 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.877 -0.278 19685 4271 1 8 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.513 -0.413 19685 4272 1 8 . 1 1 474 474 LYS H H 474 7.770 7.770 7.388 0.382 19685 4273 1 8 . 1 1 475 475 ARG N N 475 119.600 119.600 119.369 0.231 19685 4274 1 8 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.386 0.414 19685 4275 1 8 . 1 1 475 475 ARG C C 475 175.700 175.700 175.220 0.480 19685 4276 1 8 . 1 1 475 475 ARG CA C 475 54.000 54.000 55.787 -1.787 19685 4277 1 8 . 1 1 475 475 ARG CB C 475 31.300 31.300 30.055 1.245 19685 4278 1 8 . 1 1 475 475 ARG H H 475 8.350 8.350 8.825 -0.475 19685 4279 1 8 . 1 1 476 476 LEU N N 476 123.500 123.500 119.020 4.480 19685 4280 1 8 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.142 0.288 19685 4281 1 8 . 1 1 476 476 LEU C C 476 177.600 177.600 174.920 2.680 19685 4282 1 8 . 1 1 476 476 LEU CA C 476 55.500 55.500 55.989 -0.489 19685 4283 1 8 . 1 1 476 476 LEU CB C 476 42.800 42.800 42.031 0.769 19685 4284 1 8 . 1 1 476 476 LEU H H 476 9.130 9.130 8.193 0.937 19685 4285 1 8 . 1 1 477 477 LYS N N 477 123.200 123.200 123.919 -0.719 19685 4286 1 8 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.919 0.241 19685 4287 1 8 . 1 1 477 477 LYS C C 477 174.100 174.100 174.741 -0.641 19685 4288 1 8 . 1 1 477 477 LYS CA C 477 54.500 54.500 54.685 -0.185 19685 4289 1 8 . 1 1 477 477 LYS CB C 477 34.900 34.900 34.577 0.323 19685 4290 1 8 . 1 1 477 477 LYS H H 477 8.090 8.090 8.404 -0.314 19685 4291 1 8 . 1 1 478 478 VAL N N 478 127.100 127.100 122.381 4.719 19685 4292 1 8 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.871 0.029 19685 4293 1 8 . 1 1 478 478 VAL C C 478 173.700 173.700 173.796 -0.096 19685 4294 1 8 . 1 1 478 478 VAL CA C 478 61.000 61.000 59.953 1.047 19685 4295 1 8 . 1 1 478 478 VAL CB C 478 33.700 33.700 34.772 -1.072 19685 4296 1 8 . 1 1 478 478 VAL H H 478 8.820 8.820 8.351 0.469 19685 4297 1 8 . 1 1 479 479 GLN N N 479 123.600 123.600 122.345 1.255 19685 4298 1 8 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.525 0.285 19685 4299 1 8 . 1 1 479 479 GLN C C 479 173.600 173.600 172.992 0.608 19685 4300 1 8 . 1 1 479 479 GLN CA C 479 53.200 53.200 53.722 -0.522 19685 4301 1 8 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.995 0.506 19685 4302 1 8 . 1 1 479 479 GLN H H 479 9.130 9.130 7.803 1.327 19685 4303 1 8 . 1 1 480 480 LEU N N 480 123.200 123.200 121.385 1.815 19685 4304 1 8 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.806 -0.366 19685 4305 1 8 . 1 1 480 480 LEU C C 480 177.100 177.100 176.125 0.975 19685 4306 1 8 . 1 1 480 480 LEU CA C 480 54.600 54.600 54.036 0.563 19685 4307 1 8 . 1 1 480 480 LEU CB C 480 42.400 42.400 44.526 -2.126 19685 4308 1 8 . 1 1 480 480 LEU H H 480 8.840 8.840 8.185 0.655 19685 4309 1 8 . 1 1 481 481 LYS N N 481 124.500 124.500 127.033 -2.533 19685 4310 1 8 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.193 0.117 19685 4311 1 8 . 1 1 481 481 LYS C C 481 175.200 175.200 174.767 0.433 19685 4312 1 8 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.812 -1.112 19685 4313 1 8 . 1 1 481 481 LYS CB C 481 33.100 33.100 30.895 2.205 19685 4314 1 8 . 1 1 481 481 LYS H H 481 8.400 8.400 8.573 -0.173 19685 4315 1 8 . 1 1 482 482 ARG N N 482 126.600 126.600 120.346 6.254 19685 4316 1 8 . 1 1 482 482 ARG HA H 482 4.350 4.350 4.551 -0.201 19685 4317 1 8 . 1 1 482 482 ARG C C 482 175.800 175.800 175.288 0.512 19685 4318 1 8 . 1 1 482 482 ARG CA C 482 55.600 55.600 56.084 -0.484 19685 4319 1 8 . 1 1 482 482 ARG CB C 482 31.100 31.100 30.187 0.913 19685 4320 1 8 . 1 1 482 482 ARG H H 482 8.770 8.770 8.663 0.107 19685 4321 1 8 . 1 1 483 483 SER N N 483 118.100 118.100 114.752 3.348 19685 4322 1 8 . 1 1 483 483 SER HA H 483 4.400 4.400 4.343 0.057 19685 4323 1 8 . 1 1 483 483 SER C C 483 174.200 174.200 174.516 -0.316 19685 4324 1 8 . 1 1 483 483 SER CA C 483 58.000 58.000 57.879 0.121 19685 4325 1 8 . 1 1 483 483 SER CB C 483 63.500 63.500 63.919 -0.419 19685 4326 1 8 . 1 1 483 483 SER H H 483 8.610 8.610 7.815 0.795 19685 4327 1 8 . 1 1 484 484 LYS N N 484 123.000 123.000 121.584 1.416 19685 4328 1 8 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.022 0.188 19685 4329 1 8 . 1 1 484 484 LYS C C 484 175.900 175.900 176.312 -0.412 19685 4330 1 8 . 1 1 484 484 LYS CA C 484 56.300 56.300 56.638 -0.338 19685 4331 1 8 . 1 1 484 484 LYS CB C 484 32.500 32.500 30.788 1.712 19685 4332 1 8 . 1 1 484 484 LYS H H 484 8.560 8.560 8.499 0.061 19685 4333 1 8 . 1 1 485 485 ASN N N 485 119.600 119.600 117.778 1.822 19685 4334 1 8 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.462 0.138 19685 4335 1 8 . 1 1 485 485 ASN C C 485 174.400 174.400 175.994 -1.594 19685 4336 1 8 . 1 1 485 485 ASN CA C 485 52.900 52.900 54.933 -2.033 19685 4337 1 8 . 1 1 485 485 ASN CB C 485 38.400 38.400 39.041 -0.641 19685 4338 1 8 . 1 1 485 485 ASN H H 485 8.560 8.560 8.081 0.479 19685 4339 1 8 . 1 1 486 486 ASP N N 486 121.100 121.100 116.612 4.488 19685 4340 1 8 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.546 -0.026 19685 4341 1 8 . 1 1 486 486 ASP C C 486 175.700 175.700 174.398 1.302 19685 4342 1 8 . 1 1 486 486 ASP CA C 486 54.000 54.000 55.366 -1.366 19685 4343 1 8 . 1 1 486 486 ASP CB C 486 40.800 40.800 39.812 0.988 19685 4344 1 8 . 1 1 486 486 ASP H H 486 8.250 8.250 8.875 -0.625 19685 4345 1 8 . 1 1 487 487 SER N N 487 115.400 115.400 114.311 1.089 19685 4346 1 8 . 1 1 487 487 SER HA H 487 4.310 4.310 4.624 -0.314 19685 4347 1 8 . 1 1 487 487 SER C C 487 172.800 172.800 173.672 -0.872 19685 4348 1 8 . 1 1 487 487 SER CA C 487 57.700 57.700 57.187 0.513 19685 4349 1 8 . 1 1 487 487 SER CB C 487 63.600 63.600 66.793 -3.193 19685 4350 1 8 . 1 1 487 487 SER H H 487 8.090 8.090 7.949 0.141 19685 4351 1 8 . 1 1 488 488 LYS N N 488 122.300 122.300 121.529 0.771 19685 4352 1 8 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.239 -0.189 19685 4353 1 8 . 1 1 488 488 LYS C C 488 174.500 174.500 174.681 -0.181 19685 4354 1 8 . 1 1 488 488 LYS CA C 488 54.000 54.000 54.851 -0.851 19685 4355 1 8 . 1 1 488 488 LYS CB C 488 32.400 32.400 31.531 0.869 19685 4356 1 8 . 1 1 488 488 LYS H H 488 8.090 8.090 8.317 -0.227 19685 4357 1 8 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.406 -0.126 19685 4358 1 8 . 1 1 489 489 PRO C C 489 175.000 175.000 174.685 0.315 19685 4359 1 8 . 1 1 489 489 PRO CA C 489 63.200 63.200 62.647 0.553 19685 4360 1 8 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.137 -1.037 19685 4361 1 9 . 1 1 395 395 SER N N 395 115.500 115.500 114.939 0.561 19685 4362 1 9 . 1 1 395 395 SER HA H 395 4.300 4.300 4.635 -0.335 19685 4363 1 9 . 1 1 395 395 SER C C 395 173.900 173.900 173.767 0.133 19685 4364 1 9 . 1 1 395 395 SER CA C 395 57.900 57.900 57.717 0.183 19685 4365 1 9 . 1 1 395 395 SER CB C 395 63.400 63.400 64.471 -1.071 19685 4366 1 9 . 1 1 395 395 SER H H 395 8.200 8.200 8.117 0.083 19685 4367 1 9 . 1 1 396 396 HIS N N 396 123.500 123.500 119.166 4.334 19685 4368 1 9 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.650 -0.090 19685 4369 1 9 . 1 1 396 396 HIS C C 396 174.100 174.100 174.422 -0.322 19685 4370 1 9 . 1 1 396 396 HIS CA C 396 53.700 53.700 55.928 -2.228 19685 4371 1 9 . 1 1 396 396 HIS CB C 396 32.200 32.200 30.568 1.632 19685 4372 1 9 . 1 1 396 396 HIS H H 396 8.120 8.120 8.773 -0.653 19685 4373 1 9 . 1 1 397 397 MET N N 397 121.200 121.200 118.010 3.190 19685 4374 1 9 . 1 1 397 397 MET HA H 397 4.320 4.320 4.121 0.199 19685 4375 1 9 . 1 1 397 397 MET C C 397 175.400 175.400 175.850 -0.450 19685 4376 1 9 . 1 1 397 397 MET CA C 397 55.000 55.000 56.284 -1.284 19685 4377 1 9 . 1 1 397 397 MET CB C 397 32.500 32.500 31.636 0.864 19685 4378 1 9 . 1 1 397 397 MET H H 397 8.300 8.300 8.069 0.231 19685 4379 1 9 . 1 1 398 398 GLN N N 398 122.100 122.100 117.553 4.547 19685 4380 1 9 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.450 -0.260 19685 4381 1 9 . 1 1 398 398 GLN C C 398 174.800 174.800 176.793 -1.993 19685 4382 1 9 . 1 1 398 398 GLN CA C 398 55.200 55.200 56.097 -0.897 19685 4383 1 9 . 1 1 398 398 GLN CB C 398 28.900 28.900 29.848 -0.948 19685 4384 1 9 . 1 1 398 398 GLN H H 398 8.540 8.540 8.650 -0.110 19685 4385 1 9 . 1 1 399 399 LYS N N 399 123.000 123.000 120.059 2.941 19685 4386 1 9 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.372 -0.152 19685 4387 1 9 . 1 1 399 399 LYS C C 399 174.800 174.800 176.661 -1.861 19685 4388 1 9 . 1 1 399 399 LYS CA C 399 55.600 55.600 56.733 -1.133 19685 4389 1 9 . 1 1 399 399 LYS CB C 399 33.000 33.000 32.343 0.657 19685 4390 1 9 . 1 1 399 399 LYS H H 399 8.180 8.180 8.424 -0.244 19685 4391 1 9 . 1 1 400 400 GLU N N 400 122.000 122.000 116.880 5.120 19685 4392 1 9 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.652 -0.222 19685 4393 1 9 . 1 1 400 400 GLU C C 400 176.400 176.400 175.440 0.960 19685 4394 1 9 . 1 1 400 400 GLU CA C 400 55.400 55.400 55.499 -0.099 19685 4395 1 9 . 1 1 400 400 GLU CB C 400 31.400 31.400 30.620 0.780 19685 4396 1 9 . 1 1 400 400 GLU H H 400 8.350 8.350 8.233 0.117 19685 4397 1 9 . 1 1 401 401 GLY N N 401 109.500 109.500 109.311 0.189 19685 4398 1 9 . 1 1 401 401 GLY C C 401 171.500 171.500 172.364 -0.864 19685 4399 1 9 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.498 -0.798 19685 4400 1 9 . 1 1 401 401 GLY H H 401 9.050 9.050 7.943 1.107 19685 4401 1 9 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.539 -0.119 19685 4402 1 9 . 1 1 402 402 PRO C C 402 173.900 173.900 175.894 -1.994 19685 4403 1 9 . 1 1 402 402 PRO CA C 402 61.900 61.900 63.940 -2.040 19685 4404 1 9 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.809 -0.609 19685 4405 1 9 . 1 1 403 403 GLU N N 403 119.600 119.600 118.559 1.041 19685 4406 1 9 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.317 -0.357 19685 4407 1 9 . 1 1 403 403 GLU C C 403 177.300 177.300 176.454 0.846 19685 4408 1 9 . 1 1 403 403 GLU CA C 403 58.100 58.100 56.700 1.400 19685 4409 1 9 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.145 -1.145 19685 4410 1 9 . 1 1 403 403 GLU H H 403 8.420 8.420 7.858 0.562 19685 4411 1 9 . 1 1 404 404 GLY N N 404 112.800 112.800 107.416 5.384 19685 4412 1 9 . 1 1 404 404 GLY C C 404 173.300 173.300 174.406 -1.106 19685 4413 1 9 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.157 -0.257 19685 4414 1 9 . 1 1 404 404 GLY H H 404 8.500 8.500 8.356 0.144 19685 4415 1 9 . 1 1 405 405 ALA N N 405 120.000 120.000 123.626 -3.626 19685 4416 1 9 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.200 0.350 19685 4417 1 9 . 1 1 405 405 ALA C C 405 174.100 174.100 175.669 -1.569 19685 4418 1 9 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.898 -1.398 19685 4419 1 9 . 1 1 405 405 ALA CB C 405 20.800 20.800 16.883 3.917 19685 4420 1 9 . 1 1 405 405 ALA H H 405 8.360 8.360 8.192 0.168 19685 4421 1 9 . 1 1 406 406 ASN N N 406 115.500 115.500 116.740 -1.240 19685 4422 1 9 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.195 -0.005 19685 4423 1 9 . 1 1 406 406 ASN C C 406 172.900 172.900 174.692 -1.792 19685 4424 1 9 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.583 1.017 19685 4425 1 9 . 1 1 406 406 ASN CB C 406 40.900 40.900 38.616 2.284 19685 4426 1 9 . 1 1 406 406 ASN H H 406 7.690 7.690 8.060 -0.370 19685 4427 1 9 . 1 1 407 407 LEU N N 407 123.400 123.400 120.657 2.743 19685 4428 1 9 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.356 0.604 19685 4429 1 9 . 1 1 407 407 LEU C C 407 174.900 174.900 176.780 -1.880 19685 4430 1 9 . 1 1 407 407 LEU CA C 407 53.100 53.100 56.357 -3.257 19685 4431 1 9 . 1 1 407 407 LEU CB C 407 45.400 45.400 41.602 3.798 19685 4432 1 9 . 1 1 407 407 LEU H H 407 9.290 9.290 7.691 1.599 19685 4433 1 9 . 1 1 408 408 PHE N N 408 118.700 118.700 123.108 -4.408 19685 4434 1 9 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.775 0.525 19685 4435 1 9 . 1 1 408 408 PHE C C 408 174.200 174.200 175.546 -1.346 19685 4436 1 9 . 1 1 408 408 PHE CA C 408 56.300 56.300 57.691 -1.391 19685 4437 1 9 . 1 1 408 408 PHE CB C 408 42.700 42.700 37.816 4.884 19685 4438 1 9 . 1 1 408 408 PHE H H 408 9.150 9.150 8.141 1.009 19685 4439 1 9 . 1 1 409 409 ILE N N 409 120.800 120.800 121.954 -1.154 19685 4440 1 9 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.465 0.505 19685 4441 1 9 . 1 1 409 409 ILE C C 409 173.900 173.900 174.855 -0.955 19685 4442 1 9 . 1 1 409 409 ILE CA C 409 59.000 59.000 60.795 -1.795 19685 4443 1 9 . 1 1 409 409 ILE CB C 409 40.400 40.400 39.542 0.858 19685 4444 1 9 . 1 1 409 409 ILE H H 409 8.380 8.380 8.189 0.191 19685 4445 1 9 . 1 1 410 410 TYR N N 410 123.200 123.200 122.410 0.790 19685 4446 1 9 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.617 0.323 19685 4447 1 9 . 1 1 410 410 TYR C C 410 174.300 174.300 174.160 0.140 19685 4448 1 9 . 1 1 410 410 TYR CA C 410 56.200 56.200 57.469 -1.269 19685 4449 1 9 . 1 1 410 410 TYR CB C 410 40.800 40.800 38.607 2.193 19685 4450 1 9 . 1 1 410 410 TYR H H 410 9.440 9.440 8.840 0.600 19685 4451 1 9 . 1 1 411 411 HIS N N 411 112.100 112.100 119.534 -7.434 19685 4452 1 9 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.436 0.014 19685 4453 1 9 . 1 1 411 411 HIS C C 411 173.300 173.300 175.538 -2.238 19685 4454 1 9 . 1 1 411 411 HIS CA C 411 55.900 55.900 56.121 -0.221 19685 4455 1 9 . 1 1 411 411 HIS CB C 411 26.200 26.200 28.887 -2.687 19685 4456 1 9 . 1 1 411 411 HIS H H 411 8.580 8.580 8.283 0.297 19685 4457 1 9 . 1 1 412 412 LEU N N 412 115.100 115.100 117.889 -2.789 19685 4458 1 9 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.636 -0.676 19685 4459 1 9 . 1 1 412 412 LEU C C 412 175.100 175.100 175.123 -0.023 19685 4460 1 9 . 1 1 412 412 LEU CA C 412 52.400 52.400 53.590 -1.190 19685 4461 1 9 . 1 1 412 412 LEU CB C 412 42.000 42.000 41.719 0.281 19685 4462 1 9 . 1 1 412 412 LEU H H 412 7.560 7.560 7.450 0.110 19685 4463 1 9 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.350 -0.080 19685 4464 1 9 . 1 1 413 413 PRO C C 413 177.600 177.600 177.964 -0.364 19685 4465 1 9 . 1 1 413 413 PRO CA C 413 62.300 62.300 63.483 -1.183 19685 4466 1 9 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.248 -0.048 19685 4467 1 9 . 1 1 414 414 GLN N N 414 125.500 125.500 118.230 7.270 19685 4468 1 9 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.118 -0.038 19685 4469 1 9 . 1 1 414 414 GLN C C 414 175.400 175.400 175.711 -0.311 19685 4470 1 9 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.850 -0.850 19685 4471 1 9 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.895 -0.395 19685 4472 1 9 . 1 1 414 414 GLN H H 414 9.170 9.170 8.568 0.602 19685 4473 1 9 . 1 1 415 415 GLU N N 415 115.300 115.300 118.173 -2.873 19685 4474 1 9 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.317 -0.057 19685 4475 1 9 . 1 1 415 415 GLU C C 415 176.700 176.700 175.493 1.207 19685 4476 1 9 . 1 1 415 415 GLU CA C 415 58.700 58.700 55.894 2.806 19685 4477 1 9 . 1 1 415 415 GLU CB C 415 28.300 28.300 29.723 -1.423 19685 4478 1 9 . 1 1 415 415 GLU H H 415 9.390 9.390 8.162 1.228 19685 4479 1 9 . 1 1 416 416 PHE N N 416 121.700 121.700 117.658 4.042 19685 4480 1 9 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.195 -0.585 19685 4481 1 9 . 1 1 416 416 PHE C C 416 176.400 176.400 175.922 0.478 19685 4482 1 9 . 1 1 416 416 PHE CA C 416 57.400 57.400 55.407 1.993 19685 4483 1 9 . 1 1 416 416 PHE CB C 416 38.700 38.700 42.436 -3.736 19685 4484 1 9 . 1 1 416 416 PHE H H 416 7.610 7.610 7.406 0.204 19685 4485 1 9 . 1 1 417 417 GLY N N 417 113.000 113.000 107.156 5.844 19685 4486 1 9 . 1 1 417 417 GLY C C 417 174.300 174.300 173.233 1.067 19685 4487 1 9 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.391 -3.491 19685 4488 1 9 . 1 1 417 417 GLY H H 417 9.740 9.740 9.622 0.118 19685 4489 1 9 . 1 1 418 418 ASP N N 418 121.500 121.500 117.197 4.303 19685 4490 1 9 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.621 -0.681 19685 4491 1 9 . 1 1 418 418 ASP C C 418 177.900 177.900 177.011 0.889 19685 4492 1 9 . 1 1 418 418 ASP CA C 418 57.600 57.600 54.975 2.625 19685 4493 1 9 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.042 -1.342 19685 4494 1 9 . 1 1 418 418 ASP H H 418 8.680 8.680 7.930 0.750 19685 4495 1 9 . 1 1 419 419 GLN N N 419 116.400 116.400 120.309 -3.909 19685 4496 1 9 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.205 -0.295 19685 4497 1 9 . 1 1 419 419 GLN C C 419 177.600 177.600 175.728 1.872 19685 4498 1 9 . 1 1 419 419 GLN CA C 419 58.000 58.000 58.083 -0.083 19685 4499 1 9 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.528 -1.128 19685 4500 1 9 . 1 1 419 419 GLN H H 419 8.780 8.780 8.630 0.150 19685 4501 1 9 . 1 1 420 420 ASP N N 420 117.500 117.500 115.752 1.748 19685 4502 1 9 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.560 -0.550 19685 4503 1 9 . 1 1 420 420 ASP C C 420 178.000 178.000 177.199 0.801 19685 4504 1 9 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.613 3.087 19685 4505 1 9 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.501 -0.701 19685 4506 1 9 . 1 1 420 420 ASP H H 420 7.210 7.210 8.260 -1.050 19685 4507 1 9 . 1 1 421 421 ILE N N 421 117.000 117.000 121.234 -4.234 19685 4508 1 9 . 1 1 421 421 ILE HA H 421 4.080 4.080 3.810 0.270 19685 4509 1 9 . 1 1 421 421 ILE C C 421 176.500 176.500 175.919 0.581 19685 4510 1 9 . 1 1 421 421 ILE CA C 421 64.000 64.000 63.544 0.457 19685 4511 1 9 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.120 -0.820 19685 4512 1 9 . 1 1 421 421 ILE H H 421 7.610 7.610 7.861 -0.251 19685 4513 1 9 . 1 1 422 422 LEU N N 422 123.200 123.200 116.258 6.942 19685 4514 1 9 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.125 -0.365 19685 4515 1 9 . 1 1 422 422 LEU C C 422 177.800 177.800 176.805 0.995 19685 4516 1 9 . 1 1 422 422 LEU CA C 422 58.600 58.600 56.135 2.465 19685 4517 1 9 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.533 -0.333 19685 4518 1 9 . 1 1 422 422 LEU H H 422 7.870 7.870 7.849 0.021 19685 4519 1 9 . 1 1 423 423 GLN N N 423 115.600 115.600 115.670 -0.070 19685 4520 1 9 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.377 -0.497 19685 4521 1 9 . 1 1 423 423 GLN C C 423 177.800 177.800 175.303 2.497 19685 4522 1 9 . 1 1 423 423 GLN CA C 423 58.600 58.600 55.508 3.092 19685 4523 1 9 . 1 1 423 423 GLN CB C 423 27.900 27.900 29.572 -1.672 19685 4524 1 9 . 1 1 423 423 GLN H H 423 7.860 7.860 7.555 0.305 19685 4525 1 9 . 1 1 424 424 MET N N 424 115.500 115.500 118.294 -2.794 19685 4526 1 9 . 1 1 424 424 MET HA H 424 3.910 3.910 4.411 -0.501 19685 4527 1 9 . 1 1 424 424 MET C C 424 175.500 175.500 174.957 0.543 19685 4528 1 9 . 1 1 424 424 MET CA C 424 57.800 57.800 56.189 1.611 19685 4529 1 9 . 1 1 424 424 MET CB C 424 34.300 34.300 34.806 -0.506 19685 4530 1 9 . 1 1 424 424 MET H H 424 7.560 7.560 8.022 -0.462 19685 4531 1 9 . 1 1 425 425 PHE N N 425 112.300 112.300 118.128 -5.828 19685 4532 1 9 . 1 1 425 425 PHE HA H 425 4.700 4.700 5.005 -0.305 19685 4533 1 9 . 1 1 425 425 PHE C C 425 177.300 177.300 176.077 1.223 19685 4534 1 9 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.196 1.704 19685 4535 1 9 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.427 -1.927 19685 4536 1 9 . 1 1 425 425 PHE H H 425 7.680 7.680 8.488 -0.808 19685 4537 1 9 . 1 1 426 426 MET N N 426 127.400 127.400 116.775 10.625 19685 4538 1 9 . 1 1 426 426 MET HA H 426 4.630 4.630 4.489 0.141 19685 4539 1 9 . 1 1 426 426 MET C C 426 173.800 173.800 175.187 -1.387 19685 4540 1 9 . 1 1 426 426 MET CA C 426 59.100 59.100 55.665 3.435 19685 4541 1 9 . 1 1 426 426 MET CB C 426 31.800 31.800 30.393 1.407 19685 4542 1 9 . 1 1 426 426 MET H H 426 8.540 8.540 8.261 0.279 19685 4543 1 9 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.265 -0.255 19685 4544 1 9 . 1 1 427 427 PRO C C 427 176.800 176.800 176.216 0.584 19685 4545 1 9 . 1 1 427 427 PRO CA C 427 65.200 65.200 64.208 0.992 19685 4546 1 9 . 1 1 427 427 PRO CB C 427 30.600 30.600 30.806 -0.206 19685 4547 1 9 . 1 1 428 428 PHE N N 428 110.000 110.000 117.232 -7.232 19685 4548 1 9 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.650 -0.380 19685 4549 1 9 . 1 1 428 428 PHE C C 428 174.600 174.600 175.593 -0.993 19685 4550 1 9 . 1 1 428 428 PHE CA C 428 57.700 57.700 58.678 -0.978 19685 4551 1 9 . 1 1 428 428 PHE CB C 428 38.000 38.000 40.442 -2.442 19685 4552 1 9 . 1 1 428 428 PHE H H 428 6.560 6.560 7.680 -1.120 19685 4553 1 9 . 1 1 429 429 GLY N N 429 105.500 105.500 103.744 1.756 19685 4554 1 9 . 1 1 429 429 GLY C C 429 170.100 170.100 172.618 -2.518 19685 4555 1 9 . 1 1 429 429 GLY CA C 429 44.400 44.400 44.420 -0.020 19685 4556 1 9 . 1 1 429 429 GLY H H 429 7.650 7.650 7.678 -0.028 19685 4557 1 9 . 1 1 430 430 ASN N N 430 117.400 117.400 116.329 1.071 19685 4558 1 9 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.282 0.348 19685 4559 1 9 . 1 1 430 430 ASN C C 430 173.200 173.200 174.895 -1.695 19685 4560 1 9 . 1 1 430 430 ASN CA C 430 52.600 52.600 54.108 -1.508 19685 4561 1 9 . 1 1 430 430 ASN CB C 430 37.200 37.200 38.736 -1.536 19685 4562 1 9 . 1 1 430 430 ASN H H 430 9.020 9.020 7.426 1.594 19685 4563 1 9 . 1 1 431 431 VAL N N 431 128.000 128.000 117.936 10.064 19685 4564 1 9 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.332 -0.582 19685 4565 1 9 . 1 1 431 431 VAL C C 431 176.400 176.400 177.630 -1.230 19685 4566 1 9 . 1 1 431 431 VAL CA C 431 61.800 61.800 63.246 -1.446 19685 4567 1 9 . 1 1 431 431 VAL CB C 431 31.900 31.900 32.892 -0.993 19685 4568 1 9 . 1 1 431 431 VAL H H 431 8.480 8.480 8.488 -0.008 19685 4569 1 9 . 1 1 432 432 ILE N N 432 128.000 128.000 116.496 11.504 19685 4570 1 9 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.569 0.351 19685 4571 1 9 . 1 1 432 432 ILE C C 432 176.100 176.100 176.030 0.070 19685 4572 1 9 . 1 1 432 432 ILE CA C 432 62.500 62.500 64.012 -1.512 19685 4573 1 9 . 1 1 432 432 ILE CB C 432 37.400 37.400 37.225 0.175 19685 4574 1 9 . 1 1 432 432 ILE H H 432 8.840 8.840 7.846 0.994 19685 4575 1 9 . 1 1 433 433 SER N N 433 113.600 113.600 114.249 -0.649 19685 4576 1 9 . 1 1 433 433 SER HA H 433 4.440 4.440 4.680 -0.240 19685 4577 1 9 . 1 1 433 433 SER C C 433 171.000 171.000 172.042 -1.042 19685 4578 1 9 . 1 1 433 433 SER CA C 433 57.300 57.300 57.986 -0.686 19685 4579 1 9 . 1 1 433 433 SER CB C 433 65.200 65.200 66.206 -1.006 19685 4580 1 9 . 1 1 433 433 SER H H 433 7.280 7.280 8.125 -0.845 19685 4581 1 9 . 1 1 434 434 ALA N N 434 125.700 125.700 125.026 0.674 19685 4582 1 9 . 1 1 434 434 ALA HA H 434 4.910 4.910 5.176 -0.266 19685 4583 1 9 . 1 1 434 434 ALA C C 434 174.600 174.600 175.931 -1.331 19685 4584 1 9 . 1 1 434 434 ALA CA C 434 51.000 51.000 51.397 -0.397 19685 4585 1 9 . 1 1 434 434 ALA CB C 434 21.200 21.200 22.526 -1.325 19685 4586 1 9 . 1 1 434 434 ALA H H 434 8.270 8.270 8.449 -0.179 19685 4587 1 9 . 1 1 435 435 LYS N N 435 120.900 120.900 122.333 -1.433 19685 4588 1 9 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.570 -0.100 19685 4589 1 9 . 1 1 435 435 LYS C C 435 173.800 173.800 176.361 -2.561 19685 4590 1 9 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.618 -1.918 19685 4591 1 9 . 1 1 435 435 LYS CB C 435 36.400 36.400 34.981 1.419 19685 4592 1 9 . 1 1 435 435 LYS H H 435 8.490 8.490 8.144 0.346 19685 4593 1 9 . 1 1 436 436 VAL N N 436 122.200 122.200 117.184 5.016 19685 4594 1 9 . 1 1 436 436 VAL HA H 436 3.920 3.920 3.300 0.620 19685 4595 1 9 . 1 1 436 436 VAL C C 436 175.100 175.100 173.745 1.355 19685 4596 1 9 . 1 1 436 436 VAL CA C 436 63.600 63.600 63.594 0.006 19685 4597 1 9 . 1 1 436 436 VAL CB C 436 33.500 33.500 29.688 3.812 19685 4598 1 9 . 1 1 436 436 VAL H H 436 8.390 8.390 7.645 0.745 19685 4599 1 9 . 1 1 437 437 PHE N N 437 125.900 125.900 114.219 11.681 19685 4600 1 9 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.461 -0.061 19685 4601 1 9 . 1 1 437 437 PHE C C 437 173.600 173.600 174.026 -0.426 19685 4602 1 9 . 1 1 437 437 PHE CA C 437 57.700 57.700 56.923 0.777 19685 4603 1 9 . 1 1 437 437 PHE CB C 437 39.000 39.000 40.872 -1.872 19685 4604 1 9 . 1 1 437 437 PHE H H 437 8.250 8.250 7.141 1.109 19685 4605 1 9 . 1 1 438 438 ILE N N 438 121.900 121.900 117.050 4.850 19685 4606 1 9 . 1 1 438 438 ILE HA H 438 4.460 4.460 4.249 0.211 19685 4607 1 9 . 1 1 438 438 ILE C C 438 175.700 175.700 175.520 0.180 19685 4608 1 9 . 1 1 438 438 ILE CA C 438 58.300 58.300 61.323 -3.023 19685 4609 1 9 . 1 1 438 438 ILE CB C 438 39.700 39.700 38.419 1.281 19685 4610 1 9 . 1 1 438 438 ILE H H 438 8.520 8.520 8.142 0.378 19685 4611 1 9 . 1 1 439 439 ASP N N 439 126.500 126.500 122.443 4.057 19685 4612 1 9 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.479 0.101 19685 4613 1 9 . 1 1 439 439 ASP C C 439 176.300 176.300 177.220 -0.920 19685 4614 1 9 . 1 1 439 439 ASP CA C 439 53.600 53.600 54.710 -1.110 19685 4615 1 9 . 1 1 439 439 ASP CB C 439 42.300 42.300 42.623 -0.323 19685 4616 1 9 . 1 1 439 439 ASP H H 439 8.730 8.730 8.010 0.720 19685 4617 1 9 . 1 1 440 440 LYS N N 440 127.300 127.300 123.964 3.336 19685 4618 1 9 . 1 1 440 440 LYS HA H 440 4.070 4.070 4.182 -0.112 19685 4619 1 9 . 1 1 440 440 LYS C C 440 176.900 176.900 177.073 -0.173 19685 4620 1 9 . 1 1 440 440 LYS CA C 440 57.800 57.800 58.138 -0.338 19685 4621 1 9 . 1 1 440 440 LYS CB C 440 32.100 32.100 32.547 -0.447 19685 4622 1 9 . 1 1 440 440 LYS H H 440 8.930 8.930 8.648 0.282 19685 4623 1 9 . 1 1 441 441 GLN N N 441 117.400 117.400 116.208 1.192 19685 4624 1 9 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.444 -0.214 19685 4625 1 9 . 1 1 441 441 GLN C C 441 177.200 177.200 176.047 1.153 19685 4626 1 9 . 1 1 441 441 GLN CA C 441 57.600 57.600 56.217 1.383 19685 4627 1 9 . 1 1 441 441 GLN CB C 441 28.800 28.800 30.678 -1.878 19685 4628 1 9 . 1 1 441 441 GLN H H 441 8.650 8.650 8.479 0.171 19685 4629 1 9 . 1 1 442 442 THR N N 442 107.300 107.300 110.643 -3.343 19685 4630 1 9 . 1 1 442 442 THR HA H 442 4.290 4.290 4.457 -0.167 19685 4631 1 9 . 1 1 442 442 THR C C 442 175.100 175.100 174.717 0.383 19685 4632 1 9 . 1 1 442 442 THR CA C 442 61.200 61.200 60.888 0.312 19685 4633 1 9 . 1 1 442 442 THR CB C 442 70.300 70.300 69.629 0.671 19685 4634 1 9 . 1 1 442 442 THR H H 442 7.830 7.830 7.864 -0.034 19685 4635 1 9 . 1 1 443 443 ASN N N 443 117.300 117.300 118.831 -1.531 19685 4636 1 9 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.247 0.053 19685 4637 1 9 . 1 1 443 443 ASN C C 443 173.400 173.400 174.531 -1.131 19685 4638 1 9 . 1 1 443 443 ASN CA C 443 54.300 54.300 54.293 0.007 19685 4639 1 9 . 1 1 443 443 ASN CB C 443 37.600 37.600 37.257 0.343 19685 4640 1 9 . 1 1 443 443 ASN H H 443 8.470 8.470 7.938 0.532 19685 4641 1 9 . 1 1 444 444 LEU N N 444 118.000 118.000 114.600 3.400 19685 4642 1 9 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.558 0.002 19685 4643 1 9 . 1 1 444 444 LEU C C 444 176.700 176.700 177.112 -0.412 19685 4644 1 9 . 1 1 444 444 LEU CA C 444 53.300 53.300 54.243 -0.943 19685 4645 1 9 . 1 1 444 444 LEU CB C 444 43.500 43.500 42.961 0.539 19685 4646 1 9 . 1 1 444 444 LEU H H 444 7.660 7.660 7.163 0.497 19685 4647 1 9 . 1 1 445 445 SER N N 445 115.500 115.500 114.282 1.218 19685 4648 1 9 . 1 1 445 445 SER HA H 445 4.460 4.460 3.939 0.521 19685 4649 1 9 . 1 1 445 445 SER C C 445 176.500 176.500 173.414 3.086 19685 4650 1 9 . 1 1 445 445 SER CA C 445 57.900 57.900 58.912 -1.012 19685 4651 1 9 . 1 1 445 445 SER CB C 445 63.500 63.500 63.299 0.201 19685 4652 1 9 . 1 1 445 445 SER H H 445 8.840 8.840 8.524 0.317 19685 4653 1 9 . 1 1 446 446 LYS N N 446 125.200 125.200 120.246 4.954 19685 4654 1 9 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.393 0.107 19685 4655 1 9 . 1 1 446 446 LYS C C 446 176.100 176.100 176.589 -0.489 19685 4656 1 9 . 1 1 446 446 LYS CA C 446 56.300 56.300 56.045 0.255 19685 4657 1 9 . 1 1 446 446 LYS CB C 446 32.200 32.200 35.188 -2.988 19685 4658 1 9 . 1 1 446 446 LYS H H 446 9.230 9.230 8.186 1.044 19685 4659 1 9 . 1 1 447 447 CYS N N 447 113.000 113.000 118.325 -5.325 19685 4660 1 9 . 1 1 447 447 CYS C C 447 172.500 172.500 173.981 -1.481 19685 4661 1 9 . 1 1 447 447 CYS CA C 447 60.400 60.400 59.789 0.611 19685 4662 1 9 . 1 1 447 447 CYS CB C 447 24.900 24.900 25.920 -1.020 19685 4663 1 9 . 1 1 447 447 CYS H H 447 10.020 10.020 8.862 1.158 19685 4664 1 9 . 1 1 448 448 PHE N N 448 115.200 115.200 114.613 0.587 19685 4665 1 9 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.631 0.709 19685 4666 1 9 . 1 1 448 448 PHE C C 448 172.400 172.400 173.402 -1.002 19685 4667 1 9 . 1 1 448 448 PHE CA C 448 54.700 54.700 55.429 -0.730 19685 4668 1 9 . 1 1 448 448 PHE CB C 448 42.000 42.000 40.302 1.698 19685 4669 1 9 . 1 1 448 448 PHE H H 448 7.810 7.810 7.154 0.656 19685 4670 1 9 . 1 1 449 449 GLY N N 449 107.700 107.700 105.724 1.976 19685 4671 1 9 . 1 1 449 449 GLY C C 449 170.100 170.100 171.972 -1.872 19685 4672 1 9 . 1 1 449 449 GLY CA C 449 45.200 45.200 43.126 2.074 19685 4673 1 9 . 1 1 449 449 GLY H H 449 9.310 9.310 8.371 0.939 19685 4674 1 9 . 1 1 450 450 PHE N N 450 119.900 119.900 113.014 6.886 19685 4675 1 9 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.292 0.138 19685 4676 1 9 . 1 1 450 450 PHE C C 450 172.800 172.800 173.060 -0.260 19685 4677 1 9 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.352 -1.352 19685 4678 1 9 . 1 1 450 450 PHE CB C 450 43.600 43.600 40.943 2.657 19685 4679 1 9 . 1 1 450 450 PHE H H 450 8.760 8.760 7.700 1.060 19685 4680 1 9 . 1 1 451 451 VAL N N 451 123.800 123.800 117.737 6.063 19685 4681 1 9 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.722 -0.432 19685 4682 1 9 . 1 1 451 451 VAL C C 451 172.400 172.400 175.921 -3.521 19685 4683 1 9 . 1 1 451 451 VAL CA C 451 59.800 59.800 61.096 -1.296 19685 4684 1 9 . 1 1 451 451 VAL CB C 451 36.100 36.100 36.173 -0.073 19685 4685 1 9 . 1 1 451 451 VAL H H 451 7.930 7.930 8.341 -0.411 19685 4686 1 9 . 1 1 452 452 SER N N 452 119.600 119.600 121.244 -1.644 19685 4687 1 9 . 1 1 452 452 SER HA H 452 5.120 5.120 4.938 0.182 19685 4688 1 9 . 1 1 452 452 SER C C 452 173.200 173.200 174.201 -1.001 19685 4689 1 9 . 1 1 452 452 SER CA C 452 55.700 55.700 56.782 -1.082 19685 4690 1 9 . 1 1 452 452 SER CB C 452 66.100 66.100 62.460 3.640 19685 4691 1 9 . 1 1 452 452 SER H H 452 8.540 8.540 8.429 0.111 19685 4692 1 9 . 1 1 453 453 TYR N N 453 121.400 121.400 123.574 -2.174 19685 4693 1 9 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.611 0.769 19685 4694 1 9 . 1 1 453 453 TYR C C 453 173.600 173.600 177.129 -3.529 19685 4695 1 9 . 1 1 453 453 TYR CA C 453 56.500 56.500 59.992 -3.492 19685 4696 1 9 . 1 1 453 453 TYR CB C 453 42.200 42.200 38.535 3.665 19685 4697 1 9 . 1 1 453 453 TYR H H 453 8.380 8.380 8.003 0.377 19685 4698 1 9 . 1 1 454 454 ASP N N 454 113.300 113.300 123.733 -10.433 19685 4699 1 9 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.399 0.091 19685 4700 1 9 . 1 1 454 454 ASP C C 454 176.100 176.100 175.633 0.467 19685 4701 1 9 . 1 1 454 454 ASP CA C 454 52.800 52.800 56.014 -3.214 19685 4702 1 9 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.557 -1.157 19685 4703 1 9 . 1 1 454 454 ASP H H 454 7.860 7.860 8.613 -0.753 19685 4704 1 9 . 1 1 455 455 ASN N N 455 113.800 113.800 112.829 0.971 19685 4705 1 9 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.109 -0.059 19685 4706 1 9 . 1 1 455 455 ASN C C 455 173.100 173.100 173.195 -0.095 19685 4707 1 9 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.544 -0.844 19685 4708 1 9 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.650 0.450 19685 4709 1 9 . 1 1 455 455 ASN H H 455 7.200 7.200 7.842 -0.642 19685 4710 1 9 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.521 -0.351 19685 4711 1 9 . 1 1 456 456 PRO C C 456 177.300 177.300 177.045 0.255 19685 4712 1 9 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.659 -0.460 19685 4713 1 9 . 1 1 456 456 PRO CB C 456 32.300 32.300 32.128 0.172 19685 4714 1 9 . 1 1 457 457 VAL N N 457 120.900 120.900 117.190 3.710 19685 4715 1 9 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.092 -0.472 19685 4716 1 9 . 1 1 457 457 VAL C C 457 179.000 179.000 176.824 2.176 19685 4717 1 9 . 1 1 457 457 VAL CA C 457 65.900 65.900 64.006 1.894 19685 4718 1 9 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.586 -0.786 19685 4719 1 9 . 1 1 457 457 VAL H H 457 8.120 8.120 8.053 0.067 19685 4720 1 9 . 1 1 458 458 SER N N 458 117.800 117.800 115.882 1.918 19685 4721 1 9 . 1 1 458 458 SER HA H 458 3.940 3.940 4.548 -0.608 19685 4722 1 9 . 1 1 458 458 SER C C 458 173.600 173.600 175.233 -1.633 19685 4723 1 9 . 1 1 458 458 SER CA C 458 61.100 61.100 60.831 0.269 19685 4724 1 9 . 1 1 458 458 SER CB C 458 62.400 62.400 63.732 -1.332 19685 4725 1 9 . 1 1 458 458 SER H H 458 7.830 7.830 7.633 0.197 19685 4726 1 9 . 1 1 459 459 ALA N N 459 120.000 120.000 124.673 -4.673 19685 4727 1 9 . 1 1 459 459 ALA HA H 459 3.750 3.750 4.054 -0.304 19685 4728 1 9 . 1 1 459 459 ALA C C 459 178.100 178.100 178.003 0.097 19685 4729 1 9 . 1 1 459 459 ALA CA C 459 54.500 54.500 53.798 0.702 19685 4730 1 9 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.101 -0.201 19685 4731 1 9 . 1 1 459 459 ALA H H 459 6.370 6.370 7.890 -1.520 19685 4732 1 9 . 1 1 460 460 GLN N N 460 116.100 116.100 117.599 -1.499 19685 4733 1 9 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.036 -0.206 19685 4734 1 9 . 1 1 460 460 GLN C C 460 178.000 178.000 176.587 1.413 19685 4735 1 9 . 1 1 460 460 GLN CA C 460 58.500 58.500 57.981 0.519 19685 4736 1 9 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.300 -0.900 19685 4737 1 9 . 1 1 460 460 GLN H H 460 7.710 7.710 8.638 -0.928 19685 4738 1 9 . 1 1 461 461 ALA N N 461 122.800 122.800 118.024 4.776 19685 4739 1 9 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.292 -0.332 19685 4740 1 9 . 1 1 461 461 ALA C C 461 179.500 179.500 177.215 2.285 19685 4741 1 9 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.265 2.235 19685 4742 1 9 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.255 -1.755 19685 4743 1 9 . 1 1 461 461 ALA H H 461 7.880 7.880 7.376 0.504 19685 4744 1 9 . 1 1 462 462 ALA N N 462 121.400 121.400 119.911 1.489 19685 4745 1 9 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.717 -1.317 19685 4746 1 9 . 1 1 462 462 ALA C C 462 179.400 179.400 177.962 1.438 19685 4747 1 9 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.317 1.783 19685 4748 1 9 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.324 -1.624 19685 4749 1 9 . 1 1 462 462 ALA H H 462 7.860 7.860 7.481 0.379 19685 4750 1 9 . 1 1 463 463 ILE N N 463 118.600 118.600 117.796 0.804 19685 4751 1 9 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.892 -0.652 19685 4752 1 9 . 1 1 463 463 ILE C C 463 177.500 177.500 175.977 1.523 19685 4753 1 9 . 1 1 463 463 ILE CA C 463 66.000 66.000 62.809 3.191 19685 4754 1 9 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.262 0.038 19685 4755 1 9 . 1 1 463 463 ILE H H 463 8.090 8.090 7.882 0.208 19685 4756 1 9 . 1 1 464 464 GLN N N 464 117.000 117.000 116.091 0.909 19685 4757 1 9 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.330 -0.460 19685 4758 1 9 . 1 1 464 464 GLN C C 464 177.700 177.700 175.381 2.319 19685 4759 1 9 . 1 1 464 464 GLN CA C 464 58.200 58.200 56.092 2.108 19685 4760 1 9 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.624 -1.724 19685 4761 1 9 . 1 1 464 464 GLN H H 464 7.780 7.780 7.796 -0.016 19685 4762 1 9 . 1 1 465 465 ALA N N 465 117.200 117.200 120.360 -3.160 19685 4763 1 9 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.351 -0.121 19685 4764 1 9 . 1 1 465 465 ALA C C 465 179.200 179.200 176.328 2.872 19685 4765 1 9 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.719 1.081 19685 4766 1 9 . 1 1 465 465 ALA CB C 465 21.100 21.100 19.515 1.585 19685 4767 1 9 . 1 1 465 465 ALA H H 465 7.540 7.540 7.898 -0.358 19685 4768 1 9 . 1 1 466 466 MET N N 466 110.800 110.800 115.326 -4.526 19685 4769 1 9 . 1 1 466 466 MET HA H 466 4.820 4.820 4.413 0.407 19685 4770 1 9 . 1 1 466 466 MET C C 466 177.600 177.600 175.615 1.985 19685 4771 1 9 . 1 1 466 466 MET CA C 466 53.300 53.300 55.512 -2.212 19685 4772 1 9 . 1 1 466 466 MET CB C 466 31.600 31.600 35.388 -3.788 19685 4773 1 9 . 1 1 466 466 MET H H 466 8.230 8.230 7.528 0.702 19685 4774 1 9 . 1 1 467 467 ASN N N 467 119.100 119.100 119.098 0.002 19685 4775 1 9 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.555 -0.065 19685 4776 1 9 . 1 1 467 467 ASN C C 467 176.300 176.300 177.005 -0.705 19685 4777 1 9 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.693 1.507 19685 4778 1 9 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.402 -0.202 19685 4779 1 9 . 1 1 467 467 ASN H H 467 8.560 8.560 7.835 0.725 19685 4780 1 9 . 1 1 468 468 GLY N N 468 117.900 117.900 113.714 4.186 19685 4781 1 9 . 1 1 468 468 GLY C C 468 172.800 172.800 174.179 -1.379 19685 4782 1 9 . 1 1 468 468 GLY CA C 468 45.300 45.300 46.073 -0.773 19685 4783 1 9 . 1 1 468 468 GLY H H 468 8.930 8.930 9.060 -0.130 19685 4784 1 9 . 1 1 469 469 PHE N N 469 123.300 123.300 119.922 3.378 19685 4785 1 9 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.630 -0.440 19685 4786 1 9 . 1 1 469 469 PHE C C 469 174.400 174.400 174.506 -0.106 19685 4787 1 9 . 1 1 469 469 PHE CA C 469 58.700 58.700 57.966 0.734 19685 4788 1 9 . 1 1 469 469 PHE CB C 469 40.600 40.600 40.215 0.385 19685 4789 1 9 . 1 1 469 469 PHE H H 469 7.950 7.950 7.718 0.232 19685 4790 1 9 . 1 1 470 470 GLN N N 470 129.200 129.200 119.194 10.006 19685 4791 1 9 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.097 0.493 19685 4792 1 9 . 1 1 470 470 GLN C C 470 174.100 174.100 174.069 0.031 19685 4793 1 9 . 1 1 470 470 GLN CA C 470 55.500 55.500 56.815 -1.315 19685 4794 1 9 . 1 1 470 470 GLN CB C 470 28.800 28.800 28.246 0.554 19685 4795 1 9 . 1 1 470 470 GLN H H 470 8.330 8.330 8.260 0.070 19685 4796 1 9 . 1 1 471 471 ILE N N 471 126.300 126.300 124.062 2.238 19685 4797 1 9 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.377 -0.207 19685 4798 1 9 . 1 1 471 471 ILE C C 471 175.400 175.400 175.233 0.167 19685 4799 1 9 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.269 -0.669 19685 4800 1 9 . 1 1 471 471 ILE CB C 471 39.100 39.100 40.804 -1.704 19685 4801 1 9 . 1 1 471 471 ILE H H 471 8.440 8.440 7.979 0.461 19685 4802 1 9 . 1 1 472 472 GLY N N 472 117.500 117.500 114.383 3.117 19685 4803 1 9 . 1 1 472 472 GLY C C 472 174.700 174.700 174.541 0.159 19685 4804 1 9 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.428 1.072 19685 4805 1 9 . 1 1 472 472 GLY H H 472 8.980 8.980 8.501 0.479 19685 4806 1 9 . 1 1 473 473 MET N N 473 124.100 124.100 120.156 3.944 19685 4807 1 9 . 1 1 473 473 MET HA H 473 4.380 4.380 4.508 -0.128 19685 4808 1 9 . 1 1 473 473 MET C C 473 175.700 175.700 175.535 0.165 19685 4809 1 9 . 1 1 473 473 MET CA C 473 55.000 55.000 56.185 -1.185 19685 4810 1 9 . 1 1 473 473 MET CB C 473 32.900 32.900 32.210 0.690 19685 4811 1 9 . 1 1 473 473 MET H H 473 9.070 9.070 8.245 0.825 19685 4812 1 9 . 1 1 474 474 LYS N N 474 118.700 118.700 118.540 0.160 19685 4813 1 9 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.585 -0.105 19685 4814 1 9 . 1 1 474 474 LYS C C 474 174.300 174.300 174.833 -0.533 19685 4815 1 9 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.662 -0.062 19685 4816 1 9 . 1 1 474 474 LYS CB C 474 35.100 35.100 34.804 0.295 19685 4817 1 9 . 1 1 474 474 LYS H H 474 7.770 7.770 7.286 0.484 19685 4818 1 9 . 1 1 475 475 ARG N N 475 119.600 119.600 119.511 0.089 19685 4819 1 9 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.252 0.548 19685 4820 1 9 . 1 1 475 475 ARG C C 475 175.700 175.700 174.415 1.285 19685 4821 1 9 . 1 1 475 475 ARG CA C 475 54.000 54.000 56.018 -2.018 19685 4822 1 9 . 1 1 475 475 ARG CB C 475 31.300 31.300 30.406 0.894 19685 4823 1 9 . 1 1 475 475 ARG H H 475 8.350 8.350 8.540 -0.190 19685 4824 1 9 . 1 1 476 476 LEU N N 476 123.500 123.500 121.017 2.483 19685 4825 1 9 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.679 -0.249 19685 4826 1 9 . 1 1 476 476 LEU C C 476 177.600 177.600 175.015 2.585 19685 4827 1 9 . 1 1 476 476 LEU CA C 476 55.500 55.500 53.797 1.703 19685 4828 1 9 . 1 1 476 476 LEU CB C 476 42.800 42.800 44.697 -1.897 19685 4829 1 9 . 1 1 476 476 LEU H H 476 9.130 9.130 8.392 0.738 19685 4830 1 9 . 1 1 477 477 LYS N N 477 123.200 123.200 126.168 -2.968 19685 4831 1 9 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.762 0.398 19685 4832 1 9 . 1 1 477 477 LYS C C 477 174.100 174.100 174.099 0.001 19685 4833 1 9 . 1 1 477 477 LYS CA C 477 54.500 54.500 55.555 -1.055 19685 4834 1 9 . 1 1 477 477 LYS CB C 477 34.900 34.900 35.528 -0.628 19685 4835 1 9 . 1 1 477 477 LYS H H 477 8.090 8.090 8.562 -0.472 19685 4836 1 9 . 1 1 478 478 VAL N N 478 127.100 127.100 122.155 4.945 19685 4837 1 9 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.642 0.258 19685 4838 1 9 . 1 1 478 478 VAL C C 478 173.700 173.700 173.500 0.200 19685 4839 1 9 . 1 1 478 478 VAL CA C 478 61.000 61.000 60.214 0.786 19685 4840 1 9 . 1 1 478 478 VAL CB C 478 33.700 33.700 34.126 -0.426 19685 4841 1 9 . 1 1 478 478 VAL H H 478 8.820 8.820 8.554 0.266 19685 4842 1 9 . 1 1 479 479 GLN N N 479 123.600 123.600 122.375 1.225 19685 4843 1 9 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.566 0.244 19685 4844 1 9 . 1 1 479 479 GLN C C 479 173.600 173.600 173.690 -0.090 19685 4845 1 9 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.401 -1.201 19685 4846 1 9 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.283 1.217 19685 4847 1 9 . 1 1 479 479 GLN H H 479 9.130 9.130 8.442 0.688 19685 4848 1 9 . 1 1 480 480 LEU N N 480 123.200 123.200 121.233 1.967 19685 4849 1 9 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.638 -0.198 19685 4850 1 9 . 1 1 480 480 LEU C C 480 177.100 177.100 177.226 -0.126 19685 4851 1 9 . 1 1 480 480 LEU CA C 480 54.600 54.600 53.920 0.679 19685 4852 1 9 . 1 1 480 480 LEU CB C 480 42.400 42.400 44.252 -1.852 19685 4853 1 9 . 1 1 480 480 LEU H H 480 8.840 8.840 8.243 0.597 19685 4854 1 9 . 1 1 481 481 LYS N N 481 124.500 124.500 123.771 0.729 19685 4855 1 9 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.057 0.253 19685 4856 1 9 . 1 1 481 481 LYS C C 481 175.200 175.200 177.050 -1.850 19685 4857 1 9 . 1 1 481 481 LYS CA C 481 56.700 56.700 58.809 -2.110 19685 4858 1 9 . 1 1 481 481 LYS CB C 481 33.100 33.100 31.589 1.511 19685 4859 1 9 . 1 1 481 481 LYS H H 481 8.400 8.400 8.611 -0.211 19685 4860 1 9 . 1 1 482 482 ARG N N 482 126.600 126.600 118.073 8.527 19685 4861 1 9 . 1 1 482 482 ARG HA H 482 4.350 4.350 3.945 0.405 19685 4862 1 9 . 1 1 482 482 ARG C C 482 175.800 175.800 175.962 -0.162 19685 4863 1 9 . 1 1 482 482 ARG CA C 482 55.600 55.600 57.479 -1.879 19685 4864 1 9 . 1 1 482 482 ARG CB C 482 31.100 31.100 29.094 2.006 19685 4865 1 9 . 1 1 482 482 ARG H H 482 8.770 8.770 8.074 0.696 19685 4866 1 9 . 1 1 483 483 SER N N 483 118.100 118.100 114.911 3.189 19685 4867 1 9 . 1 1 483 483 SER HA H 483 4.400 4.400 4.387 0.013 19685 4868 1 9 . 1 1 483 483 SER C C 483 174.200 174.200 174.138 0.062 19685 4869 1 9 . 1 1 483 483 SER CA C 483 58.000 58.000 58.353 -0.353 19685 4870 1 9 . 1 1 483 483 SER CB C 483 63.500 63.500 63.629 -0.129 19685 4871 1 9 . 1 1 483 483 SER H H 483 8.610 8.610 8.417 0.193 19685 4872 1 9 . 1 1 484 484 LYS N N 484 123.000 123.000 119.661 3.339 19685 4873 1 9 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.309 -0.099 19685 4874 1 9 . 1 1 484 484 LYS C C 484 175.900 175.900 175.171 0.729 19685 4875 1 9 . 1 1 484 484 LYS CA C 484 56.300 56.300 57.729 -1.429 19685 4876 1 9 . 1 1 484 484 LYS CB C 484 32.500 32.500 32.252 0.248 19685 4877 1 9 . 1 1 484 484 LYS H H 484 8.560 8.560 8.042 0.518 19685 4878 1 9 . 1 1 485 485 ASN N N 485 119.600 119.600 118.326 1.274 19685 4879 1 9 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.943 -0.343 19685 4880 1 9 . 1 1 485 485 ASN C C 485 174.400 174.400 173.758 0.642 19685 4881 1 9 . 1 1 485 485 ASN CA C 485 52.900 52.900 53.209 -0.309 19685 4882 1 9 . 1 1 485 485 ASN CB C 485 38.400 38.400 40.318 -1.918 19685 4883 1 9 . 1 1 485 485 ASN H H 485 8.560 8.560 8.257 0.303 19685 4884 1 9 . 1 1 486 486 ASP N N 486 121.100 121.100 121.143 -0.043 19685 4885 1 9 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.764 -0.244 19685 4886 1 9 . 1 1 486 486 ASP C C 486 175.700 175.700 175.750 -0.050 19685 4887 1 9 . 1 1 486 486 ASP CA C 486 54.000 54.000 53.740 0.260 19685 4888 1 9 . 1 1 486 486 ASP CB C 486 40.800 40.800 41.798 -0.998 19685 4889 1 9 . 1 1 486 486 ASP H H 486 8.250 8.250 8.662 -0.412 19685 4890 1 9 . 1 1 487 487 SER N N 487 115.400 115.400 117.013 -1.613 19685 4891 1 9 . 1 1 487 487 SER HA H 487 4.310 4.310 4.484 -0.174 19685 4892 1 9 . 1 1 487 487 SER C C 487 172.800 172.800 172.981 -0.181 19685 4893 1 9 . 1 1 487 487 SER CA C 487 57.700 57.700 59.425 -1.726 19685 4894 1 9 . 1 1 487 487 SER CB C 487 63.600 63.600 64.452 -0.852 19685 4895 1 9 . 1 1 487 487 SER H H 487 8.090 8.090 8.371 -0.281 19685 4896 1 9 . 1 1 488 488 LYS N N 488 122.300 122.300 120.144 2.156 19685 4897 1 9 . 1 1 488 488 LYS HA H 488 4.050 4.050 5.091 -1.041 19685 4898 1 9 . 1 1 488 488 LYS C C 488 174.500 174.500 174.399 0.101 19685 4899 1 9 . 1 1 488 488 LYS CA C 488 54.000 54.000 52.778 1.222 19685 4900 1 9 . 1 1 488 488 LYS CB C 488 32.400 32.400 33.984 -1.584 19685 4901 1 9 . 1 1 488 488 LYS H H 488 8.090 8.090 8.316 -0.226 19685 4902 1 9 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.291 -0.011 19685 4903 1 9 . 1 1 489 489 PRO C C 489 175.000 175.000 175.253 -0.253 19685 4904 1 9 . 1 1 489 489 PRO CA C 489 63.200 63.200 62.456 0.744 19685 4905 1 9 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.178 -1.078 19685 4906 1 10 . 1 1 395 395 SER N N 395 115.500 115.500 114.188 1.312 19685 4907 1 10 . 1 1 395 395 SER HA H 395 4.300 4.300 4.838 -0.538 19685 4908 1 10 . 1 1 395 395 SER C C 395 173.900 173.900 173.159 0.741 19685 4909 1 10 . 1 1 395 395 SER CA C 395 57.900 57.900 57.132 0.768 19685 4910 1 10 . 1 1 395 395 SER CB C 395 63.400 63.400 64.303 -0.903 19685 4911 1 10 . 1 1 395 395 SER H H 395 8.200 8.200 8.471 -0.271 19685 4912 1 10 . 1 1 396 396 HIS N N 396 123.500 123.500 120.039 3.461 19685 4913 1 10 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.869 -0.309 19685 4914 1 10 . 1 1 396 396 HIS C C 396 174.100 174.100 174.391 -0.291 19685 4915 1 10 . 1 1 396 396 HIS CA C 396 53.700 53.700 56.262 -2.562 19685 4916 1 10 . 1 1 396 396 HIS CB C 396 32.200 32.200 30.860 1.340 19685 4917 1 10 . 1 1 396 396 HIS H H 396 8.120 8.120 8.529 -0.409 19685 4918 1 10 . 1 1 397 397 MET N N 397 121.200 121.200 117.311 3.889 19685 4919 1 10 . 1 1 397 397 MET HA H 397 4.320 4.320 5.029 -0.709 19685 4920 1 10 . 1 1 397 397 MET C C 397 175.400 175.400 174.504 0.896 19685 4921 1 10 . 1 1 397 397 MET CA C 397 55.000 55.000 55.472 -0.472 19685 4922 1 10 . 1 1 397 397 MET CB C 397 32.500 32.500 35.355 -2.856 19685 4923 1 10 . 1 1 397 397 MET H H 397 8.300 8.300 7.661 0.639 19685 4924 1 10 . 1 1 398 398 GLN N N 398 122.100 122.100 115.068 7.032 19685 4925 1 10 . 1 1 398 398 GLN HA H 398 4.190 4.190 3.957 0.233 19685 4926 1 10 . 1 1 398 398 GLN C C 398 174.800 174.800 174.897 -0.097 19685 4927 1 10 . 1 1 398 398 GLN CA C 398 55.200 55.200 57.240 -2.040 19685 4928 1 10 . 1 1 398 398 GLN CB C 398 28.900 28.900 27.951 0.949 19685 4929 1 10 . 1 1 398 398 GLN H H 398 8.540 8.540 8.658 -0.118 19685 4930 1 10 . 1 1 399 399 LYS N N 399 123.000 123.000 116.987 6.013 19685 4931 1 10 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.345 -0.125 19685 4932 1 10 . 1 1 399 399 LYS C C 399 174.800 174.800 177.018 -2.218 19685 4933 1 10 . 1 1 399 399 LYS CA C 399 55.600 55.600 57.239 -1.639 19685 4934 1 10 . 1 1 399 399 LYS CB C 399 33.000 33.000 32.941 0.059 19685 4935 1 10 . 1 1 399 399 LYS H H 399 8.180 8.180 8.395 -0.215 19685 4936 1 10 . 1 1 400 400 GLU N N 400 122.000 122.000 118.607 3.393 19685 4937 1 10 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.795 -0.365 19685 4938 1 10 . 1 1 400 400 GLU C C 400 176.400 176.400 175.283 1.117 19685 4939 1 10 . 1 1 400 400 GLU CA C 400 55.400 55.400 55.085 0.315 19685 4940 1 10 . 1 1 400 400 GLU CB C 400 31.400 31.400 30.882 0.518 19685 4941 1 10 . 1 1 400 400 GLU H H 400 8.350 8.350 8.396 -0.046 19685 4942 1 10 . 1 1 401 401 GLY N N 401 109.500 109.500 107.655 1.845 19685 4943 1 10 . 1 1 401 401 GLY C C 401 171.500 171.500 172.489 -0.989 19685 4944 1 10 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.336 -0.636 19685 4945 1 10 . 1 1 401 401 GLY H H 401 9.050 9.050 7.978 1.072 19685 4946 1 10 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.409 0.011 19685 4947 1 10 . 1 1 402 402 PRO C C 402 173.900 173.900 176.370 -2.470 19685 4948 1 10 . 1 1 402 402 PRO CA C 402 61.900 61.900 63.868 -1.968 19685 4949 1 10 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.637 -0.437 19685 4950 1 10 . 1 1 403 403 GLU N N 403 119.600 119.600 116.739 2.861 19685 4951 1 10 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.318 -0.358 19685 4952 1 10 . 1 1 403 403 GLU C C 403 177.300 177.300 175.921 1.379 19685 4953 1 10 . 1 1 403 403 GLU CA C 403 58.100 58.100 56.390 1.710 19685 4954 1 10 . 1 1 403 403 GLU CB C 403 29.000 29.000 31.612 -2.612 19685 4955 1 10 . 1 1 403 403 GLU H H 403 8.420 8.420 7.395 1.025 19685 4956 1 10 . 1 1 404 404 GLY N N 404 112.800 112.800 111.965 0.835 19685 4957 1 10 . 1 1 404 404 GLY C C 404 173.300 173.300 174.133 -0.833 19685 4958 1 10 . 1 1 404 404 GLY CA C 404 44.900 44.900 46.722 -1.822 19685 4959 1 10 . 1 1 404 404 GLY H H 404 8.500 8.500 8.506 -0.006 19685 4960 1 10 . 1 1 405 405 ALA N N 405 120.000 120.000 123.205 -3.205 19685 4961 1 10 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.334 0.216 19685 4962 1 10 . 1 1 405 405 ALA C C 405 174.100 174.100 175.959 -1.859 19685 4963 1 10 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.351 -0.851 19685 4964 1 10 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.860 2.940 19685 4965 1 10 . 1 1 405 405 ALA H H 405 8.360 8.360 8.159 0.201 19685 4966 1 10 . 1 1 406 406 ASN N N 406 115.500 115.500 117.153 -1.653 19685 4967 1 10 . 1 1 406 406 ASN HA H 406 5.190 5.190 4.797 0.393 19685 4968 1 10 . 1 1 406 406 ASN C C 406 172.900 172.900 174.801 -1.901 19685 4969 1 10 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.707 0.893 19685 4970 1 10 . 1 1 406 406 ASN CB C 406 40.900 40.900 39.201 1.699 19685 4971 1 10 . 1 1 406 406 ASN H H 406 7.690 7.690 7.687 0.003 19685 4972 1 10 . 1 1 407 407 LEU N N 407 123.400 123.400 122.147 1.253 19685 4973 1 10 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.056 0.904 19685 4974 1 10 . 1 1 407 407 LEU C C 407 174.900 174.900 176.231 -1.331 19685 4975 1 10 . 1 1 407 407 LEU CA C 407 53.100 53.100 56.100 -3.000 19685 4976 1 10 . 1 1 407 407 LEU CB C 407 45.400 45.400 41.757 3.643 19685 4977 1 10 . 1 1 407 407 LEU H H 407 9.290 9.290 7.762 1.528 19685 4978 1 10 . 1 1 408 408 PHE N N 408 118.700 118.700 125.832 -7.132 19685 4979 1 10 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.785 0.515 19685 4980 1 10 . 1 1 408 408 PHE C C 408 174.200 174.200 175.230 -1.030 19685 4981 1 10 . 1 1 408 408 PHE CA C 408 56.300 56.300 56.855 -0.555 19685 4982 1 10 . 1 1 408 408 PHE CB C 408 42.700 42.700 38.341 4.359 19685 4983 1 10 . 1 1 408 408 PHE H H 408 9.150 9.150 8.412 0.738 19685 4984 1 10 . 1 1 409 409 ILE N N 409 120.800 120.800 121.868 -1.068 19685 4985 1 10 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.006 0.964 19685 4986 1 10 . 1 1 409 409 ILE C C 409 173.900 173.900 174.999 -1.099 19685 4987 1 10 . 1 1 409 409 ILE CA C 409 59.000 59.000 62.169 -3.169 19685 4988 1 10 . 1 1 409 409 ILE CB C 409 40.400 40.400 37.434 2.966 19685 4989 1 10 . 1 1 409 409 ILE H H 409 8.380 8.380 7.635 0.745 19685 4990 1 10 . 1 1 410 410 TYR N N 410 123.200 123.200 123.032 0.168 19685 4991 1 10 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.826 0.114 19685 4992 1 10 . 1 1 410 410 TYR C C 410 174.300 174.300 174.224 0.076 19685 4993 1 10 . 1 1 410 410 TYR CA C 410 56.200 56.200 57.723 -1.523 19685 4994 1 10 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.320 1.480 19685 4995 1 10 . 1 1 410 410 TYR H H 410 9.440 9.440 8.833 0.607 19685 4996 1 10 . 1 1 411 411 HIS N N 411 112.100 112.100 120.871 -8.771 19685 4997 1 10 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.534 -0.084 19685 4998 1 10 . 1 1 411 411 HIS C C 411 173.300 173.300 175.188 -1.888 19685 4999 1 10 . 1 1 411 411 HIS CA C 411 55.900 55.900 56.147 -0.247 19685 5000 1 10 . 1 1 411 411 HIS CB C 411 26.200 26.200 29.406 -3.206 19685 5001 1 10 . 1 1 411 411 HIS H H 411 8.580 8.580 8.158 0.422 19685 5002 1 10 . 1 1 412 412 LEU N N 412 115.100 115.100 118.007 -2.907 19685 5003 1 10 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.573 -0.613 19685 5004 1 10 . 1 1 412 412 LEU C C 412 175.100 175.100 174.966 0.134 19685 5005 1 10 . 1 1 412 412 LEU CA C 412 52.400 52.400 52.748 -0.348 19685 5006 1 10 . 1 1 412 412 LEU CB C 412 42.000 42.000 40.413 1.587 19685 5007 1 10 . 1 1 412 412 LEU H H 412 7.560 7.560 7.667 -0.107 19685 5008 1 10 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.413 -0.143 19685 5009 1 10 . 1 1 413 413 PRO C C 413 177.600 177.600 176.902 0.698 19685 5010 1 10 . 1 1 413 413 PRO CA C 413 62.300 62.300 63.447 -1.147 19685 5011 1 10 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.143 0.057 19685 5012 1 10 . 1 1 414 414 GLN N N 414 125.500 125.500 118.425 7.075 19685 5013 1 10 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.324 -0.244 19685 5014 1 10 . 1 1 414 414 GLN C C 414 175.400 175.400 176.309 -0.909 19685 5015 1 10 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.464 -0.464 19685 5016 1 10 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.948 -0.448 19685 5017 1 10 . 1 1 414 414 GLN H H 414 9.170 9.170 8.843 0.327 19685 5018 1 10 . 1 1 415 415 GLU N N 415 115.300 115.300 117.872 -2.572 19685 5019 1 10 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.551 -0.291 19685 5020 1 10 . 1 1 415 415 GLU C C 415 176.700 176.700 175.535 1.165 19685 5021 1 10 . 1 1 415 415 GLU CA C 415 58.700 58.700 56.170 2.530 19685 5022 1 10 . 1 1 415 415 GLU CB C 415 28.300 28.300 30.233 -1.933 19685 5023 1 10 . 1 1 415 415 GLU H H 415 9.390 9.390 8.344 1.046 19685 5024 1 10 . 1 1 416 416 PHE N N 416 121.700 121.700 118.315 3.385 19685 5025 1 10 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.160 -0.550 19685 5026 1 10 . 1 1 416 416 PHE C C 416 176.400 176.400 176.204 0.196 19685 5027 1 10 . 1 1 416 416 PHE CA C 416 57.400 57.400 56.669 0.731 19685 5028 1 10 . 1 1 416 416 PHE CB C 416 38.700 38.700 42.660 -3.960 19685 5029 1 10 . 1 1 416 416 PHE H H 416 7.610 7.610 7.598 0.012 19685 5030 1 10 . 1 1 417 417 GLY N N 417 113.000 113.000 107.290 5.710 19685 5031 1 10 . 1 1 417 417 GLY C C 417 174.300 174.300 172.882 1.418 19685 5032 1 10 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.122 -3.222 19685 5033 1 10 . 1 1 417 417 GLY H H 417 9.740 9.740 9.335 0.405 19685 5034 1 10 . 1 1 418 418 ASP N N 418 121.500 121.500 116.132 5.368 19685 5035 1 10 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.583 -0.643 19685 5036 1 10 . 1 1 418 418 ASP C C 418 177.900 177.900 176.373 1.527 19685 5037 1 10 . 1 1 418 418 ASP CA C 418 57.600 57.600 54.749 2.851 19685 5038 1 10 . 1 1 418 418 ASP CB C 418 39.700 39.700 40.615 -0.915 19685 5039 1 10 . 1 1 418 418 ASP H H 418 8.680 8.680 7.992 0.688 19685 5040 1 10 . 1 1 419 419 GLN N N 419 116.400 116.400 120.553 -4.153 19685 5041 1 10 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.260 -0.350 19685 5042 1 10 . 1 1 419 419 GLN C C 419 177.600 177.600 175.657 1.943 19685 5043 1 10 . 1 1 419 419 GLN CA C 419 58.000 58.000 57.842 0.159 19685 5044 1 10 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.523 -1.123 19685 5045 1 10 . 1 1 419 419 GLN H H 419 8.780 8.780 8.523 0.257 19685 5046 1 10 . 1 1 420 420 ASP N N 420 117.500 117.500 116.126 1.374 19685 5047 1 10 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.624 -0.614 19685 5048 1 10 . 1 1 420 420 ASP C C 420 178.000 178.000 177.762 0.238 19685 5049 1 10 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.849 2.851 19685 5050 1 10 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.159 -0.359 19685 5051 1 10 . 1 1 420 420 ASP H H 420 7.210 7.210 8.198 -0.988 19685 5052 1 10 . 1 1 421 421 ILE N N 421 117.000 117.000 121.170 -4.170 19685 5053 1 10 . 1 1 421 421 ILE HA H 421 4.080 4.080 4.233 -0.153 19685 5054 1 10 . 1 1 421 421 ILE C C 421 176.500 176.500 176.522 -0.022 19685 5055 1 10 . 1 1 421 421 ILE CA C 421 64.000 64.000 63.979 0.021 19685 5056 1 10 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.147 -0.847 19685 5057 1 10 . 1 1 421 421 ILE H H 421 7.610 7.610 7.890 -0.280 19685 5058 1 10 . 1 1 422 422 LEU N N 422 123.200 123.200 117.902 5.298 19685 5059 1 10 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.253 -0.493 19685 5060 1 10 . 1 1 422 422 LEU C C 422 177.800 177.800 176.753 1.047 19685 5061 1 10 . 1 1 422 422 LEU CA C 422 58.600 58.600 55.959 2.641 19685 5062 1 10 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.806 -0.606 19685 5063 1 10 . 1 1 422 422 LEU H H 422 7.870 7.870 7.960 -0.090 19685 5064 1 10 . 1 1 423 423 GLN N N 423 115.600 115.600 116.261 -0.661 19685 5065 1 10 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.493 -0.613 19685 5066 1 10 . 1 1 423 423 GLN C C 423 177.800 177.800 175.931 1.869 19685 5067 1 10 . 1 1 423 423 GLN CA C 423 58.600 58.600 56.084 2.516 19685 5068 1 10 . 1 1 423 423 GLN CB C 423 27.900 27.900 30.019 -2.119 19685 5069 1 10 . 1 1 423 423 GLN H H 423 7.860 7.860 7.873 -0.013 19685 5070 1 10 . 1 1 424 424 MET N N 424 115.500 115.500 118.661 -3.161 19685 5071 1 10 . 1 1 424 424 MET HA H 424 3.910 3.910 4.576 -0.666 19685 5072 1 10 . 1 1 424 424 MET C C 424 175.500 175.500 175.295 0.205 19685 5073 1 10 . 1 1 424 424 MET CA C 424 57.800 57.800 56.654 1.146 19685 5074 1 10 . 1 1 424 424 MET CB C 424 34.300 34.300 34.889 -0.589 19685 5075 1 10 . 1 1 424 424 MET H H 424 7.560 7.560 7.998 -0.438 19685 5076 1 10 . 1 1 425 425 PHE N N 425 112.300 112.300 116.906 -4.606 19685 5077 1 10 . 1 1 425 425 PHE HA H 425 4.700 4.700 5.069 -0.369 19685 5078 1 10 . 1 1 425 425 PHE C C 425 177.300 177.300 177.322 -0.022 19685 5079 1 10 . 1 1 425 425 PHE CA C 425 59.900 59.900 57.778 2.123 19685 5080 1 10 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.483 -1.982 19685 5081 1 10 . 1 1 425 425 PHE H H 425 7.680 7.680 7.808 -0.128 19685 5082 1 10 . 1 1 426 426 MET N N 426 127.400 127.400 120.088 7.312 19685 5083 1 10 . 1 1 426 426 MET HA H 426 4.630 4.630 4.368 0.262 19685 5084 1 10 . 1 1 426 426 MET C C 426 173.800 173.800 175.539 -1.739 19685 5085 1 10 . 1 1 426 426 MET CA C 426 59.100 59.100 60.145 -1.045 19685 5086 1 10 . 1 1 426 426 MET CB C 426 31.800 31.800 30.182 1.618 19685 5087 1 10 . 1 1 426 426 MET H H 426 8.540 8.540 8.451 0.089 19685 5088 1 10 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.248 -0.238 19685 5089 1 10 . 1 1 427 427 PRO C C 427 176.800 176.800 176.787 0.013 19685 5090 1 10 . 1 1 427 427 PRO CA C 427 65.200 65.200 64.119 1.081 19685 5091 1 10 . 1 1 427 427 PRO CB C 427 30.600 30.600 30.695 -0.095 19685 5092 1 10 . 1 1 428 428 PHE N N 428 110.000 110.000 118.263 -8.263 19685 5093 1 10 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.599 -0.329 19685 5094 1 10 . 1 1 428 428 PHE C C 428 174.600 174.600 176.154 -1.554 19685 5095 1 10 . 1 1 428 428 PHE CA C 428 57.700 57.700 58.943 -1.243 19685 5096 1 10 . 1 1 428 428 PHE CB C 428 38.000 38.000 39.697 -1.697 19685 5097 1 10 . 1 1 428 428 PHE H H 428 6.560 6.560 7.405 -0.845 19685 5098 1 10 . 1 1 429 429 GLY N N 429 105.500 105.500 102.082 3.418 19685 5099 1 10 . 1 1 429 429 GLY C C 429 170.100 170.100 172.863 -2.763 19685 5100 1 10 . 1 1 429 429 GLY CA C 429 44.400 44.400 44.072 0.328 19685 5101 1 10 . 1 1 429 429 GLY H H 429 7.650 7.650 7.314 0.336 19685 5102 1 10 . 1 1 430 430 ASN N N 430 117.400 117.400 116.574 0.826 19685 5103 1 10 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.372 0.258 19685 5104 1 10 . 1 1 430 430 ASN C C 430 173.200 173.200 175.151 -1.951 19685 5105 1 10 . 1 1 430 430 ASN CA C 430 52.600 52.600 54.467 -1.867 19685 5106 1 10 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.051 -1.851 19685 5107 1 10 . 1 1 430 430 ASN H H 430 9.020 9.020 7.555 1.465 19685 5108 1 10 . 1 1 431 431 VAL N N 431 128.000 128.000 119.181 8.819 19685 5109 1 10 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.347 -0.597 19685 5110 1 10 . 1 1 431 431 VAL C C 431 176.400 176.400 177.992 -1.592 19685 5111 1 10 . 1 1 431 431 VAL CA C 431 61.800 61.800 64.068 -2.268 19685 5112 1 10 . 1 1 431 431 VAL CB C 431 31.900 31.900 32.728 -0.828 19685 5113 1 10 . 1 1 431 431 VAL H H 431 8.480 8.480 8.763 -0.283 19685 5114 1 10 . 1 1 432 432 ILE N N 432 128.000 128.000 115.104 12.896 19685 5115 1 10 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.756 0.164 19685 5116 1 10 . 1 1 432 432 ILE C C 432 176.100 176.100 175.719 0.381 19685 5117 1 10 . 1 1 432 432 ILE CA C 432 62.500 62.500 63.879 -1.379 19685 5118 1 10 . 1 1 432 432 ILE CB C 432 37.400 37.400 36.885 0.515 19685 5119 1 10 . 1 1 432 432 ILE H H 432 8.840 8.840 8.507 0.333 19685 5120 1 10 . 1 1 433 433 SER N N 433 113.600 113.600 114.077 -0.477 19685 5121 1 10 . 1 1 433 433 SER HA H 433 4.440 4.440 4.675 -0.235 19685 5122 1 10 . 1 1 433 433 SER C C 433 171.000 171.000 172.143 -1.143 19685 5123 1 10 . 1 1 433 433 SER CA C 433 57.300 57.300 58.063 -0.763 19685 5124 1 10 . 1 1 433 433 SER CB C 433 65.200 65.200 66.734 -1.534 19685 5125 1 10 . 1 1 433 433 SER H H 433 7.280 7.280 8.149 -0.869 19685 5126 1 10 . 1 1 434 434 ALA N N 434 125.700 125.700 124.232 1.468 19685 5127 1 10 . 1 1 434 434 ALA HA H 434 4.910 4.910 5.215 -0.305 19685 5128 1 10 . 1 1 434 434 ALA C C 434 174.600 174.600 175.156 -0.556 19685 5129 1 10 . 1 1 434 434 ALA CA C 434 51.000 51.000 51.043 -0.043 19685 5130 1 10 . 1 1 434 434 ALA CB C 434 21.200 21.200 22.895 -1.695 19685 5131 1 10 . 1 1 434 434 ALA H H 434 8.270 8.270 8.434 -0.164 19685 5132 1 10 . 1 1 435 435 LYS N N 435 120.900 120.900 120.896 0.004 19685 5133 1 10 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.618 -0.148 19685 5134 1 10 . 1 1 435 435 LYS C C 435 173.800 173.800 174.303 -0.503 19685 5135 1 10 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.097 -1.397 19685 5136 1 10 . 1 1 435 435 LYS CB C 435 36.400 36.400 35.822 0.578 19685 5137 1 10 . 1 1 435 435 LYS H H 435 8.490 8.490 8.296 0.194 19685 5138 1 10 . 1 1 436 436 VAL N N 436 122.200 122.200 121.185 1.015 19685 5139 1 10 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.182 -0.262 19685 5140 1 10 . 1 1 436 436 VAL C C 436 175.100 175.100 174.431 0.669 19685 5141 1 10 . 1 1 436 436 VAL CA C 436 63.600 63.600 61.171 2.429 19685 5142 1 10 . 1 1 436 436 VAL CB C 436 33.500 33.500 31.745 1.755 19685 5143 1 10 . 1 1 436 436 VAL H H 436 8.390 8.390 8.261 0.129 19685 5144 1 10 . 1 1 437 437 PHE N N 437 125.900 125.900 117.620 8.280 19685 5145 1 10 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.019 0.381 19685 5146 1 10 . 1 1 437 437 PHE C C 437 173.600 173.600 175.647 -2.047 19685 5147 1 10 . 1 1 437 437 PHE CA C 437 57.700 57.700 57.657 0.043 19685 5148 1 10 . 1 1 437 437 PHE CB C 437 39.000 39.000 37.870 1.130 19685 5149 1 10 . 1 1 437 437 PHE H H 437 8.250 8.250 7.418 0.832 19685 5150 1 10 . 1 1 438 438 ILE N N 438 121.900 121.900 114.731 7.169 19685 5151 1 10 . 1 1 438 438 ILE HA H 438 4.460 4.460 3.598 0.862 19685 5152 1 10 . 1 1 438 438 ILE C C 438 175.700 175.700 175.565 0.135 19685 5153 1 10 . 1 1 438 438 ILE CA C 438 58.300 58.300 62.608 -4.308 19685 5154 1 10 . 1 1 438 438 ILE CB C 438 39.700 39.700 36.477 3.223 19685 5155 1 10 . 1 1 438 438 ILE H H 438 8.520 8.520 8.887 -0.367 19685 5156 1 10 . 1 1 439 439 ASP N N 439 126.500 126.500 119.808 6.692 19685 5157 1 10 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.075 0.505 19685 5158 1 10 . 1 1 439 439 ASP C C 439 176.300 176.300 176.284 0.016 19685 5159 1 10 . 1 1 439 439 ASP CA C 439 53.600 53.600 55.308 -1.708 19685 5160 1 10 . 1 1 439 439 ASP CB C 439 42.300 42.300 39.633 2.667 19685 5161 1 10 . 1 1 439 439 ASP H H 439 8.730 8.730 8.423 0.307 19685 5162 1 10 . 1 1 440 440 LYS N N 440 127.300 127.300 117.031 10.269 19685 5163 1 10 . 1 1 440 440 LYS HA H 440 4.070 4.070 3.693 0.377 19685 5164 1 10 . 1 1 440 440 LYS C C 440 176.900 176.900 176.198 0.702 19685 5165 1 10 . 1 1 440 440 LYS CA C 440 57.800 57.800 59.058 -1.258 19685 5166 1 10 . 1 1 440 440 LYS CB C 440 32.100 32.100 30.894 1.206 19685 5167 1 10 . 1 1 440 440 LYS H H 440 8.930 8.930 8.024 0.906 19685 5168 1 10 . 1 1 441 441 GLN N N 441 117.400 117.400 115.391 2.009 19685 5169 1 10 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.464 -0.234 19685 5170 1 10 . 1 1 441 441 GLN C C 441 177.200 177.200 176.030 1.170 19685 5171 1 10 . 1 1 441 441 GLN CA C 441 57.600 57.600 55.835 1.765 19685 5172 1 10 . 1 1 441 441 GLN CB C 441 28.800 28.800 29.217 -0.417 19685 5173 1 10 . 1 1 441 441 GLN H H 441 8.650 8.650 8.051 0.599 19685 5174 1 10 . 1 1 442 442 THR N N 442 107.300 107.300 115.584 -8.284 19685 5175 1 10 . 1 1 442 442 THR HA H 442 4.290 4.290 4.274 0.016 19685 5176 1 10 . 1 1 442 442 THR C C 442 175.100 175.100 174.662 0.438 19685 5177 1 10 . 1 1 442 442 THR CA C 442 61.200 61.200 61.024 0.176 19685 5178 1 10 . 1 1 442 442 THR CB C 442 70.300 70.300 69.685 0.615 19685 5179 1 10 . 1 1 442 442 THR H H 442 7.830 7.830 8.166 -0.336 19685 5180 1 10 . 1 1 443 443 ASN N N 443 117.300 117.300 118.303 -1.003 19685 5181 1 10 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.844 -0.544 19685 5182 1 10 . 1 1 443 443 ASN C C 443 173.400 173.400 174.581 -1.181 19685 5183 1 10 . 1 1 443 443 ASN CA C 443 54.300 54.300 52.267 2.033 19685 5184 1 10 . 1 1 443 443 ASN CB C 443 37.600 37.600 37.863 -0.263 19685 5185 1 10 . 1 1 443 443 ASN H H 443 8.470 8.470 8.417 0.053 19685 5186 1 10 . 1 1 444 444 LEU N N 444 118.000 118.000 119.491 -1.491 19685 5187 1 10 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.513 0.047 19685 5188 1 10 . 1 1 444 444 LEU C C 444 176.700 176.700 177.484 -0.784 19685 5189 1 10 . 1 1 444 444 LEU CA C 444 53.300 53.300 53.822 -0.522 19685 5190 1 10 . 1 1 444 444 LEU CB C 444 43.500 43.500 43.179 0.320 19685 5191 1 10 . 1 1 444 444 LEU H H 444 7.660 7.660 7.436 0.224 19685 5192 1 10 . 1 1 445 445 SER N N 445 115.500 115.500 114.887 0.613 19685 5193 1 10 . 1 1 445 445 SER HA H 445 4.460 4.460 4.158 0.302 19685 5194 1 10 . 1 1 445 445 SER C C 445 176.500 176.500 173.412 3.088 19685 5195 1 10 . 1 1 445 445 SER CA C 445 57.900 57.900 58.675 -0.775 19685 5196 1 10 . 1 1 445 445 SER CB C 445 63.500 63.500 63.673 -0.173 19685 5197 1 10 . 1 1 445 445 SER H H 445 8.840 8.840 8.130 0.710 19685 5198 1 10 . 1 1 446 446 LYS N N 446 125.200 125.200 122.483 2.717 19685 5199 1 10 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.345 0.155 19685 5200 1 10 . 1 1 446 446 LYS C C 446 176.100 176.100 176.805 -0.705 19685 5201 1 10 . 1 1 446 446 LYS CA C 446 56.300 56.300 55.133 1.167 19685 5202 1 10 . 1 1 446 446 LYS CB C 446 32.200 32.200 34.685 -2.485 19685 5203 1 10 . 1 1 446 446 LYS H H 446 9.230 9.230 8.398 0.832 19685 5204 1 10 . 1 1 447 447 CYS N N 447 113.000 113.000 116.681 -3.681 19685 5205 1 10 . 1 1 447 447 CYS C C 447 172.500 172.500 172.670 -0.170 19685 5206 1 10 . 1 1 447 447 CYS CA C 447 60.400 60.400 59.797 0.603 19685 5207 1 10 . 1 1 447 447 CYS CB C 447 24.900 24.900 27.095 -2.195 19685 5208 1 10 . 1 1 447 447 CYS H H 447 10.020 10.020 8.126 1.894 19685 5209 1 10 . 1 1 448 448 PHE N N 448 115.200 115.200 113.205 1.995 19685 5210 1 10 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.715 0.625 19685 5211 1 10 . 1 1 448 448 PHE C C 448 172.400 172.400 173.285 -0.885 19685 5212 1 10 . 1 1 448 448 PHE CA C 448 54.700 54.700 55.736 -1.036 19685 5213 1 10 . 1 1 448 448 PHE CB C 448 42.000 42.000 40.144 1.856 19685 5214 1 10 . 1 1 448 448 PHE H H 448 7.810 7.810 6.900 0.910 19685 5215 1 10 . 1 1 449 449 GLY N N 449 107.700 107.700 107.031 0.669 19685 5216 1 10 . 1 1 449 449 GLY C C 449 170.100 170.100 172.304 -2.204 19685 5217 1 10 . 1 1 449 449 GLY CA C 449 45.200 45.200 43.916 1.284 19685 5218 1 10 . 1 1 449 449 GLY H H 449 9.310 9.310 8.243 1.067 19685 5219 1 10 . 1 1 450 450 PHE N N 450 119.900 119.900 111.751 8.149 19685 5220 1 10 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.065 0.365 19685 5221 1 10 . 1 1 450 450 PHE C C 450 172.800 172.800 172.859 -0.059 19685 5222 1 10 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.909 -1.909 19685 5223 1 10 . 1 1 450 450 PHE CB C 450 43.600 43.600 40.586 3.014 19685 5224 1 10 . 1 1 450 450 PHE H H 450 8.760 8.760 7.933 0.827 19685 5225 1 10 . 1 1 451 451 VAL N N 451 123.800 123.800 119.791 4.009 19685 5226 1 10 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.801 -0.511 19685 5227 1 10 . 1 1 451 451 VAL C C 451 172.400 172.400 175.464 -3.064 19685 5228 1 10 . 1 1 451 451 VAL CA C 451 59.800 59.800 60.456 -0.656 19685 5229 1 10 . 1 1 451 451 VAL CB C 451 36.100 36.100 35.096 1.004 19685 5230 1 10 . 1 1 451 451 VAL H H 451 7.930 7.930 8.430 -0.500 19685 5231 1 10 . 1 1 452 452 SER N N 452 119.600 119.600 127.077 -7.477 19685 5232 1 10 . 1 1 452 452 SER HA H 452 5.120 5.120 4.877 0.243 19685 5233 1 10 . 1 1 452 452 SER C C 452 173.200 173.200 173.924 -0.724 19685 5234 1 10 . 1 1 452 452 SER CA C 452 55.700 55.700 58.124 -2.424 19685 5235 1 10 . 1 1 452 452 SER CB C 452 66.100 66.100 62.107 3.993 19685 5236 1 10 . 1 1 452 452 SER H H 452 8.540 8.540 8.862 -0.322 19685 5237 1 10 . 1 1 453 453 TYR N N 453 121.400 121.400 122.905 -1.505 19685 5238 1 10 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.623 0.757 19685 5239 1 10 . 1 1 453 453 TYR C C 453 173.600 173.600 177.318 -3.718 19685 5240 1 10 . 1 1 453 453 TYR CA C 453 56.500 56.500 58.687 -2.187 19685 5241 1 10 . 1 1 453 453 TYR CB C 453 42.200 42.200 38.549 3.651 19685 5242 1 10 . 1 1 453 453 TYR H H 453 8.380 8.380 8.035 0.345 19685 5243 1 10 . 1 1 454 454 ASP N N 454 113.300 113.300 122.361 -9.061 19685 5244 1 10 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.396 0.094 19685 5245 1 10 . 1 1 454 454 ASP C C 454 176.100 176.100 175.557 0.543 19685 5246 1 10 . 1 1 454 454 ASP CA C 454 52.800 52.800 56.348 -3.548 19685 5247 1 10 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.613 -1.213 19685 5248 1 10 . 1 1 454 454 ASP H H 454 7.860 7.860 8.743 -0.883 19685 5249 1 10 . 1 1 455 455 ASN N N 455 113.800 113.800 111.658 2.142 19685 5250 1 10 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.009 0.041 19685 5251 1 10 . 1 1 455 455 ASN C C 455 173.100 173.100 173.803 -0.703 19685 5252 1 10 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.839 -1.139 19685 5253 1 10 . 1 1 455 455 ASN CB C 455 41.100 41.100 39.561 1.539 19685 5254 1 10 . 1 1 455 455 ASN H H 455 7.200 7.200 7.798 -0.598 19685 5255 1 10 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.469 -0.299 19685 5256 1 10 . 1 1 456 456 PRO C C 456 177.300 177.300 177.157 0.143 19685 5257 1 10 . 1 1 456 456 PRO CA C 456 64.200 64.200 65.206 -1.006 19685 5258 1 10 . 1 1 456 456 PRO CB C 456 32.300 32.300 32.231 0.069 19685 5259 1 10 . 1 1 457 457 VAL N N 457 120.900 120.900 117.362 3.538 19685 5260 1 10 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.112 -0.492 19685 5261 1 10 . 1 1 457 457 VAL C C 457 179.000 179.000 176.946 2.054 19685 5262 1 10 . 1 1 457 457 VAL CA C 457 65.900 65.900 64.142 1.758 19685 5263 1 10 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.169 -0.369 19685 5264 1 10 . 1 1 457 457 VAL H H 457 8.120 8.120 7.978 0.142 19685 5265 1 10 . 1 1 458 458 SER N N 458 117.800 117.800 115.208 2.592 19685 5266 1 10 . 1 1 458 458 SER HA H 458 3.940 3.940 4.648 -0.708 19685 5267 1 10 . 1 1 458 458 SER C C 458 173.600 173.600 174.666 -1.066 19685 5268 1 10 . 1 1 458 458 SER CA C 458 61.100 61.100 60.000 1.100 19685 5269 1 10 . 1 1 458 458 SER CB C 458 62.400 62.400 64.718 -2.318 19685 5270 1 10 . 1 1 458 458 SER H H 458 7.830 7.830 7.648 0.182 19685 5271 1 10 . 1 1 459 459 ALA N N 459 120.000 120.000 124.062 -4.062 19685 5272 1 10 . 1 1 459 459 ALA HA H 459 3.750 3.750 4.461 -0.711 19685 5273 1 10 . 1 1 459 459 ALA C C 459 178.100 178.100 178.051 0.049 19685 5274 1 10 . 1 1 459 459 ALA CA C 459 54.500 54.500 53.564 0.936 19685 5275 1 10 . 1 1 459 459 ALA CB C 459 17.900 17.900 19.070 -1.170 19685 5276 1 10 . 1 1 459 459 ALA H H 459 6.370 6.370 7.892 -1.522 19685 5277 1 10 . 1 1 460 460 GLN N N 460 116.100 116.100 118.852 -2.752 19685 5278 1 10 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.010 -0.180 19685 5279 1 10 . 1 1 460 460 GLN C C 460 178.000 178.000 177.011 0.989 19685 5280 1 10 . 1 1 460 460 GLN CA C 460 58.500 58.500 58.329 0.171 19685 5281 1 10 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.546 -1.145 19685 5282 1 10 . 1 1 460 460 GLN H H 460 7.710 7.710 8.400 -0.690 19685 5283 1 10 . 1 1 461 461 ALA N N 461 122.800 122.800 119.741 3.059 19685 5284 1 10 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.252 -0.292 19685 5285 1 10 . 1 1 461 461 ALA C C 461 179.500 179.500 177.388 2.112 19685 5286 1 10 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.907 1.593 19685 5287 1 10 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.151 -1.651 19685 5288 1 10 . 1 1 461 461 ALA H H 461 7.880 7.880 7.707 0.173 19685 5289 1 10 . 1 1 462 462 ALA N N 462 121.400 121.400 120.054 1.346 19685 5290 1 10 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.508 -1.108 19685 5291 1 10 . 1 1 462 462 ALA C C 462 179.400 179.400 178.262 1.138 19685 5292 1 10 . 1 1 462 462 ALA CA C 462 54.100 54.100 53.303 0.797 19685 5293 1 10 . 1 1 462 462 ALA CB C 462 18.700 18.700 19.732 -1.032 19685 5294 1 10 . 1 1 462 462 ALA H H 462 7.860 7.860 7.560 0.300 19685 5295 1 10 . 1 1 463 463 ILE N N 463 118.600 118.600 117.662 0.938 19685 5296 1 10 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.847 -0.607 19685 5297 1 10 . 1 1 463 463 ILE C C 463 177.500 177.500 176.091 1.409 19685 5298 1 10 . 1 1 463 463 ILE CA C 463 66.000 66.000 62.488 3.512 19685 5299 1 10 . 1 1 463 463 ILE CB C 463 38.300 38.300 37.913 0.387 19685 5300 1 10 . 1 1 463 463 ILE H H 463 8.090 8.090 7.729 0.361 19685 5301 1 10 . 1 1 464 464 GLN N N 464 117.000 117.000 116.711 0.289 19685 5302 1 10 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.412 -0.542 19685 5303 1 10 . 1 1 464 464 GLN C C 464 177.700 177.700 175.002 2.698 19685 5304 1 10 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.952 2.248 19685 5305 1 10 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.535 -1.635 19685 5306 1 10 . 1 1 464 464 GLN H H 464 7.780 7.780 7.907 -0.127 19685 5307 1 10 . 1 1 465 465 ALA N N 465 117.200 117.200 121.005 -3.805 19685 5308 1 10 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.444 -0.214 19685 5309 1 10 . 1 1 465 465 ALA C C 465 179.200 179.200 176.724 2.476 19685 5310 1 10 . 1 1 465 465 ALA CA C 465 53.800 53.800 53.505 0.295 19685 5311 1 10 . 1 1 465 465 ALA CB C 465 21.100 21.100 20.566 0.534 19685 5312 1 10 . 1 1 465 465 ALA H H 465 7.540 7.540 7.635 -0.095 19685 5313 1 10 . 1 1 466 466 MET N N 466 110.800 110.800 116.366 -5.566 19685 5314 1 10 . 1 1 466 466 MET HA H 466 4.820 4.820 4.473 0.347 19685 5315 1 10 . 1 1 466 466 MET C C 466 177.600 177.600 175.727 1.873 19685 5316 1 10 . 1 1 466 466 MET CA C 466 53.300 53.300 54.944 -1.644 19685 5317 1 10 . 1 1 466 466 MET CB C 466 31.600 31.600 34.838 -3.238 19685 5318 1 10 . 1 1 466 466 MET H H 466 8.230 8.230 7.897 0.333 19685 5319 1 10 . 1 1 467 467 ASN N N 467 119.100 119.100 118.768 0.332 19685 5320 1 10 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.625 -0.135 19685 5321 1 10 . 1 1 467 467 ASN C C 467 176.300 176.300 177.001 -0.701 19685 5322 1 10 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.551 1.649 19685 5323 1 10 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.536 -0.336 19685 5324 1 10 . 1 1 467 467 ASN H H 467 8.560 8.560 7.484 1.076 19685 5325 1 10 . 1 1 468 468 GLY N N 468 117.900 117.900 113.377 4.523 19685 5326 1 10 . 1 1 468 468 GLY C C 468 172.800 172.800 174.146 -1.346 19685 5327 1 10 . 1 1 468 468 GLY CA C 468 45.300 45.300 46.136 -0.836 19685 5328 1 10 . 1 1 468 468 GLY H H 468 8.930 8.930 9.047 -0.117 19685 5329 1 10 . 1 1 469 469 PHE N N 469 123.300 123.300 119.954 3.346 19685 5330 1 10 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.500 -0.310 19685 5331 1 10 . 1 1 469 469 PHE C C 469 174.400 174.400 175.139 -0.739 19685 5332 1 10 . 1 1 469 469 PHE CA C 469 58.700 58.700 58.191 0.509 19685 5333 1 10 . 1 1 469 469 PHE CB C 469 40.600 40.600 40.730 -0.130 19685 5334 1 10 . 1 1 469 469 PHE H H 469 7.950 7.950 7.611 0.339 19685 5335 1 10 . 1 1 470 470 GLN N N 470 129.200 129.200 119.353 9.847 19685 5336 1 10 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.142 0.448 19685 5337 1 10 . 1 1 470 470 GLN C C 470 174.100 174.100 174.125 -0.025 19685 5338 1 10 . 1 1 470 470 GLN CA C 470 55.500 55.500 56.871 -1.371 19685 5339 1 10 . 1 1 470 470 GLN CB C 470 28.800 28.800 27.892 0.907 19685 5340 1 10 . 1 1 470 470 GLN H H 470 8.330 8.330 8.206 0.124 19685 5341 1 10 . 1 1 471 471 ILE N N 471 126.300 126.300 123.453 2.847 19685 5342 1 10 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.382 -0.212 19685 5343 1 10 . 1 1 471 471 ILE C C 471 175.400 175.400 175.688 -0.288 19685 5344 1 10 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.389 -0.789 19685 5345 1 10 . 1 1 471 471 ILE CB C 471 39.100 39.100 40.654 -1.554 19685 5346 1 10 . 1 1 471 471 ILE H H 471 8.440 8.440 8.295 0.145 19685 5347 1 10 . 1 1 472 472 GLY N N 472 117.500 117.500 115.159 2.341 19685 5348 1 10 . 1 1 472 472 GLY C C 472 174.700 174.700 175.104 -0.404 19685 5349 1 10 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.298 1.202 19685 5350 1 10 . 1 1 472 472 GLY H H 472 8.980 8.980 8.558 0.422 19685 5351 1 10 . 1 1 473 473 MET N N 473 124.100 124.100 112.397 11.703 19685 5352 1 10 . 1 1 473 473 MET HA H 473 4.380 4.380 4.159 0.221 19685 5353 1 10 . 1 1 473 473 MET C C 473 175.700 175.700 174.754 0.946 19685 5354 1 10 . 1 1 473 473 MET CA C 473 55.000 55.000 57.030 -2.030 19685 5355 1 10 . 1 1 473 473 MET CB C 473 32.900 32.900 30.633 2.267 19685 5356 1 10 . 1 1 473 473 MET H H 473 9.070 9.070 8.620 0.450 19685 5357 1 10 . 1 1 474 474 LYS N N 474 118.700 118.700 116.311 2.389 19685 5358 1 10 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.718 -0.238 19685 5359 1 10 . 1 1 474 474 LYS C C 474 174.300 174.300 175.160 -0.860 19685 5360 1 10 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.225 0.375 19685 5361 1 10 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.280 -0.180 19685 5362 1 10 . 1 1 474 474 LYS H H 474 7.770 7.770 7.415 0.355 19685 5363 1 10 . 1 1 475 475 ARG N N 475 119.600 119.600 120.330 -0.730 19685 5364 1 10 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.273 0.527 19685 5365 1 10 . 1 1 475 475 ARG C C 475 175.700 175.700 174.835 0.865 19685 5366 1 10 . 1 1 475 475 ARG CA C 475 54.000 54.000 56.581 -2.581 19685 5367 1 10 . 1 1 475 475 ARG CB C 475 31.300 31.300 30.326 0.974 19685 5368 1 10 . 1 1 475 475 ARG H H 475 8.350 8.350 8.723 -0.373 19685 5369 1 10 . 1 1 476 476 LEU N N 476 123.500 123.500 123.440 0.060 19685 5370 1 10 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.593 -0.163 19685 5371 1 10 . 1 1 476 476 LEU C C 476 177.600 177.600 175.169 2.431 19685 5372 1 10 . 1 1 476 476 LEU CA C 476 55.500 55.500 53.491 2.009 19685 5373 1 10 . 1 1 476 476 LEU CB C 476 42.800 42.800 43.735 -0.935 19685 5374 1 10 . 1 1 476 476 LEU H H 476 9.130 9.130 8.433 0.697 19685 5375 1 10 . 1 1 477 477 LYS N N 477 123.200 123.200 126.941 -3.741 19685 5376 1 10 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.643 0.517 19685 5377 1 10 . 1 1 477 477 LYS C C 477 174.100 174.100 174.481 -0.381 19685 5378 1 10 . 1 1 477 477 LYS CA C 477 54.500 54.500 54.683 -0.183 19685 5379 1 10 . 1 1 477 477 LYS CB C 477 34.900 34.900 34.789 0.111 19685 5380 1 10 . 1 1 477 477 LYS H H 477 8.090 8.090 8.551 -0.461 19685 5381 1 10 . 1 1 478 478 VAL N N 478 127.100 127.100 122.166 4.934 19685 5382 1 10 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.462 0.438 19685 5383 1 10 . 1 1 478 478 VAL C C 478 173.700 173.700 173.733 -0.033 19685 5384 1 10 . 1 1 478 478 VAL CA C 478 61.000 61.000 60.450 0.550 19685 5385 1 10 . 1 1 478 478 VAL CB C 478 33.700 33.700 34.348 -0.648 19685 5386 1 10 . 1 1 478 478 VAL H H 478 8.820 8.820 8.482 0.338 19685 5387 1 10 . 1 1 479 479 GLN N N 479 123.600 123.600 120.400 3.200 19685 5388 1 10 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.786 0.024 19685 5389 1 10 . 1 1 479 479 GLN C C 479 173.600 173.600 173.710 -0.110 19685 5390 1 10 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.413 -1.214 19685 5391 1 10 . 1 1 479 479 GLN CB C 479 33.500 33.500 33.051 0.449 19685 5392 1 10 . 1 1 479 479 GLN H H 479 9.130 9.130 8.462 0.668 19685 5393 1 10 . 1 1 480 480 LEU N N 480 123.200 123.200 114.933 8.267 19685 5394 1 10 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.913 -0.473 19685 5395 1 10 . 1 1 480 480 LEU C C 480 177.100 177.100 176.680 0.420 19685 5396 1 10 . 1 1 480 480 LEU CA C 480 54.600 54.600 53.549 1.051 19685 5397 1 10 . 1 1 480 480 LEU CB C 480 42.400 42.400 45.573 -3.173 19685 5398 1 10 . 1 1 480 480 LEU H H 480 8.840 8.840 8.182 0.658 19685 5399 1 10 . 1 1 481 481 LYS N N 481 124.500 124.500 120.275 4.225 19685 5400 1 10 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.004 0.306 19685 5401 1 10 . 1 1 481 481 LYS C C 481 175.200 175.200 177.154 -1.954 19685 5402 1 10 . 1 1 481 481 LYS CA C 481 56.700 56.700 58.599 -1.899 19685 5403 1 10 . 1 1 481 481 LYS CB C 481 33.100 33.100 31.390 1.710 19685 5404 1 10 . 1 1 481 481 LYS H H 481 8.400 8.400 8.436 -0.036 19685 5405 1 10 . 1 1 482 482 ARG N N 482 126.600 126.600 117.728 8.872 19685 5406 1 10 . 1 1 482 482 ARG HA H 482 4.350 4.350 3.886 0.464 19685 5407 1 10 . 1 1 482 482 ARG C C 482 175.800 175.800 174.811 0.989 19685 5408 1 10 . 1 1 482 482 ARG CA C 482 55.600 55.600 57.118 -1.518 19685 5409 1 10 . 1 1 482 482 ARG CB C 482 31.100 31.100 29.420 1.680 19685 5410 1 10 . 1 1 482 482 ARG H H 482 8.770 8.770 8.267 0.503 19685 5411 1 10 . 1 1 483 483 SER N N 483 118.100 118.100 116.450 1.650 19685 5412 1 10 . 1 1 483 483 SER HA H 483 4.400 4.400 4.388 0.012 19685 5413 1 10 . 1 1 483 483 SER C C 483 174.200 174.200 174.391 -0.191 19685 5414 1 10 . 1 1 483 483 SER CA C 483 58.000 58.000 58.182 -0.182 19685 5415 1 10 . 1 1 483 483 SER CB C 483 63.500 63.500 63.427 0.073 19685 5416 1 10 . 1 1 483 483 SER H H 483 8.610 8.610 8.142 0.468 19685 5417 1 10 . 1 1 484 484 LYS N N 484 123.000 123.000 121.224 1.776 19685 5418 1 10 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.455 -0.245 19685 5419 1 10 . 1 1 484 484 LYS C C 484 175.900 175.900 175.753 0.147 19685 5420 1 10 . 1 1 484 484 LYS CA C 484 56.300 56.300 55.567 0.733 19685 5421 1 10 . 1 1 484 484 LYS CB C 484 32.500 32.500 32.730 -0.230 19685 5422 1 10 . 1 1 484 484 LYS H H 484 8.560 8.560 8.555 0.005 19685 5423 1 10 . 1 1 485 485 ASN N N 485 119.600 119.600 118.892 0.708 19685 5424 1 10 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.761 -0.161 19685 5425 1 10 . 1 1 485 485 ASN C C 485 174.400 174.400 175.647 -1.247 19685 5426 1 10 . 1 1 485 485 ASN CA C 485 52.900 52.900 53.091 -0.191 19685 5427 1 10 . 1 1 485 485 ASN CB C 485 38.400 38.400 38.985 -0.585 19685 5428 1 10 . 1 1 485 485 ASN H H 485 8.560 8.560 7.803 0.757 19685 5429 1 10 . 1 1 486 486 ASP N N 486 121.100 121.100 119.815 1.285 19685 5430 1 10 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.681 -0.161 19685 5431 1 10 . 1 1 486 486 ASP C C 486 175.700 175.700 175.900 -0.200 19685 5432 1 10 . 1 1 486 486 ASP CA C 486 54.000 54.000 54.531 -0.531 19685 5433 1 10 . 1 1 486 486 ASP CB C 486 40.800 40.800 41.055 -0.255 19685 5434 1 10 . 1 1 486 486 ASP H H 486 8.250 8.250 8.702 -0.452 19685 5435 1 10 . 1 1 487 487 SER N N 487 115.400 115.400 114.349 1.051 19685 5436 1 10 . 1 1 487 487 SER HA H 487 4.310 4.310 4.286 0.024 19685 5437 1 10 . 1 1 487 487 SER C C 487 172.800 172.800 173.426 -0.626 19685 5438 1 10 . 1 1 487 487 SER CA C 487 57.700 57.700 59.023 -1.323 19685 5439 1 10 . 1 1 487 487 SER CB C 487 63.600 63.600 63.737 -0.137 19685 5440 1 10 . 1 1 487 487 SER H H 487 8.090 8.090 7.747 0.343 19685 5441 1 10 . 1 1 488 488 LYS N N 488 122.300 122.300 121.256 1.044 19685 5442 1 10 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.744 -0.694 19685 5443 1 10 . 1 1 488 488 LYS C C 488 174.500 174.500 173.928 0.572 19685 5444 1 10 . 1 1 488 488 LYS CA C 488 54.000 54.000 54.065 -0.065 19685 5445 1 10 . 1 1 488 488 LYS CB C 488 32.400 32.400 33.497 -1.097 19685 5446 1 10 . 1 1 488 488 LYS H H 488 8.090 8.090 8.427 -0.337 19685 5447 1 10 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.527 -0.247 19685 5448 1 10 . 1 1 489 489 PRO C C 489 175.000 175.000 175.564 -0.564 19685 5449 1 10 . 1 1 489 489 PRO CA C 489 63.200 63.200 63.242 -0.042 19685 5450 1 10 . 1 1 489 489 PRO CB C 489 31.100 31.100 31.949 -0.849 19685 5451 1 11 . 1 1 395 395 SER N N 395 115.500 115.500 117.713 -2.213 19685 5452 1 11 . 1 1 395 395 SER HA H 395 4.300 4.300 4.201 0.099 19685 5453 1 11 . 1 1 395 395 SER C C 395 173.900 173.900 173.684 0.216 19685 5454 1 11 . 1 1 395 395 SER CA C 395 57.900 57.900 57.922 -0.022 19685 5455 1 11 . 1 1 395 395 SER CB C 395 63.400 63.400 63.491 -0.091 19685 5456 1 11 . 1 1 395 395 SER H H 395 8.200 8.200 8.233 -0.033 19685 5457 1 11 . 1 1 396 396 HIS N N 396 123.500 123.500 120.594 2.906 19685 5458 1 11 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.789 -0.229 19685 5459 1 11 . 1 1 396 396 HIS C C 396 174.100 174.100 175.488 -1.388 19685 5460 1 11 . 1 1 396 396 HIS CA C 396 53.700 53.700 54.830 -1.130 19685 5461 1 11 . 1 1 396 396 HIS CB C 396 32.200 32.200 31.117 1.083 19685 5462 1 11 . 1 1 396 396 HIS H H 396 8.120 8.120 8.334 -0.213 19685 5463 1 11 . 1 1 397 397 MET N N 397 121.200 121.200 119.825 1.375 19685 5464 1 11 . 1 1 397 397 MET HA H 397 4.320 4.320 4.356 -0.036 19685 5465 1 11 . 1 1 397 397 MET C C 397 175.400 175.400 175.813 -0.413 19685 5466 1 11 . 1 1 397 397 MET CA C 397 55.000 55.000 57.260 -2.260 19685 5467 1 11 . 1 1 397 397 MET CB C 397 32.500 32.500 32.968 -0.468 19685 5468 1 11 . 1 1 397 397 MET H H 397 8.300 8.300 8.646 -0.346 19685 5469 1 11 . 1 1 398 398 GLN N N 398 122.100 122.100 118.358 3.742 19685 5470 1 11 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.413 -0.223 19685 5471 1 11 . 1 1 398 398 GLN C C 398 174.800 174.800 174.176 0.624 19685 5472 1 11 . 1 1 398 398 GLN CA C 398 55.200 55.200 55.802 -0.602 19685 5473 1 11 . 1 1 398 398 GLN CB C 398 28.900 28.900 29.690 -0.790 19685 5474 1 11 . 1 1 398 398 GLN H H 398 8.540 8.540 8.121 0.419 19685 5475 1 11 . 1 1 399 399 LYS N N 399 123.000 123.000 121.750 1.250 19685 5476 1 11 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.589 -0.369 19685 5477 1 11 . 1 1 399 399 LYS C C 399 174.800 174.800 175.660 -0.860 19685 5478 1 11 . 1 1 399 399 LYS CA C 399 55.600 55.600 55.273 0.327 19685 5479 1 11 . 1 1 399 399 LYS CB C 399 33.000 33.000 35.155 -2.155 19685 5480 1 11 . 1 1 399 399 LYS H H 399 8.180 8.180 8.319 -0.139 19685 5481 1 11 . 1 1 400 400 GLU N N 400 122.000 122.000 116.028 5.972 19685 5482 1 11 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.186 0.244 19685 5483 1 11 . 1 1 400 400 GLU C C 400 176.400 176.400 175.972 0.428 19685 5484 1 11 . 1 1 400 400 GLU CA C 400 55.400 55.400 57.539 -2.139 19685 5485 1 11 . 1 1 400 400 GLU CB C 400 31.400 31.400 28.415 2.985 19685 5486 1 11 . 1 1 400 400 GLU H H 400 8.350 8.350 8.897 -0.547 19685 5487 1 11 . 1 1 401 401 GLY N N 401 109.500 109.500 107.210 2.290 19685 5488 1 11 . 1 1 401 401 GLY C C 401 171.500 171.500 172.275 -0.775 19685 5489 1 11 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.484 -0.784 19685 5490 1 11 . 1 1 401 401 GLY H H 401 9.050 9.050 7.960 1.090 19685 5491 1 11 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.490 -0.070 19685 5492 1 11 . 1 1 402 402 PRO C C 402 173.900 173.900 176.404 -2.504 19685 5493 1 11 . 1 1 402 402 PRO CA C 402 61.900 61.900 64.331 -2.431 19685 5494 1 11 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.648 -0.448 19685 5495 1 11 . 1 1 403 403 GLU N N 403 119.600 119.600 117.611 1.989 19685 5496 1 11 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.418 -0.458 19685 5497 1 11 . 1 1 403 403 GLU C C 403 177.300 177.300 175.683 1.617 19685 5498 1 11 . 1 1 403 403 GLU CA C 403 58.100 58.100 56.920 1.180 19685 5499 1 11 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.281 -1.281 19685 5500 1 11 . 1 1 403 403 GLU H H 403 8.420 8.420 8.323 0.097 19685 5501 1 11 . 1 1 404 404 GLY N N 404 112.800 112.800 106.702 6.098 19685 5502 1 11 . 1 1 404 404 GLY C C 404 173.300 173.300 173.591 -0.291 19685 5503 1 11 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.425 -0.525 19685 5504 1 11 . 1 1 404 404 GLY H H 404 8.500 8.500 8.324 0.176 19685 5505 1 11 . 1 1 405 405 ALA N N 405 120.000 120.000 124.570 -4.570 19685 5506 1 11 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.355 0.195 19685 5507 1 11 . 1 1 405 405 ALA C C 405 174.100 174.100 175.795 -1.695 19685 5508 1 11 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.916 -1.416 19685 5509 1 11 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.293 3.507 19685 5510 1 11 . 1 1 405 405 ALA H H 405 8.360 8.360 8.258 0.102 19685 5511 1 11 . 1 1 406 406 ASN N N 406 115.500 115.500 118.657 -3.157 19685 5512 1 11 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.541 -0.351 19685 5513 1 11 . 1 1 406 406 ASN C C 406 172.900 172.900 174.474 -1.574 19685 5514 1 11 . 1 1 406 406 ASN CA C 406 52.600 52.600 52.115 0.485 19685 5515 1 11 . 1 1 406 406 ASN CB C 406 40.900 40.900 38.753 2.147 19685 5516 1 11 . 1 1 406 406 ASN H H 406 7.690 7.690 8.037 -0.347 19685 5517 1 11 . 1 1 407 407 LEU N N 407 123.400 123.400 121.900 1.500 19685 5518 1 11 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.295 0.665 19685 5519 1 11 . 1 1 407 407 LEU C C 407 174.900 174.900 177.183 -2.283 19685 5520 1 11 . 1 1 407 407 LEU CA C 407 53.100 53.100 56.428 -3.328 19685 5521 1 11 . 1 1 407 407 LEU CB C 407 45.400 45.400 42.655 2.745 19685 5522 1 11 . 1 1 407 407 LEU H H 407 9.290 9.290 7.747 1.543 19685 5523 1 11 . 1 1 408 408 PHE N N 408 118.700 118.700 116.617 2.083 19685 5524 1 11 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.965 0.335 19685 5525 1 11 . 1 1 408 408 PHE C C 408 174.200 174.200 174.351 -0.151 19685 5526 1 11 . 1 1 408 408 PHE CA C 408 56.300 56.300 57.093 -0.793 19685 5527 1 11 . 1 1 408 408 PHE CB C 408 42.700 42.700 39.946 2.754 19685 5528 1 11 . 1 1 408 408 PHE H H 408 9.150 9.150 8.246 0.904 19685 5529 1 11 . 1 1 409 409 ILE N N 409 120.800 120.800 122.243 -1.443 19685 5530 1 11 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.135 0.835 19685 5531 1 11 . 1 1 409 409 ILE C C 409 173.900 173.900 174.970 -1.070 19685 5532 1 11 . 1 1 409 409 ILE CA C 409 59.000 59.000 61.972 -2.972 19685 5533 1 11 . 1 1 409 409 ILE CB C 409 40.400 40.400 37.255 3.145 19685 5534 1 11 . 1 1 409 409 ILE H H 409 8.380 8.380 8.015 0.365 19685 5535 1 11 . 1 1 410 410 TYR N N 410 123.200 123.200 124.256 -1.056 19685 5536 1 11 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.813 0.127 19685 5537 1 11 . 1 1 410 410 TYR C C 410 174.300 174.300 175.052 -0.752 19685 5538 1 11 . 1 1 410 410 TYR CA C 410 56.200 56.200 57.189 -0.989 19685 5539 1 11 . 1 1 410 410 TYR CB C 410 40.800 40.800 38.739 2.061 19685 5540 1 11 . 1 1 410 410 TYR H H 410 9.440 9.440 8.615 0.825 19685 5541 1 11 . 1 1 411 411 HIS N N 411 112.100 112.100 121.973 -9.873 19685 5542 1 11 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.388 0.062 19685 5543 1 11 . 1 1 411 411 HIS C C 411 173.300 173.300 174.601 -1.301 19685 5544 1 11 . 1 1 411 411 HIS CA C 411 55.900 55.900 55.620 0.280 19685 5545 1 11 . 1 1 411 411 HIS CB C 411 26.200 26.200 27.078 -0.878 19685 5546 1 11 . 1 1 411 411 HIS H H 411 8.580 8.580 8.191 0.389 19685 5547 1 11 . 1 1 412 412 LEU N N 412 115.100 115.100 123.873 -8.773 19685 5548 1 11 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.191 -0.231 19685 5549 1 11 . 1 1 412 412 LEU C C 412 175.100 175.100 175.676 -0.576 19685 5550 1 11 . 1 1 412 412 LEU CA C 412 52.400 52.400 54.314 -1.914 19685 5551 1 11 . 1 1 412 412 LEU CB C 412 42.000 42.000 42.511 -0.511 19685 5552 1 11 . 1 1 412 412 LEU H H 412 7.560 7.560 7.593 -0.033 19685 5553 1 11 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.386 -0.116 19685 5554 1 11 . 1 1 413 413 PRO C C 413 177.600 177.600 177.361 0.239 19685 5555 1 11 . 1 1 413 413 PRO CA C 413 62.300 62.300 63.287 -0.987 19685 5556 1 11 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.279 -0.079 19685 5557 1 11 . 1 1 414 414 GLN N N 414 125.500 125.500 118.250 7.250 19685 5558 1 11 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.298 -0.218 19685 5559 1 11 . 1 1 414 414 GLN C C 414 175.400 175.400 176.022 -0.622 19685 5560 1 11 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.578 -0.578 19685 5561 1 11 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.726 -0.226 19685 5562 1 11 . 1 1 414 414 GLN H H 414 9.170 9.170 8.683 0.487 19685 5563 1 11 . 1 1 415 415 GLU N N 415 115.300 115.300 118.920 -3.620 19685 5564 1 11 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.638 -0.378 19685 5565 1 11 . 1 1 415 415 GLU C C 415 176.700 176.700 174.910 1.790 19685 5566 1 11 . 1 1 415 415 GLU CA C 415 58.700 58.700 55.906 2.794 19685 5567 1 11 . 1 1 415 415 GLU CB C 415 28.300 28.300 30.742 -2.442 19685 5568 1 11 . 1 1 415 415 GLU H H 415 9.390 9.390 8.624 0.766 19685 5569 1 11 . 1 1 416 416 PHE N N 416 121.700 121.700 117.827 3.873 19685 5570 1 11 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.164 -0.554 19685 5571 1 11 . 1 1 416 416 PHE C C 416 176.400 176.400 175.374 1.026 19685 5572 1 11 . 1 1 416 416 PHE CA C 416 57.400 57.400 56.901 0.499 19685 5573 1 11 . 1 1 416 416 PHE CB C 416 38.700 38.700 43.068 -4.368 19685 5574 1 11 . 1 1 416 416 PHE H H 416 7.610 7.610 7.727 -0.117 19685 5575 1 11 . 1 1 417 417 GLY N N 417 113.000 113.000 107.733 5.267 19685 5576 1 11 . 1 1 417 417 GLY C C 417 174.300 174.300 173.392 0.908 19685 5577 1 11 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.346 -3.446 19685 5578 1 11 . 1 1 417 417 GLY H H 417 9.740 9.740 9.409 0.331 19685 5579 1 11 . 1 1 418 418 ASP N N 418 121.500 121.500 118.308 3.192 19685 5580 1 11 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.628 -0.688 19685 5581 1 11 . 1 1 418 418 ASP C C 418 177.900 177.900 176.318 1.582 19685 5582 1 11 . 1 1 418 418 ASP CA C 418 57.600 57.600 54.348 3.252 19685 5583 1 11 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.763 -2.063 19685 5584 1 11 . 1 1 418 418 ASP H H 418 8.680 8.680 8.298 0.382 19685 5585 1 11 . 1 1 419 419 GLN N N 419 116.400 116.400 120.707 -4.307 19685 5586 1 11 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.282 -0.372 19685 5587 1 11 . 1 1 419 419 GLN C C 419 177.600 177.600 175.739 1.861 19685 5588 1 11 . 1 1 419 419 GLN CA C 419 58.000 58.000 57.920 0.080 19685 5589 1 11 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.868 -1.468 19685 5590 1 11 . 1 1 419 419 GLN H H 419 8.780 8.780 8.389 0.391 19685 5591 1 11 . 1 1 420 420 ASP N N 420 117.500 117.500 115.323 2.177 19685 5592 1 11 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.641 -0.631 19685 5593 1 11 . 1 1 420 420 ASP C C 420 178.000 178.000 177.501 0.499 19685 5594 1 11 . 1 1 420 420 ASP CA C 420 56.700 56.700 54.612 2.088 19685 5595 1 11 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.234 -0.435 19685 5596 1 11 . 1 1 420 420 ASP H H 420 7.210 7.210 8.252 -1.042 19685 5597 1 11 . 1 1 421 421 ILE N N 421 117.000 117.000 121.115 -4.115 19685 5598 1 11 . 1 1 421 421 ILE HA H 421 4.080 4.080 4.184 -0.104 19685 5599 1 11 . 1 1 421 421 ILE C C 421 176.500 176.500 176.552 -0.052 19685 5600 1 11 . 1 1 421 421 ILE CA C 421 64.000 64.000 63.395 0.605 19685 5601 1 11 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.217 -0.917 19685 5602 1 11 . 1 1 421 421 ILE H H 421 7.610 7.610 7.784 -0.174 19685 5603 1 11 . 1 1 422 422 LEU N N 422 123.200 123.200 119.913 3.287 19685 5604 1 11 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.233 -0.473 19685 5605 1 11 . 1 1 422 422 LEU C C 422 177.800 177.800 177.044 0.756 19685 5606 1 11 . 1 1 422 422 LEU CA C 422 58.600 58.600 56.086 2.514 19685 5607 1 11 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.700 -0.500 19685 5608 1 11 . 1 1 422 422 LEU H H 422 7.870 7.870 8.049 -0.179 19685 5609 1 11 . 1 1 423 423 GLN N N 423 115.600 115.600 118.249 -2.649 19685 5610 1 11 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.441 -0.561 19685 5611 1 11 . 1 1 423 423 GLN C C 423 177.800 177.800 175.883 1.917 19685 5612 1 11 . 1 1 423 423 GLN CA C 423 58.600 58.600 56.010 2.590 19685 5613 1 11 . 1 1 423 423 GLN CB C 423 27.900 27.900 30.278 -2.378 19685 5614 1 11 . 1 1 423 423 GLN H H 423 7.860 7.860 7.996 -0.136 19685 5615 1 11 . 1 1 424 424 MET N N 424 115.500 115.500 118.229 -2.729 19685 5616 1 11 . 1 1 424 424 MET HA H 424 3.910 3.910 4.554 -0.644 19685 5617 1 11 . 1 1 424 424 MET C C 424 175.500 175.500 175.177 0.323 19685 5618 1 11 . 1 1 424 424 MET CA C 424 57.800 57.800 55.924 1.876 19685 5619 1 11 . 1 1 424 424 MET CB C 424 34.300 34.300 34.360 -0.060 19685 5620 1 11 . 1 1 424 424 MET H H 424 7.560 7.560 8.059 -0.499 19685 5621 1 11 . 1 1 425 425 PHE N N 425 112.300 112.300 117.052 -4.752 19685 5622 1 11 . 1 1 425 425 PHE HA H 425 4.700 4.700 4.792 -0.092 19685 5623 1 11 . 1 1 425 425 PHE C C 425 177.300 177.300 177.095 0.205 19685 5624 1 11 . 1 1 425 425 PHE CA C 425 59.900 59.900 59.178 0.723 19685 5625 1 11 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.864 -2.364 19685 5626 1 11 . 1 1 425 425 PHE H H 425 7.680 7.680 7.618 0.062 19685 5627 1 11 . 1 1 426 426 MET N N 426 127.400 127.400 117.381 10.019 19685 5628 1 11 . 1 1 426 426 MET HA H 426 4.630 4.630 4.044 0.586 19685 5629 1 11 . 1 1 426 426 MET C C 426 173.800 173.800 174.291 -0.491 19685 5630 1 11 . 1 1 426 426 MET CA C 426 59.100 59.100 59.121 -0.021 19685 5631 1 11 . 1 1 426 426 MET CB C 426 31.800 31.800 29.215 2.585 19685 5632 1 11 . 1 1 426 426 MET H H 426 8.540 8.540 8.873 -0.333 19685 5633 1 11 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.220 -0.210 19685 5634 1 11 . 1 1 427 427 PRO C C 427 176.800 176.800 178.172 -1.372 19685 5635 1 11 . 1 1 427 427 PRO CA C 427 65.200 65.200 64.689 0.511 19685 5636 1 11 . 1 1 427 427 PRO CB C 427 30.600 30.600 31.250 -0.650 19685 5637 1 11 . 1 1 428 428 PHE N N 428 110.000 110.000 118.583 -8.583 19685 5638 1 11 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.277 -0.007 19685 5639 1 11 . 1 1 428 428 PHE C C 428 174.600 174.600 175.710 -1.110 19685 5640 1 11 . 1 1 428 428 PHE CA C 428 57.700 57.700 60.067 -2.367 19685 5641 1 11 . 1 1 428 428 PHE CB C 428 38.000 38.000 39.177 -1.177 19685 5642 1 11 . 1 1 428 428 PHE H H 428 6.560 6.560 7.530 -0.970 19685 5643 1 11 . 1 1 429 429 GLY N N 429 105.500 105.500 101.559 3.941 19685 5644 1 11 . 1 1 429 429 GLY C C 429 170.100 170.100 172.514 -2.414 19685 5645 1 11 . 1 1 429 429 GLY CA C 429 44.400 44.400 44.261 0.139 19685 5646 1 11 . 1 1 429 429 GLY H H 429 7.650 7.650 6.986 0.664 19685 5647 1 11 . 1 1 430 430 ASN N N 430 117.400 117.400 116.933 0.467 19685 5648 1 11 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.305 0.325 19685 5649 1 11 . 1 1 430 430 ASN C C 430 173.200 173.200 172.747 0.453 19685 5650 1 11 . 1 1 430 430 ASN CA C 430 52.600 52.600 54.805 -2.205 19685 5651 1 11 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.053 -1.853 19685 5652 1 11 . 1 1 430 430 ASN H H 430 9.020 9.020 8.116 0.904 19685 5653 1 11 . 1 1 431 431 VAL N N 431 128.000 128.000 114.562 13.438 19685 5654 1 11 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.525 -0.775 19685 5655 1 11 . 1 1 431 431 VAL C C 431 176.400 176.400 174.531 1.869 19685 5656 1 11 . 1 1 431 431 VAL CA C 431 61.800 61.800 60.422 1.378 19685 5657 1 11 . 1 1 431 431 VAL CB C 431 31.900 31.900 35.119 -3.219 19685 5658 1 11 . 1 1 431 431 VAL H H 431 8.480 8.480 8.283 0.197 19685 5659 1 11 . 1 1 432 432 ILE N N 432 128.000 128.000 115.880 12.120 19685 5660 1 11 . 1 1 432 432 ILE HA H 432 3.920 3.920 4.572 -0.652 19685 5661 1 11 . 1 1 432 432 ILE C C 432 176.100 176.100 175.014 1.086 19685 5662 1 11 . 1 1 432 432 ILE CA C 432 62.500 62.500 60.738 1.762 19685 5663 1 11 . 1 1 432 432 ILE CB C 432 37.400 37.400 39.658 -2.259 19685 5664 1 11 . 1 1 432 432 ILE H H 432 8.840 8.840 7.879 0.961 19685 5665 1 11 . 1 1 433 433 SER N N 433 113.600 113.600 114.973 -1.373 19685 5666 1 11 . 1 1 433 433 SER HA H 433 4.440 4.440 4.481 -0.041 19685 5667 1 11 . 1 1 433 433 SER C C 433 171.000 171.000 172.469 -1.469 19685 5668 1 11 . 1 1 433 433 SER CA C 433 57.300 57.300 58.019 -0.719 19685 5669 1 11 . 1 1 433 433 SER CB C 433 65.200 65.200 65.514 -0.314 19685 5670 1 11 . 1 1 433 433 SER H H 433 7.280 7.280 7.573 -0.293 19685 5671 1 11 . 1 1 434 434 ALA N N 434 125.700 125.700 127.551 -1.851 19685 5672 1 11 . 1 1 434 434 ALA HA H 434 4.910 4.910 4.707 0.203 19685 5673 1 11 . 1 1 434 434 ALA C C 434 174.600 174.600 175.798 -1.198 19685 5674 1 11 . 1 1 434 434 ALA CA C 434 51.000 51.000 51.130 -0.131 19685 5675 1 11 . 1 1 434 434 ALA CB C 434 21.200 21.200 20.006 1.194 19685 5676 1 11 . 1 1 434 434 ALA H H 434 8.270 8.270 8.441 -0.171 19685 5677 1 11 . 1 1 435 435 LYS N N 435 120.900 120.900 119.457 1.443 19685 5678 1 11 . 1 1 435 435 LYS HA H 435 4.470 4.470 3.998 0.472 19685 5679 1 11 . 1 1 435 435 LYS C C 435 173.800 173.800 175.699 -1.899 19685 5680 1 11 . 1 1 435 435 LYS CA C 435 53.700 53.700 56.737 -3.037 19685 5681 1 11 . 1 1 435 435 LYS CB C 435 36.400 36.400 33.084 3.316 19685 5682 1 11 . 1 1 435 435 LYS H H 435 8.490 8.490 6.836 1.654 19685 5683 1 11 . 1 1 436 436 VAL N N 436 122.200 122.200 120.358 1.842 19685 5684 1 11 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.247 -0.327 19685 5685 1 11 . 1 1 436 436 VAL C C 436 175.100 175.100 174.938 0.162 19685 5686 1 11 . 1 1 436 436 VAL CA C 436 63.600 63.600 61.315 2.285 19685 5687 1 11 . 1 1 436 436 VAL CB C 436 33.500 33.500 32.293 1.207 19685 5688 1 11 . 1 1 436 436 VAL H H 436 8.390 8.390 8.459 -0.069 19685 5689 1 11 . 1 1 437 437 PHE N N 437 125.900 125.900 117.258 8.642 19685 5690 1 11 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.072 0.328 19685 5691 1 11 . 1 1 437 437 PHE C C 437 173.600 173.600 175.787 -2.187 19685 5692 1 11 . 1 1 437 437 PHE CA C 437 57.700 57.700 59.043 -1.343 19685 5693 1 11 . 1 1 437 437 PHE CB C 437 39.000 39.000 39.177 -0.177 19685 5694 1 11 . 1 1 437 437 PHE H H 437 8.250 8.250 7.443 0.807 19685 5695 1 11 . 1 1 438 438 ILE N N 438 121.900 121.900 120.324 1.576 19685 5696 1 11 . 1 1 438 438 ILE HA H 438 4.460 4.460 3.977 0.483 19685 5697 1 11 . 1 1 438 438 ILE C C 438 175.700 175.700 174.774 0.926 19685 5698 1 11 . 1 1 438 438 ILE CA C 438 58.300 58.300 62.425 -4.125 19685 5699 1 11 . 1 1 438 438 ILE CB C 438 39.700 39.700 38.551 1.149 19685 5700 1 11 . 1 1 438 438 ILE H H 438 8.520 8.520 8.665 -0.145 19685 5701 1 11 . 1 1 439 439 ASP N N 439 126.500 126.500 123.318 3.182 19685 5702 1 11 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.588 -0.008 19685 5703 1 11 . 1 1 439 439 ASP C C 439 176.300 176.300 176.168 0.132 19685 5704 1 11 . 1 1 439 439 ASP CA C 439 53.600 53.600 54.096 -0.496 19685 5705 1 11 . 1 1 439 439 ASP CB C 439 42.300 42.300 41.039 1.261 19685 5706 1 11 . 1 1 439 439 ASP H H 439 8.730 8.730 8.742 -0.012 19685 5707 1 11 . 1 1 440 440 LYS N N 440 127.300 127.300 116.020 11.280 19685 5708 1 11 . 1 1 440 440 LYS HA H 440 4.070 4.070 3.965 0.105 19685 5709 1 11 . 1 1 440 440 LYS C C 440 176.900 176.900 175.943 0.957 19685 5710 1 11 . 1 1 440 440 LYS CA C 440 57.800 57.800 58.186 -0.386 19685 5711 1 11 . 1 1 440 440 LYS CB C 440 32.100 32.100 30.460 1.640 19685 5712 1 11 . 1 1 440 440 LYS H H 440 8.930 8.930 8.338 0.592 19685 5713 1 11 . 1 1 441 441 GLN N N 441 117.400 117.400 115.130 2.270 19685 5714 1 11 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.438 -0.208 19685 5715 1 11 . 1 1 441 441 GLN C C 441 177.200 177.200 175.988 1.212 19685 5716 1 11 . 1 1 441 441 GLN CA C 441 57.600 57.600 56.278 1.322 19685 5717 1 11 . 1 1 441 441 GLN CB C 441 28.800 28.800 31.025 -2.225 19685 5718 1 11 . 1 1 441 441 GLN H H 441 8.650 8.650 8.041 0.609 19685 5719 1 11 . 1 1 442 442 THR N N 442 107.300 107.300 113.385 -6.085 19685 5720 1 11 . 1 1 442 442 THR HA H 442 4.290 4.290 4.428 -0.138 19685 5721 1 11 . 1 1 442 442 THR C C 442 175.100 175.100 174.216 0.884 19685 5722 1 11 . 1 1 442 442 THR CA C 442 61.200 61.200 62.265 -1.065 19685 5723 1 11 . 1 1 442 442 THR CB C 442 70.300 70.300 70.152 0.148 19685 5724 1 11 . 1 1 442 442 THR H H 442 7.830 7.830 8.377 -0.547 19685 5725 1 11 . 1 1 443 443 ASN N N 443 117.300 117.300 119.112 -1.812 19685 5726 1 11 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.362 -0.062 19685 5727 1 11 . 1 1 443 443 ASN C C 443 173.400 173.400 175.091 -1.691 19685 5728 1 11 . 1 1 443 443 ASN CA C 443 54.300 54.300 53.917 0.383 19685 5729 1 11 . 1 1 443 443 ASN CB C 443 37.600 37.600 36.855 0.745 19685 5730 1 11 . 1 1 443 443 ASN H H 443 8.470 8.470 8.132 0.338 19685 5731 1 11 . 1 1 444 444 LEU N N 444 118.000 118.000 118.021 -0.021 19685 5732 1 11 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.042 0.518 19685 5733 1 11 . 1 1 444 444 LEU C C 444 176.700 176.700 176.353 0.347 19685 5734 1 11 . 1 1 444 444 LEU CA C 444 53.300 53.300 57.374 -4.074 19685 5735 1 11 . 1 1 444 444 LEU CB C 444 43.500 43.500 42.500 1.000 19685 5736 1 11 . 1 1 444 444 LEU H H 444 7.660 7.660 7.796 -0.136 19685 5737 1 11 . 1 1 445 445 SER N N 445 115.500 115.500 109.288 6.212 19685 5738 1 11 . 1 1 445 445 SER HA H 445 4.460 4.460 4.435 0.025 19685 5739 1 11 . 1 1 445 445 SER C C 445 176.500 176.500 172.574 3.926 19685 5740 1 11 . 1 1 445 445 SER CA C 445 57.900 57.900 57.308 0.592 19685 5741 1 11 . 1 1 445 445 SER CB C 445 63.500 63.500 64.106 -0.606 19685 5742 1 11 . 1 1 445 445 SER H H 445 8.840 8.840 7.884 0.956 19685 5743 1 11 . 1 1 446 446 LYS N N 446 125.200 125.200 122.877 2.323 19685 5744 1 11 . 1 1 446 446 LYS HA H 446 4.500 4.500 3.663 0.837 19685 5745 1 11 . 1 1 446 446 LYS C C 446 176.100 176.100 174.324 1.776 19685 5746 1 11 . 1 1 446 446 LYS CA C 446 56.300 56.300 57.483 -1.183 19685 5747 1 11 . 1 1 446 446 LYS CB C 446 32.200 32.200 31.722 0.478 19685 5748 1 11 . 1 1 446 446 LYS H H 446 9.230 9.230 8.505 0.725 19685 5749 1 11 . 1 1 447 447 CYS N N 447 113.000 113.000 114.141 -1.141 19685 5750 1 11 . 1 1 447 447 CYS C C 447 172.500 172.500 172.671 -0.171 19685 5751 1 11 . 1 1 447 447 CYS CA C 447 60.400 60.400 58.042 2.358 19685 5752 1 11 . 1 1 447 447 CYS CB C 447 24.900 24.900 28.315 -3.415 19685 5753 1 11 . 1 1 447 447 CYS H H 447 10.020 10.020 7.897 2.123 19685 5754 1 11 . 1 1 448 448 PHE N N 448 115.200 115.200 116.449 -1.249 19685 5755 1 11 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.652 0.688 19685 5756 1 11 . 1 1 448 448 PHE C C 448 172.400 172.400 173.832 -1.432 19685 5757 1 11 . 1 1 448 448 PHE CA C 448 54.700 54.700 55.760 -1.060 19685 5758 1 11 . 1 1 448 448 PHE CB C 448 42.000 42.000 40.068 1.932 19685 5759 1 11 . 1 1 448 448 PHE H H 448 7.810 7.810 6.879 0.931 19685 5760 1 11 . 1 1 449 449 GLY N N 449 107.700 107.700 106.907 0.793 19685 5761 1 11 . 1 1 449 449 GLY C C 449 170.100 170.100 172.015 -1.915 19685 5762 1 11 . 1 1 449 449 GLY CA C 449 45.200 45.200 43.834 1.366 19685 5763 1 11 . 1 1 449 449 GLY H H 449 9.310 9.310 8.700 0.610 19685 5764 1 11 . 1 1 450 450 PHE N N 450 119.900 119.900 114.215 5.685 19685 5765 1 11 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.049 0.381 19685 5766 1 11 . 1 1 450 450 PHE C C 450 172.800 172.800 172.941 -0.141 19685 5767 1 11 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.829 -1.829 19685 5768 1 11 . 1 1 450 450 PHE CB C 450 43.600 43.600 41.123 2.477 19685 5769 1 11 . 1 1 450 450 PHE H H 450 8.760 8.760 7.993 0.767 19685 5770 1 11 . 1 1 451 451 VAL N N 451 123.800 123.800 117.471 6.329 19685 5771 1 11 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.435 -0.145 19685 5772 1 11 . 1 1 451 451 VAL C C 451 172.400 172.400 175.203 -2.803 19685 5773 1 11 . 1 1 451 451 VAL CA C 451 59.800 59.800 61.590 -1.790 19685 5774 1 11 . 1 1 451 451 VAL CB C 451 36.100 36.100 35.877 0.223 19685 5775 1 11 . 1 1 451 451 VAL H H 451 7.930 7.930 8.415 -0.485 19685 5776 1 11 . 1 1 452 452 SER N N 452 119.600 119.600 121.455 -1.855 19685 5777 1 11 . 1 1 452 452 SER HA H 452 5.120 5.120 5.122 -0.002 19685 5778 1 11 . 1 1 452 452 SER C C 452 173.200 173.200 174.384 -1.184 19685 5779 1 11 . 1 1 452 452 SER CA C 452 55.700 55.700 56.369 -0.669 19685 5780 1 11 . 1 1 452 452 SER CB C 452 66.100 66.100 62.229 3.871 19685 5781 1 11 . 1 1 452 452 SER H H 452 8.540 8.540 8.714 -0.174 19685 5782 1 11 . 1 1 453 453 TYR N N 453 121.400 121.400 125.418 -4.018 19685 5783 1 11 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.770 0.610 19685 5784 1 11 . 1 1 453 453 TYR C C 453 173.600 173.600 177.318 -3.718 19685 5785 1 11 . 1 1 453 453 TYR CA C 453 56.500 56.500 58.467 -1.967 19685 5786 1 11 . 1 1 453 453 TYR CB C 453 42.200 42.200 38.872 3.328 19685 5787 1 11 . 1 1 453 453 TYR H H 453 8.380 8.380 7.866 0.514 19685 5788 1 11 . 1 1 454 454 ASP N N 454 113.300 113.300 120.835 -7.535 19685 5789 1 11 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.633 -0.143 19685 5790 1 11 . 1 1 454 454 ASP C C 454 176.100 176.100 175.413 0.687 19685 5791 1 11 . 1 1 454 454 ASP CA C 454 52.800 52.800 55.457 -2.657 19685 5792 1 11 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.722 -1.323 19685 5793 1 11 . 1 1 454 454 ASP H H 454 7.860 7.860 8.817 -0.957 19685 5794 1 11 . 1 1 455 455 ASN N N 455 113.800 113.800 114.125 -0.325 19685 5795 1 11 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.133 -0.083 19685 5796 1 11 . 1 1 455 455 ASN C C 455 173.100 173.100 174.073 -0.973 19685 5797 1 11 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.469 -0.769 19685 5798 1 11 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.574 0.526 19685 5799 1 11 . 1 1 455 455 ASN H H 455 7.200 7.200 7.912 -0.712 19685 5800 1 11 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.612 -0.442 19685 5801 1 11 . 1 1 456 456 PRO C C 456 177.300 177.300 177.693 -0.393 19685 5802 1 11 . 1 1 456 456 PRO CA C 456 64.200 64.200 65.112 -0.912 19685 5803 1 11 . 1 1 456 456 PRO CB C 456 32.300 32.300 31.944 0.356 19685 5804 1 11 . 1 1 457 457 VAL N N 457 120.900 120.900 111.265 9.635 19685 5805 1 11 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.398 -0.778 19685 5806 1 11 . 1 1 457 457 VAL C C 457 179.000 179.000 176.189 2.811 19685 5807 1 11 . 1 1 457 457 VAL CA C 457 65.900 65.900 63.667 2.233 19685 5808 1 11 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.300 -0.500 19685 5809 1 11 . 1 1 457 457 VAL H H 457 8.120 8.120 7.995 0.125 19685 5810 1 11 . 1 1 458 458 SER N N 458 117.800 117.800 117.024 0.776 19685 5811 1 11 . 1 1 458 458 SER HA H 458 3.940 3.940 4.670 -0.730 19685 5812 1 11 . 1 1 458 458 SER C C 458 173.600 173.600 175.903 -2.303 19685 5813 1 11 . 1 1 458 458 SER CA C 458 61.100 61.100 60.454 0.646 19685 5814 1 11 . 1 1 458 458 SER CB C 458 62.400 62.400 64.859 -2.458 19685 5815 1 11 . 1 1 458 458 SER H H 458 7.830 7.830 7.793 0.037 19685 5816 1 11 . 1 1 459 459 ALA N N 459 120.000 120.000 125.288 -5.288 19685 5817 1 11 . 1 1 459 459 ALA HA H 459 3.750 3.750 4.354 -0.604 19685 5818 1 11 . 1 1 459 459 ALA C C 459 178.100 178.100 178.433 -0.333 19685 5819 1 11 . 1 1 459 459 ALA CA C 459 54.500 54.500 55.068 -0.568 19685 5820 1 11 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.362 -0.462 19685 5821 1 11 . 1 1 459 459 ALA H H 459 6.370 6.370 7.840 -1.470 19685 5822 1 11 . 1 1 460 460 GLN N N 460 116.100 116.100 117.393 -1.293 19685 5823 1 11 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.182 -0.352 19685 5824 1 11 . 1 1 460 460 GLN C C 460 178.000 178.000 176.341 1.659 19685 5825 1 11 . 1 1 460 460 GLN CA C 460 58.500 58.500 57.269 1.232 19685 5826 1 11 . 1 1 460 460 GLN CB C 460 27.400 27.400 27.809 -0.409 19685 5827 1 11 . 1 1 460 460 GLN H H 460 7.710 7.710 8.624 -0.914 19685 5828 1 11 . 1 1 461 461 ALA N N 461 122.800 122.800 118.987 3.813 19685 5829 1 11 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.473 -0.513 19685 5830 1 11 . 1 1 461 461 ALA C C 461 179.500 179.500 176.972 2.528 19685 5831 1 11 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.114 2.386 19685 5832 1 11 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.326 -1.826 19685 5833 1 11 . 1 1 461 461 ALA H H 461 7.880 7.880 7.646 0.234 19685 5834 1 11 . 1 1 462 462 ALA N N 462 121.400 121.400 120.173 1.227 19685 5835 1 11 . 1 1 462 462 ALA HA H 462 2.400 2.400 4.003 -1.603 19685 5836 1 11 . 1 1 462 462 ALA C C 462 179.400 179.400 177.997 1.403 19685 5837 1 11 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.840 1.260 19685 5838 1 11 . 1 1 462 462 ALA CB C 462 18.700 18.700 21.091 -2.391 19685 5839 1 11 . 1 1 462 462 ALA H H 462 7.860 7.860 7.771 0.089 19685 5840 1 11 . 1 1 463 463 ILE N N 463 118.600 118.600 118.843 -0.243 19685 5841 1 11 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.915 -0.675 19685 5842 1 11 . 1 1 463 463 ILE C C 463 177.500 177.500 176.100 1.400 19685 5843 1 11 . 1 1 463 463 ILE CA C 463 66.000 66.000 62.644 3.357 19685 5844 1 11 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.152 0.148 19685 5845 1 11 . 1 1 463 463 ILE H H 463 8.090 8.090 8.318 -0.228 19685 5846 1 11 . 1 1 464 464 GLN N N 464 117.000 117.000 115.900 1.100 19685 5847 1 11 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.402 -0.532 19685 5848 1 11 . 1 1 464 464 GLN C C 464 177.700 177.700 175.060 2.640 19685 5849 1 11 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.563 2.637 19685 5850 1 11 . 1 1 464 464 GLN CB C 464 27.900 27.900 28.948 -1.048 19685 5851 1 11 . 1 1 464 464 GLN H H 464 7.780 7.780 8.246 -0.466 19685 5852 1 11 . 1 1 465 465 ALA N N 465 117.200 117.200 120.534 -3.334 19685 5853 1 11 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.388 -0.158 19685 5854 1 11 . 1 1 465 465 ALA C C 465 179.200 179.200 176.542 2.658 19685 5855 1 11 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.746 1.054 19685 5856 1 11 . 1 1 465 465 ALA CB C 465 21.100 21.100 20.267 0.833 19685 5857 1 11 . 1 1 465 465 ALA H H 465 7.540 7.540 7.420 0.120 19685 5858 1 11 . 1 1 466 466 MET N N 466 110.800 110.800 117.208 -6.408 19685 5859 1 11 . 1 1 466 466 MET HA H 466 4.820 4.820 4.483 0.337 19685 5860 1 11 . 1 1 466 466 MET C C 466 177.600 177.600 174.982 2.618 19685 5861 1 11 . 1 1 466 466 MET CA C 466 53.300 53.300 55.063 -1.763 19685 5862 1 11 . 1 1 466 466 MET CB C 466 31.600 31.600 35.523 -3.922 19685 5863 1 11 . 1 1 466 466 MET H H 466 8.230 8.230 7.718 0.512 19685 5864 1 11 . 1 1 467 467 ASN N N 467 119.100 119.100 118.903 0.197 19685 5865 1 11 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.530 -0.040 19685 5866 1 11 . 1 1 467 467 ASN C C 467 176.300 176.300 176.822 -0.522 19685 5867 1 11 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.594 1.606 19685 5868 1 11 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.502 -0.302 19685 5869 1 11 . 1 1 467 467 ASN H H 467 8.560 8.560 7.734 0.826 19685 5870 1 11 . 1 1 468 468 GLY N N 468 117.900 117.900 113.654 4.246 19685 5871 1 11 . 1 1 468 468 GLY C C 468 172.800 172.800 174.259 -1.459 19685 5872 1 11 . 1 1 468 468 GLY CA C 468 45.300 45.300 45.846 -0.546 19685 5873 1 11 . 1 1 468 468 GLY H H 468 8.930 8.930 9.054 -0.124 19685 5874 1 11 . 1 1 469 469 PHE N N 469 123.300 123.300 119.984 3.316 19685 5875 1 11 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.532 -0.342 19685 5876 1 11 . 1 1 469 469 PHE C C 469 174.400 174.400 174.623 -0.223 19685 5877 1 11 . 1 1 469 469 PHE CA C 469 58.700 58.700 58.330 0.370 19685 5878 1 11 . 1 1 469 469 PHE CB C 469 40.600 40.600 39.931 0.669 19685 5879 1 11 . 1 1 469 469 PHE H H 469 7.950 7.950 7.639 0.311 19685 5880 1 11 . 1 1 470 470 GLN N N 470 129.200 129.200 118.750 10.450 19685 5881 1 11 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.087 0.503 19685 5882 1 11 . 1 1 470 470 GLN C C 470 174.100 174.100 174.130 -0.030 19685 5883 1 11 . 1 1 470 470 GLN CA C 470 55.500 55.500 56.833 -1.333 19685 5884 1 11 . 1 1 470 470 GLN CB C 470 28.800 28.800 28.288 0.512 19685 5885 1 11 . 1 1 470 470 GLN H H 470 8.330 8.330 8.241 0.089 19685 5886 1 11 . 1 1 471 471 ILE N N 471 126.300 126.300 124.250 2.050 19685 5887 1 11 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.351 -0.181 19685 5888 1 11 . 1 1 471 471 ILE C C 471 175.400 175.400 175.048 0.352 19685 5889 1 11 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.432 -0.832 19685 5890 1 11 . 1 1 471 471 ILE CB C 471 39.100 39.100 40.150 -1.050 19685 5891 1 11 . 1 1 471 471 ILE H H 471 8.440 8.440 7.995 0.445 19685 5892 1 11 . 1 1 472 472 GLY N N 472 117.500 117.500 115.713 1.787 19685 5893 1 11 . 1 1 472 472 GLY C C 472 174.700 174.700 174.432 0.268 19685 5894 1 11 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.415 1.085 19685 5895 1 11 . 1 1 472 472 GLY H H 472 8.980 8.980 8.638 0.342 19685 5896 1 11 . 1 1 473 473 MET N N 473 124.100 124.100 120.150 3.950 19685 5897 1 11 . 1 1 473 473 MET HA H 473 4.380 4.380 4.492 -0.112 19685 5898 1 11 . 1 1 473 473 MET C C 473 175.700 175.700 175.581 0.119 19685 5899 1 11 . 1 1 473 473 MET CA C 473 55.000 55.000 56.170 -1.170 19685 5900 1 11 . 1 1 473 473 MET CB C 473 32.900 32.900 32.202 0.698 19685 5901 1 11 . 1 1 473 473 MET H H 473 9.070 9.070 8.308 0.762 19685 5902 1 11 . 1 1 474 474 LYS N N 474 118.700 118.700 118.381 0.319 19685 5903 1 11 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.565 -0.085 19685 5904 1 11 . 1 1 474 474 LYS C C 474 174.300 174.300 175.187 -0.887 19685 5905 1 11 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.617 -0.017 19685 5906 1 11 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.294 -0.194 19685 5907 1 11 . 1 1 474 474 LYS H H 474 7.770 7.770 7.253 0.517 19685 5908 1 11 . 1 1 475 475 ARG N N 475 119.600 119.600 119.387 0.213 19685 5909 1 11 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.229 0.571 19685 5910 1 11 . 1 1 475 475 ARG C C 475 175.700 175.700 174.218 1.482 19685 5911 1 11 . 1 1 475 475 ARG CA C 475 54.000 54.000 55.864 -1.864 19685 5912 1 11 . 1 1 475 475 ARG CB C 475 31.300 31.300 30.392 0.908 19685 5913 1 11 . 1 1 475 475 ARG H H 475 8.350 8.350 8.482 -0.132 19685 5914 1 11 . 1 1 476 476 LEU N N 476 123.500 123.500 121.184 2.316 19685 5915 1 11 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.517 -0.087 19685 5916 1 11 . 1 1 476 476 LEU C C 476 177.600 177.600 174.834 2.766 19685 5917 1 11 . 1 1 476 476 LEU CA C 476 55.500 55.500 53.545 1.955 19685 5918 1 11 . 1 1 476 476 LEU CB C 476 42.800 42.800 44.758 -1.958 19685 5919 1 11 . 1 1 476 476 LEU H H 476 9.130 9.130 8.236 0.894 19685 5920 1 11 . 1 1 477 477 LYS N N 477 123.200 123.200 126.037 -2.837 19685 5921 1 11 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.859 0.301 19685 5922 1 11 . 1 1 477 477 LYS C C 477 174.100 174.100 173.958 0.142 19685 5923 1 11 . 1 1 477 477 LYS CA C 477 54.500 54.500 55.499 -0.999 19685 5924 1 11 . 1 1 477 477 LYS CB C 477 34.900 34.900 35.689 -0.789 19685 5925 1 11 . 1 1 477 477 LYS H H 477 8.090 8.090 8.138 -0.048 19685 5926 1 11 . 1 1 478 478 VAL N N 478 127.100 127.100 123.038 4.062 19685 5927 1 11 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.380 0.520 19685 5928 1 11 . 1 1 478 478 VAL C C 478 173.700 173.700 173.881 -0.181 19685 5929 1 11 . 1 1 478 478 VAL CA C 478 61.000 61.000 61.755 -0.755 19685 5930 1 11 . 1 1 478 478 VAL CB C 478 33.700 33.700 34.222 -0.522 19685 5931 1 11 . 1 1 478 478 VAL H H 478 8.820 8.820 8.572 0.248 19685 5932 1 11 . 1 1 479 479 GLN N N 479 123.600 123.600 124.395 -0.795 19685 5933 1 11 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.503 0.307 19685 5934 1 11 . 1 1 479 479 GLN C C 479 173.600 173.600 174.879 -1.279 19685 5935 1 11 . 1 1 479 479 GLN CA C 479 53.200 53.200 55.514 -2.314 19685 5936 1 11 . 1 1 479 479 GLN CB C 479 33.500 33.500 29.357 4.143 19685 5937 1 11 . 1 1 479 479 GLN H H 479 9.130 9.130 8.723 0.407 19685 5938 1 11 . 1 1 480 480 LEU N N 480 123.200 123.200 116.844 6.356 19685 5939 1 11 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.049 0.391 19685 5940 1 11 . 1 1 480 480 LEU C C 480 177.100 177.100 178.193 -1.093 19685 5941 1 11 . 1 1 480 480 LEU CA C 480 54.600 54.600 56.599 -1.999 19685 5942 1 11 . 1 1 480 480 LEU CB C 480 42.400 42.400 41.822 0.578 19685 5943 1 11 . 1 1 480 480 LEU H H 480 8.840 8.840 8.007 0.833 19685 5944 1 11 . 1 1 481 481 LYS N N 481 124.500 124.500 120.271 4.229 19685 5945 1 11 . 1 1 481 481 LYS HA H 481 4.310 4.310 3.439 0.871 19685 5946 1 11 . 1 1 481 481 LYS C C 481 175.200 175.200 176.614 -1.414 19685 5947 1 11 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.083 -0.383 19685 5948 1 11 . 1 1 481 481 LYS CB C 481 33.100 33.100 32.401 0.698 19685 5949 1 11 . 1 1 481 481 LYS H H 481 8.400 8.400 8.541 -0.141 19685 5950 1 11 . 1 1 482 482 ARG N N 482 126.600 126.600 116.188 10.412 19685 5951 1 11 . 1 1 482 482 ARG HA H 482 4.350 4.350 3.899 0.451 19685 5952 1 11 . 1 1 482 482 ARG C C 482 175.800 175.800 174.383 1.417 19685 5953 1 11 . 1 1 482 482 ARG CA C 482 55.600 55.600 57.330 -1.730 19685 5954 1 11 . 1 1 482 482 ARG CB C 482 31.100 31.100 28.033 3.067 19685 5955 1 11 . 1 1 482 482 ARG H H 482 8.770 8.770 8.460 0.310 19685 5956 1 11 . 1 1 483 483 SER N N 483 118.100 118.100 111.692 6.408 19685 5957 1 11 . 1 1 483 483 SER HA H 483 4.400 4.400 4.613 -0.213 19685 5958 1 11 . 1 1 483 483 SER C C 483 174.200 174.200 173.067 1.133 19685 5959 1 11 . 1 1 483 483 SER CA C 483 58.000 58.000 57.048 0.952 19685 5960 1 11 . 1 1 483 483 SER CB C 483 63.500 63.500 65.947 -2.447 19685 5961 1 11 . 1 1 483 483 SER H H 483 8.610 8.610 7.471 1.139 19685 5962 1 11 . 1 1 484 484 LYS N N 484 123.000 123.000 119.977 3.023 19685 5963 1 11 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.453 -0.243 19685 5964 1 11 . 1 1 484 484 LYS C C 484 175.900 175.900 175.383 0.517 19685 5965 1 11 . 1 1 484 484 LYS CA C 484 56.300 56.300 56.868 -0.568 19685 5966 1 11 . 1 1 484 484 LYS CB C 484 32.500 32.500 32.779 -0.279 19685 5967 1 11 . 1 1 484 484 LYS H H 484 8.560 8.560 8.592 -0.032 19685 5968 1 11 . 1 1 485 485 ASN N N 485 119.600 119.600 118.796 0.804 19685 5969 1 11 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.698 -0.098 19685 5970 1 11 . 1 1 485 485 ASN C C 485 174.400 174.400 174.656 -0.256 19685 5971 1 11 . 1 1 485 485 ASN CA C 485 52.900 52.900 52.730 0.170 19685 5972 1 11 . 1 1 485 485 ASN CB C 485 38.400 38.400 39.233 -0.833 19685 5973 1 11 . 1 1 485 485 ASN H H 485 8.560 8.560 8.019 0.541 19685 5974 1 11 . 1 1 486 486 ASP N N 486 121.100 121.100 119.726 1.374 19685 5975 1 11 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.861 -0.341 19685 5976 1 11 . 1 1 486 486 ASP C C 486 175.700 175.700 174.988 0.712 19685 5977 1 11 . 1 1 486 486 ASP CA C 486 54.000 54.000 53.888 0.112 19685 5978 1 11 . 1 1 486 486 ASP CB C 486 40.800 40.800 42.529 -1.729 19685 5979 1 11 . 1 1 486 486 ASP H H 486 8.250 8.250 8.699 -0.449 19685 5980 1 11 . 1 1 487 487 SER N N 487 115.400 115.400 116.432 -1.032 19685 5981 1 11 . 1 1 487 487 SER HA H 487 4.310 4.310 4.611 -0.301 19685 5982 1 11 . 1 1 487 487 SER C C 487 172.800 172.800 172.038 0.762 19685 5983 1 11 . 1 1 487 487 SER CA C 487 57.700 57.700 57.995 -0.295 19685 5984 1 11 . 1 1 487 487 SER CB C 487 63.600 63.600 65.471 -1.871 19685 5985 1 11 . 1 1 487 487 SER H H 487 8.090 8.090 8.380 -0.290 19685 5986 1 11 . 1 1 488 488 LYS N N 488 122.300 122.300 120.428 1.872 19685 5987 1 11 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.688 -0.638 19685 5988 1 11 . 1 1 488 488 LYS C C 488 174.500 174.500 174.214 0.286 19685 5989 1 11 . 1 1 488 488 LYS CA C 488 54.000 54.000 53.726 0.274 19685 5990 1 11 . 1 1 488 488 LYS CB C 488 32.400 32.400 33.852 -1.452 19685 5991 1 11 . 1 1 488 488 LYS H H 488 8.090 8.090 8.412 -0.322 19685 5992 1 11 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.527 -0.247 19685 5993 1 11 . 1 1 489 489 PRO C C 489 175.000 175.000 175.885 -0.885 19685 5994 1 11 . 1 1 489 489 PRO CA C 489 63.200 63.200 63.147 0.053 19685 5995 1 11 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.049 -0.949 19685 5996 1 12 . 1 1 395 395 SER N N 395 115.500 115.500 114.937 0.563 19685 5997 1 12 . 1 1 395 395 SER HA H 395 4.300 4.300 4.798 -0.498 19685 5998 1 12 . 1 1 395 395 SER C C 395 173.900 173.900 172.838 1.062 19685 5999 1 12 . 1 1 395 395 SER CA C 395 57.900 57.900 57.335 0.565 19685 6000 1 12 . 1 1 395 395 SER CB C 395 63.400 63.400 65.187 -1.787 19685 6001 1 12 . 1 1 395 395 SER H H 395 8.200 8.200 8.149 0.051 19685 6002 1 12 . 1 1 396 396 HIS N N 396 123.500 123.500 118.897 4.603 19685 6003 1 12 . 1 1 396 396 HIS HA H 396 4.560 4.560 5.216 -0.656 19685 6004 1 12 . 1 1 396 396 HIS C C 396 174.100 174.100 173.651 0.449 19685 6005 1 12 . 1 1 396 396 HIS CA C 396 53.700 53.700 55.337 -1.637 19685 6006 1 12 . 1 1 396 396 HIS CB C 396 32.200 32.200 32.028 0.172 19685 6007 1 12 . 1 1 396 396 HIS H H 396 8.120 8.120 8.739 -0.619 19685 6008 1 12 . 1 1 397 397 MET N N 397 121.200 121.200 121.320 -0.120 19685 6009 1 12 . 1 1 397 397 MET HA H 397 4.320 4.320 4.809 -0.489 19685 6010 1 12 . 1 1 397 397 MET C C 397 175.400 175.400 174.181 1.219 19685 6011 1 12 . 1 1 397 397 MET CA C 397 55.000 55.000 55.090 -0.090 19685 6012 1 12 . 1 1 397 397 MET CB C 397 32.500 32.500 35.151 -2.651 19685 6013 1 12 . 1 1 397 397 MET H H 397 8.300 8.300 9.066 -0.766 19685 6014 1 12 . 1 1 398 398 GLN N N 398 122.100 122.100 122.886 -0.786 19685 6015 1 12 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.690 -0.500 19685 6016 1 12 . 1 1 398 398 GLN C C 398 174.800 174.800 173.955 0.845 19685 6017 1 12 . 1 1 398 398 GLN CA C 398 55.200 55.200 54.999 0.201 19685 6018 1 12 . 1 1 398 398 GLN CB C 398 28.900 28.900 30.771 -1.871 19685 6019 1 12 . 1 1 398 398 GLN H H 398 8.540 8.540 8.279 0.261 19685 6020 1 12 . 1 1 399 399 LYS N N 399 123.000 123.000 119.457 3.543 19685 6021 1 12 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.506 -0.286 19685 6022 1 12 . 1 1 399 399 LYS C C 399 174.800 174.800 177.421 -2.621 19685 6023 1 12 . 1 1 399 399 LYS CA C 399 55.600 55.600 56.413 -0.813 19685 6024 1 12 . 1 1 399 399 LYS CB C 399 33.000 33.000 33.371 -0.371 19685 6025 1 12 . 1 1 399 399 LYS H H 399 8.180 8.180 8.612 -0.432 19685 6026 1 12 . 1 1 400 400 GLU N N 400 122.000 122.000 121.469 0.531 19685 6027 1 12 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.315 0.115 19685 6028 1 12 . 1 1 400 400 GLU C C 400 176.400 176.400 176.040 0.360 19685 6029 1 12 . 1 1 400 400 GLU CA C 400 55.400 55.400 55.690 -0.290 19685 6030 1 12 . 1 1 400 400 GLU CB C 400 31.400 31.400 28.018 3.381 19685 6031 1 12 . 1 1 400 400 GLU H H 400 8.350 8.350 8.374 -0.024 19685 6032 1 12 . 1 1 401 401 GLY N N 401 109.500 109.500 109.323 0.177 19685 6033 1 12 . 1 1 401 401 GLY C C 401 171.500 171.500 173.091 -1.591 19685 6034 1 12 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.694 -0.994 19685 6035 1 12 . 1 1 401 401 GLY H H 401 9.050 9.050 7.850 1.200 19685 6036 1 12 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.514 -0.094 19685 6037 1 12 . 1 1 402 402 PRO C C 402 173.900 173.900 176.689 -2.789 19685 6038 1 12 . 1 1 402 402 PRO CA C 402 61.900 61.900 64.145 -2.245 19685 6039 1 12 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.546 -0.346 19685 6040 1 12 . 1 1 403 403 GLU N N 403 119.600 119.600 117.820 1.780 19685 6041 1 12 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.422 -0.462 19685 6042 1 12 . 1 1 403 403 GLU C C 403 177.300 177.300 175.936 1.364 19685 6043 1 12 . 1 1 403 403 GLU CA C 403 58.100 58.100 57.009 1.091 19685 6044 1 12 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.719 -1.719 19685 6045 1 12 . 1 1 403 403 GLU H H 403 8.420 8.420 8.388 0.032 19685 6046 1 12 . 1 1 404 404 GLY N N 404 112.800 112.800 107.127 5.673 19685 6047 1 12 . 1 1 404 404 GLY C C 404 173.300 173.300 173.486 -0.186 19685 6048 1 12 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.813 -0.913 19685 6049 1 12 . 1 1 404 404 GLY H H 404 8.500 8.500 8.519 -0.019 19685 6050 1 12 . 1 1 405 405 ALA N N 405 120.000 120.000 124.315 -4.315 19685 6051 1 12 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.318 0.232 19685 6052 1 12 . 1 1 405 405 ALA C C 405 174.100 174.100 175.837 -1.737 19685 6053 1 12 . 1 1 405 405 ALA CA C 405 50.500 50.500 52.121 -1.621 19685 6054 1 12 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.120 3.680 19685 6055 1 12 . 1 1 405 405 ALA H H 405 8.360 8.360 8.386 -0.026 19685 6056 1 12 . 1 1 406 406 ASN N N 406 115.500 115.500 117.839 -2.339 19685 6057 1 12 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.010 0.180 19685 6058 1 12 . 1 1 406 406 ASN C C 406 172.900 172.900 174.233 -1.333 19685 6059 1 12 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.705 0.895 19685 6060 1 12 . 1 1 406 406 ASN CB C 406 40.900 40.900 39.236 1.664 19685 6061 1 12 . 1 1 406 406 ASN H H 406 7.690 7.690 8.175 -0.485 19685 6062 1 12 . 1 1 407 407 LEU N N 407 123.400 123.400 120.013 3.387 19685 6063 1 12 . 1 1 407 407 LEU HA H 407 4.960 4.960 3.954 1.006 19685 6064 1 12 . 1 1 407 407 LEU C C 407 174.900 174.900 177.617 -2.717 19685 6065 1 12 . 1 1 407 407 LEU CA C 407 53.100 53.100 56.236 -3.136 19685 6066 1 12 . 1 1 407 407 LEU CB C 407 45.400 45.400 41.041 4.359 19685 6067 1 12 . 1 1 407 407 LEU H H 407 9.290 9.290 7.836 1.454 19685 6068 1 12 . 1 1 408 408 PHE N N 408 118.700 118.700 125.521 -6.821 19685 6069 1 12 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.676 0.624 19685 6070 1 12 . 1 1 408 408 PHE C C 408 174.200 174.200 175.295 -1.095 19685 6071 1 12 . 1 1 408 408 PHE CA C 408 56.300 56.300 55.894 0.406 19685 6072 1 12 . 1 1 408 408 PHE CB C 408 42.700 42.700 36.717 5.983 19685 6073 1 12 . 1 1 408 408 PHE H H 408 9.150 9.150 8.052 1.098 19685 6074 1 12 . 1 1 409 409 ILE N N 409 120.800 120.800 121.161 -0.361 19685 6075 1 12 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.135 0.835 19685 6076 1 12 . 1 1 409 409 ILE C C 409 173.900 173.900 175.088 -1.188 19685 6077 1 12 . 1 1 409 409 ILE CA C 409 59.000 59.000 61.420 -2.420 19685 6078 1 12 . 1 1 409 409 ILE CB C 409 40.400 40.400 37.731 2.669 19685 6079 1 12 . 1 1 409 409 ILE H H 409 8.380 8.380 8.017 0.363 19685 6080 1 12 . 1 1 410 410 TYR N N 410 123.200 123.200 123.348 -0.148 19685 6081 1 12 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.881 0.059 19685 6082 1 12 . 1 1 410 410 TYR C C 410 174.300 174.300 175.738 -1.438 19685 6083 1 12 . 1 1 410 410 TYR CA C 410 56.200 56.200 57.578 -1.378 19685 6084 1 12 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.246 1.554 19685 6085 1 12 . 1 1 410 410 TYR H H 410 9.440 9.440 8.370 1.071 19685 6086 1 12 . 1 1 411 411 HIS N N 411 112.100 112.100 121.701 -9.601 19685 6087 1 12 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.530 -0.080 19685 6088 1 12 . 1 1 411 411 HIS C C 411 173.300 173.300 174.875 -1.575 19685 6089 1 12 . 1 1 411 411 HIS CA C 411 55.900 55.900 55.212 0.688 19685 6090 1 12 . 1 1 411 411 HIS CB C 411 26.200 26.200 27.382 -1.182 19685 6091 1 12 . 1 1 411 411 HIS H H 411 8.580 8.580 8.337 0.243 19685 6092 1 12 . 1 1 412 412 LEU N N 412 115.100 115.100 123.907 -8.807 19685 6093 1 12 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.279 -0.319 19685 6094 1 12 . 1 1 412 412 LEU C C 412 175.100 175.100 175.579 -0.479 19685 6095 1 12 . 1 1 412 412 LEU CA C 412 52.400 52.400 54.124 -1.724 19685 6096 1 12 . 1 1 412 412 LEU CB C 412 42.000 42.000 42.651 -0.651 19685 6097 1 12 . 1 1 412 412 LEU H H 412 7.560 7.560 7.419 0.141 19685 6098 1 12 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.616 -0.346 19685 6099 1 12 . 1 1 413 413 PRO C C 413 177.600 177.600 176.481 1.119 19685 6100 1 12 . 1 1 413 413 PRO CA C 413 62.300 62.300 62.500 -0.200 19685 6101 1 12 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.750 -0.550 19685 6102 1 12 . 1 1 414 414 GLN N N 414 125.500 125.500 117.815 7.685 19685 6103 1 12 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.269 -0.189 19685 6104 1 12 . 1 1 414 414 GLN C C 414 175.400 175.400 176.005 -0.605 19685 6105 1 12 . 1 1 414 414 GLN CA C 414 57.000 57.000 55.521 1.479 19685 6106 1 12 . 1 1 414 414 GLN CB C 414 28.500 28.500 29.681 -1.181 19685 6107 1 12 . 1 1 414 414 GLN H H 414 9.170 9.170 8.243 0.927 19685 6108 1 12 . 1 1 415 415 GLU N N 415 115.300 115.300 117.048 -1.748 19685 6109 1 12 . 1 1 415 415 GLU HA H 415 4.260 4.260 3.897 0.363 19685 6110 1 12 . 1 1 415 415 GLU C C 415 176.700 176.700 174.265 2.435 19685 6111 1 12 . 1 1 415 415 GLU CA C 415 58.700 58.700 57.321 1.379 19685 6112 1 12 . 1 1 415 415 GLU CB C 415 28.300 28.300 28.928 -0.628 19685 6113 1 12 . 1 1 415 415 GLU H H 415 9.390 9.390 8.817 0.573 19685 6114 1 12 . 1 1 416 416 PHE N N 416 121.700 121.700 115.751 5.949 19685 6115 1 12 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.045 -0.435 19685 6116 1 12 . 1 1 416 416 PHE C C 416 176.400 176.400 174.685 1.715 19685 6117 1 12 . 1 1 416 416 PHE CA C 416 57.400 57.400 57.152 0.248 19685 6118 1 12 . 1 1 416 416 PHE CB C 416 38.700 38.700 42.243 -3.543 19685 6119 1 12 . 1 1 416 416 PHE H H 416 7.610 7.610 7.521 0.089 19685 6120 1 12 . 1 1 417 417 GLY N N 417 113.000 113.000 108.589 4.411 19685 6121 1 12 . 1 1 417 417 GLY C C 417 174.300 174.300 173.156 1.144 19685 6122 1 12 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.579 -3.679 19685 6123 1 12 . 1 1 417 417 GLY H H 417 9.740 9.740 9.514 0.226 19685 6124 1 12 . 1 1 418 418 ASP N N 418 121.500 121.500 117.767 3.733 19685 6125 1 12 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.693 -0.753 19685 6126 1 12 . 1 1 418 418 ASP C C 418 177.900 177.900 176.987 0.913 19685 6127 1 12 . 1 1 418 418 ASP CA C 418 57.600 57.600 54.670 2.930 19685 6128 1 12 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.001 -1.300 19685 6129 1 12 . 1 1 418 418 ASP H H 418 8.680 8.680 8.094 0.586 19685 6130 1 12 . 1 1 419 419 GLN N N 419 116.400 116.400 120.969 -4.569 19685 6131 1 12 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.300 -0.390 19685 6132 1 12 . 1 1 419 419 GLN C C 419 177.600 177.600 175.748 1.852 19685 6133 1 12 . 1 1 419 419 GLN CA C 419 58.000 58.000 58.260 -0.260 19685 6134 1 12 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.699 -1.299 19685 6135 1 12 . 1 1 419 419 GLN H H 419 8.780 8.780 8.510 0.270 19685 6136 1 12 . 1 1 420 420 ASP N N 420 117.500 117.500 116.091 1.409 19685 6137 1 12 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.785 -0.775 19685 6138 1 12 . 1 1 420 420 ASP C C 420 178.000 178.000 177.298 0.702 19685 6139 1 12 . 1 1 420 420 ASP CA C 420 56.700 56.700 54.336 2.364 19685 6140 1 12 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.174 -0.374 19685 6141 1 12 . 1 1 420 420 ASP H H 420 7.210 7.210 8.487 -1.277 19685 6142 1 12 . 1 1 421 421 ILE N N 421 117.000 117.000 121.227 -4.227 19685 6143 1 12 . 1 1 421 421 ILE HA H 421 4.080 4.080 4.006 0.074 19685 6144 1 12 . 1 1 421 421 ILE C C 421 176.500 176.500 176.192 0.308 19685 6145 1 12 . 1 1 421 421 ILE CA C 421 64.000 64.000 63.442 0.558 19685 6146 1 12 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.089 -0.789 19685 6147 1 12 . 1 1 421 421 ILE H H 421 7.610 7.610 7.950 -0.340 19685 6148 1 12 . 1 1 422 422 LEU N N 422 123.200 123.200 120.224 2.976 19685 6149 1 12 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.239 -0.479 19685 6150 1 12 . 1 1 422 422 LEU C C 422 177.800 177.800 176.957 0.843 19685 6151 1 12 . 1 1 422 422 LEU CA C 422 58.600 58.600 56.089 2.511 19685 6152 1 12 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.708 -0.507 19685 6153 1 12 . 1 1 422 422 LEU H H 422 7.870 7.870 8.010 -0.140 19685 6154 1 12 . 1 1 423 423 GLN N N 423 115.600 115.600 118.306 -2.706 19685 6155 1 12 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.465 -0.585 19685 6156 1 12 . 1 1 423 423 GLN C C 423 177.800 177.800 175.885 1.915 19685 6157 1 12 . 1 1 423 423 GLN CA C 423 58.600 58.600 55.954 2.646 19685 6158 1 12 . 1 1 423 423 GLN CB C 423 27.900 27.900 30.404 -2.504 19685 6159 1 12 . 1 1 423 423 GLN H H 423 7.860 7.860 7.936 -0.076 19685 6160 1 12 . 1 1 424 424 MET N N 424 115.500 115.500 118.510 -3.010 19685 6161 1 12 . 1 1 424 424 MET HA H 424 3.910 3.910 4.524 -0.614 19685 6162 1 12 . 1 1 424 424 MET C C 424 175.500 175.500 175.046 0.454 19685 6163 1 12 . 1 1 424 424 MET CA C 424 57.800 57.800 55.617 2.183 19685 6164 1 12 . 1 1 424 424 MET CB C 424 34.300 34.300 34.212 0.088 19685 6165 1 12 . 1 1 424 424 MET H H 424 7.560 7.560 7.974 -0.414 19685 6166 1 12 . 1 1 425 425 PHE N N 425 112.300 112.300 115.815 -3.515 19685 6167 1 12 . 1 1 425 425 PHE HA H 425 4.700 4.700 4.999 -0.299 19685 6168 1 12 . 1 1 425 425 PHE C C 425 177.300 177.300 178.234 -0.934 19685 6169 1 12 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.286 1.614 19685 6170 1 12 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.830 -2.330 19685 6171 1 12 . 1 1 425 425 PHE H H 425 7.680 7.680 7.647 0.033 19685 6172 1 12 . 1 1 426 426 MET N N 426 127.400 127.400 120.194 7.206 19685 6173 1 12 . 1 1 426 426 MET HA H 426 4.630 4.630 4.417 0.213 19685 6174 1 12 . 1 1 426 426 MET C C 426 173.800 173.800 175.652 -1.852 19685 6175 1 12 . 1 1 426 426 MET CA C 426 59.100 59.100 59.891 -0.791 19685 6176 1 12 . 1 1 426 426 MET CB C 426 31.800 31.800 29.999 1.801 19685 6177 1 12 . 1 1 426 426 MET H H 426 8.540 8.540 8.885 -0.345 19685 6178 1 12 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.261 -0.251 19685 6179 1 12 . 1 1 427 427 PRO C C 427 176.800 176.800 176.623 0.177 19685 6180 1 12 . 1 1 427 427 PRO CA C 427 65.200 65.200 64.252 0.948 19685 6181 1 12 . 1 1 427 427 PRO CB C 427 30.600 30.600 31.293 -0.693 19685 6182 1 12 . 1 1 428 428 PHE N N 428 110.000 110.000 118.282 -8.282 19685 6183 1 12 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.668 -0.398 19685 6184 1 12 . 1 1 428 428 PHE C C 428 174.600 174.600 176.424 -1.824 19685 6185 1 12 . 1 1 428 428 PHE CA C 428 57.700 57.700 59.502 -1.802 19685 6186 1 12 . 1 1 428 428 PHE CB C 428 38.000 38.000 40.214 -2.214 19685 6187 1 12 . 1 1 428 428 PHE H H 428 6.560 6.560 7.936 -1.376 19685 6188 1 12 . 1 1 429 429 GLY N N 429 105.500 105.500 105.301 0.199 19685 6189 1 12 . 1 1 429 429 GLY C C 429 170.100 170.100 172.022 -1.922 19685 6190 1 12 . 1 1 429 429 GLY CA C 429 44.400 44.400 43.495 0.905 19685 6191 1 12 . 1 1 429 429 GLY H H 429 7.650 7.650 7.315 0.335 19685 6192 1 12 . 1 1 430 430 ASN N N 430 117.400 117.400 117.055 0.345 19685 6193 1 12 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.704 -0.074 19685 6194 1 12 . 1 1 430 430 ASN C C 430 173.200 173.200 175.226 -2.026 19685 6195 1 12 . 1 1 430 430 ASN CA C 430 52.600 52.600 53.213 -0.613 19685 6196 1 12 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.519 -2.319 19685 6197 1 12 . 1 1 430 430 ASN H H 430 9.020 9.020 8.470 0.550 19685 6198 1 12 . 1 1 431 431 VAL N N 431 128.000 128.000 119.868 8.132 19685 6199 1 12 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.656 -0.906 19685 6200 1 12 . 1 1 431 431 VAL C C 431 176.400 176.400 174.988 1.412 19685 6201 1 12 . 1 1 431 431 VAL CA C 431 61.800 61.800 60.621 1.179 19685 6202 1 12 . 1 1 431 431 VAL CB C 431 31.900 31.900 33.953 -2.053 19685 6203 1 12 . 1 1 431 431 VAL H H 431 8.480 8.480 8.300 0.180 19685 6204 1 12 . 1 1 432 432 ILE N N 432 128.000 128.000 121.444 6.556 19685 6205 1 12 . 1 1 432 432 ILE HA H 432 3.920 3.920 4.446 -0.526 19685 6206 1 12 . 1 1 432 432 ILE C C 432 176.100 176.100 174.892 1.208 19685 6207 1 12 . 1 1 432 432 ILE CA C 432 62.500 62.500 60.987 1.513 19685 6208 1 12 . 1 1 432 432 ILE CB C 432 37.400 37.400 38.197 -0.797 19685 6209 1 12 . 1 1 432 432 ILE H H 432 8.840 8.840 8.383 0.457 19685 6210 1 12 . 1 1 433 433 SER N N 433 113.600 113.600 114.655 -1.055 19685 6211 1 12 . 1 1 433 433 SER HA H 433 4.440 4.440 4.383 0.057 19685 6212 1 12 . 1 1 433 433 SER C C 433 171.000 171.000 173.427 -2.427 19685 6213 1 12 . 1 1 433 433 SER CA C 433 57.300 57.300 58.356 -1.056 19685 6214 1 12 . 1 1 433 433 SER CB C 433 65.200 65.200 64.823 0.377 19685 6215 1 12 . 1 1 433 433 SER H H 433 7.280 7.280 7.575 -0.295 19685 6216 1 12 . 1 1 434 434 ALA N N 434 125.700 125.700 123.653 2.047 19685 6217 1 12 . 1 1 434 434 ALA HA H 434 4.910 4.910 3.894 1.016 19685 6218 1 12 . 1 1 434 434 ALA C C 434 174.600 174.600 176.385 -1.785 19685 6219 1 12 . 1 1 434 434 ALA CA C 434 51.000 51.000 52.803 -1.803 19685 6220 1 12 . 1 1 434 434 ALA CB C 434 21.200 21.200 17.167 4.033 19685 6221 1 12 . 1 1 434 434 ALA H H 434 8.270 8.270 7.119 1.151 19685 6222 1 12 . 1 1 435 435 LYS N N 435 120.900 120.900 119.130 1.770 19685 6223 1 12 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.152 0.318 19685 6224 1 12 . 1 1 435 435 LYS C C 435 173.800 173.800 175.214 -1.414 19685 6225 1 12 . 1 1 435 435 LYS CA C 435 53.700 53.700 56.090 -2.389 19685 6226 1 12 . 1 1 435 435 LYS CB C 435 36.400 36.400 33.063 3.337 19685 6227 1 12 . 1 1 435 435 LYS H H 435 8.490 8.490 6.766 1.724 19685 6228 1 12 . 1 1 436 436 VAL N N 436 122.200 122.200 123.299 -1.099 19685 6229 1 12 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.376 -0.456 19685 6230 1 12 . 1 1 436 436 VAL C C 436 175.100 175.100 174.435 0.665 19685 6231 1 12 . 1 1 436 436 VAL CA C 436 63.600 63.600 61.721 1.879 19685 6232 1 12 . 1 1 436 436 VAL CB C 436 33.500 33.500 34.044 -0.544 19685 6233 1 12 . 1 1 436 436 VAL H H 436 8.390 8.390 8.418 -0.028 19685 6234 1 12 . 1 1 437 437 PHE N N 437 125.900 125.900 128.152 -2.252 19685 6235 1 12 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.689 -0.289 19685 6236 1 12 . 1 1 437 437 PHE C C 437 173.600 173.600 173.348 0.252 19685 6237 1 12 . 1 1 437 437 PHE CA C 437 57.700 57.700 57.188 0.512 19685 6238 1 12 . 1 1 437 437 PHE CB C 437 39.000 39.000 39.472 -0.472 19685 6239 1 12 . 1 1 437 437 PHE H H 437 8.250 8.250 8.537 -0.287 19685 6240 1 12 . 1 1 438 438 ILE N N 438 121.900 121.900 119.240 2.660 19685 6241 1 12 . 1 1 438 438 ILE HA H 438 4.460 4.460 4.638 -0.178 19685 6242 1 12 . 1 1 438 438 ILE C C 438 175.700 175.700 175.413 0.287 19685 6243 1 12 . 1 1 438 438 ILE CA C 438 58.300 58.300 59.864 -1.564 19685 6244 1 12 . 1 1 438 438 ILE CB C 438 39.700 39.700 41.679 -1.979 19685 6245 1 12 . 1 1 438 438 ILE H H 438 8.520 8.520 7.708 0.812 19685 6246 1 12 . 1 1 439 439 ASP N N 439 126.500 126.500 123.972 2.528 19685 6247 1 12 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.498 0.082 19685 6248 1 12 . 1 1 439 439 ASP C C 439 176.300 176.300 175.726 0.574 19685 6249 1 12 . 1 1 439 439 ASP CA C 439 53.600 53.600 56.110 -2.510 19685 6250 1 12 . 1 1 439 439 ASP CB C 439 42.300 42.300 41.090 1.210 19685 6251 1 12 . 1 1 439 439 ASP H H 439 8.730 8.730 8.546 0.184 19685 6252 1 12 . 1 1 440 440 LYS N N 440 127.300 127.300 114.789 12.511 19685 6253 1 12 . 1 1 440 440 LYS HA H 440 4.070 4.070 4.076 -0.006 19685 6254 1 12 . 1 1 440 440 LYS C C 440 176.900 176.900 175.291 1.609 19685 6255 1 12 . 1 1 440 440 LYS CA C 440 57.800 57.800 58.062 -0.263 19685 6256 1 12 . 1 1 440 440 LYS CB C 440 32.100 32.100 30.946 1.154 19685 6257 1 12 . 1 1 440 440 LYS H H 440 8.930 8.930 8.460 0.470 19685 6258 1 12 . 1 1 441 441 GLN N N 441 117.400 117.400 112.320 5.080 19685 6259 1 12 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.532 -0.302 19685 6260 1 12 . 1 1 441 441 GLN C C 441 177.200 177.200 175.526 1.674 19685 6261 1 12 . 1 1 441 441 GLN CA C 441 57.600 57.600 56.123 1.477 19685 6262 1 12 . 1 1 441 441 GLN CB C 441 28.800 28.800 29.857 -1.057 19685 6263 1 12 . 1 1 441 441 GLN H H 441 8.650 8.650 8.094 0.556 19685 6264 1 12 . 1 1 442 442 THR N N 442 107.300 107.300 107.139 0.161 19685 6265 1 12 . 1 1 442 442 THR HA H 442 4.290 4.290 4.421 -0.131 19685 6266 1 12 . 1 1 442 442 THR C C 442 175.100 175.100 174.155 0.945 19685 6267 1 12 . 1 1 442 442 THR CA C 442 61.200 61.200 61.295 -0.095 19685 6268 1 12 . 1 1 442 442 THR CB C 442 70.300 70.300 69.384 0.916 19685 6269 1 12 . 1 1 442 442 THR H H 442 7.830 7.830 7.836 -0.006 19685 6270 1 12 . 1 1 443 443 ASN N N 443 117.300 117.300 118.926 -1.626 19685 6271 1 12 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.707 -0.407 19685 6272 1 12 . 1 1 443 443 ASN C C 443 173.400 173.400 175.806 -2.406 19685 6273 1 12 . 1 1 443 443 ASN CA C 443 54.300 54.300 53.133 1.167 19685 6274 1 12 . 1 1 443 443 ASN CB C 443 37.600 37.600 39.041 -1.441 19685 6275 1 12 . 1 1 443 443 ASN H H 443 8.470 8.470 8.175 0.295 19685 6276 1 12 . 1 1 444 444 LEU N N 444 118.000 118.000 116.028 1.972 19685 6277 1 12 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.723 -0.163 19685 6278 1 12 . 1 1 444 444 LEU C C 444 176.700 176.700 177.258 -0.558 19685 6279 1 12 . 1 1 444 444 LEU CA C 444 53.300 53.300 55.586 -2.286 19685 6280 1 12 . 1 1 444 444 LEU CB C 444 43.500 43.500 40.732 2.768 19685 6281 1 12 . 1 1 444 444 LEU H H 444 7.660 7.660 7.908 -0.248 19685 6282 1 12 . 1 1 445 445 SER N N 445 115.500 115.500 112.339 3.161 19685 6283 1 12 . 1 1 445 445 SER HA H 445 4.460 4.460 4.294 0.166 19685 6284 1 12 . 1 1 445 445 SER C C 445 176.500 176.500 175.002 1.498 19685 6285 1 12 . 1 1 445 445 SER CA C 445 57.900 57.900 59.195 -1.295 19685 6286 1 12 . 1 1 445 445 SER CB C 445 63.500 63.500 63.526 -0.026 19685 6287 1 12 . 1 1 445 445 SER H H 445 8.840 8.840 8.044 0.796 19685 6288 1 12 . 1 1 446 446 LYS N N 446 125.200 125.200 115.793 9.407 19685 6289 1 12 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.420 0.080 19685 6290 1 12 . 1 1 446 446 LYS C C 446 176.100 176.100 175.663 0.437 19685 6291 1 12 . 1 1 446 446 LYS CA C 446 56.300 56.300 56.129 0.171 19685 6292 1 12 . 1 1 446 446 LYS CB C 446 32.200 32.200 33.517 -1.317 19685 6293 1 12 . 1 1 446 446 LYS H H 446 9.230 9.230 7.182 2.048 19685 6294 1 12 . 1 1 447 447 CYS N N 447 113.000 113.000 116.171 -3.171 19685 6295 1 12 . 1 1 447 447 CYS C C 447 172.500 172.500 171.987 0.513 19685 6296 1 12 . 1 1 447 447 CYS CA C 447 60.400 60.400 58.100 2.300 19685 6297 1 12 . 1 1 447 447 CYS CB C 447 24.900 24.900 29.489 -4.589 19685 6298 1 12 . 1 1 447 447 CYS H H 447 10.020 10.020 7.359 2.661 19685 6299 1 12 . 1 1 448 448 PHE N N 448 115.200 115.200 119.342 -4.142 19685 6300 1 12 . 1 1 448 448 PHE HA H 448 5.340 5.340 5.046 0.294 19685 6301 1 12 . 1 1 448 448 PHE C C 448 172.400 172.400 175.258 -2.858 19685 6302 1 12 . 1 1 448 448 PHE CA C 448 54.700 54.700 56.580 -1.880 19685 6303 1 12 . 1 1 448 448 PHE CB C 448 42.000 42.000 41.190 0.810 19685 6304 1 12 . 1 1 448 448 PHE H H 448 7.810 7.810 8.034 -0.224 19685 6305 1 12 . 1 1 449 449 GLY N N 449 107.700 107.700 107.410 0.290 19685 6306 1 12 . 1 1 449 449 GLY C C 449 170.100 170.100 172.345 -2.245 19685 6307 1 12 . 1 1 449 449 GLY CA C 449 45.200 45.200 45.402 -0.202 19685 6308 1 12 . 1 1 449 449 GLY H H 449 9.310 9.310 8.835 0.475 19685 6309 1 12 . 1 1 450 450 PHE N N 450 119.900 119.900 115.889 4.011 19685 6310 1 12 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.020 0.410 19685 6311 1 12 . 1 1 450 450 PHE C C 450 172.800 172.800 173.108 -0.308 19685 6312 1 12 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.497 -1.497 19685 6313 1 12 . 1 1 450 450 PHE CB C 450 43.600 43.600 40.480 3.120 19685 6314 1 12 . 1 1 450 450 PHE H H 450 8.760 8.760 8.193 0.567 19685 6315 1 12 . 1 1 451 451 VAL N N 451 123.800 123.800 118.990 4.810 19685 6316 1 12 . 1 1 451 451 VAL HA H 451 4.290 4.290 3.953 0.337 19685 6317 1 12 . 1 1 451 451 VAL C C 451 172.400 172.400 175.337 -2.937 19685 6318 1 12 . 1 1 451 451 VAL CA C 451 59.800 59.800 62.061 -2.261 19685 6319 1 12 . 1 1 451 451 VAL CB C 451 36.100 36.100 32.415 3.685 19685 6320 1 12 . 1 1 451 451 VAL H H 451 7.930 7.930 8.206 -0.276 19685 6321 1 12 . 1 1 452 452 SER N N 452 119.600 119.600 115.772 3.828 19685 6322 1 12 . 1 1 452 452 SER HA H 452 5.120 5.120 4.352 0.768 19685 6323 1 12 . 1 1 452 452 SER C C 452 173.200 173.200 173.832 -0.632 19685 6324 1 12 . 1 1 452 452 SER CA C 452 55.700 55.700 59.361 -3.661 19685 6325 1 12 . 1 1 452 452 SER CB C 452 66.100 66.100 62.400 3.700 19685 6326 1 12 . 1 1 452 452 SER H H 452 8.540 8.540 8.349 0.191 19685 6327 1 12 . 1 1 453 453 TYR N N 453 121.400 121.400 118.794 2.606 19685 6328 1 12 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.481 0.899 19685 6329 1 12 . 1 1 453 453 TYR C C 453 173.600 173.600 177.228 -3.628 19685 6330 1 12 . 1 1 453 453 TYR CA C 453 56.500 56.500 58.115 -1.615 19685 6331 1 12 . 1 1 453 453 TYR CB C 453 42.200 42.200 38.610 3.590 19685 6332 1 12 . 1 1 453 453 TYR H H 453 8.380 8.380 7.459 0.921 19685 6333 1 12 . 1 1 454 454 ASP N N 454 113.300 113.300 122.583 -9.283 19685 6334 1 12 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.455 0.035 19685 6335 1 12 . 1 1 454 454 ASP C C 454 176.100 176.100 175.378 0.722 19685 6336 1 12 . 1 1 454 454 ASP CA C 454 52.800 52.800 55.946 -3.146 19685 6337 1 12 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.681 -1.281 19685 6338 1 12 . 1 1 454 454 ASP H H 454 7.860 7.860 8.686 -0.826 19685 6339 1 12 . 1 1 455 455 ASN N N 455 113.800 113.800 113.253 0.547 19685 6340 1 12 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.071 -0.021 19685 6341 1 12 . 1 1 455 455 ASN C C 455 173.100 173.100 173.815 -0.715 19685 6342 1 12 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.396 -0.696 19685 6343 1 12 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.505 0.595 19685 6344 1 12 . 1 1 455 455 ASN H H 455 7.200 7.200 7.846 -0.646 19685 6345 1 12 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.491 -0.321 19685 6346 1 12 . 1 1 456 456 PRO C C 456 177.300 177.300 177.624 -0.324 19685 6347 1 12 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.972 -0.772 19685 6348 1 12 . 1 1 456 456 PRO CB C 456 32.300 32.300 31.880 0.420 19685 6349 1 12 . 1 1 457 457 VAL N N 457 120.900 120.900 110.043 10.857 19685 6350 1 12 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.429 -0.809 19685 6351 1 12 . 1 1 457 457 VAL C C 457 179.000 179.000 176.208 2.792 19685 6352 1 12 . 1 1 457 457 VAL CA C 457 65.900 65.900 62.797 3.103 19685 6353 1 12 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.433 -0.633 19685 6354 1 12 . 1 1 457 457 VAL H H 457 8.120 8.120 7.938 0.182 19685 6355 1 12 . 1 1 458 458 SER N N 458 117.800 117.800 117.573 0.227 19685 6356 1 12 . 1 1 458 458 SER HA H 458 3.940 3.940 4.281 -0.341 19685 6357 1 12 . 1 1 458 458 SER C C 458 173.600 173.600 175.394 -1.794 19685 6358 1 12 . 1 1 458 458 SER CA C 458 61.100 61.100 60.323 0.777 19685 6359 1 12 . 1 1 458 458 SER CB C 458 62.400 62.400 63.405 -1.005 19685 6360 1 12 . 1 1 458 458 SER H H 458 7.830 7.830 7.702 0.128 19685 6361 1 12 . 1 1 459 459 ALA N N 459 120.000 120.000 124.208 -4.208 19685 6362 1 12 . 1 1 459 459 ALA HA H 459 3.750 3.750 4.652 -0.902 19685 6363 1 12 . 1 1 459 459 ALA C C 459 178.100 178.100 178.151 -0.051 19685 6364 1 12 . 1 1 459 459 ALA CA C 459 54.500 54.500 54.501 -0.001 19685 6365 1 12 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.900 -1.000 19685 6366 1 12 . 1 1 459 459 ALA H H 459 6.370 6.370 7.803 -1.433 19685 6367 1 12 . 1 1 460 460 GLN N N 460 116.100 116.100 119.342 -3.242 19685 6368 1 12 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.085 -0.255 19685 6369 1 12 . 1 1 460 460 GLN C C 460 178.000 178.000 176.344 1.656 19685 6370 1 12 . 1 1 460 460 GLN CA C 460 58.500 58.500 57.999 0.501 19685 6371 1 12 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.558 -1.158 19685 6372 1 12 . 1 1 460 460 GLN H H 460 7.710 7.710 8.294 -0.584 19685 6373 1 12 . 1 1 461 461 ALA N N 461 122.800 122.800 119.291 3.509 19685 6374 1 12 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.336 -0.376 19685 6375 1 12 . 1 1 461 461 ALA C C 461 179.500 179.500 176.422 3.078 19685 6376 1 12 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.224 2.276 19685 6377 1 12 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.006 -1.506 19685 6378 1 12 . 1 1 461 461 ALA H H 461 7.880 7.880 7.481 0.399 19685 6379 1 12 . 1 1 462 462 ALA N N 462 121.400 121.400 119.469 1.931 19685 6380 1 12 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.986 -1.586 19685 6381 1 12 . 1 1 462 462 ALA C C 462 179.400 179.400 177.740 1.660 19685 6382 1 12 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.841 1.259 19685 6383 1 12 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.672 -1.972 19685 6384 1 12 . 1 1 462 462 ALA H H 462 7.860 7.860 7.764 0.096 19685 6385 1 12 . 1 1 463 463 ILE N N 463 118.600 118.600 118.674 -0.074 19685 6386 1 12 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.919 -0.679 19685 6387 1 12 . 1 1 463 463 ILE C C 463 177.500 177.500 175.939 1.561 19685 6388 1 12 . 1 1 463 463 ILE CA C 463 66.000 66.000 63.377 2.623 19685 6389 1 12 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.309 -0.008 19685 6390 1 12 . 1 1 463 463 ILE H H 463 8.090 8.090 8.224 -0.134 19685 6391 1 12 . 1 1 464 464 GLN N N 464 117.000 117.000 115.385 1.615 19685 6392 1 12 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.370 -0.500 19685 6393 1 12 . 1 1 464 464 GLN C C 464 177.700 177.700 175.135 2.565 19685 6394 1 12 . 1 1 464 464 GLN CA C 464 58.200 58.200 56.012 2.188 19685 6395 1 12 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.535 -1.635 19685 6396 1 12 . 1 1 464 464 GLN H H 464 7.780 7.780 8.122 -0.342 19685 6397 1 12 . 1 1 465 465 ALA N N 465 117.200 117.200 120.105 -2.905 19685 6398 1 12 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.392 -0.162 19685 6399 1 12 . 1 1 465 465 ALA C C 465 179.200 179.200 176.146 3.054 19685 6400 1 12 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.602 1.198 19685 6401 1 12 . 1 1 465 465 ALA CB C 465 21.100 21.100 19.981 1.119 19685 6402 1 12 . 1 1 465 465 ALA H H 465 7.540 7.540 7.711 -0.171 19685 6403 1 12 . 1 1 466 466 MET N N 466 110.800 110.800 117.207 -6.407 19685 6404 1 12 . 1 1 466 466 MET HA H 466 4.820 4.820 4.614 0.206 19685 6405 1 12 . 1 1 466 466 MET C C 466 177.600 177.600 175.348 2.252 19685 6406 1 12 . 1 1 466 466 MET CA C 466 53.300 53.300 55.817 -2.517 19685 6407 1 12 . 1 1 466 466 MET CB C 466 31.600 31.600 35.452 -3.852 19685 6408 1 12 . 1 1 466 466 MET H H 466 8.230 8.230 7.771 0.459 19685 6409 1 12 . 1 1 467 467 ASN N N 467 119.100 119.100 119.578 -0.478 19685 6410 1 12 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.615 -0.125 19685 6411 1 12 . 1 1 467 467 ASN C C 467 176.300 176.300 176.735 -0.435 19685 6412 1 12 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.610 1.590 19685 6413 1 12 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.266 -0.066 19685 6414 1 12 . 1 1 467 467 ASN H H 467 8.560 8.560 7.652 0.908 19685 6415 1 12 . 1 1 468 468 GLY N N 468 117.900 117.900 114.082 3.818 19685 6416 1 12 . 1 1 468 468 GLY C C 468 172.800 172.800 174.398 -1.598 19685 6417 1 12 . 1 1 468 468 GLY CA C 468 45.300 45.300 45.964 -0.664 19685 6418 1 12 . 1 1 468 468 GLY H H 468 8.930 8.930 9.072 -0.142 19685 6419 1 12 . 1 1 469 469 PHE N N 469 123.300 123.300 120.705 2.595 19685 6420 1 12 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.573 -0.383 19685 6421 1 12 . 1 1 469 469 PHE C C 469 174.400 174.400 174.927 -0.527 19685 6422 1 12 . 1 1 469 469 PHE CA C 469 58.700 58.700 57.891 0.809 19685 6423 1 12 . 1 1 469 469 PHE CB C 469 40.600 40.600 40.068 0.532 19685 6424 1 12 . 1 1 469 469 PHE H H 469 7.950 7.950 7.642 0.308 19685 6425 1 12 . 1 1 470 470 GLN N N 470 129.200 129.200 117.962 11.238 19685 6426 1 12 . 1 1 470 470 GLN HA H 470 4.590 4.590 3.968 0.622 19685 6427 1 12 . 1 1 470 470 GLN C C 470 174.100 174.100 173.776 0.324 19685 6428 1 12 . 1 1 470 470 GLN CA C 470 55.500 55.500 56.717 -1.217 19685 6429 1 12 . 1 1 470 470 GLN CB C 470 28.800 28.800 28.422 0.378 19685 6430 1 12 . 1 1 470 470 GLN H H 470 8.330 8.330 8.229 0.101 19685 6431 1 12 . 1 1 471 471 ILE N N 471 126.300 126.300 124.367 1.933 19685 6432 1 12 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.225 -0.055 19685 6433 1 12 . 1 1 471 471 ILE C C 471 175.400 175.400 175.214 0.186 19685 6434 1 12 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.347 -0.747 19685 6435 1 12 . 1 1 471 471 ILE CB C 471 39.100 39.100 41.236 -2.136 19685 6436 1 12 . 1 1 471 471 ILE H H 471 8.440 8.440 7.950 0.490 19685 6437 1 12 . 1 1 472 472 GLY N N 472 117.500 117.500 115.808 1.692 19685 6438 1 12 . 1 1 472 472 GLY C C 472 174.700 174.700 174.654 0.046 19685 6439 1 12 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.367 1.133 19685 6440 1 12 . 1 1 472 472 GLY H H 472 8.980 8.980 8.430 0.550 19685 6441 1 12 . 1 1 473 473 MET N N 473 124.100 124.100 120.131 3.969 19685 6442 1 12 . 1 1 473 473 MET HA H 473 4.380 4.380 4.485 -0.105 19685 6443 1 12 . 1 1 473 473 MET C C 473 175.700 175.700 176.208 -0.508 19685 6444 1 12 . 1 1 473 473 MET CA C 473 55.000 55.000 56.407 -1.407 19685 6445 1 12 . 1 1 473 473 MET CB C 473 32.900 32.900 32.321 0.580 19685 6446 1 12 . 1 1 473 473 MET H H 473 9.070 9.070 8.596 0.474 19685 6447 1 12 . 1 1 474 474 LYS N N 474 118.700 118.700 118.942 -0.242 19685 6448 1 12 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.522 -0.042 19685 6449 1 12 . 1 1 474 474 LYS C C 474 174.300 174.300 174.306 -0.006 19685 6450 1 12 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.757 -0.157 19685 6451 1 12 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.227 -0.127 19685 6452 1 12 . 1 1 474 474 LYS H H 474 7.770 7.770 7.381 0.389 19685 6453 1 12 . 1 1 475 475 ARG N N 475 119.600 119.600 118.262 1.338 19685 6454 1 12 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.534 0.266 19685 6455 1 12 . 1 1 475 475 ARG C C 475 175.700 175.700 173.955 1.745 19685 6456 1 12 . 1 1 475 475 ARG CA C 475 54.000 54.000 54.869 -0.869 19685 6457 1 12 . 1 1 475 475 ARG CB C 475 31.300 31.300 31.882 -0.582 19685 6458 1 12 . 1 1 475 475 ARG H H 475 8.350 8.350 8.299 0.051 19685 6459 1 12 . 1 1 476 476 LEU N N 476 123.500 123.500 123.458 0.042 19685 6460 1 12 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.541 -0.111 19685 6461 1 12 . 1 1 476 476 LEU C C 476 177.600 177.600 175.491 2.109 19685 6462 1 12 . 1 1 476 476 LEU CA C 476 55.500 55.500 54.151 1.349 19685 6463 1 12 . 1 1 476 476 LEU CB C 476 42.800 42.800 43.507 -0.707 19685 6464 1 12 . 1 1 476 476 LEU H H 476 9.130 9.130 8.580 0.550 19685 6465 1 12 . 1 1 477 477 LYS N N 477 123.200 123.200 126.238 -3.038 19685 6466 1 12 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.784 0.376 19685 6467 1 12 . 1 1 477 477 LYS C C 477 174.100 174.100 174.540 -0.440 19685 6468 1 12 . 1 1 477 477 LYS CA C 477 54.500 54.500 54.342 0.158 19685 6469 1 12 . 1 1 477 477 LYS CB C 477 34.900 34.900 34.883 0.017 19685 6470 1 12 . 1 1 477 477 LYS H H 477 8.090 8.090 8.416 -0.326 19685 6471 1 12 . 1 1 478 478 VAL N N 478 127.100 127.100 121.973 5.127 19685 6472 1 12 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.302 0.598 19685 6473 1 12 . 1 1 478 478 VAL C C 478 173.700 173.700 174.028 -0.328 19685 6474 1 12 . 1 1 478 478 VAL CA C 478 61.000 61.000 59.672 1.328 19685 6475 1 12 . 1 1 478 478 VAL CB C 478 33.700 33.700 34.991 -1.291 19685 6476 1 12 . 1 1 478 478 VAL H H 478 8.820 8.820 8.455 0.365 19685 6477 1 12 . 1 1 479 479 GLN N N 479 123.600 123.600 120.105 3.495 19685 6478 1 12 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.540 0.270 19685 6479 1 12 . 1 1 479 479 GLN C C 479 173.600 173.600 173.633 -0.033 19685 6480 1 12 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.006 -0.806 19685 6481 1 12 . 1 1 479 479 GLN CB C 479 33.500 33.500 30.410 3.091 19685 6482 1 12 . 1 1 479 479 GLN H H 479 9.130 9.130 8.163 0.967 19685 6483 1 12 . 1 1 480 480 LEU N N 480 123.200 123.200 119.953 3.247 19685 6484 1 12 . 1 1 480 480 LEU HA H 480 4.440 4.440 3.987 0.453 19685 6485 1 12 . 1 1 480 480 LEU C C 480 177.100 177.100 177.593 -0.493 19685 6486 1 12 . 1 1 480 480 LEU CA C 480 54.600 54.600 55.156 -0.556 19685 6487 1 12 . 1 1 480 480 LEU CB C 480 42.400 42.400 42.486 -0.086 19685 6488 1 12 . 1 1 480 480 LEU H H 480 8.840 8.840 8.369 0.471 19685 6489 1 12 . 1 1 481 481 LYS N N 481 124.500 124.500 118.449 6.051 19685 6490 1 12 . 1 1 481 481 LYS HA H 481 4.310 4.310 3.058 1.252 19685 6491 1 12 . 1 1 481 481 LYS C C 481 175.200 175.200 176.314 -1.114 19685 6492 1 12 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.053 -0.353 19685 6493 1 12 . 1 1 481 481 LYS CB C 481 33.100 33.100 31.658 1.442 19685 6494 1 12 . 1 1 481 481 LYS H H 481 8.400 8.400 7.872 0.528 19685 6495 1 12 . 1 1 482 482 ARG N N 482 126.600 126.600 118.883 7.717 19685 6496 1 12 . 1 1 482 482 ARG HA H 482 4.350 4.350 4.194 0.156 19685 6497 1 12 . 1 1 482 482 ARG C C 482 175.800 175.800 176.191 -0.391 19685 6498 1 12 . 1 1 482 482 ARG CA C 482 55.600 55.600 56.015 -0.415 19685 6499 1 12 . 1 1 482 482 ARG CB C 482 31.100 31.100 29.889 1.212 19685 6500 1 12 . 1 1 482 482 ARG H H 482 8.770 8.770 7.308 1.462 19685 6501 1 12 . 1 1 483 483 SER N N 483 118.100 118.100 113.039 5.061 19685 6502 1 12 . 1 1 483 483 SER HA H 483 4.400 4.400 4.124 0.276 19685 6503 1 12 . 1 1 483 483 SER C C 483 174.200 174.200 174.088 0.112 19685 6504 1 12 . 1 1 483 483 SER CA C 483 58.000 58.000 58.984 -0.984 19685 6505 1 12 . 1 1 483 483 SER CB C 483 63.500 63.500 61.888 1.612 19685 6506 1 12 . 1 1 483 483 SER H H 483 8.610 8.610 8.757 -0.147 19685 6507 1 12 . 1 1 484 484 LYS N N 484 123.000 123.000 120.618 2.382 19685 6508 1 12 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.372 -0.162 19685 6509 1 12 . 1 1 484 484 LYS C C 484 175.900 175.900 176.561 -0.661 19685 6510 1 12 . 1 1 484 484 LYS CA C 484 56.300 56.300 57.139 -0.839 19685 6511 1 12 . 1 1 484 484 LYS CB C 484 32.500 32.500 33.569 -1.069 19685 6512 1 12 . 1 1 484 484 LYS H H 484 8.560 8.560 7.763 0.797 19685 6513 1 12 . 1 1 485 485 ASN N N 485 119.600 119.600 121.738 -2.138 19685 6514 1 12 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.579 0.021 19685 6515 1 12 . 1 1 485 485 ASN C C 485 174.400 174.400 175.208 -0.808 19685 6516 1 12 . 1 1 485 485 ASN CA C 485 52.900 52.900 54.496 -1.596 19685 6517 1 12 . 1 1 485 485 ASN CB C 485 38.400 38.400 38.975 -0.575 19685 6518 1 12 . 1 1 485 485 ASN H H 485 8.560 8.560 8.512 0.048 19685 6519 1 12 . 1 1 486 486 ASP N N 486 121.100 121.100 118.449 2.651 19685 6520 1 12 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.723 -0.203 19685 6521 1 12 . 1 1 486 486 ASP C C 486 175.700 175.700 175.651 0.049 19685 6522 1 12 . 1 1 486 486 ASP CA C 486 54.000 54.000 53.865 0.135 19685 6523 1 12 . 1 1 486 486 ASP CB C 486 40.800 40.800 41.230 -0.430 19685 6524 1 12 . 1 1 486 486 ASP H H 486 8.250 8.250 8.278 -0.028 19685 6525 1 12 . 1 1 487 487 SER N N 487 115.400 115.400 115.726 -0.326 19685 6526 1 12 . 1 1 487 487 SER HA H 487 4.310 4.310 4.598 -0.288 19685 6527 1 12 . 1 1 487 487 SER C C 487 172.800 172.800 172.617 0.183 19685 6528 1 12 . 1 1 487 487 SER CA C 487 57.700 57.700 58.173 -0.473 19685 6529 1 12 . 1 1 487 487 SER CB C 487 63.600 63.600 63.956 -0.356 19685 6530 1 12 . 1 1 487 487 SER H H 487 8.090 8.090 8.071 0.019 19685 6531 1 12 . 1 1 488 488 LYS N N 488 122.300 122.300 122.810 -0.510 19685 6532 1 12 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.822 -0.772 19685 6533 1 12 . 1 1 488 488 LYS C C 488 174.500 174.500 174.054 0.446 19685 6534 1 12 . 1 1 488 488 LYS CA C 488 54.000 54.000 54.133 -0.133 19685 6535 1 12 . 1 1 488 488 LYS CB C 488 32.400 32.400 32.366 0.034 19685 6536 1 12 . 1 1 488 488 LYS H H 488 8.090 8.090 8.066 0.024 19685 6537 1 12 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.602 -0.322 19685 6538 1 12 . 1 1 489 489 PRO C C 489 175.000 175.000 175.824 -0.824 19685 6539 1 12 . 1 1 489 489 PRO CA C 489 63.200 63.200 63.089 0.111 19685 6540 1 12 . 1 1 489 489 PRO CB C 489 31.100 31.100 31.896 -0.796 19685 6541 1 13 . 1 1 395 395 SER N N 395 115.500 115.500 115.373 0.127 19685 6542 1 13 . 1 1 395 395 SER HA H 395 4.300 4.300 4.215 0.085 19685 6543 1 13 . 1 1 395 395 SER C C 395 173.900 173.900 173.953 -0.053 19685 6544 1 13 . 1 1 395 395 SER CA C 395 57.900 57.900 58.728 -0.828 19685 6545 1 13 . 1 1 395 395 SER CB C 395 63.400 63.400 63.311 0.089 19685 6546 1 13 . 1 1 395 395 SER H H 395 8.200 8.200 8.373 -0.173 19685 6547 1 13 . 1 1 396 396 HIS N N 396 123.500 123.500 118.186 5.314 19685 6548 1 13 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.696 -0.136 19685 6549 1 13 . 1 1 396 396 HIS C C 396 174.100 174.100 176.088 -1.988 19685 6550 1 13 . 1 1 396 396 HIS CA C 396 53.700 53.700 55.885 -2.184 19685 6551 1 13 . 1 1 396 396 HIS CB C 396 32.200 32.200 30.441 1.759 19685 6552 1 13 . 1 1 396 396 HIS H H 396 8.120 8.120 8.335 -0.215 19685 6553 1 13 . 1 1 397 397 MET N N 397 121.200 121.200 121.006 0.194 19685 6554 1 13 . 1 1 397 397 MET HA H 397 4.320 4.320 4.269 0.051 19685 6555 1 13 . 1 1 397 397 MET C C 397 175.400 175.400 176.360 -0.960 19685 6556 1 13 . 1 1 397 397 MET CA C 397 55.000 55.000 57.967 -2.967 19685 6557 1 13 . 1 1 397 397 MET CB C 397 32.500 32.500 32.553 -0.053 19685 6558 1 13 . 1 1 397 397 MET H H 397 8.300 8.300 8.525 -0.225 19685 6559 1 13 . 1 1 398 398 GLN N N 398 122.100 122.100 113.715 8.385 19685 6560 1 13 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.231 -0.041 19685 6561 1 13 . 1 1 398 398 GLN C C 398 174.800 174.800 176.406 -1.606 19685 6562 1 13 . 1 1 398 398 GLN CA C 398 55.200 55.200 57.132 -1.932 19685 6563 1 13 . 1 1 398 398 GLN CB C 398 28.900 28.900 28.364 0.536 19685 6564 1 13 . 1 1 398 398 GLN H H 398 8.540 8.540 8.436 0.104 19685 6565 1 13 . 1 1 399 399 LYS N N 399 123.000 123.000 116.970 6.030 19685 6566 1 13 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.312 -0.092 19685 6567 1 13 . 1 1 399 399 LYS C C 399 174.800 174.800 175.898 -1.098 19685 6568 1 13 . 1 1 399 399 LYS CA C 399 55.600 55.600 55.697 -0.097 19685 6569 1 13 . 1 1 399 399 LYS CB C 399 33.000 33.000 32.789 0.211 19685 6570 1 13 . 1 1 399 399 LYS H H 399 8.180 8.180 7.600 0.580 19685 6571 1 13 . 1 1 400 400 GLU N N 400 122.000 122.000 115.899 6.101 19685 6572 1 13 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.645 -0.215 19685 6573 1 13 . 1 1 400 400 GLU C C 400 176.400 176.400 176.216 0.184 19685 6574 1 13 . 1 1 400 400 GLU CA C 400 55.400 55.400 55.726 -0.326 19685 6575 1 13 . 1 1 400 400 GLU CB C 400 31.400 31.400 31.447 -0.047 19685 6576 1 13 . 1 1 400 400 GLU H H 400 8.350 8.350 7.406 0.944 19685 6577 1 13 . 1 1 401 401 GLY N N 401 109.500 109.500 110.410 -0.910 19685 6578 1 13 . 1 1 401 401 GLY C C 401 171.500 171.500 172.988 -1.488 19685 6579 1 13 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.519 -0.819 19685 6580 1 13 . 1 1 401 401 GLY H H 401 9.050 9.050 7.579 1.471 19685 6581 1 13 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.506 -0.086 19685 6582 1 13 . 1 1 402 402 PRO C C 402 173.900 173.900 176.159 -2.259 19685 6583 1 13 . 1 1 402 402 PRO CA C 402 61.900 61.900 64.611 -2.711 19685 6584 1 13 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.206 -0.006 19685 6585 1 13 . 1 1 403 403 GLU N N 403 119.600 119.600 119.923 -0.323 19685 6586 1 13 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.439 -0.479 19685 6587 1 13 . 1 1 403 403 GLU C C 403 177.300 177.300 176.340 0.960 19685 6588 1 13 . 1 1 403 403 GLU CA C 403 58.100 58.100 56.849 1.251 19685 6589 1 13 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.037 -1.037 19685 6590 1 13 . 1 1 403 403 GLU H H 403 8.420 8.420 7.802 0.618 19685 6591 1 13 . 1 1 404 404 GLY N N 404 112.800 112.800 106.814 5.986 19685 6592 1 13 . 1 1 404 404 GLY C C 404 173.300 173.300 174.442 -1.142 19685 6593 1 13 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.149 -0.249 19685 6594 1 13 . 1 1 404 404 GLY H H 404 8.500 8.500 8.387 0.113 19685 6595 1 13 . 1 1 405 405 ALA N N 405 120.000 120.000 123.777 -3.777 19685 6596 1 13 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.218 0.332 19685 6597 1 13 . 1 1 405 405 ALA C C 405 174.100 174.100 175.777 -1.677 19685 6598 1 13 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.941 -1.441 19685 6599 1 13 . 1 1 405 405 ALA CB C 405 20.800 20.800 16.922 3.878 19685 6600 1 13 . 1 1 405 405 ALA H H 405 8.360 8.360 8.233 0.127 19685 6601 1 13 . 1 1 406 406 ASN N N 406 115.500 115.500 117.064 -1.564 19685 6602 1 13 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.313 -0.123 19685 6603 1 13 . 1 1 406 406 ASN C C 406 172.900 172.900 174.591 -1.691 19685 6604 1 13 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.691 0.909 19685 6605 1 13 . 1 1 406 406 ASN CB C 406 40.900 40.900 38.792 2.108 19685 6606 1 13 . 1 1 406 406 ASN H H 406 7.690 7.690 8.115 -0.425 19685 6607 1 13 . 1 1 407 407 LEU N N 407 123.400 123.400 120.322 3.078 19685 6608 1 13 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.040 0.920 19685 6609 1 13 . 1 1 407 407 LEU C C 407 174.900 174.900 176.591 -1.691 19685 6610 1 13 . 1 1 407 407 LEU CA C 407 53.100 53.100 56.523 -3.422 19685 6611 1 13 . 1 1 407 407 LEU CB C 407 45.400 45.400 41.745 3.655 19685 6612 1 13 . 1 1 407 407 LEU H H 407 9.290 9.290 7.525 1.765 19685 6613 1 13 . 1 1 408 408 PHE N N 408 118.700 118.700 121.517 -2.817 19685 6614 1 13 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.807 0.493 19685 6615 1 13 . 1 1 408 408 PHE C C 408 174.200 174.200 175.987 -1.787 19685 6616 1 13 . 1 1 408 408 PHE CA C 408 56.300 56.300 56.908 -0.608 19685 6617 1 13 . 1 1 408 408 PHE CB C 408 42.700 42.700 38.139 4.561 19685 6618 1 13 . 1 1 408 408 PHE H H 408 9.150 9.150 8.223 0.927 19685 6619 1 13 . 1 1 409 409 ILE N N 409 120.800 120.800 123.903 -3.103 19685 6620 1 13 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.255 0.715 19685 6621 1 13 . 1 1 409 409 ILE C C 409 173.900 173.900 175.368 -1.468 19685 6622 1 13 . 1 1 409 409 ILE CA C 409 59.000 59.000 62.268 -3.268 19685 6623 1 13 . 1 1 409 409 ILE CB C 409 40.400 40.400 37.389 3.011 19685 6624 1 13 . 1 1 409 409 ILE H H 409 8.380 8.380 7.783 0.597 19685 6625 1 13 . 1 1 410 410 TYR N N 410 123.200 123.200 123.595 -0.395 19685 6626 1 13 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.918 0.022 19685 6627 1 13 . 1 1 410 410 TYR C C 410 174.300 174.300 175.097 -0.797 19685 6628 1 13 . 1 1 410 410 TYR CA C 410 56.200 56.200 57.462 -1.262 19685 6629 1 13 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.350 1.450 19685 6630 1 13 . 1 1 410 410 TYR H H 410 9.440 9.440 8.747 0.693 19685 6631 1 13 . 1 1 411 411 HIS N N 411 112.100 112.100 121.945 -9.845 19685 6632 1 13 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.400 0.050 19685 6633 1 13 . 1 1 411 411 HIS C C 411 173.300 173.300 174.921 -1.621 19685 6634 1 13 . 1 1 411 411 HIS CA C 411 55.900 55.900 54.918 0.982 19685 6635 1 13 . 1 1 411 411 HIS CB C 411 26.200 26.200 27.628 -1.428 19685 6636 1 13 . 1 1 411 411 HIS H H 411 8.580 8.580 8.310 0.270 19685 6637 1 13 . 1 1 412 412 LEU N N 412 115.100 115.100 123.740 -8.640 19685 6638 1 13 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.300 -0.340 19685 6639 1 13 . 1 1 412 412 LEU C C 412 175.100 175.100 175.884 -0.784 19685 6640 1 13 . 1 1 412 412 LEU CA C 412 52.400 52.400 54.098 -1.698 19685 6641 1 13 . 1 1 412 412 LEU CB C 412 42.000 42.000 42.441 -0.441 19685 6642 1 13 . 1 1 412 412 LEU H H 412 7.560 7.560 7.615 -0.055 19685 6643 1 13 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.348 -0.078 19685 6644 1 13 . 1 1 413 413 PRO C C 413 177.600 177.600 175.845 1.755 19685 6645 1 13 . 1 1 413 413 PRO CA C 413 62.300 62.300 62.751 -0.451 19685 6646 1 13 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.046 0.154 19685 6647 1 13 . 1 1 414 414 GLN N N 414 125.500 125.500 116.991 8.509 19685 6648 1 13 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.421 -0.341 19685 6649 1 13 . 1 1 414 414 GLN C C 414 175.400 175.400 175.642 -0.242 19685 6650 1 13 . 1 1 414 414 GLN CA C 414 57.000 57.000 54.954 2.046 19685 6651 1 13 . 1 1 414 414 GLN CB C 414 28.500 28.500 30.502 -2.002 19685 6652 1 13 . 1 1 414 414 GLN H H 414 9.170 9.170 8.067 1.103 19685 6653 1 13 . 1 1 415 415 GLU N N 415 115.300 115.300 118.298 -2.998 19685 6654 1 13 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.087 0.173 19685 6655 1 13 . 1 1 415 415 GLU C C 415 176.700 176.700 174.757 1.943 19685 6656 1 13 . 1 1 415 415 GLU CA C 415 58.700 58.700 57.742 0.958 19685 6657 1 13 . 1 1 415 415 GLU CB C 415 28.300 28.300 29.315 -1.015 19685 6658 1 13 . 1 1 415 415 GLU H H 415 9.390 9.390 8.952 0.438 19685 6659 1 13 . 1 1 416 416 PHE N N 416 121.700 121.700 115.558 6.142 19685 6660 1 13 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.268 -0.658 19685 6661 1 13 . 1 1 416 416 PHE C C 416 176.400 176.400 175.356 1.044 19685 6662 1 13 . 1 1 416 416 PHE CA C 416 57.400 57.400 56.521 0.879 19685 6663 1 13 . 1 1 416 416 PHE CB C 416 38.700 38.700 41.601 -2.901 19685 6664 1 13 . 1 1 416 416 PHE H H 416 7.610 7.610 7.733 -0.123 19685 6665 1 13 . 1 1 417 417 GLY N N 417 113.000 113.000 107.917 5.083 19685 6666 1 13 . 1 1 417 417 GLY C C 417 174.300 174.300 172.921 1.379 19685 6667 1 13 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.306 -3.406 19685 6668 1 13 . 1 1 417 417 GLY H H 417 9.740 9.740 9.125 0.615 19685 6669 1 13 . 1 1 418 418 ASP N N 418 121.500 121.500 118.002 3.498 19685 6670 1 13 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.662 -0.722 19685 6671 1 13 . 1 1 418 418 ASP C C 418 177.900 177.900 176.771 1.129 19685 6672 1 13 . 1 1 418 418 ASP CA C 418 57.600 57.600 55.060 2.540 19685 6673 1 13 . 1 1 418 418 ASP CB C 418 39.700 39.700 42.376 -2.676 19685 6674 1 13 . 1 1 418 418 ASP H H 418 8.680 8.680 8.406 0.274 19685 6675 1 13 . 1 1 419 419 GLN N N 419 116.400 116.400 120.395 -3.995 19685 6676 1 13 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.218 -0.308 19685 6677 1 13 . 1 1 419 419 GLN C C 419 177.600 177.600 175.920 1.680 19685 6678 1 13 . 1 1 419 419 GLN CA C 419 58.000 58.000 58.017 -0.017 19685 6679 1 13 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.483 -1.083 19685 6680 1 13 . 1 1 419 419 GLN H H 419 8.780 8.780 8.508 0.272 19685 6681 1 13 . 1 1 420 420 ASP N N 420 117.500 117.500 116.970 0.530 19685 6682 1 13 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.534 -0.524 19685 6683 1 13 . 1 1 420 420 ASP C C 420 178.000 178.000 178.101 -0.101 19685 6684 1 13 . 1 1 420 420 ASP CA C 420 56.700 56.700 54.704 1.996 19685 6685 1 13 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.441 -0.641 19685 6686 1 13 . 1 1 420 420 ASP H H 420 7.210 7.210 8.316 -1.106 19685 6687 1 13 . 1 1 421 421 ILE N N 421 117.000 117.000 120.717 -3.717 19685 6688 1 13 . 1 1 421 421 ILE HA H 421 4.080 4.080 4.110 -0.030 19685 6689 1 13 . 1 1 421 421 ILE C C 421 176.500 176.500 176.780 -0.280 19685 6690 1 13 . 1 1 421 421 ILE CA C 421 64.000 64.000 64.159 -0.159 19685 6691 1 13 . 1 1 421 421 ILE CB C 421 37.300 37.300 37.892 -0.591 19685 6692 1 13 . 1 1 421 421 ILE H H 421 7.610 7.610 7.801 -0.191 19685 6693 1 13 . 1 1 422 422 LEU N N 422 123.200 123.200 116.644 6.556 19685 6694 1 13 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.134 -0.374 19685 6695 1 13 . 1 1 422 422 LEU C C 422 177.800 177.800 177.082 0.718 19685 6696 1 13 . 1 1 422 422 LEU CA C 422 58.600 58.600 56.205 2.396 19685 6697 1 13 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.349 -0.148 19685 6698 1 13 . 1 1 422 422 LEU H H 422 7.870 7.870 7.575 0.295 19685 6699 1 13 . 1 1 423 423 GLN N N 423 115.600 115.600 116.835 -1.235 19685 6700 1 13 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.344 -0.464 19685 6701 1 13 . 1 1 423 423 GLN C C 423 177.800 177.800 175.930 1.870 19685 6702 1 13 . 1 1 423 423 GLN CA C 423 58.600 58.600 56.426 2.174 19685 6703 1 13 . 1 1 423 423 GLN CB C 423 27.900 27.900 30.557 -2.657 19685 6704 1 13 . 1 1 423 423 GLN H H 423 7.860 7.860 7.869 -0.009 19685 6705 1 13 . 1 1 424 424 MET N N 424 115.500 115.500 116.906 -1.406 19685 6706 1 13 . 1 1 424 424 MET HA H 424 3.910 3.910 4.555 -0.645 19685 6707 1 13 . 1 1 424 424 MET C C 424 175.500 175.500 175.822 -0.322 19685 6708 1 13 . 1 1 424 424 MET CA C 424 57.800 57.800 55.134 2.666 19685 6709 1 13 . 1 1 424 424 MET CB C 424 34.300 34.300 34.699 -0.399 19685 6710 1 13 . 1 1 424 424 MET H H 424 7.560 7.560 7.758 -0.198 19685 6711 1 13 . 1 1 425 425 PHE N N 425 112.300 112.300 117.349 -5.049 19685 6712 1 13 . 1 1 425 425 PHE HA H 425 4.700 4.700 5.059 -0.359 19685 6713 1 13 . 1 1 425 425 PHE C C 425 177.300 177.300 176.882 0.418 19685 6714 1 13 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.114 1.786 19685 6715 1 13 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.411 -1.911 19685 6716 1 13 . 1 1 425 425 PHE H H 425 7.680 7.680 7.870 -0.190 19685 6717 1 13 . 1 1 426 426 MET N N 426 127.400 127.400 120.060 7.340 19685 6718 1 13 . 1 1 426 426 MET HA H 426 4.630 4.630 4.232 0.398 19685 6719 1 13 . 1 1 426 426 MET C C 426 173.800 173.800 175.352 -1.552 19685 6720 1 13 . 1 1 426 426 MET CA C 426 59.100 59.100 60.143 -1.043 19685 6721 1 13 . 1 1 426 426 MET CB C 426 31.800 31.800 30.114 1.686 19685 6722 1 13 . 1 1 426 426 MET H H 426 8.540 8.540 8.503 0.037 19685 6723 1 13 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.226 -0.216 19685 6724 1 13 . 1 1 427 427 PRO C C 427 176.800 176.800 176.769 0.031 19685 6725 1 13 . 1 1 427 427 PRO CA C 427 65.200 65.200 64.126 1.074 19685 6726 1 13 . 1 1 427 427 PRO CB C 427 30.600 30.600 30.705 -0.105 19685 6727 1 13 . 1 1 428 428 PHE N N 428 110.000 110.000 117.972 -7.972 19685 6728 1 13 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.632 -0.362 19685 6729 1 13 . 1 1 428 428 PHE C C 428 174.600 174.600 176.317 -1.717 19685 6730 1 13 . 1 1 428 428 PHE CA C 428 57.700 57.700 59.420 -1.720 19685 6731 1 13 . 1 1 428 428 PHE CB C 428 38.000 38.000 40.279 -2.279 19685 6732 1 13 . 1 1 428 428 PHE H H 428 6.560 6.560 7.256 -0.696 19685 6733 1 13 . 1 1 429 429 GLY N N 429 105.500 105.500 103.141 2.359 19685 6734 1 13 . 1 1 429 429 GLY C C 429 170.100 170.100 172.596 -2.496 19685 6735 1 13 . 1 1 429 429 GLY CA C 429 44.400 44.400 44.384 0.016 19685 6736 1 13 . 1 1 429 429 GLY H H 429 7.650 7.650 7.424 0.226 19685 6737 1 13 . 1 1 430 430 ASN N N 430 117.400 117.400 116.650 0.750 19685 6738 1 13 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.302 0.328 19685 6739 1 13 . 1 1 430 430 ASN C C 430 173.200 173.200 175.066 -1.866 19685 6740 1 13 . 1 1 430 430 ASN CA C 430 52.600 52.600 54.516 -1.916 19685 6741 1 13 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.100 -1.900 19685 6742 1 13 . 1 1 430 430 ASN H H 430 9.020 9.020 7.675 1.345 19685 6743 1 13 . 1 1 431 431 VAL N N 431 128.000 128.000 119.135 8.865 19685 6744 1 13 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.211 -0.461 19685 6745 1 13 . 1 1 431 431 VAL C C 431 176.400 176.400 177.626 -1.226 19685 6746 1 13 . 1 1 431 431 VAL CA C 431 61.800 61.800 63.649 -1.849 19685 6747 1 13 . 1 1 431 431 VAL CB C 431 31.900 31.900 32.521 -0.621 19685 6748 1 13 . 1 1 431 431 VAL H H 431 8.480 8.480 8.657 -0.177 19685 6749 1 13 . 1 1 432 432 ILE N N 432 128.000 128.000 117.500 10.500 19685 6750 1 13 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.565 0.355 19685 6751 1 13 . 1 1 432 432 ILE C C 432 176.100 176.100 175.872 0.228 19685 6752 1 13 . 1 1 432 432 ILE CA C 432 62.500 62.500 63.877 -1.377 19685 6753 1 13 . 1 1 432 432 ILE CB C 432 37.400 37.400 36.675 0.725 19685 6754 1 13 . 1 1 432 432 ILE H H 432 8.840 8.840 9.025 -0.185 19685 6755 1 13 . 1 1 433 433 SER N N 433 113.600 113.600 113.887 -0.287 19685 6756 1 13 . 1 1 433 433 SER HA H 433 4.440 4.440 4.579 -0.139 19685 6757 1 13 . 1 1 433 433 SER C C 433 171.000 171.000 172.147 -1.147 19685 6758 1 13 . 1 1 433 433 SER CA C 433 57.300 57.300 57.877 -0.577 19685 6759 1 13 . 1 1 433 433 SER CB C 433 65.200 65.200 66.142 -0.942 19685 6760 1 13 . 1 1 433 433 SER H H 433 7.280 7.280 7.989 -0.709 19685 6761 1 13 . 1 1 434 434 ALA N N 434 125.700 125.700 124.610 1.090 19685 6762 1 13 . 1 1 434 434 ALA HA H 434 4.910 4.910 4.993 -0.083 19685 6763 1 13 . 1 1 434 434 ALA C C 434 174.600 174.600 175.643 -1.043 19685 6764 1 13 . 1 1 434 434 ALA CA C 434 51.000 51.000 50.749 0.251 19685 6765 1 13 . 1 1 434 434 ALA CB C 434 21.200 21.200 22.493 -1.293 19685 6766 1 13 . 1 1 434 434 ALA H H 434 8.270 8.270 8.278 -0.008 19685 6767 1 13 . 1 1 435 435 LYS N N 435 120.900 120.900 120.807 0.093 19685 6768 1 13 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.601 -0.131 19685 6769 1 13 . 1 1 435 435 LYS C C 435 173.800 173.800 174.163 -0.363 19685 6770 1 13 . 1 1 435 435 LYS CA C 435 53.700 53.700 54.959 -1.259 19685 6771 1 13 . 1 1 435 435 LYS CB C 435 36.400 36.400 35.694 0.706 19685 6772 1 13 . 1 1 435 435 LYS H H 435 8.490 8.490 7.951 0.539 19685 6773 1 13 . 1 1 436 436 VAL N N 436 122.200 122.200 121.316 0.884 19685 6774 1 13 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.524 -0.604 19685 6775 1 13 . 1 1 436 436 VAL C C 436 175.100 175.100 175.203 -0.103 19685 6776 1 13 . 1 1 436 436 VAL CA C 436 63.600 63.600 61.802 1.798 19685 6777 1 13 . 1 1 436 436 VAL CB C 436 33.500 33.500 32.284 1.216 19685 6778 1 13 . 1 1 436 436 VAL H H 436 8.390 8.390 8.653 -0.263 19685 6779 1 13 . 1 1 437 437 PHE N N 437 125.900 125.900 119.315 6.585 19685 6780 1 13 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.601 -0.201 19685 6781 1 13 . 1 1 437 437 PHE C C 437 173.600 173.600 174.596 -0.996 19685 6782 1 13 . 1 1 437 437 PHE CA C 437 57.700 57.700 54.626 3.074 19685 6783 1 13 . 1 1 437 437 PHE CB C 437 39.000 39.000 37.189 1.811 19685 6784 1 13 . 1 1 437 437 PHE H H 437 8.250 8.250 8.653 -0.403 19685 6785 1 13 . 1 1 438 438 ILE N N 438 121.900 121.900 120.432 1.468 19685 6786 1 13 . 1 1 438 438 ILE HA H 438 4.460 4.460 4.324 0.136 19685 6787 1 13 . 1 1 438 438 ILE C C 438 175.700 175.700 174.797 0.903 19685 6788 1 13 . 1 1 438 438 ILE CA C 438 58.300 58.300 59.163 -0.864 19685 6789 1 13 . 1 1 438 438 ILE CB C 438 39.700 39.700 41.884 -2.184 19685 6790 1 13 . 1 1 438 438 ILE H H 438 8.520 8.520 7.255 1.265 19685 6791 1 13 . 1 1 439 439 ASP N N 439 126.500 126.500 124.802 1.698 19685 6792 1 13 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.628 -0.048 19685 6793 1 13 . 1 1 439 439 ASP C C 439 176.300 176.300 176.518 -0.218 19685 6794 1 13 . 1 1 439 439 ASP CA C 439 53.600 53.600 54.215 -0.615 19685 6795 1 13 . 1 1 439 439 ASP CB C 439 42.300 42.300 40.715 1.585 19685 6796 1 13 . 1 1 439 439 ASP H H 439 8.730 8.730 8.741 -0.011 19685 6797 1 13 . 1 1 440 440 LYS N N 440 127.300 127.300 116.315 10.985 19685 6798 1 13 . 1 1 440 440 LYS HA H 440 4.070 4.070 3.938 0.132 19685 6799 1 13 . 1 1 440 440 LYS C C 440 176.900 176.900 176.136 0.764 19685 6800 1 13 . 1 1 440 440 LYS CA C 440 57.800 57.800 58.474 -0.674 19685 6801 1 13 . 1 1 440 440 LYS CB C 440 32.100 32.100 30.496 1.604 19685 6802 1 13 . 1 1 440 440 LYS H H 440 8.930 8.930 8.523 0.407 19685 6803 1 13 . 1 1 441 441 GLN N N 441 117.400 117.400 115.479 1.921 19685 6804 1 13 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.458 -0.228 19685 6805 1 13 . 1 1 441 441 GLN C C 441 177.200 177.200 175.700 1.500 19685 6806 1 13 . 1 1 441 441 GLN CA C 441 57.600 57.600 56.052 1.548 19685 6807 1 13 . 1 1 441 441 GLN CB C 441 28.800 28.800 29.874 -1.074 19685 6808 1 13 . 1 1 441 441 GLN H H 441 8.650 8.650 7.530 1.120 19685 6809 1 13 . 1 1 442 442 THR N N 442 107.300 107.300 115.491 -8.191 19685 6810 1 13 . 1 1 442 442 THR HA H 442 4.290 4.290 4.292 -0.002 19685 6811 1 13 . 1 1 442 442 THR C C 442 175.100 175.100 174.214 0.886 19685 6812 1 13 . 1 1 442 442 THR CA C 442 61.200 61.200 63.634 -2.434 19685 6813 1 13 . 1 1 442 442 THR CB C 442 70.300 70.300 68.802 1.498 19685 6814 1 13 . 1 1 442 442 THR H H 442 7.830 7.830 7.829 0.001 19685 6815 1 13 . 1 1 443 443 ASN N N 443 117.300 117.300 117.028 0.272 19685 6816 1 13 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.384 -0.084 19685 6817 1 13 . 1 1 443 443 ASN C C 443 173.400 173.400 173.820 -0.420 19685 6818 1 13 . 1 1 443 443 ASN CA C 443 54.300 54.300 53.666 0.634 19685 6819 1 13 . 1 1 443 443 ASN CB C 443 37.600 37.600 37.911 -0.311 19685 6820 1 13 . 1 1 443 443 ASN H H 443 8.470 8.470 8.244 0.226 19685 6821 1 13 . 1 1 444 444 LEU N N 444 118.000 118.000 115.256 2.744 19685 6822 1 13 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.312 0.248 19685 6823 1 13 . 1 1 444 444 LEU C C 444 176.700 176.700 176.148 0.552 19685 6824 1 13 . 1 1 444 444 LEU CA C 444 53.300 53.300 55.614 -2.314 19685 6825 1 13 . 1 1 444 444 LEU CB C 444 43.500 43.500 42.440 1.060 19685 6826 1 13 . 1 1 444 444 LEU H H 444 7.660 7.660 7.567 0.093 19685 6827 1 13 . 1 1 445 445 SER N N 445 115.500 115.500 113.704 1.796 19685 6828 1 13 . 1 1 445 445 SER HA H 445 4.460 4.460 3.784 0.676 19685 6829 1 13 . 1 1 445 445 SER C C 445 176.500 176.500 173.680 2.820 19685 6830 1 13 . 1 1 445 445 SER CA C 445 57.900 57.900 58.908 -1.008 19685 6831 1 13 . 1 1 445 445 SER CB C 445 63.500 63.500 61.510 1.990 19685 6832 1 13 . 1 1 445 445 SER H H 445 8.840 8.840 8.102 0.738 19685 6833 1 13 . 1 1 446 446 LYS N N 446 125.200 125.200 120.731 4.469 19685 6834 1 13 . 1 1 446 446 LYS HA H 446 4.500 4.500 3.945 0.555 19685 6835 1 13 . 1 1 446 446 LYS C C 446 176.100 176.100 176.943 -0.843 19685 6836 1 13 . 1 1 446 446 LYS CA C 446 56.300 56.300 57.014 -0.714 19685 6837 1 13 . 1 1 446 446 LYS CB C 446 32.200 32.200 32.632 -0.432 19685 6838 1 13 . 1 1 446 446 LYS H H 446 9.230 9.230 7.896 1.334 19685 6839 1 13 . 1 1 447 447 CYS N N 447 113.000 113.000 118.459 -5.459 19685 6840 1 13 . 1 1 447 447 CYS C C 447 172.500 172.500 174.746 -2.246 19685 6841 1 13 . 1 1 447 447 CYS CA C 447 60.400 60.400 59.742 0.658 19685 6842 1 13 . 1 1 447 447 CYS CB C 447 24.900 24.900 26.953 -2.053 19685 6843 1 13 . 1 1 447 447 CYS H H 447 10.020 10.020 8.578 1.442 19685 6844 1 13 . 1 1 448 448 PHE N N 448 115.200 115.200 114.933 0.267 19685 6845 1 13 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.750 0.590 19685 6846 1 13 . 1 1 448 448 PHE C C 448 172.400 172.400 174.195 -1.795 19685 6847 1 13 . 1 1 448 448 PHE CA C 448 54.700 54.700 55.952 -1.252 19685 6848 1 13 . 1 1 448 448 PHE CB C 448 42.000 42.000 40.940 1.060 19685 6849 1 13 . 1 1 448 448 PHE H H 448 7.810 7.810 6.965 0.845 19685 6850 1 13 . 1 1 449 449 GLY N N 449 107.700 107.700 106.870 0.830 19685 6851 1 13 . 1 1 449 449 GLY C C 449 170.100 170.100 172.518 -2.418 19685 6852 1 13 . 1 1 449 449 GLY CA C 449 45.200 45.200 44.087 1.113 19685 6853 1 13 . 1 1 449 449 GLY H H 449 9.310 9.310 8.887 0.423 19685 6854 1 13 . 1 1 450 450 PHE N N 450 119.900 119.900 113.903 5.997 19685 6855 1 13 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.252 0.178 19685 6856 1 13 . 1 1 450 450 PHE C C 450 172.800 172.800 173.022 -0.222 19685 6857 1 13 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.434 -1.434 19685 6858 1 13 . 1 1 450 450 PHE CB C 450 43.600 43.600 41.099 2.501 19685 6859 1 13 . 1 1 450 450 PHE H H 450 8.760 8.760 8.241 0.519 19685 6860 1 13 . 1 1 451 451 VAL N N 451 123.800 123.800 118.031 5.769 19685 6861 1 13 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.607 -0.317 19685 6862 1 13 . 1 1 451 451 VAL C C 451 172.400 172.400 176.135 -3.735 19685 6863 1 13 . 1 1 451 451 VAL CA C 451 59.800 59.800 60.944 -1.145 19685 6864 1 13 . 1 1 451 451 VAL CB C 451 36.100 36.100 36.372 -0.272 19685 6865 1 13 . 1 1 451 451 VAL H H 451 7.930 7.930 8.261 -0.331 19685 6866 1 13 . 1 1 452 452 SER N N 452 119.600 119.600 120.407 -0.807 19685 6867 1 13 . 1 1 452 452 SER HA H 452 5.120 5.120 5.020 0.100 19685 6868 1 13 . 1 1 452 452 SER C C 452 173.200 173.200 174.569 -1.369 19685 6869 1 13 . 1 1 452 452 SER CA C 452 55.700 55.700 56.798 -1.098 19685 6870 1 13 . 1 1 452 452 SER CB C 452 66.100 66.100 62.693 3.407 19685 6871 1 13 . 1 1 452 452 SER H H 452 8.540 8.540 8.519 0.021 19685 6872 1 13 . 1 1 453 453 TYR N N 453 121.400 121.400 123.890 -2.490 19685 6873 1 13 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.503 0.877 19685 6874 1 13 . 1 1 453 453 TYR C C 453 173.600 173.600 177.091 -3.491 19685 6875 1 13 . 1 1 453 453 TYR CA C 453 56.500 56.500 59.961 -3.461 19685 6876 1 13 . 1 1 453 453 TYR CB C 453 42.200 42.200 38.733 3.467 19685 6877 1 13 . 1 1 453 453 TYR H H 453 8.380 8.380 7.772 0.608 19685 6878 1 13 . 1 1 454 454 ASP N N 454 113.300 113.300 121.843 -8.543 19685 6879 1 13 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.384 0.106 19685 6880 1 13 . 1 1 454 454 ASP C C 454 176.100 176.100 175.705 0.395 19685 6881 1 13 . 1 1 454 454 ASP CA C 454 52.800 52.800 56.119 -3.319 19685 6882 1 13 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.635 -1.235 19685 6883 1 13 . 1 1 454 454 ASP H H 454 7.860 7.860 8.665 -0.805 19685 6884 1 13 . 1 1 455 455 ASN N N 455 113.800 113.800 112.280 1.520 19685 6885 1 13 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.086 -0.036 19685 6886 1 13 . 1 1 455 455 ASN C C 455 173.100 173.100 173.678 -0.578 19685 6887 1 13 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.716 -1.016 19685 6888 1 13 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.089 1.011 19685 6889 1 13 . 1 1 455 455 ASN H H 455 7.200 7.200 7.908 -0.708 19685 6890 1 13 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.548 -0.378 19685 6891 1 13 . 1 1 456 456 PRO C C 456 177.300 177.300 177.881 -0.581 19685 6892 1 13 . 1 1 456 456 PRO CA C 456 64.200 64.200 65.003 -0.803 19685 6893 1 13 . 1 1 456 456 PRO CB C 456 32.300 32.300 31.983 0.317 19685 6894 1 13 . 1 1 457 457 VAL N N 457 120.900 120.900 110.491 10.409 19685 6895 1 13 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.332 -0.712 19685 6896 1 13 . 1 1 457 457 VAL C C 457 179.000 179.000 176.193 2.807 19685 6897 1 13 . 1 1 457 457 VAL CA C 457 65.900 65.900 63.421 2.479 19685 6898 1 13 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.408 -0.608 19685 6899 1 13 . 1 1 457 457 VAL H H 457 8.120 8.120 7.952 0.168 19685 6900 1 13 . 1 1 458 458 SER N N 458 117.800 117.800 116.202 1.598 19685 6901 1 13 . 1 1 458 458 SER HA H 458 3.940 3.940 4.726 -0.786 19685 6902 1 13 . 1 1 458 458 SER C C 458 173.600 173.600 175.125 -1.525 19685 6903 1 13 . 1 1 458 458 SER CA C 458 61.100 61.100 59.330 1.770 19685 6904 1 13 . 1 1 458 458 SER CB C 458 62.400 62.400 65.655 -3.255 19685 6905 1 13 . 1 1 458 458 SER H H 458 7.830 7.830 7.729 0.101 19685 6906 1 13 . 1 1 459 459 ALA N N 459 120.000 120.000 125.011 -5.011 19685 6907 1 13 . 1 1 459 459 ALA HA H 459 3.750 3.750 4.150 -0.400 19685 6908 1 13 . 1 1 459 459 ALA C C 459 178.100 178.100 177.855 0.245 19685 6909 1 13 . 1 1 459 459 ALA CA C 459 54.500 54.500 53.860 0.640 19685 6910 1 13 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.801 -0.901 19685 6911 1 13 . 1 1 459 459 ALA H H 459 6.370 6.370 7.780 -1.410 19685 6912 1 13 . 1 1 460 460 GLN N N 460 116.100 116.100 117.582 -1.482 19685 6913 1 13 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.085 -0.255 19685 6914 1 13 . 1 1 460 460 GLN C C 460 178.000 178.000 176.438 1.562 19685 6915 1 13 . 1 1 460 460 GLN CA C 460 58.500 58.500 57.947 0.553 19685 6916 1 13 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.195 -0.795 19685 6917 1 13 . 1 1 460 460 GLN H H 460 7.710 7.710 8.206 -0.496 19685 6918 1 13 . 1 1 461 461 ALA N N 461 122.800 122.800 118.626 4.174 19685 6919 1 13 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.331 -0.371 19685 6920 1 13 . 1 1 461 461 ALA C C 461 179.500 179.500 177.093 2.407 19685 6921 1 13 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.405 2.095 19685 6922 1 13 . 1 1 461 461 ALA CB C 461 17.500 17.500 18.983 -1.483 19685 6923 1 13 . 1 1 461 461 ALA H H 461 7.880 7.880 7.492 0.388 19685 6924 1 13 . 1 1 462 462 ALA N N 462 121.400 121.400 119.751 1.649 19685 6925 1 13 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.791 -1.391 19685 6926 1 13 . 1 1 462 462 ALA C C 462 179.400 179.400 178.237 1.163 19685 6927 1 13 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.369 1.731 19685 6928 1 13 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.207 -1.507 19685 6929 1 13 . 1 1 462 462 ALA H H 462 7.860 7.860 7.585 0.275 19685 6930 1 13 . 1 1 463 463 ILE N N 463 118.600 118.600 117.991 0.609 19685 6931 1 13 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.829 -0.589 19685 6932 1 13 . 1 1 463 463 ILE C C 463 177.500 177.500 176.023 1.477 19685 6933 1 13 . 1 1 463 463 ILE CA C 463 66.000 66.000 63.314 2.686 19685 6934 1 13 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.249 0.051 19685 6935 1 13 . 1 1 463 463 ILE H H 463 8.090 8.090 7.806 0.284 19685 6936 1 13 . 1 1 464 464 GLN N N 464 117.000 117.000 116.454 0.546 19685 6937 1 13 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.361 -0.491 19685 6938 1 13 . 1 1 464 464 GLN C C 464 177.700 177.700 175.151 2.549 19685 6939 1 13 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.794 2.405 19685 6940 1 13 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.837 -1.937 19685 6941 1 13 . 1 1 464 464 GLN H H 464 7.780 7.780 7.717 0.063 19685 6942 1 13 . 1 1 465 465 ALA N N 465 117.200 117.200 120.355 -3.155 19685 6943 1 13 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.523 -0.293 19685 6944 1 13 . 1 1 465 465 ALA C C 465 179.200 179.200 176.765 2.435 19685 6945 1 13 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.773 1.027 19685 6946 1 13 . 1 1 465 465 ALA CB C 465 21.100 21.100 19.797 1.304 19685 6947 1 13 . 1 1 465 465 ALA H H 465 7.540 7.540 7.855 -0.315 19685 6948 1 13 . 1 1 466 466 MET N N 466 110.800 110.800 117.772 -6.972 19685 6949 1 13 . 1 1 466 466 MET HA H 466 4.820 4.820 4.657 0.163 19685 6950 1 13 . 1 1 466 466 MET C C 466 177.600 177.600 177.239 0.361 19685 6951 1 13 . 1 1 466 466 MET CA C 466 53.300 53.300 56.210 -2.910 19685 6952 1 13 . 1 1 466 466 MET CB C 466 31.600 31.600 34.542 -2.942 19685 6953 1 13 . 1 1 466 466 MET H H 466 8.230 8.230 7.821 0.409 19685 6954 1 13 . 1 1 467 467 ASN N N 467 119.100 119.100 120.910 -1.810 19685 6955 1 13 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.576 -0.086 19685 6956 1 13 . 1 1 467 467 ASN C C 467 176.300 176.300 175.974 0.326 19685 6957 1 13 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.853 1.347 19685 6958 1 13 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.767 -0.567 19685 6959 1 13 . 1 1 467 467 ASN H H 467 8.560 8.560 7.784 0.776 19685 6960 1 13 . 1 1 468 468 GLY N N 468 117.900 117.900 103.557 14.343 19685 6961 1 13 . 1 1 468 468 GLY C C 468 172.800 172.800 173.908 -1.108 19685 6962 1 13 . 1 1 468 468 GLY CA C 468 45.300 45.300 44.752 0.548 19685 6963 1 13 . 1 1 468 468 GLY H H 468 8.930 8.930 8.068 0.862 19685 6964 1 13 . 1 1 469 469 PHE N N 469 123.300 123.300 121.473 1.827 19685 6965 1 13 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.641 -0.451 19685 6966 1 13 . 1 1 469 469 PHE C C 469 174.400 174.400 175.156 -0.756 19685 6967 1 13 . 1 1 469 469 PHE CA C 469 58.700 58.700 57.579 1.121 19685 6968 1 13 . 1 1 469 469 PHE CB C 469 40.600 40.600 40.658 -0.058 19685 6969 1 13 . 1 1 469 469 PHE H H 469 7.950 7.950 7.451 0.499 19685 6970 1 13 . 1 1 470 470 GLN N N 470 129.200 129.200 118.049 11.151 19685 6971 1 13 . 1 1 470 470 GLN HA H 470 4.590 4.590 3.949 0.641 19685 6972 1 13 . 1 1 470 470 GLN C C 470 174.100 174.100 173.821 0.279 19685 6973 1 13 . 1 1 470 470 GLN CA C 470 55.500 55.500 56.732 -1.232 19685 6974 1 13 . 1 1 470 470 GLN CB C 470 28.800 28.800 28.433 0.367 19685 6975 1 13 . 1 1 470 470 GLN H H 470 8.330 8.330 8.252 0.078 19685 6976 1 13 . 1 1 471 471 ILE N N 471 126.300 126.300 122.973 3.327 19685 6977 1 13 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.086 0.084 19685 6978 1 13 . 1 1 471 471 ILE C C 471 175.400 175.400 175.139 0.261 19685 6979 1 13 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.233 -0.633 19685 6980 1 13 . 1 1 471 471 ILE CB C 471 39.100 39.100 39.811 -0.711 19685 6981 1 13 . 1 1 471 471 ILE H H 471 8.440 8.440 8.698 -0.258 19685 6982 1 13 . 1 1 472 472 GLY N N 472 117.500 117.500 116.086 1.414 19685 6983 1 13 . 1 1 472 472 GLY C C 472 174.700 174.700 174.673 0.027 19685 6984 1 13 . 1 1 472 472 GLY CA C 472 46.500 46.500 46.471 0.029 19685 6985 1 13 . 1 1 472 472 GLY H H 472 8.980 8.980 8.394 0.586 19685 6986 1 13 . 1 1 473 473 MET N N 473 124.100 124.100 120.992 3.108 19685 6987 1 13 . 1 1 473 473 MET HA H 473 4.380 4.380 4.675 -0.295 19685 6988 1 13 . 1 1 473 473 MET C C 473 175.700 175.700 175.866 -0.166 19685 6989 1 13 . 1 1 473 473 MET CA C 473 55.000 55.000 55.490 -0.490 19685 6990 1 13 . 1 1 473 473 MET CB C 473 32.900 32.900 32.980 -0.080 19685 6991 1 13 . 1 1 473 473 MET H H 473 9.070 9.070 8.484 0.586 19685 6992 1 13 . 1 1 474 474 LYS N N 474 118.700 118.700 118.793 -0.093 19685 6993 1 13 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.683 -0.203 19685 6994 1 13 . 1 1 474 474 LYS C C 474 174.300 174.300 174.164 0.136 19685 6995 1 13 . 1 1 474 474 LYS CA C 474 54.600 54.600 55.096 -0.497 19685 6996 1 13 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.490 -0.390 19685 6997 1 13 . 1 1 474 474 LYS H H 474 7.770 7.770 7.830 -0.060 19685 6998 1 13 . 1 1 475 475 ARG N N 475 119.600 119.600 118.981 0.619 19685 6999 1 13 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.602 0.198 19685 7000 1 13 . 1 1 475 475 ARG C C 475 175.700 175.700 173.876 1.824 19685 7001 1 13 . 1 1 475 475 ARG CA C 475 54.000 54.000 54.666 -0.666 19685 7002 1 13 . 1 1 475 475 ARG CB C 475 31.300 31.300 32.214 -0.914 19685 7003 1 13 . 1 1 475 475 ARG H H 475 8.350 8.350 8.425 -0.075 19685 7004 1 13 . 1 1 476 476 LEU N N 476 123.500 123.500 120.986 2.514 19685 7005 1 13 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.261 0.169 19685 7006 1 13 . 1 1 476 476 LEU C C 476 177.600 177.600 176.591 1.009 19685 7007 1 13 . 1 1 476 476 LEU CA C 476 55.500 55.500 54.890 0.610 19685 7008 1 13 . 1 1 476 476 LEU CB C 476 42.800 42.800 42.683 0.117 19685 7009 1 13 . 1 1 476 476 LEU H H 476 9.130 9.130 8.554 0.576 19685 7010 1 13 . 1 1 477 477 LYS N N 477 123.200 123.200 119.654 3.546 19685 7011 1 13 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.455 0.705 19685 7012 1 13 . 1 1 477 477 LYS C C 477 174.100 174.100 175.800 -1.700 19685 7013 1 13 . 1 1 477 477 LYS CA C 477 54.500 54.500 54.842 -0.341 19685 7014 1 13 . 1 1 477 477 LYS CB C 477 34.900 34.900 32.739 2.161 19685 7015 1 13 . 1 1 477 477 LYS H H 477 8.090 8.090 8.337 -0.247 19685 7016 1 13 . 1 1 478 478 VAL N N 478 127.100 127.100 119.296 7.804 19685 7017 1 13 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.188 0.712 19685 7018 1 13 . 1 1 478 478 VAL C C 478 173.700 173.700 174.777 -1.077 19685 7019 1 13 . 1 1 478 478 VAL CA C 478 61.000 61.000 62.679 -1.679 19685 7020 1 13 . 1 1 478 478 VAL CB C 478 33.700 33.700 32.724 0.976 19685 7021 1 13 . 1 1 478 478 VAL H H 478 8.820 8.820 7.712 1.108 19685 7022 1 13 . 1 1 479 479 GLN N N 479 123.600 123.600 125.715 -2.115 19685 7023 1 13 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.499 0.311 19685 7024 1 13 . 1 1 479 479 GLN C C 479 173.600 173.600 173.749 -0.149 19685 7025 1 13 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.205 -1.005 19685 7026 1 13 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.502 0.998 19685 7027 1 13 . 1 1 479 479 GLN H H 479 9.130 9.130 8.355 0.775 19685 7028 1 13 . 1 1 480 480 LEU N N 480 123.200 123.200 121.426 1.774 19685 7029 1 13 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.491 -0.051 19685 7030 1 13 . 1 1 480 480 LEU C C 480 177.100 177.100 176.157 0.943 19685 7031 1 13 . 1 1 480 480 LEU CA C 480 54.600 54.600 53.899 0.701 19685 7032 1 13 . 1 1 480 480 LEU CB C 480 42.400 42.400 43.311 -0.911 19685 7033 1 13 . 1 1 480 480 LEU H H 480 8.840 8.840 8.233 0.607 19685 7034 1 13 . 1 1 481 481 LYS N N 481 124.500 124.500 124.706 -0.206 19685 7035 1 13 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.234 0.076 19685 7036 1 13 . 1 1 481 481 LYS C C 481 175.200 175.200 175.759 -0.559 19685 7037 1 13 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.762 -1.062 19685 7038 1 13 . 1 1 481 481 LYS CB C 481 33.100 33.100 31.352 1.748 19685 7039 1 13 . 1 1 481 481 LYS H H 481 8.400 8.400 8.869 -0.469 19685 7040 1 13 . 1 1 482 482 ARG N N 482 126.600 126.600 119.663 6.937 19685 7041 1 13 . 1 1 482 482 ARG HA H 482 4.350 4.350 4.333 0.017 19685 7042 1 13 . 1 1 482 482 ARG C C 482 175.800 175.800 174.869 0.931 19685 7043 1 13 . 1 1 482 482 ARG CA C 482 55.600 55.600 55.873 -0.273 19685 7044 1 13 . 1 1 482 482 ARG CB C 482 31.100 31.100 30.220 0.880 19685 7045 1 13 . 1 1 482 482 ARG H H 482 8.770 8.770 8.034 0.736 19685 7046 1 13 . 1 1 483 483 SER N N 483 118.100 118.100 115.390 2.710 19685 7047 1 13 . 1 1 483 483 SER HA H 483 4.400 4.400 4.353 0.047 19685 7048 1 13 . 1 1 483 483 SER C C 483 174.200 174.200 173.568 0.632 19685 7049 1 13 . 1 1 483 483 SER CA C 483 58.000 58.000 58.330 -0.330 19685 7050 1 13 . 1 1 483 483 SER CB C 483 63.500 63.500 64.009 -0.509 19685 7051 1 13 . 1 1 483 483 SER H H 483 8.610 8.610 7.555 1.055 19685 7052 1 13 . 1 1 484 484 LYS N N 484 123.000 123.000 121.118 1.882 19685 7053 1 13 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.254 -0.044 19685 7054 1 13 . 1 1 484 484 LYS C C 484 175.900 175.900 174.968 0.932 19685 7055 1 13 . 1 1 484 484 LYS CA C 484 56.300 56.300 56.936 -0.636 19685 7056 1 13 . 1 1 484 484 LYS CB C 484 32.500 32.500 31.897 0.603 19685 7057 1 13 . 1 1 484 484 LYS H H 484 8.560 8.560 8.686 -0.126 19685 7058 1 13 . 1 1 485 485 ASN N N 485 119.600 119.600 117.736 1.864 19685 7059 1 13 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.616 -0.016 19685 7060 1 13 . 1 1 485 485 ASN C C 485 174.400 174.400 174.833 -0.433 19685 7061 1 13 . 1 1 485 485 ASN CA C 485 52.900 52.900 53.073 -0.173 19685 7062 1 13 . 1 1 485 485 ASN CB C 485 38.400 38.400 39.372 -0.972 19685 7063 1 13 . 1 1 485 485 ASN H H 485 8.560 8.560 8.184 0.376 19685 7064 1 13 . 1 1 486 486 ASP N N 486 121.100 121.100 119.139 1.961 19685 7065 1 13 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.641 -0.121 19685 7066 1 13 . 1 1 486 486 ASP C C 486 175.700 175.700 176.321 -0.621 19685 7067 1 13 . 1 1 486 486 ASP CA C 486 54.000 54.000 53.894 0.106 19685 7068 1 13 . 1 1 486 486 ASP CB C 486 40.800 40.800 42.875 -2.075 19685 7069 1 13 . 1 1 486 486 ASP H H 486 8.250 8.250 8.435 -0.185 19685 7070 1 13 . 1 1 487 487 SER N N 487 115.400 115.400 114.694 0.706 19685 7071 1 13 . 1 1 487 487 SER HA H 487 4.310 4.310 4.309 0.001 19685 7072 1 13 . 1 1 487 487 SER C C 487 172.800 172.800 174.087 -1.287 19685 7073 1 13 . 1 1 487 487 SER CA C 487 57.700 57.700 59.013 -1.312 19685 7074 1 13 . 1 1 487 487 SER CB C 487 63.600 63.600 63.903 -0.303 19685 7075 1 13 . 1 1 487 487 SER H H 487 8.090 8.090 8.164 -0.074 19685 7076 1 13 . 1 1 488 488 LYS N N 488 122.300 122.300 117.980 4.320 19685 7077 1 13 . 1 1 488 488 LYS HA H 488 4.050 4.050 3.823 0.227 19685 7078 1 13 . 1 1 488 488 LYS C C 488 174.500 174.500 174.160 0.340 19685 7079 1 13 . 1 1 488 488 LYS CA C 488 54.000 54.000 56.106 -2.106 19685 7080 1 13 . 1 1 488 488 LYS CB C 488 32.400 32.400 30.412 1.988 19685 7081 1 13 . 1 1 488 488 LYS H H 488 8.090 8.090 7.801 0.289 19685 7082 1 13 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.312 -0.032 19685 7083 1 13 . 1 1 489 489 PRO C C 489 175.000 175.000 175.136 -0.136 19685 7084 1 13 . 1 1 489 489 PRO CA C 489 63.200 63.200 62.880 0.320 19685 7085 1 13 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.518 -1.418 19685 7086 1 14 . 1 1 395 395 SER N N 395 115.500 115.500 114.886 0.614 19685 7087 1 14 . 1 1 395 395 SER HA H 395 4.300 4.300 4.073 0.227 19685 7088 1 14 . 1 1 395 395 SER C C 395 173.900 173.900 173.961 -0.061 19685 7089 1 14 . 1 1 395 395 SER CA C 395 57.900 57.900 59.504 -1.604 19685 7090 1 14 . 1 1 395 395 SER CB C 395 63.400 63.400 61.704 1.696 19685 7091 1 14 . 1 1 395 395 SER H H 395 8.200 8.200 8.429 -0.229 19685 7092 1 14 . 1 1 396 396 HIS N N 396 123.500 123.500 117.085 6.415 19685 7093 1 14 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.605 -0.045 19685 7094 1 14 . 1 1 396 396 HIS C C 396 174.100 174.100 174.880 -0.780 19685 7095 1 14 . 1 1 396 396 HIS CA C 396 53.700 53.700 55.440 -1.740 19685 7096 1 14 . 1 1 396 396 HIS CB C 396 32.200 32.200 30.114 2.086 19685 7097 1 14 . 1 1 396 396 HIS H H 396 8.120 8.120 7.691 0.429 19685 7098 1 14 . 1 1 397 397 MET N N 397 121.200 121.200 118.397 2.803 19685 7099 1 14 . 1 1 397 397 MET HA H 397 4.320 4.320 4.117 0.203 19685 7100 1 14 . 1 1 397 397 MET C C 397 175.400 175.400 174.693 0.707 19685 7101 1 14 . 1 1 397 397 MET CA C 397 55.000 55.000 55.930 -0.930 19685 7102 1 14 . 1 1 397 397 MET CB C 397 32.500 32.500 32.194 0.306 19685 7103 1 14 . 1 1 397 397 MET H H 397 8.300 8.300 7.840 0.460 19685 7104 1 14 . 1 1 398 398 GLN N N 398 122.100 122.100 120.915 1.185 19685 7105 1 14 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.424 -0.234 19685 7106 1 14 . 1 1 398 398 GLN C C 398 174.800 174.800 175.239 -0.439 19685 7107 1 14 . 1 1 398 398 GLN CA C 398 55.200 55.200 55.444 -0.244 19685 7108 1 14 . 1 1 398 398 GLN CB C 398 28.900 28.900 29.567 -0.667 19685 7109 1 14 . 1 1 398 398 GLN H H 398 8.540 8.540 8.508 0.032 19685 7110 1 14 . 1 1 399 399 LYS N N 399 123.000 123.000 118.524 4.476 19685 7111 1 14 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.079 0.141 19685 7112 1 14 . 1 1 399 399 LYS C C 399 174.800 174.800 174.631 0.169 19685 7113 1 14 . 1 1 399 399 LYS CA C 399 55.600 55.600 57.637 -2.037 19685 7114 1 14 . 1 1 399 399 LYS CB C 399 33.000 33.000 32.547 0.453 19685 7115 1 14 . 1 1 399 399 LYS H H 399 8.180 8.180 8.407 -0.227 19685 7116 1 14 . 1 1 400 400 GLU N N 400 122.000 122.000 117.185 4.815 19685 7117 1 14 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.731 -0.301 19685 7118 1 14 . 1 1 400 400 GLU C C 400 176.400 176.400 175.580 0.820 19685 7119 1 14 . 1 1 400 400 GLU CA C 400 55.400 55.400 55.220 0.180 19685 7120 1 14 . 1 1 400 400 GLU CB C 400 31.400 31.400 32.074 -0.674 19685 7121 1 14 . 1 1 400 400 GLU H H 400 8.350 8.350 8.292 0.058 19685 7122 1 14 . 1 1 401 401 GLY N N 401 109.500 109.500 107.292 2.208 19685 7123 1 14 . 1 1 401 401 GLY C C 401 171.500 171.500 174.509 -3.009 19685 7124 1 14 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.245 -0.545 19685 7125 1 14 . 1 1 401 401 GLY H H 401 9.050 9.050 8.479 0.571 19685 7126 1 14 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.410 0.010 19685 7127 1 14 . 1 1 402 402 PRO C C 402 173.900 173.900 176.841 -2.941 19685 7128 1 14 . 1 1 402 402 PRO CA C 402 61.900 61.900 63.746 -1.846 19685 7129 1 14 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.899 -0.699 19685 7130 1 14 . 1 1 403 403 GLU N N 403 119.600 119.600 116.266 3.334 19685 7131 1 14 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.409 -0.449 19685 7132 1 14 . 1 1 403 403 GLU C C 403 177.300 177.300 176.241 1.059 19685 7133 1 14 . 1 1 403 403 GLU CA C 403 58.100 58.100 56.430 1.670 19685 7134 1 14 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.856 -1.856 19685 7135 1 14 . 1 1 403 403 GLU H H 403 8.420 8.420 8.132 0.288 19685 7136 1 14 . 1 1 404 404 GLY N N 404 112.800 112.800 107.144 5.656 19685 7137 1 14 . 1 1 404 404 GLY C C 404 173.300 173.300 173.333 -0.033 19685 7138 1 14 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.649 -0.749 19685 7139 1 14 . 1 1 404 404 GLY H H 404 8.500 8.500 7.984 0.516 19685 7140 1 14 . 1 1 405 405 ALA N N 405 120.000 120.000 123.983 -3.983 19685 7141 1 14 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.141 0.409 19685 7142 1 14 . 1 1 405 405 ALA C C 405 174.100 174.100 175.782 -1.682 19685 7143 1 14 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.998 -1.498 19685 7144 1 14 . 1 1 405 405 ALA CB C 405 20.800 20.800 16.992 3.808 19685 7145 1 14 . 1 1 405 405 ALA H H 405 8.360 8.360 8.210 0.150 19685 7146 1 14 . 1 1 406 406 ASN N N 406 115.500 115.500 117.289 -1.789 19685 7147 1 14 . 1 1 406 406 ASN HA H 406 5.190 5.190 4.995 0.195 19685 7148 1 14 . 1 1 406 406 ASN C C 406 172.900 172.900 174.490 -1.590 19685 7149 1 14 . 1 1 406 406 ASN CA C 406 52.600 52.600 50.939 1.661 19685 7150 1 14 . 1 1 406 406 ASN CB C 406 40.900 40.900 38.444 2.456 19685 7151 1 14 . 1 1 406 406 ASN H H 406 7.690 7.690 7.993 -0.303 19685 7152 1 14 . 1 1 407 407 LEU N N 407 123.400 123.400 121.050 2.350 19685 7153 1 14 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.012 0.948 19685 7154 1 14 . 1 1 407 407 LEU C C 407 174.900 174.900 177.103 -2.203 19685 7155 1 14 . 1 1 407 407 LEU CA C 407 53.100 53.100 55.930 -2.830 19685 7156 1 14 . 1 1 407 407 LEU CB C 407 45.400 45.400 41.649 3.751 19685 7157 1 14 . 1 1 407 407 LEU H H 407 9.290 9.290 7.577 1.713 19685 7158 1 14 . 1 1 408 408 PHE N N 408 118.700 118.700 124.949 -6.249 19685 7159 1 14 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.625 0.675 19685 7160 1 14 . 1 1 408 408 PHE C C 408 174.200 174.200 175.715 -1.515 19685 7161 1 14 . 1 1 408 408 PHE CA C 408 56.300 56.300 57.560 -1.260 19685 7162 1 14 . 1 1 408 408 PHE CB C 408 42.700 42.700 37.457 5.243 19685 7163 1 14 . 1 1 408 408 PHE H H 408 9.150 9.150 8.256 0.894 19685 7164 1 14 . 1 1 409 409 ILE N N 409 120.800 120.800 122.317 -1.517 19685 7165 1 14 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.241 0.729 19685 7166 1 14 . 1 1 409 409 ILE C C 409 173.900 173.900 175.425 -1.525 19685 7167 1 14 . 1 1 409 409 ILE CA C 409 59.000 59.000 61.792 -2.792 19685 7168 1 14 . 1 1 409 409 ILE CB C 409 40.400 40.400 37.221 3.179 19685 7169 1 14 . 1 1 409 409 ILE H H 409 8.380 8.380 7.986 0.394 19685 7170 1 14 . 1 1 410 410 TYR N N 410 123.200 123.200 123.930 -0.730 19685 7171 1 14 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.926 0.014 19685 7172 1 14 . 1 1 410 410 TYR C C 410 174.300 174.300 175.592 -1.292 19685 7173 1 14 . 1 1 410 410 TYR CA C 410 56.200 56.200 57.120 -0.920 19685 7174 1 14 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.272 1.528 19685 7175 1 14 . 1 1 410 410 TYR H H 410 9.440 9.440 8.246 1.194 19685 7176 1 14 . 1 1 411 411 HIS N N 411 112.100 112.100 121.791 -9.691 19685 7177 1 14 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.515 -0.065 19685 7178 1 14 . 1 1 411 411 HIS C C 411 173.300 173.300 174.784 -1.484 19685 7179 1 14 . 1 1 411 411 HIS CA C 411 55.900 55.900 55.691 0.208 19685 7180 1 14 . 1 1 411 411 HIS CB C 411 26.200 26.200 27.420 -1.220 19685 7181 1 14 . 1 1 411 411 HIS H H 411 8.580 8.580 8.275 0.305 19685 7182 1 14 . 1 1 412 412 LEU N N 412 115.100 115.100 123.932 -8.832 19685 7183 1 14 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.314 -0.354 19685 7184 1 14 . 1 1 412 412 LEU C C 412 175.100 175.100 175.615 -0.515 19685 7185 1 14 . 1 1 412 412 LEU CA C 412 52.400 52.400 53.849 -1.449 19685 7186 1 14 . 1 1 412 412 LEU CB C 412 42.000 42.000 42.526 -0.526 19685 7187 1 14 . 1 1 412 412 LEU H H 412 7.560 7.560 7.572 -0.012 19685 7188 1 14 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.319 -0.049 19685 7189 1 14 . 1 1 413 413 PRO C C 413 177.600 177.600 177.107 0.493 19685 7190 1 14 . 1 1 413 413 PRO CA C 413 62.300 62.300 63.233 -0.933 19685 7191 1 14 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.160 0.040 19685 7192 1 14 . 1 1 414 414 GLN N N 414 125.500 125.500 117.698 7.802 19685 7193 1 14 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.176 -0.096 19685 7194 1 14 . 1 1 414 414 GLN C C 414 175.400 175.400 175.378 0.022 19685 7195 1 14 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.698 -0.698 19685 7196 1 14 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.551 -0.051 19685 7197 1 14 . 1 1 414 414 GLN H H 414 9.170 9.170 8.579 0.591 19685 7198 1 14 . 1 1 415 415 GLU N N 415 115.300 115.300 117.850 -2.550 19685 7199 1 14 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.348 -0.088 19685 7200 1 14 . 1 1 415 415 GLU C C 415 176.700 176.700 175.375 1.325 19685 7201 1 14 . 1 1 415 415 GLU CA C 415 58.700 58.700 55.506 3.194 19685 7202 1 14 . 1 1 415 415 GLU CB C 415 28.300 28.300 30.014 -1.714 19685 7203 1 14 . 1 1 415 415 GLU H H 415 9.390 9.390 8.144 1.246 19685 7204 1 14 . 1 1 416 416 PHE N N 416 121.700 121.700 117.434 4.266 19685 7205 1 14 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.175 -0.565 19685 7206 1 14 . 1 1 416 416 PHE C C 416 176.400 176.400 175.941 0.459 19685 7207 1 14 . 1 1 416 416 PHE CA C 416 57.400 57.400 55.769 1.631 19685 7208 1 14 . 1 1 416 416 PHE CB C 416 38.700 38.700 42.431 -3.731 19685 7209 1 14 . 1 1 416 416 PHE H H 416 7.610 7.610 7.334 0.276 19685 7210 1 14 . 1 1 417 417 GLY N N 417 113.000 113.000 106.842 6.158 19685 7211 1 14 . 1 1 417 417 GLY C C 417 174.300 174.300 173.107 1.193 19685 7212 1 14 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.309 -3.409 19685 7213 1 14 . 1 1 417 417 GLY H H 417 9.740 9.740 9.558 0.182 19685 7214 1 14 . 1 1 418 418 ASP N N 418 121.500 121.500 117.506 3.994 19685 7215 1 14 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.656 -0.716 19685 7216 1 14 . 1 1 418 418 ASP C C 418 177.900 177.900 176.932 0.968 19685 7217 1 14 . 1 1 418 418 ASP CA C 418 57.600 57.600 55.010 2.590 19685 7218 1 14 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.310 -1.610 19685 7219 1 14 . 1 1 418 418 ASP H H 418 8.680 8.680 7.877 0.803 19685 7220 1 14 . 1 1 419 419 GLN N N 419 116.400 116.400 120.226 -3.826 19685 7221 1 14 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.222 -0.312 19685 7222 1 14 . 1 1 419 419 GLN C C 419 177.600 177.600 175.518 2.082 19685 7223 1 14 . 1 1 419 419 GLN CA C 419 58.000 58.000 58.062 -0.062 19685 7224 1 14 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.579 -1.179 19685 7225 1 14 . 1 1 419 419 GLN H H 419 8.780 8.780 8.567 0.213 19685 7226 1 14 . 1 1 420 420 ASP N N 420 117.500 117.500 115.578 1.922 19685 7227 1 14 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.515 -0.505 19685 7228 1 14 . 1 1 420 420 ASP C C 420 178.000 178.000 175.961 2.039 19685 7229 1 14 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.190 3.510 19685 7230 1 14 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.647 -0.847 19685 7231 1 14 . 1 1 420 420 ASP H H 420 7.210 7.210 8.109 -0.899 19685 7232 1 14 . 1 1 421 421 ILE N N 421 117.000 117.000 119.877 -2.877 19685 7233 1 14 . 1 1 421 421 ILE HA H 421 4.080 4.080 3.981 0.099 19685 7234 1 14 . 1 1 421 421 ILE C C 421 176.500 176.500 176.618 -0.118 19685 7235 1 14 . 1 1 421 421 ILE CA C 421 64.000 64.000 62.937 1.063 19685 7236 1 14 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.128 -0.828 19685 7237 1 14 . 1 1 421 421 ILE H H 421 7.610 7.610 7.686 -0.076 19685 7238 1 14 . 1 1 422 422 LEU N N 422 123.200 123.200 121.477 1.723 19685 7239 1 14 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.071 -0.311 19685 7240 1 14 . 1 1 422 422 LEU C C 422 177.800 177.800 177.856 -0.056 19685 7241 1 14 . 1 1 422 422 LEU CA C 422 58.600 58.600 58.193 0.407 19685 7242 1 14 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.648 -0.448 19685 7243 1 14 . 1 1 422 422 LEU H H 422 7.870 7.870 7.686 0.184 19685 7244 1 14 . 1 1 423 423 GLN N N 423 115.600 115.600 117.604 -2.004 19685 7245 1 14 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.083 -0.203 19685 7246 1 14 . 1 1 423 423 GLN C C 423 177.800 177.800 176.148 1.652 19685 7247 1 14 . 1 1 423 423 GLN CA C 423 58.600 58.600 57.927 0.673 19685 7248 1 14 . 1 1 423 423 GLN CB C 423 27.900 27.900 28.175 -0.275 19685 7249 1 14 . 1 1 423 423 GLN H H 423 7.860 7.860 8.520 -0.660 19685 7250 1 14 . 1 1 424 424 MET N N 424 115.500 115.500 115.566 -0.066 19685 7251 1 14 . 1 1 424 424 MET HA H 424 3.910 3.910 4.404 -0.494 19685 7252 1 14 . 1 1 424 424 MET C C 424 175.500 175.500 175.005 0.495 19685 7253 1 14 . 1 1 424 424 MET CA C 424 57.800 57.800 54.341 3.459 19685 7254 1 14 . 1 1 424 424 MET CB C 424 34.300 34.300 32.937 1.363 19685 7255 1 14 . 1 1 424 424 MET H H 424 7.560 7.560 7.478 0.082 19685 7256 1 14 . 1 1 425 425 PHE N N 425 112.300 112.300 114.799 -2.499 19685 7257 1 14 . 1 1 425 425 PHE HA H 425 4.700 4.700 4.834 -0.134 19685 7258 1 14 . 1 1 425 425 PHE C C 425 177.300 177.300 176.709 0.591 19685 7259 1 14 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.475 1.425 19685 7260 1 14 . 1 1 425 425 PHE CB C 425 38.500 38.500 41.062 -2.562 19685 7261 1 14 . 1 1 425 425 PHE H H 425 7.680 7.680 7.600 0.080 19685 7262 1 14 . 1 1 426 426 MET N N 426 127.400 127.400 120.913 6.487 19685 7263 1 14 . 1 1 426 426 MET HA H 426 4.630 4.630 4.273 0.357 19685 7264 1 14 . 1 1 426 426 MET C C 426 173.800 173.800 174.994 -1.194 19685 7265 1 14 . 1 1 426 426 MET CA C 426 59.100 59.100 59.550 -0.450 19685 7266 1 14 . 1 1 426 426 MET CB C 426 31.800 31.800 30.351 1.449 19685 7267 1 14 . 1 1 426 426 MET H H 426 8.540 8.540 8.198 0.342 19685 7268 1 14 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.265 -0.255 19685 7269 1 14 . 1 1 427 427 PRO C C 427 176.800 176.800 176.483 0.317 19685 7270 1 14 . 1 1 427 427 PRO CA C 427 65.200 65.200 63.838 1.362 19685 7271 1 14 . 1 1 427 427 PRO CB C 427 30.600 30.600 31.461 -0.861 19685 7272 1 14 . 1 1 428 428 PHE N N 428 110.000 110.000 118.192 -8.192 19685 7273 1 14 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.696 -0.426 19685 7274 1 14 . 1 1 428 428 PHE C C 428 174.600 174.600 176.570 -1.970 19685 7275 1 14 . 1 1 428 428 PHE CA C 428 57.700 57.700 59.362 -1.662 19685 7276 1 14 . 1 1 428 428 PHE CB C 428 38.000 38.000 40.628 -2.628 19685 7277 1 14 . 1 1 428 428 PHE H H 428 6.560 6.560 7.880 -1.320 19685 7278 1 14 . 1 1 429 429 GLY N N 429 105.500 105.500 105.021 0.479 19685 7279 1 14 . 1 1 429 429 GLY C C 429 170.100 170.100 171.698 -1.598 19685 7280 1 14 . 1 1 429 429 GLY CA C 429 44.400 44.400 44.361 0.039 19685 7281 1 14 . 1 1 429 429 GLY H H 429 7.650 7.650 7.654 -0.004 19685 7282 1 14 . 1 1 430 430 ASN N N 430 117.400 117.400 117.126 0.274 19685 7283 1 14 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.607 0.023 19685 7284 1 14 . 1 1 430 430 ASN C C 430 173.200 173.200 176.387 -3.187 19685 7285 1 14 . 1 1 430 430 ASN CA C 430 52.600 52.600 53.415 -0.815 19685 7286 1 14 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.350 -2.150 19685 7287 1 14 . 1 1 430 430 ASN H H 430 9.020 9.020 8.543 0.477 19685 7288 1 14 . 1 1 431 431 VAL N N 431 128.000 128.000 122.393 5.607 19685 7289 1 14 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.172 -0.422 19685 7290 1 14 . 1 1 431 431 VAL C C 431 176.400 176.400 176.642 -0.242 19685 7291 1 14 . 1 1 431 431 VAL CA C 431 61.800 61.800 62.192 -0.392 19685 7292 1 14 . 1 1 431 431 VAL CB C 431 31.900 31.900 32.084 -0.184 19685 7293 1 14 . 1 1 431 431 VAL H H 431 8.480 8.480 8.459 0.021 19685 7294 1 14 . 1 1 432 432 ILE N N 432 128.000 128.000 117.252 10.748 19685 7295 1 14 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.613 0.307 19685 7296 1 14 . 1 1 432 432 ILE C C 432 176.100 176.100 175.360 0.740 19685 7297 1 14 . 1 1 432 432 ILE CA C 432 62.500 62.500 64.617 -2.117 19685 7298 1 14 . 1 1 432 432 ILE CB C 432 37.400 37.400 36.919 0.481 19685 7299 1 14 . 1 1 432 432 ILE H H 432 8.840 8.840 8.461 0.379 19685 7300 1 14 . 1 1 433 433 SER N N 433 113.600 113.600 115.158 -1.558 19685 7301 1 14 . 1 1 433 433 SER HA H 433 4.440 4.440 4.663 -0.223 19685 7302 1 14 . 1 1 433 433 SER C C 433 171.000 171.000 172.177 -1.177 19685 7303 1 14 . 1 1 433 433 SER CA C 433 57.300 57.300 57.741 -0.441 19685 7304 1 14 . 1 1 433 433 SER CB C 433 65.200 65.200 66.523 -1.323 19685 7305 1 14 . 1 1 433 433 SER H H 433 7.280 7.280 8.297 -1.017 19685 7306 1 14 . 1 1 434 434 ALA N N 434 125.700 125.700 125.968 -0.268 19685 7307 1 14 . 1 1 434 434 ALA HA H 434 4.910 4.910 4.840 0.070 19685 7308 1 14 . 1 1 434 434 ALA C C 434 174.600 174.600 176.240 -1.640 19685 7309 1 14 . 1 1 434 434 ALA CA C 434 51.000 51.000 50.972 0.028 19685 7310 1 14 . 1 1 434 434 ALA CB C 434 21.200 21.200 21.634 -0.434 19685 7311 1 14 . 1 1 434 434 ALA H H 434 8.270 8.270 8.328 -0.058 19685 7312 1 14 . 1 1 435 435 LYS N N 435 120.900 120.900 121.444 -0.544 19685 7313 1 14 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.620 -0.150 19685 7314 1 14 . 1 1 435 435 LYS C C 435 173.800 173.800 173.973 -0.173 19685 7315 1 14 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.129 -1.429 19685 7316 1 14 . 1 1 435 435 LYS CB C 435 36.400 36.400 35.761 0.639 19685 7317 1 14 . 1 1 435 435 LYS H H 435 8.490 8.490 8.128 0.362 19685 7318 1 14 . 1 1 436 436 VAL N N 436 122.200 122.200 118.975 3.225 19685 7319 1 14 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.426 -0.506 19685 7320 1 14 . 1 1 436 436 VAL C C 436 175.100 175.100 174.720 0.380 19685 7321 1 14 . 1 1 436 436 VAL CA C 436 63.600 63.600 61.928 1.673 19685 7322 1 14 . 1 1 436 436 VAL CB C 436 33.500 33.500 34.797 -1.297 19685 7323 1 14 . 1 1 436 436 VAL H H 436 8.390 8.390 8.326 0.064 19685 7324 1 14 . 1 1 437 437 PHE N N 437 125.900 125.900 125.648 0.252 19685 7325 1 14 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.730 -0.330 19685 7326 1 14 . 1 1 437 437 PHE C C 437 173.600 173.600 174.210 -0.610 19685 7327 1 14 . 1 1 437 437 PHE CA C 437 57.700 57.700 57.597 0.103 19685 7328 1 14 . 1 1 437 437 PHE CB C 437 39.000 39.000 39.792 -0.792 19685 7329 1 14 . 1 1 437 437 PHE H H 437 8.250 8.250 8.563 -0.313 19685 7330 1 14 . 1 1 438 438 ILE N N 438 121.900 121.900 113.562 8.338 19685 7331 1 14 . 1 1 438 438 ILE HA H 438 4.460 4.460 4.891 -0.431 19685 7332 1 14 . 1 1 438 438 ILE C C 438 175.700 175.700 173.955 1.745 19685 7333 1 14 . 1 1 438 438 ILE CA C 438 58.300 58.300 58.813 -0.513 19685 7334 1 14 . 1 1 438 438 ILE CB C 438 39.700 39.700 42.176 -2.476 19685 7335 1 14 . 1 1 438 438 ILE H H 438 8.520 8.520 7.371 1.149 19685 7336 1 14 . 1 1 439 439 ASP N N 439 126.500 126.500 119.470 7.030 19685 7337 1 14 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.843 -0.263 19685 7338 1 14 . 1 1 439 439 ASP C C 439 176.300 176.300 175.493 0.807 19685 7339 1 14 . 1 1 439 439 ASP CA C 439 53.600 53.600 52.806 0.794 19685 7340 1 14 . 1 1 439 439 ASP CB C 439 42.300 42.300 42.617 -0.318 19685 7341 1 14 . 1 1 439 439 ASP H H 439 8.730 8.730 8.327 0.403 19685 7342 1 14 . 1 1 440 440 LYS N N 440 127.300 127.300 118.390 8.910 19685 7343 1 14 . 1 1 440 440 LYS HA H 440 4.070 4.070 4.300 -0.230 19685 7344 1 14 . 1 1 440 440 LYS C C 440 176.900 176.900 176.222 0.678 19685 7345 1 14 . 1 1 440 440 LYS CA C 440 57.800 57.800 57.501 0.299 19685 7346 1 14 . 1 1 440 440 LYS CB C 440 32.100 32.100 32.562 -0.463 19685 7347 1 14 . 1 1 440 440 LYS H H 440 8.930 8.930 8.617 0.313 19685 7348 1 14 . 1 1 441 441 GLN N N 441 117.400 117.400 112.888 4.512 19685 7349 1 14 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.536 -0.306 19685 7350 1 14 . 1 1 441 441 GLN C C 441 177.200 177.200 175.620 1.580 19685 7351 1 14 . 1 1 441 441 GLN CA C 441 57.600 57.600 56.461 1.139 19685 7352 1 14 . 1 1 441 441 GLN CB C 441 28.800 28.800 29.346 -0.546 19685 7353 1 14 . 1 1 441 441 GLN H H 441 8.650 8.650 8.731 -0.081 19685 7354 1 14 . 1 1 442 442 THR N N 442 107.300 107.300 114.262 -6.962 19685 7355 1 14 . 1 1 442 442 THR HA H 442 4.290 4.290 4.476 -0.186 19685 7356 1 14 . 1 1 442 442 THR C C 442 175.100 175.100 174.057 1.043 19685 7357 1 14 . 1 1 442 442 THR CA C 442 61.200 61.200 62.239 -1.039 19685 7358 1 14 . 1 1 442 442 THR CB C 442 70.300 70.300 69.380 0.920 19685 7359 1 14 . 1 1 442 442 THR H H 442 7.830 7.830 7.749 0.081 19685 7360 1 14 . 1 1 443 443 ASN N N 443 117.300 117.300 118.367 -1.067 19685 7361 1 14 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.779 -0.479 19685 7362 1 14 . 1 1 443 443 ASN C C 443 173.400 173.400 175.398 -1.998 19685 7363 1 14 . 1 1 443 443 ASN CA C 443 54.300 54.300 52.986 1.314 19685 7364 1 14 . 1 1 443 443 ASN CB C 443 37.600 37.600 39.176 -1.577 19685 7365 1 14 . 1 1 443 443 ASN H H 443 8.470 8.470 8.274 0.196 19685 7366 1 14 . 1 1 444 444 LEU N N 444 118.000 118.000 117.045 0.955 19685 7367 1 14 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.873 -0.313 19685 7368 1 14 . 1 1 444 444 LEU C C 444 176.700 176.700 176.544 0.156 19685 7369 1 14 . 1 1 444 444 LEU CA C 444 53.300 53.300 54.815 -1.515 19685 7370 1 14 . 1 1 444 444 LEU CB C 444 43.500 43.500 40.983 2.517 19685 7371 1 14 . 1 1 444 444 LEU H H 444 7.660 7.660 8.060 -0.400 19685 7372 1 14 . 1 1 445 445 SER N N 445 115.500 115.500 110.069 5.431 19685 7373 1 14 . 1 1 445 445 SER HA H 445 4.460 4.460 4.523 -0.063 19685 7374 1 14 . 1 1 445 445 SER C C 445 176.500 176.500 174.993 1.507 19685 7375 1 14 . 1 1 445 445 SER CA C 445 57.900 57.900 59.078 -1.179 19685 7376 1 14 . 1 1 445 445 SER CB C 445 63.500 63.500 63.465 0.035 19685 7377 1 14 . 1 1 445 445 SER H H 445 8.840 8.840 7.869 0.971 19685 7378 1 14 . 1 1 446 446 LYS N N 446 125.200 125.200 119.177 6.023 19685 7379 1 14 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.534 -0.034 19685 7380 1 14 . 1 1 446 446 LYS C C 446 176.100 176.100 175.289 0.811 19685 7381 1 14 . 1 1 446 446 LYS CA C 446 56.300 56.300 56.344 -0.044 19685 7382 1 14 . 1 1 446 446 LYS CB C 446 32.200 32.200 34.565 -2.365 19685 7383 1 14 . 1 1 446 446 LYS H H 446 9.230 9.230 7.731 1.499 19685 7384 1 14 . 1 1 447 447 CYS N N 447 113.000 113.000 117.348 -4.348 19685 7385 1 14 . 1 1 447 447 CYS C C 447 172.500 172.500 172.529 -0.029 19685 7386 1 14 . 1 1 447 447 CYS CA C 447 60.400 60.400 57.855 2.545 19685 7387 1 14 . 1 1 447 447 CYS CB C 447 24.900 24.900 29.966 -5.066 19685 7388 1 14 . 1 1 447 447 CYS H H 447 10.020 10.020 7.821 2.199 19685 7389 1 14 . 1 1 448 448 PHE N N 448 115.200 115.200 118.198 -2.998 19685 7390 1 14 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.888 0.452 19685 7391 1 14 . 1 1 448 448 PHE C C 448 172.400 172.400 174.027 -1.627 19685 7392 1 14 . 1 1 448 448 PHE CA C 448 54.700 54.700 56.205 -1.504 19685 7393 1 14 . 1 1 448 448 PHE CB C 448 42.000 42.000 40.860 1.140 19685 7394 1 14 . 1 1 448 448 PHE H H 448 7.810 7.810 7.794 0.016 19685 7395 1 14 . 1 1 449 449 GLY N N 449 107.700 107.700 107.347 0.353 19685 7396 1 14 . 1 1 449 449 GLY C C 449 170.100 170.100 172.385 -2.285 19685 7397 1 14 . 1 1 449 449 GLY CA C 449 45.200 45.200 44.569 0.631 19685 7398 1 14 . 1 1 449 449 GLY H H 449 9.310 9.310 8.651 0.659 19685 7399 1 14 . 1 1 450 450 PHE N N 450 119.900 119.900 114.226 5.674 19685 7400 1 14 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.418 0.012 19685 7401 1 14 . 1 1 450 450 PHE C C 450 172.800 172.800 172.939 -0.139 19685 7402 1 14 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.865 -1.865 19685 7403 1 14 . 1 1 450 450 PHE CB C 450 43.600 43.600 41.510 2.090 19685 7404 1 14 . 1 1 450 450 PHE H H 450 8.760 8.760 8.328 0.432 19685 7405 1 14 . 1 1 451 451 VAL N N 451 123.800 123.800 118.367 5.433 19685 7406 1 14 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.597 -0.307 19685 7407 1 14 . 1 1 451 451 VAL C C 451 172.400 172.400 175.528 -3.128 19685 7408 1 14 . 1 1 451 451 VAL CA C 451 59.800 59.800 60.686 -0.886 19685 7409 1 14 . 1 1 451 451 VAL CB C 451 36.100 36.100 35.545 0.555 19685 7410 1 14 . 1 1 451 451 VAL H H 451 7.930 7.930 8.340 -0.410 19685 7411 1 14 . 1 1 452 452 SER N N 452 119.600 119.600 126.225 -6.625 19685 7412 1 14 . 1 1 452 452 SER HA H 452 5.120 5.120 5.031 0.089 19685 7413 1 14 . 1 1 452 452 SER C C 452 173.200 173.200 173.625 -0.425 19685 7414 1 14 . 1 1 452 452 SER CA C 452 55.700 55.700 57.741 -2.041 19685 7415 1 14 . 1 1 452 452 SER CB C 452 66.100 66.100 61.830 4.270 19685 7416 1 14 . 1 1 452 452 SER H H 452 8.540 8.540 9.051 -0.511 19685 7417 1 14 . 1 1 453 453 TYR N N 453 121.400 121.400 125.728 -4.328 19685 7418 1 14 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.560 0.820 19685 7419 1 14 . 1 1 453 453 TYR C C 453 173.600 173.600 176.425 -2.825 19685 7420 1 14 . 1 1 453 453 TYR CA C 453 56.500 56.500 57.135 -0.635 19685 7421 1 14 . 1 1 453 453 TYR CB C 453 42.200 42.200 36.717 5.483 19685 7422 1 14 . 1 1 453 453 TYR H H 453 8.380 8.380 7.719 0.661 19685 7423 1 14 . 1 1 454 454 ASP N N 454 113.300 113.300 126.676 -13.376 19685 7424 1 14 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.240 0.250 19685 7425 1 14 . 1 1 454 454 ASP C C 454 176.100 176.100 174.754 1.346 19685 7426 1 14 . 1 1 454 454 ASP CA C 454 52.800 52.800 57.085 -4.285 19685 7427 1 14 . 1 1 454 454 ASP CB C 454 40.400 40.400 40.749 -0.349 19685 7428 1 14 . 1 1 454 454 ASP H H 454 7.860 7.860 8.555 -0.695 19685 7429 1 14 . 1 1 455 455 ASN N N 455 113.800 113.800 113.921 -0.121 19685 7430 1 14 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.097 -0.047 19685 7431 1 14 . 1 1 455 455 ASN C C 455 173.100 173.100 173.144 -0.044 19685 7432 1 14 . 1 1 455 455 ASN CA C 455 50.700 50.700 52.096 -1.395 19685 7433 1 14 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.048 1.052 19685 7434 1 14 . 1 1 455 455 ASN H H 455 7.200 7.200 8.171 -0.971 19685 7435 1 14 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.226 -0.056 19685 7436 1 14 . 1 1 456 456 PRO C C 456 177.300 177.300 177.106 0.194 19685 7437 1 14 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.925 -0.725 19685 7438 1 14 . 1 1 456 456 PRO CB C 456 32.300 32.300 31.861 0.439 19685 7439 1 14 . 1 1 457 457 VAL N N 457 120.900 120.900 115.783 5.117 19685 7440 1 14 . 1 1 457 457 VAL HA H 457 3.620 3.620 3.944 -0.324 19685 7441 1 14 . 1 1 457 457 VAL C C 457 179.000 179.000 176.608 2.392 19685 7442 1 14 . 1 1 457 457 VAL CA C 457 65.900 65.900 63.784 2.116 19685 7443 1 14 . 1 1 457 457 VAL CB C 457 30.800 30.800 30.686 0.115 19685 7444 1 14 . 1 1 457 457 VAL H H 457 8.120 8.120 7.878 0.242 19685 7445 1 14 . 1 1 458 458 SER N N 458 117.800 117.800 115.234 2.566 19685 7446 1 14 . 1 1 458 458 SER HA H 458 3.940 3.940 4.470 -0.530 19685 7447 1 14 . 1 1 458 458 SER C C 458 173.600 173.600 175.219 -1.619 19685 7448 1 14 . 1 1 458 458 SER CA C 458 61.100 61.100 59.263 1.837 19685 7449 1 14 . 1 1 458 458 SER CB C 458 62.400 62.400 64.075 -1.675 19685 7450 1 14 . 1 1 458 458 SER H H 458 7.830 7.830 8.000 -0.170 19685 7451 1 14 . 1 1 459 459 ALA N N 459 120.000 120.000 124.968 -4.968 19685 7452 1 14 . 1 1 459 459 ALA HA H 459 3.750 3.750 3.235 0.515 19685 7453 1 14 . 1 1 459 459 ALA C C 459 178.100 178.100 178.145 -0.045 19685 7454 1 14 . 1 1 459 459 ALA CA C 459 54.500 54.500 53.925 0.576 19685 7455 1 14 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.045 -0.145 19685 7456 1 14 . 1 1 459 459 ALA H H 459 6.370 6.370 8.114 -1.744 19685 7457 1 14 . 1 1 460 460 GLN N N 460 116.100 116.100 118.941 -2.841 19685 7458 1 14 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.045 -0.215 19685 7459 1 14 . 1 1 460 460 GLN C C 460 178.000 178.000 176.981 1.019 19685 7460 1 14 . 1 1 460 460 GLN CA C 460 58.500 58.500 57.729 0.771 19685 7461 1 14 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.443 -1.043 19685 7462 1 14 . 1 1 460 460 GLN H H 460 7.710 7.710 7.906 -0.196 19685 7463 1 14 . 1 1 461 461 ALA N N 461 122.800 122.800 120.794 2.006 19685 7464 1 14 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.254 -0.294 19685 7465 1 14 . 1 1 461 461 ALA C C 461 179.500 179.500 178.164 1.336 19685 7466 1 14 . 1 1 461 461 ALA CA C 461 54.500 54.500 53.576 0.924 19685 7467 1 14 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.088 -1.588 19685 7468 1 14 . 1 1 461 461 ALA H H 461 7.880 7.880 7.480 0.400 19685 7469 1 14 . 1 1 462 462 ALA N N 462 121.400 121.400 120.305 1.095 19685 7470 1 14 . 1 1 462 462 ALA HA H 462 2.400 2.400 4.021 -1.621 19685 7471 1 14 . 1 1 462 462 ALA C C 462 179.400 179.400 178.741 0.659 19685 7472 1 14 . 1 1 462 462 ALA CA C 462 54.100 54.100 53.891 0.209 19685 7473 1 14 . 1 1 462 462 ALA CB C 462 18.700 18.700 19.798 -1.098 19685 7474 1 14 . 1 1 462 462 ALA H H 462 7.860 7.860 7.511 0.349 19685 7475 1 14 . 1 1 463 463 ILE N N 463 118.600 118.600 115.559 3.041 19685 7476 1 14 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.910 -0.670 19685 7477 1 14 . 1 1 463 463 ILE C C 463 177.500 177.500 176.058 1.442 19685 7478 1 14 . 1 1 463 463 ILE CA C 463 66.000 66.000 63.048 2.952 19685 7479 1 14 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.028 0.272 19685 7480 1 14 . 1 1 463 463 ILE H H 463 8.090 8.090 7.337 0.753 19685 7481 1 14 . 1 1 464 464 GLN N N 464 117.000 117.000 116.212 0.788 19685 7482 1 14 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.432 -0.562 19685 7483 1 14 . 1 1 464 464 GLN C C 464 177.700 177.700 175.185 2.515 19685 7484 1 14 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.841 2.359 19685 7485 1 14 . 1 1 464 464 GLN CB C 464 27.900 27.900 30.002 -2.102 19685 7486 1 14 . 1 1 464 464 GLN H H 464 7.780 7.780 7.492 0.288 19685 7487 1 14 . 1 1 465 465 ALA N N 465 117.200 117.200 120.803 -3.603 19685 7488 1 14 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.459 -0.229 19685 7489 1 14 . 1 1 465 465 ALA C C 465 179.200 179.200 176.427 2.773 19685 7490 1 14 . 1 1 465 465 ALA CA C 465 53.800 53.800 53.049 0.751 19685 7491 1 14 . 1 1 465 465 ALA CB C 465 21.100 21.100 20.706 0.394 19685 7492 1 14 . 1 1 465 465 ALA H H 465 7.540 7.540 7.521 0.019 19685 7493 1 14 . 1 1 466 466 MET N N 466 110.800 110.800 117.686 -6.886 19685 7494 1 14 . 1 1 466 466 MET HA H 466 4.820 4.820 4.684 0.136 19685 7495 1 14 . 1 1 466 466 MET C C 466 177.600 177.600 175.055 2.545 19685 7496 1 14 . 1 1 466 466 MET CA C 466 53.300 53.300 55.331 -2.031 19685 7497 1 14 . 1 1 466 466 MET CB C 466 31.600 31.600 35.978 -4.378 19685 7498 1 14 . 1 1 466 466 MET H H 466 8.230 8.230 8.016 0.214 19685 7499 1 14 . 1 1 467 467 ASN N N 467 119.100 119.100 118.716 0.384 19685 7500 1 14 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.611 -0.121 19685 7501 1 14 . 1 1 467 467 ASN C C 467 176.300 176.300 176.753 -0.453 19685 7502 1 14 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.506 1.694 19685 7503 1 14 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.857 -0.657 19685 7504 1 14 . 1 1 467 467 ASN H H 467 8.560 8.560 7.766 0.794 19685 7505 1 14 . 1 1 468 468 GLY N N 468 117.900 117.900 112.799 5.101 19685 7506 1 14 . 1 1 468 468 GLY C C 468 172.800 172.800 173.733 -0.933 19685 7507 1 14 . 1 1 468 468 GLY CA C 468 45.300 45.300 45.612 -0.312 19685 7508 1 14 . 1 1 468 468 GLY H H 468 8.930 8.930 8.490 0.440 19685 7509 1 14 . 1 1 469 469 PHE N N 469 123.300 123.300 119.859 3.441 19685 7510 1 14 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.874 -0.684 19685 7511 1 14 . 1 1 469 469 PHE C C 469 174.400 174.400 173.584 0.816 19685 7512 1 14 . 1 1 469 469 PHE CA C 469 58.700 58.700 55.342 3.358 19685 7513 1 14 . 1 1 469 469 PHE CB C 469 40.600 40.600 41.761 -1.161 19685 7514 1 14 . 1 1 469 469 PHE H H 469 7.950 7.950 7.674 0.276 19685 7515 1 14 . 1 1 470 470 GLN N N 470 129.200 129.200 120.544 8.656 19685 7516 1 14 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.275 0.315 19685 7517 1 14 . 1 1 470 470 GLN C C 470 174.100 174.100 173.552 0.548 19685 7518 1 14 . 1 1 470 470 GLN CA C 470 55.500 55.500 54.548 0.952 19685 7519 1 14 . 1 1 470 470 GLN CB C 470 28.800 28.800 31.570 -2.770 19685 7520 1 14 . 1 1 470 470 GLN H H 470 8.330 8.330 7.137 1.193 19685 7521 1 14 . 1 1 471 471 ILE N N 471 126.300 126.300 124.423 1.877 19685 7522 1 14 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.176 -0.006 19685 7523 1 14 . 1 1 471 471 ILE C C 471 175.400 175.400 174.884 0.516 19685 7524 1 14 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.447 -0.847 19685 7525 1 14 . 1 1 471 471 ILE CB C 471 39.100 39.100 40.007 -0.907 19685 7526 1 14 . 1 1 471 471 ILE H H 471 8.440 8.440 8.666 -0.226 19685 7527 1 14 . 1 1 472 472 GLY N N 472 117.500 117.500 116.422 1.078 19685 7528 1 14 . 1 1 472 472 GLY C C 472 174.700 174.700 174.287 0.413 19685 7529 1 14 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.548 0.952 19685 7530 1 14 . 1 1 472 472 GLY H H 472 8.980 8.980 8.537 0.443 19685 7531 1 14 . 1 1 473 473 MET N N 473 124.100 124.100 119.595 4.505 19685 7532 1 14 . 1 1 473 473 MET HA H 473 4.380 4.380 4.421 -0.041 19685 7533 1 14 . 1 1 473 473 MET C C 473 175.700 175.700 176.126 -0.426 19685 7534 1 14 . 1 1 473 473 MET CA C 473 55.000 55.000 56.533 -1.533 19685 7535 1 14 . 1 1 473 473 MET CB C 473 32.900 32.900 32.340 0.561 19685 7536 1 14 . 1 1 473 473 MET H H 473 9.070 9.070 8.304 0.766 19685 7537 1 14 . 1 1 474 474 LYS N N 474 118.700 118.700 118.018 0.682 19685 7538 1 14 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.656 -0.176 19685 7539 1 14 . 1 1 474 474 LYS C C 474 174.300 174.300 174.354 -0.054 19685 7540 1 14 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.783 -0.183 19685 7541 1 14 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.440 -0.340 19685 7542 1 14 . 1 1 474 474 LYS H H 474 7.770 7.770 7.334 0.436 19685 7543 1 14 . 1 1 475 475 ARG N N 475 119.600 119.600 119.006 0.594 19685 7544 1 14 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.429 0.371 19685 7545 1 14 . 1 1 475 475 ARG C C 475 175.700 175.700 175.118 0.582 19685 7546 1 14 . 1 1 475 475 ARG CA C 475 54.000 54.000 55.432 -1.433 19685 7547 1 14 . 1 1 475 475 ARG CB C 475 31.300 31.300 31.723 -0.423 19685 7548 1 14 . 1 1 475 475 ARG H H 475 8.350 8.350 8.244 0.106 19685 7549 1 14 . 1 1 476 476 LEU N N 476 123.500 123.500 121.105 2.395 19685 7550 1 14 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.609 -0.179 19685 7551 1 14 . 1 1 476 476 LEU C C 476 177.600 177.600 174.901 2.699 19685 7552 1 14 . 1 1 476 476 LEU CA C 476 55.500 55.500 53.480 2.020 19685 7553 1 14 . 1 1 476 476 LEU CB C 476 42.800 42.800 44.848 -2.048 19685 7554 1 14 . 1 1 476 476 LEU H H 476 9.130 9.130 8.718 0.412 19685 7555 1 14 . 1 1 477 477 LYS N N 477 123.200 123.200 125.765 -2.565 19685 7556 1 14 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.792 0.368 19685 7557 1 14 . 1 1 477 477 LYS C C 477 174.100 174.100 174.177 -0.077 19685 7558 1 14 . 1 1 477 477 LYS CA C 477 54.500 54.500 55.141 -0.641 19685 7559 1 14 . 1 1 477 477 LYS CB C 477 34.900 34.900 35.830 -0.929 19685 7560 1 14 . 1 1 477 477 LYS H H 477 8.090 8.090 8.227 -0.137 19685 7561 1 14 . 1 1 478 478 VAL N N 478 127.100 127.100 122.845 4.255 19685 7562 1 14 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.482 0.418 19685 7563 1 14 . 1 1 478 478 VAL C C 478 173.700 173.700 173.937 -0.237 19685 7564 1 14 . 1 1 478 478 VAL CA C 478 61.000 61.000 60.436 0.564 19685 7565 1 14 . 1 1 478 478 VAL CB C 478 33.700 33.700 35.461 -1.761 19685 7566 1 14 . 1 1 478 478 VAL H H 478 8.820 8.820 8.198 0.622 19685 7567 1 14 . 1 1 479 479 GLN N N 479 123.600 123.600 121.434 2.166 19685 7568 1 14 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.746 0.064 19685 7569 1 14 . 1 1 479 479 GLN C C 479 173.600 173.600 174.161 -0.561 19685 7570 1 14 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.355 -1.155 19685 7571 1 14 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.454 1.046 19685 7572 1 14 . 1 1 479 479 GLN H H 479 9.130 9.130 8.431 0.699 19685 7573 1 14 . 1 1 480 480 LEU N N 480 123.200 123.200 122.313 0.887 19685 7574 1 14 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.371 0.069 19685 7575 1 14 . 1 1 480 480 LEU C C 480 177.100 177.100 176.751 0.349 19685 7576 1 14 . 1 1 480 480 LEU CA C 480 54.600 54.600 54.397 0.203 19685 7577 1 14 . 1 1 480 480 LEU CB C 480 42.400 42.400 42.811 -0.411 19685 7578 1 14 . 1 1 480 480 LEU H H 480 8.840 8.840 8.382 0.458 19685 7579 1 14 . 1 1 481 481 LYS N N 481 124.500 124.500 125.581 -1.081 19685 7580 1 14 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.430 -0.120 19685 7581 1 14 . 1 1 481 481 LYS C C 481 175.200 175.200 175.915 -0.715 19685 7582 1 14 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.892 -1.192 19685 7583 1 14 . 1 1 481 481 LYS CB C 481 33.100 33.100 31.341 1.758 19685 7584 1 14 . 1 1 481 481 LYS H H 481 8.400 8.400 8.540 -0.140 19685 7585 1 14 . 1 1 482 482 ARG N N 482 126.600 126.600 119.914 6.686 19685 7586 1 14 . 1 1 482 482 ARG HA H 482 4.350 4.350 4.366 -0.016 19685 7587 1 14 . 1 1 482 482 ARG C C 482 175.800 175.800 174.623 1.177 19685 7588 1 14 . 1 1 482 482 ARG CA C 482 55.600 55.600 55.740 -0.140 19685 7589 1 14 . 1 1 482 482 ARG CB C 482 31.100 31.100 31.468 -0.367 19685 7590 1 14 . 1 1 482 482 ARG H H 482 8.770 8.770 8.799 -0.029 19685 7591 1 14 . 1 1 483 483 SER N N 483 118.100 118.100 113.496 4.604 19685 7592 1 14 . 1 1 483 483 SER HA H 483 4.400 4.400 4.680 -0.280 19685 7593 1 14 . 1 1 483 483 SER C C 483 174.200 174.200 172.548 1.652 19685 7594 1 14 . 1 1 483 483 SER CA C 483 58.000 58.000 57.408 0.592 19685 7595 1 14 . 1 1 483 483 SER CB C 483 63.500 63.500 65.981 -2.481 19685 7596 1 14 . 1 1 483 483 SER H H 483 8.610 8.610 7.215 1.395 19685 7597 1 14 . 1 1 484 484 LYS N N 484 123.000 123.000 118.870 4.130 19685 7598 1 14 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.712 -0.502 19685 7599 1 14 . 1 1 484 484 LYS C C 484 175.900 175.900 175.579 0.321 19685 7600 1 14 . 1 1 484 484 LYS CA C 484 56.300 56.300 57.612 -1.312 19685 7601 1 14 . 1 1 484 484 LYS CB C 484 32.500 32.500 34.937 -2.437 19685 7602 1 14 . 1 1 484 484 LYS H H 484 8.560 8.560 9.018 -0.458 19685 7603 1 14 . 1 1 485 485 ASN N N 485 119.600 119.600 116.777 2.823 19685 7604 1 14 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.865 -0.265 19685 7605 1 14 . 1 1 485 485 ASN C C 485 174.400 174.400 173.629 0.771 19685 7606 1 14 . 1 1 485 485 ASN CA C 485 52.900 52.900 53.068 -0.168 19685 7607 1 14 . 1 1 485 485 ASN CB C 485 38.400 38.400 39.255 -0.855 19685 7608 1 14 . 1 1 485 485 ASN H H 485 8.560 8.560 8.100 0.460 19685 7609 1 14 . 1 1 486 486 ASP N N 486 121.100 121.100 119.954 1.146 19685 7610 1 14 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.728 -0.208 19685 7611 1 14 . 1 1 486 486 ASP C C 486 175.700 175.700 176.024 -0.324 19685 7612 1 14 . 1 1 486 486 ASP CA C 486 54.000 54.000 54.342 -0.342 19685 7613 1 14 . 1 1 486 486 ASP CB C 486 40.800 40.800 41.761 -0.961 19685 7614 1 14 . 1 1 486 486 ASP H H 486 8.250 8.250 8.212 0.038 19685 7615 1 14 . 1 1 487 487 SER N N 487 115.400 115.400 115.701 -0.301 19685 7616 1 14 . 1 1 487 487 SER HA H 487 4.310 4.310 4.695 -0.385 19685 7617 1 14 . 1 1 487 487 SER C C 487 172.800 172.800 174.948 -2.148 19685 7618 1 14 . 1 1 487 487 SER CA C 487 57.700 57.700 57.766 -0.066 19685 7619 1 14 . 1 1 487 487 SER CB C 487 63.600 63.600 64.857 -1.257 19685 7620 1 14 . 1 1 487 487 SER H H 487 8.090 8.090 8.448 -0.358 19685 7621 1 14 . 1 1 488 488 LYS N N 488 122.300 122.300 120.487 1.813 19685 7622 1 14 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.737 -0.687 19685 7623 1 14 . 1 1 488 488 LYS C C 488 174.500 174.500 174.797 -0.297 19685 7624 1 14 . 1 1 488 488 LYS CA C 488 54.000 54.000 54.070 -0.070 19685 7625 1 14 . 1 1 488 488 LYS CB C 488 32.400 32.400 31.215 1.185 19685 7626 1 14 . 1 1 488 488 LYS H H 488 8.090 8.090 8.219 -0.129 19685 7627 1 14 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.477 -0.197 19685 7628 1 14 . 1 1 489 489 PRO C C 489 175.000 175.000 175.904 -0.904 19685 7629 1 14 . 1 1 489 489 PRO CA C 489 63.200 63.200 62.982 0.218 19685 7630 1 14 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.131 -1.031 19685 7631 1 15 . 1 1 395 395 SER N N 395 115.500 115.500 115.729 -0.229 19685 7632 1 15 . 1 1 395 395 SER HA H 395 4.300 4.300 3.996 0.304 19685 7633 1 15 . 1 1 395 395 SER C C 395 173.900 173.900 173.500 0.400 19685 7634 1 15 . 1 1 395 395 SER CA C 395 57.900 57.900 58.811 -0.911 19685 7635 1 15 . 1 1 395 395 SER CB C 395 63.400 63.400 63.075 0.325 19685 7636 1 15 . 1 1 395 395 SER H H 395 8.200 8.200 8.360 -0.160 19685 7637 1 15 . 1 1 396 396 HIS N N 396 123.500 123.500 116.650 6.850 19685 7638 1 15 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.456 0.104 19685 7639 1 15 . 1 1 396 396 HIS C C 396 174.100 174.100 174.200 -0.100 19685 7640 1 15 . 1 1 396 396 HIS CA C 396 53.700 53.700 57.142 -3.442 19685 7641 1 15 . 1 1 396 396 HIS CB C 396 32.200 32.200 28.540 3.660 19685 7642 1 15 . 1 1 396 396 HIS H H 396 8.120 8.120 7.988 0.132 19685 7643 1 15 . 1 1 397 397 MET N N 397 121.200 121.200 114.387 6.813 19685 7644 1 15 . 1 1 397 397 MET HA H 397 4.320 4.320 4.781 -0.461 19685 7645 1 15 . 1 1 397 397 MET C C 397 175.400 175.400 175.292 0.108 19685 7646 1 15 . 1 1 397 397 MET CA C 397 55.000 55.000 54.741 0.259 19685 7647 1 15 . 1 1 397 397 MET CB C 397 32.500 32.500 34.341 -1.841 19685 7648 1 15 . 1 1 397 397 MET H H 397 8.300 8.300 7.529 0.771 19685 7649 1 15 . 1 1 398 398 GLN N N 398 122.100 122.100 121.208 0.892 19685 7650 1 15 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.398 -0.208 19685 7651 1 15 . 1 1 398 398 GLN C C 398 174.800 174.800 176.335 -1.535 19685 7652 1 15 . 1 1 398 398 GLN CA C 398 55.200 55.200 56.330 -1.130 19685 7653 1 15 . 1 1 398 398 GLN CB C 398 28.900 28.900 29.354 -0.454 19685 7654 1 15 . 1 1 398 398 GLN H H 398 8.540 8.540 8.400 0.140 19685 7655 1 15 . 1 1 399 399 LYS N N 399 123.000 123.000 120.210 2.790 19685 7656 1 15 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.504 -0.284 19685 7657 1 15 . 1 1 399 399 LYS C C 399 174.800 174.800 176.473 -1.673 19685 7658 1 15 . 1 1 399 399 LYS CA C 399 55.600 55.600 56.623 -1.023 19685 7659 1 15 . 1 1 399 399 LYS CB C 399 33.000 33.000 32.379 0.621 19685 7660 1 15 . 1 1 399 399 LYS H H 399 8.180 8.180 8.662 -0.482 19685 7661 1 15 . 1 1 400 400 GLU N N 400 122.000 122.000 118.864 3.136 19685 7662 1 15 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.830 -0.400 19685 7663 1 15 . 1 1 400 400 GLU C C 400 176.400 176.400 175.227 1.173 19685 7664 1 15 . 1 1 400 400 GLU CA C 400 55.400 55.400 55.465 -0.065 19685 7665 1 15 . 1 1 400 400 GLU CB C 400 31.400 31.400 30.404 0.996 19685 7666 1 15 . 1 1 400 400 GLU H H 400 8.350 8.350 8.207 0.143 19685 7667 1 15 . 1 1 401 401 GLY N N 401 109.500 109.500 107.904 1.596 19685 7668 1 15 . 1 1 401 401 GLY C C 401 171.500 171.500 173.150 -1.650 19685 7669 1 15 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.361 -0.661 19685 7670 1 15 . 1 1 401 401 GLY H H 401 9.050 9.050 7.747 1.303 19685 7671 1 15 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.506 -0.086 19685 7672 1 15 . 1 1 402 402 PRO C C 402 173.900 173.900 176.501 -2.601 19685 7673 1 15 . 1 1 402 402 PRO CA C 402 61.900 61.900 64.213 -2.313 19685 7674 1 15 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.214 -0.014 19685 7675 1 15 . 1 1 403 403 GLU N N 403 119.600 119.600 119.208 0.392 19685 7676 1 15 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.481 -0.521 19685 7677 1 15 . 1 1 403 403 GLU C C 403 177.300 177.300 176.834 0.466 19685 7678 1 15 . 1 1 403 403 GLU CA C 403 58.100 58.100 56.799 1.301 19685 7679 1 15 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.672 -1.672 19685 7680 1 15 . 1 1 403 403 GLU H H 403 8.420 8.420 7.773 0.647 19685 7681 1 15 . 1 1 404 404 GLY N N 404 112.800 112.800 107.512 5.288 19685 7682 1 15 . 1 1 404 404 GLY C C 404 173.300 173.300 174.222 -0.922 19685 7683 1 15 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.493 -0.593 19685 7684 1 15 . 1 1 404 404 GLY H H 404 8.500 8.500 8.498 0.002 19685 7685 1 15 . 1 1 405 405 ALA N N 405 120.000 120.000 123.631 -3.631 19685 7686 1 15 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.235 0.315 19685 7687 1 15 . 1 1 405 405 ALA C C 405 174.100 174.100 175.735 -1.635 19685 7688 1 15 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.860 -1.360 19685 7689 1 15 . 1 1 405 405 ALA CB C 405 20.800 20.800 16.910 3.890 19685 7690 1 15 . 1 1 405 405 ALA H H 405 8.360 8.360 8.206 0.154 19685 7691 1 15 . 1 1 406 406 ASN N N 406 115.500 115.500 116.916 -1.416 19685 7692 1 15 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.441 -0.251 19685 7693 1 15 . 1 1 406 406 ASN C C 406 172.900 172.900 175.125 -2.225 19685 7694 1 15 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.953 0.646 19685 7695 1 15 . 1 1 406 406 ASN CB C 406 40.900 40.900 38.936 1.964 19685 7696 1 15 . 1 1 406 406 ASN H H 406 7.690 7.690 8.089 -0.399 19685 7697 1 15 . 1 1 407 407 LEU N N 407 123.400 123.400 120.535 2.865 19685 7698 1 15 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.361 0.599 19685 7699 1 15 . 1 1 407 407 LEU C C 407 174.900 174.900 177.552 -2.652 19685 7700 1 15 . 1 1 407 407 LEU CA C 407 53.100 53.100 56.448 -3.348 19685 7701 1 15 . 1 1 407 407 LEU CB C 407 45.400 45.400 42.174 3.226 19685 7702 1 15 . 1 1 407 407 LEU H H 407 9.290 9.290 7.574 1.716 19685 7703 1 15 . 1 1 408 408 PHE N N 408 118.700 118.700 119.812 -1.112 19685 7704 1 15 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.832 0.468 19685 7705 1 15 . 1 1 408 408 PHE C C 408 174.200 174.200 175.769 -1.569 19685 7706 1 15 . 1 1 408 408 PHE CA C 408 56.300 56.300 56.745 -0.445 19685 7707 1 15 . 1 1 408 408 PHE CB C 408 42.700 42.700 39.506 3.194 19685 7708 1 15 . 1 1 408 408 PHE H H 408 9.150 9.150 8.321 0.829 19685 7709 1 15 . 1 1 409 409 ILE N N 409 120.800 120.800 121.401 -0.601 19685 7710 1 15 . 1 1 409 409 ILE HA H 409 4.970 4.970 3.932 1.038 19685 7711 1 15 . 1 1 409 409 ILE C C 409 173.900 173.900 174.855 -0.955 19685 7712 1 15 . 1 1 409 409 ILE CA C 409 59.000 59.000 62.289 -3.289 19685 7713 1 15 . 1 1 409 409 ILE CB C 409 40.400 40.400 37.248 3.152 19685 7714 1 15 . 1 1 409 409 ILE H H 409 8.380 8.380 7.617 0.763 19685 7715 1 15 . 1 1 410 410 TYR N N 410 123.200 123.200 122.625 0.575 19685 7716 1 15 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.592 0.348 19685 7717 1 15 . 1 1 410 410 TYR C C 410 174.300 174.300 175.590 -1.290 19685 7718 1 15 . 1 1 410 410 TYR CA C 410 56.200 56.200 58.494 -2.294 19685 7719 1 15 . 1 1 410 410 TYR CB C 410 40.800 40.800 38.224 2.576 19685 7720 1 15 . 1 1 410 410 TYR H H 410 9.440 9.440 8.118 1.322 19685 7721 1 15 . 1 1 411 411 HIS N N 411 112.100 112.100 119.534 -7.434 19685 7722 1 15 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.119 0.331 19685 7723 1 15 . 1 1 411 411 HIS C C 411 173.300 173.300 175.153 -1.853 19685 7724 1 15 . 1 1 411 411 HIS CA C 411 55.900 55.900 57.947 -2.047 19685 7725 1 15 . 1 1 411 411 HIS CB C 411 26.200 26.200 29.373 -3.173 19685 7726 1 15 . 1 1 411 411 HIS H H 411 8.580 8.580 7.585 0.995 19685 7727 1 15 . 1 1 412 412 LEU N N 412 115.100 115.100 120.298 -5.198 19685 7728 1 15 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.100 -0.140 19685 7729 1 15 . 1 1 412 412 LEU C C 412 175.100 175.100 175.178 -0.078 19685 7730 1 15 . 1 1 412 412 LEU CA C 412 52.400 52.400 54.021 -1.621 19685 7731 1 15 . 1 1 412 412 LEU CB C 412 42.000 42.000 42.156 -0.156 19685 7732 1 15 . 1 1 412 412 LEU H H 412 7.560 7.560 8.048 -0.488 19685 7733 1 15 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.467 -0.197 19685 7734 1 15 . 1 1 413 413 PRO C C 413 177.600 177.600 176.925 0.675 19685 7735 1 15 . 1 1 413 413 PRO CA C 413 62.300 62.300 63.182 -0.882 19685 7736 1 15 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.396 -0.196 19685 7737 1 15 . 1 1 414 414 GLN N N 414 125.500 125.500 116.701 8.799 19685 7738 1 15 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.247 -0.167 19685 7739 1 15 . 1 1 414 414 GLN C C 414 175.400 175.400 175.559 -0.159 19685 7740 1 15 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.027 -0.027 19685 7741 1 15 . 1 1 414 414 GLN CB C 414 28.500 28.500 29.044 -0.544 19685 7742 1 15 . 1 1 414 414 GLN H H 414 9.170 9.170 8.493 0.677 19685 7743 1 15 . 1 1 415 415 GLU N N 415 115.300 115.300 118.386 -3.086 19685 7744 1 15 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.767 -0.507 19685 7745 1 15 . 1 1 415 415 GLU C C 415 176.700 176.700 175.316 1.384 19685 7746 1 15 . 1 1 415 415 GLU CA C 415 58.700 58.700 55.505 3.195 19685 7747 1 15 . 1 1 415 415 GLU CB C 415 28.300 28.300 31.930 -3.630 19685 7748 1 15 . 1 1 415 415 GLU H H 415 9.390 9.390 7.748 1.642 19685 7749 1 15 . 1 1 416 416 PHE N N 416 121.700 121.700 115.706 5.994 19685 7750 1 15 . 1 1 416 416 PHE HA H 416 4.610 4.610 4.407 0.203 19685 7751 1 15 . 1 1 416 416 PHE C C 416 176.400 176.400 175.582 0.818 19685 7752 1 15 . 1 1 416 416 PHE CA C 416 57.400 57.400 59.030 -1.630 19685 7753 1 15 . 1 1 416 416 PHE CB C 416 38.700 38.700 38.593 0.108 19685 7754 1 15 . 1 1 416 416 PHE H H 416 7.610 7.610 7.875 -0.265 19685 7755 1 15 . 1 1 417 417 GLY N N 417 113.000 113.000 107.226 5.774 19685 7756 1 15 . 1 1 417 417 GLY C C 417 174.300 174.300 173.302 0.998 19685 7757 1 15 . 1 1 417 417 GLY CA C 417 42.900 42.900 45.288 -2.388 19685 7758 1 15 . 1 1 417 417 GLY H H 417 9.740 9.740 8.391 1.349 19685 7759 1 15 . 1 1 418 418 ASP N N 418 121.500 121.500 118.079 3.421 19685 7760 1 15 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.462 -0.522 19685 7761 1 15 . 1 1 418 418 ASP C C 418 177.900 177.900 175.180 2.720 19685 7762 1 15 . 1 1 418 418 ASP CA C 418 57.600 57.600 54.747 2.853 19685 7763 1 15 . 1 1 418 418 ASP CB C 418 39.700 39.700 40.579 -0.879 19685 7764 1 15 . 1 1 418 418 ASP H H 418 8.680 8.680 8.789 -0.109 19685 7765 1 15 . 1 1 419 419 GLN N N 419 116.400 116.400 113.475 2.925 19685 7766 1 15 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.524 -0.614 19685 7767 1 15 . 1 1 419 419 GLN C C 419 177.600 177.600 174.974 2.626 19685 7768 1 15 . 1 1 419 419 GLN CA C 419 58.000 58.000 55.528 2.472 19685 7769 1 15 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.994 -1.594 19685 7770 1 15 . 1 1 419 419 GLN H H 419 8.780 8.780 7.928 0.852 19685 7771 1 15 . 1 1 420 420 ASP N N 420 117.500 117.500 119.691 -2.191 19685 7772 1 15 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.764 -0.754 19685 7773 1 15 . 1 1 420 420 ASP C C 420 178.000 178.000 177.488 0.512 19685 7774 1 15 . 1 1 420 420 ASP CA C 420 56.700 56.700 54.414 2.286 19685 7775 1 15 . 1 1 420 420 ASP CB C 420 39.800 39.800 42.850 -3.050 19685 7776 1 15 . 1 1 420 420 ASP H H 420 7.210 7.210 7.821 -0.611 19685 7777 1 15 . 1 1 421 421 ILE N N 421 117.000 117.000 122.294 -5.294 19685 7778 1 15 . 1 1 421 421 ILE HA H 421 4.080 4.080 4.342 -0.262 19685 7779 1 15 . 1 1 421 421 ILE C C 421 176.500 176.500 177.348 -0.848 19685 7780 1 15 . 1 1 421 421 ILE CA C 421 64.000 64.000 65.171 -1.171 19685 7781 1 15 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.442 -1.142 19685 7782 1 15 . 1 1 421 421 ILE H H 421 7.610 7.610 8.653 -1.043 19685 7783 1 15 . 1 1 422 422 LEU N N 422 123.200 123.200 117.010 6.190 19685 7784 1 15 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.181 -0.421 19685 7785 1 15 . 1 1 422 422 LEU C C 422 177.800 177.800 176.579 1.221 19685 7786 1 15 . 1 1 422 422 LEU CA C 422 58.600 58.600 57.123 1.477 19685 7787 1 15 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.655 -0.455 19685 7788 1 15 . 1 1 422 422 LEU H H 422 7.870 7.870 8.266 -0.396 19685 7789 1 15 . 1 1 423 423 GLN N N 423 115.600 115.600 115.397 0.203 19685 7790 1 15 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.440 -0.560 19685 7791 1 15 . 1 1 423 423 GLN C C 423 177.800 177.800 175.506 2.294 19685 7792 1 15 . 1 1 423 423 GLN CA C 423 58.600 58.600 56.016 2.584 19685 7793 1 15 . 1 1 423 423 GLN CB C 423 27.900 27.900 29.531 -1.631 19685 7794 1 15 . 1 1 423 423 GLN H H 423 7.860 7.860 7.460 0.400 19685 7795 1 15 . 1 1 424 424 MET N N 424 115.500 115.500 117.552 -2.052 19685 7796 1 15 . 1 1 424 424 MET HA H 424 3.910 3.910 4.584 -0.674 19685 7797 1 15 . 1 1 424 424 MET C C 424 175.500 175.500 175.280 0.220 19685 7798 1 15 . 1 1 424 424 MET CA C 424 57.800 57.800 56.087 1.714 19685 7799 1 15 . 1 1 424 424 MET CB C 424 34.300 34.300 35.189 -0.889 19685 7800 1 15 . 1 1 424 424 MET H H 424 7.560 7.560 7.967 -0.407 19685 7801 1 15 . 1 1 425 425 PHE N N 425 112.300 112.300 119.516 -7.216 19685 7802 1 15 . 1 1 425 425 PHE HA H 425 4.700 4.700 5.170 -0.470 19685 7803 1 15 . 1 1 425 425 PHE C C 425 177.300 177.300 176.592 0.708 19685 7804 1 15 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.770 1.130 19685 7805 1 15 . 1 1 425 425 PHE CB C 425 38.500 38.500 39.932 -1.432 19685 7806 1 15 . 1 1 425 425 PHE H H 425 7.680 7.680 8.511 -0.831 19685 7807 1 15 . 1 1 426 426 MET N N 426 127.400 127.400 119.917 7.483 19685 7808 1 15 . 1 1 426 426 MET HA H 426 4.630 4.630 4.303 0.327 19685 7809 1 15 . 1 1 426 426 MET C C 426 173.800 173.800 175.484 -1.684 19685 7810 1 15 . 1 1 426 426 MET CA C 426 59.100 59.100 60.087 -0.987 19685 7811 1 15 . 1 1 426 426 MET CB C 426 31.800 31.800 30.170 1.630 19685 7812 1 15 . 1 1 426 426 MET H H 426 8.540 8.540 8.485 0.055 19685 7813 1 15 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.262 -0.252 19685 7814 1 15 . 1 1 427 427 PRO C C 427 176.800 176.800 176.874 -0.074 19685 7815 1 15 . 1 1 427 427 PRO CA C 427 65.200 65.200 64.238 0.962 19685 7816 1 15 . 1 1 427 427 PRO CB C 427 30.600 30.600 30.815 -0.215 19685 7817 1 15 . 1 1 428 428 PHE N N 428 110.000 110.000 118.332 -8.332 19685 7818 1 15 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.574 -0.304 19685 7819 1 15 . 1 1 428 428 PHE C C 428 174.600 174.600 176.381 -1.781 19685 7820 1 15 . 1 1 428 428 PHE CA C 428 57.700 57.700 60.101 -2.401 19685 7821 1 15 . 1 1 428 428 PHE CB C 428 38.000 38.000 40.080 -2.080 19685 7822 1 15 . 1 1 428 428 PHE H H 428 6.560 6.560 7.399 -0.839 19685 7823 1 15 . 1 1 429 429 GLY N N 429 105.500 105.500 102.714 2.786 19685 7824 1 15 . 1 1 429 429 GLY C C 429 170.100 170.100 172.613 -2.513 19685 7825 1 15 . 1 1 429 429 GLY CA C 429 44.400 44.400 43.934 0.466 19685 7826 1 15 . 1 1 429 429 GLY H H 429 7.650 7.650 7.705 -0.055 19685 7827 1 15 . 1 1 430 430 ASN N N 430 117.400 117.400 116.529 0.871 19685 7828 1 15 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.354 0.276 19685 7829 1 15 . 1 1 430 430 ASN C C 430 173.200 173.200 175.186 -1.986 19685 7830 1 15 . 1 1 430 430 ASN CA C 430 52.600 52.600 54.473 -1.873 19685 7831 1 15 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.115 -1.915 19685 7832 1 15 . 1 1 430 430 ASN H H 430 9.020 9.020 7.628 1.392 19685 7833 1 15 . 1 1 431 431 VAL N N 431 128.000 128.000 119.271 8.729 19685 7834 1 15 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.254 -0.504 19685 7835 1 15 . 1 1 431 431 VAL C C 431 176.400 176.400 177.757 -1.357 19685 7836 1 15 . 1 1 431 431 VAL CA C 431 61.800 61.800 63.926 -2.126 19685 7837 1 15 . 1 1 431 431 VAL CB C 431 31.900 31.900 32.480 -0.580 19685 7838 1 15 . 1 1 431 431 VAL H H 431 8.480 8.480 8.748 -0.268 19685 7839 1 15 . 1 1 432 432 ILE N N 432 128.000 128.000 116.154 11.846 19685 7840 1 15 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.713 0.207 19685 7841 1 15 . 1 1 432 432 ILE C C 432 176.100 176.100 175.414 0.686 19685 7842 1 15 . 1 1 432 432 ILE CA C 432 62.500 62.500 64.341 -1.841 19685 7843 1 15 . 1 1 432 432 ILE CB C 432 37.400 37.400 36.537 0.863 19685 7844 1 15 . 1 1 432 432 ILE H H 432 8.840 8.840 8.601 0.239 19685 7845 1 15 . 1 1 433 433 SER N N 433 113.600 113.600 115.324 -1.724 19685 7846 1 15 . 1 1 433 433 SER HA H 433 4.440 4.440 4.610 -0.170 19685 7847 1 15 . 1 1 433 433 SER C C 433 171.000 171.000 171.972 -0.972 19685 7848 1 15 . 1 1 433 433 SER CA C 433 57.300 57.300 57.592 -0.292 19685 7849 1 15 . 1 1 433 433 SER CB C 433 65.200 65.200 66.219 -1.019 19685 7850 1 15 . 1 1 433 433 SER H H 433 7.280 7.280 8.164 -0.884 19685 7851 1 15 . 1 1 434 434 ALA N N 434 125.700 125.700 124.971 0.729 19685 7852 1 15 . 1 1 434 434 ALA HA H 434 4.910 4.910 5.044 -0.134 19685 7853 1 15 . 1 1 434 434 ALA C C 434 174.600 174.600 175.585 -0.985 19685 7854 1 15 . 1 1 434 434 ALA CA C 434 51.000 51.000 51.026 -0.027 19685 7855 1 15 . 1 1 434 434 ALA CB C 434 21.200 21.200 22.163 -0.963 19685 7856 1 15 . 1 1 434 434 ALA H H 434 8.270 8.270 8.449 -0.179 19685 7857 1 15 . 1 1 435 435 LYS N N 435 120.900 120.900 121.639 -0.739 19685 7858 1 15 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.640 -0.170 19685 7859 1 15 . 1 1 435 435 LYS C C 435 173.800 173.800 174.800 -1.000 19685 7860 1 15 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.401 -1.701 19685 7861 1 15 . 1 1 435 435 LYS CB C 435 36.400 36.400 35.014 1.386 19685 7862 1 15 . 1 1 435 435 LYS H H 435 8.490 8.490 8.068 0.422 19685 7863 1 15 . 1 1 436 436 VAL N N 436 122.200 122.200 118.538 3.662 19685 7864 1 15 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.299 -0.379 19685 7865 1 15 . 1 1 436 436 VAL C C 436 175.100 175.100 175.096 0.004 19685 7866 1 15 . 1 1 436 436 VAL CA C 436 63.600 63.600 62.024 1.576 19685 7867 1 15 . 1 1 436 436 VAL CB C 436 33.500 33.500 33.160 0.340 19685 7868 1 15 . 1 1 436 436 VAL H H 436 8.390 8.390 8.503 -0.113 19685 7869 1 15 . 1 1 437 437 PHE N N 437 125.900 125.900 118.686 7.214 19685 7870 1 15 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.251 0.149 19685 7871 1 15 . 1 1 437 437 PHE C C 437 173.600 173.600 173.917 -0.317 19685 7872 1 15 . 1 1 437 437 PHE CA C 437 57.700 57.700 59.328 -1.629 19685 7873 1 15 . 1 1 437 437 PHE CB C 437 39.000 39.000 37.693 1.307 19685 7874 1 15 . 1 1 437 437 PHE H H 437 8.250 8.250 8.037 0.213 19685 7875 1 15 . 1 1 438 438 ILE N N 438 121.900 121.900 116.774 5.126 19685 7876 1 15 . 1 1 438 438 ILE HA H 438 4.460 4.460 4.588 -0.128 19685 7877 1 15 . 1 1 438 438 ILE C C 438 175.700 175.700 174.787 0.913 19685 7878 1 15 . 1 1 438 438 ILE CA C 438 58.300 58.300 60.411 -2.111 19685 7879 1 15 . 1 1 438 438 ILE CB C 438 39.700 39.700 38.522 1.178 19685 7880 1 15 . 1 1 438 438 ILE H H 438 8.520 8.520 7.745 0.775 19685 7881 1 15 . 1 1 439 439 ASP N N 439 126.500 126.500 120.316 6.184 19685 7882 1 15 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.301 0.279 19685 7883 1 15 . 1 1 439 439 ASP C C 439 176.300 176.300 175.558 0.742 19685 7884 1 15 . 1 1 439 439 ASP CA C 439 53.600 53.600 56.397 -2.797 19685 7885 1 15 . 1 1 439 439 ASP CB C 439 42.300 42.300 40.712 1.588 19685 7886 1 15 . 1 1 439 439 ASP H H 439 8.730 8.730 8.201 0.529 19685 7887 1 15 . 1 1 440 440 LYS N N 440 127.300 127.300 119.160 8.140 19685 7888 1 15 . 1 1 440 440 LYS HA H 440 4.070 4.070 4.429 -0.359 19685 7889 1 15 . 1 1 440 440 LYS C C 440 176.900 176.900 176.718 0.182 19685 7890 1 15 . 1 1 440 440 LYS CA C 440 57.800 57.800 57.283 0.517 19685 7891 1 15 . 1 1 440 440 LYS CB C 440 32.100 32.100 33.446 -1.346 19685 7892 1 15 . 1 1 440 440 LYS H H 440 8.930 8.930 8.516 0.414 19685 7893 1 15 . 1 1 441 441 GLN N N 441 117.400 117.400 115.693 1.707 19685 7894 1 15 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.518 -0.288 19685 7895 1 15 . 1 1 441 441 GLN C C 441 177.200 177.200 176.679 0.521 19685 7896 1 15 . 1 1 441 441 GLN CA C 441 57.600 57.600 56.230 1.370 19685 7897 1 15 . 1 1 441 441 GLN CB C 441 28.800 28.800 29.894 -1.094 19685 7898 1 15 . 1 1 441 441 GLN H H 441 8.650 8.650 8.072 0.578 19685 7899 1 15 . 1 1 442 442 THR N N 442 107.300 107.300 113.685 -6.385 19685 7900 1 15 . 1 1 442 442 THR HA H 442 4.290 4.290 4.191 0.099 19685 7901 1 15 . 1 1 442 442 THR C C 442 175.100 175.100 175.474 -0.374 19685 7902 1 15 . 1 1 442 442 THR CA C 442 61.200 61.200 62.591 -1.391 19685 7903 1 15 . 1 1 442 442 THR CB C 442 70.300 70.300 68.966 1.334 19685 7904 1 15 . 1 1 442 442 THR H H 442 7.830 7.830 8.070 -0.240 19685 7905 1 15 . 1 1 443 443 ASN N N 443 117.300 117.300 119.073 -1.773 19685 7906 1 15 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.351 -0.051 19685 7907 1 15 . 1 1 443 443 ASN C C 443 173.400 173.400 174.563 -1.163 19685 7908 1 15 . 1 1 443 443 ASN CA C 443 54.300 54.300 53.984 0.316 19685 7909 1 15 . 1 1 443 443 ASN CB C 443 37.600 37.600 37.353 0.247 19685 7910 1 15 . 1 1 443 443 ASN H H 443 8.470 8.470 8.094 0.376 19685 7911 1 15 . 1 1 444 444 LEU N N 444 118.000 118.000 114.840 3.160 19685 7912 1 15 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.429 0.131 19685 7913 1 15 . 1 1 444 444 LEU C C 444 176.700 176.700 177.418 -0.718 19685 7914 1 15 . 1 1 444 444 LEU CA C 444 53.300 53.300 55.200 -1.900 19685 7915 1 15 . 1 1 444 444 LEU CB C 444 43.500 43.500 42.362 1.138 19685 7916 1 15 . 1 1 444 444 LEU H H 444 7.660 7.660 7.523 0.137 19685 7917 1 15 . 1 1 445 445 SER N N 445 115.500 115.500 115.194 0.306 19685 7918 1 15 . 1 1 445 445 SER HA H 445 4.460 4.460 3.884 0.576 19685 7919 1 15 . 1 1 445 445 SER C C 445 176.500 176.500 174.004 2.496 19685 7920 1 15 . 1 1 445 445 SER CA C 445 57.900 57.900 59.446 -1.546 19685 7921 1 15 . 1 1 445 445 SER CB C 445 63.500 63.500 62.556 0.944 19685 7922 1 15 . 1 1 445 445 SER H H 445 8.840 8.840 8.461 0.379 19685 7923 1 15 . 1 1 446 446 LYS N N 446 125.200 125.200 120.923 4.277 19685 7924 1 15 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.275 0.225 19685 7925 1 15 . 1 1 446 446 LYS C C 446 176.100 176.100 175.770 0.330 19685 7926 1 15 . 1 1 446 446 LYS CA C 446 56.300 56.300 55.714 0.586 19685 7927 1 15 . 1 1 446 446 LYS CB C 446 32.200 32.200 33.969 -1.769 19685 7928 1 15 . 1 1 446 446 LYS H H 446 9.230 9.230 7.999 1.231 19685 7929 1 15 . 1 1 447 447 CYS N N 447 113.000 113.000 118.557 -5.557 19685 7930 1 15 . 1 1 447 447 CYS C C 447 172.500 172.500 173.500 -1.000 19685 7931 1 15 . 1 1 447 447 CYS CA C 447 60.400 60.400 57.959 2.441 19685 7932 1 15 . 1 1 447 447 CYS CB C 447 24.900 24.900 28.759 -3.859 19685 7933 1 15 . 1 1 447 447 CYS H H 447 10.020 10.020 6.849 3.171 19685 7934 1 15 . 1 1 448 448 PHE N N 448 115.200 115.200 121.375 -6.175 19685 7935 1 15 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.546 0.794 19685 7936 1 15 . 1 1 448 448 PHE C C 448 172.400 172.400 176.409 -4.009 19685 7937 1 15 . 1 1 448 448 PHE CA C 448 54.700 54.700 56.654 -1.954 19685 7938 1 15 . 1 1 448 448 PHE CB C 448 42.000 42.000 39.354 2.646 19685 7939 1 15 . 1 1 448 448 PHE H H 448 7.810 7.810 7.808 0.002 19685 7940 1 15 . 1 1 449 449 GLY N N 449 107.700 107.700 106.937 0.763 19685 7941 1 15 . 1 1 449 449 GLY C C 449 170.100 170.100 172.505 -2.405 19685 7942 1 15 . 1 1 449 449 GLY CA C 449 45.200 45.200 45.270 -0.070 19685 7943 1 15 . 1 1 449 449 GLY H H 449 9.310 9.310 8.338 0.972 19685 7944 1 15 . 1 1 450 450 PHE N N 450 119.900 119.900 114.869 5.031 19685 7945 1 15 . 1 1 450 450 PHE HA H 450 5.430 5.430 4.967 0.463 19685 7946 1 15 . 1 1 450 450 PHE C C 450 172.800 172.800 172.876 -0.076 19685 7947 1 15 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.521 -1.521 19685 7948 1 15 . 1 1 450 450 PHE CB C 450 43.600 43.600 40.604 2.996 19685 7949 1 15 . 1 1 450 450 PHE H H 450 8.760 8.760 8.213 0.547 19685 7950 1 15 . 1 1 451 451 VAL N N 451 123.800 123.800 118.277 5.523 19685 7951 1 15 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.553 -0.263 19685 7952 1 15 . 1 1 451 451 VAL C C 451 172.400 172.400 176.310 -3.910 19685 7953 1 15 . 1 1 451 451 VAL CA C 451 59.800 59.800 61.150 -1.350 19685 7954 1 15 . 1 1 451 451 VAL CB C 451 36.100 36.100 35.742 0.358 19685 7955 1 15 . 1 1 451 451 VAL H H 451 7.930 7.930 8.410 -0.480 19685 7956 1 15 . 1 1 452 452 SER N N 452 119.600 119.600 123.213 -3.613 19685 7957 1 15 . 1 1 452 452 SER HA H 452 5.120 5.120 4.944 0.176 19685 7958 1 15 . 1 1 452 452 SER C C 452 173.200 173.200 173.820 -0.620 19685 7959 1 15 . 1 1 452 452 SER CA C 452 55.700 55.700 57.798 -2.098 19685 7960 1 15 . 1 1 452 452 SER CB C 452 66.100 66.100 62.382 3.718 19685 7961 1 15 . 1 1 452 452 SER H H 452 8.540 8.540 8.545 -0.005 19685 7962 1 15 . 1 1 453 453 TYR N N 453 121.400 121.400 123.043 -1.643 19685 7963 1 15 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.561 0.819 19685 7964 1 15 . 1 1 453 453 TYR C C 453 173.600 173.600 177.138 -3.538 19685 7965 1 15 . 1 1 453 453 TYR CA C 453 56.500 56.500 59.806 -3.305 19685 7966 1 15 . 1 1 453 453 TYR CB C 453 42.200 42.200 38.680 3.520 19685 7967 1 15 . 1 1 453 453 TYR H H 453 8.380 8.380 7.963 0.417 19685 7968 1 15 . 1 1 454 454 ASP N N 454 113.300 113.300 122.725 -9.425 19685 7969 1 15 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.439 0.051 19685 7970 1 15 . 1 1 454 454 ASP C C 454 176.100 176.100 175.514 0.586 19685 7971 1 15 . 1 1 454 454 ASP CA C 454 52.800 52.800 56.003 -3.203 19685 7972 1 15 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.593 -1.194 19685 7973 1 15 . 1 1 454 454 ASP H H 454 7.860 7.860 8.704 -0.844 19685 7974 1 15 . 1 1 455 455 ASN N N 455 113.800 113.800 112.587 1.213 19685 7975 1 15 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.122 -0.072 19685 7976 1 15 . 1 1 455 455 ASN C C 455 173.100 173.100 173.288 -0.188 19685 7977 1 15 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.596 -0.896 19685 7978 1 15 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.535 0.565 19685 7979 1 15 . 1 1 455 455 ASN H H 455 7.200 7.200 7.875 -0.675 19685 7980 1 15 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.524 -0.354 19685 7981 1 15 . 1 1 456 456 PRO C C 456 177.300 177.300 177.629 -0.329 19685 7982 1 15 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.975 -0.775 19685 7983 1 15 . 1 1 456 456 PRO CB C 456 32.300 32.300 32.102 0.198 19685 7984 1 15 . 1 1 457 457 VAL N N 457 120.900 120.900 108.966 11.934 19685 7985 1 15 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.457 -0.837 19685 7986 1 15 . 1 1 457 457 VAL C C 457 179.000 179.000 176.304 2.696 19685 7987 1 15 . 1 1 457 457 VAL CA C 457 65.900 65.900 63.020 2.880 19685 7988 1 15 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.938 -1.138 19685 7989 1 15 . 1 1 457 457 VAL H H 457 8.120 8.120 7.933 0.187 19685 7990 1 15 . 1 1 458 458 SER N N 458 117.800 117.800 116.391 1.409 19685 7991 1 15 . 1 1 458 458 SER HA H 458 3.940 3.940 4.658 -0.718 19685 7992 1 15 . 1 1 458 458 SER C C 458 173.600 173.600 175.542 -1.942 19685 7993 1 15 . 1 1 458 458 SER CA C 458 61.100 61.100 60.084 1.016 19685 7994 1 15 . 1 1 458 458 SER CB C 458 62.400 62.400 64.944 -2.544 19685 7995 1 15 . 1 1 458 458 SER H H 458 7.830 7.830 7.676 0.154 19685 7996 1 15 . 1 1 459 459 ALA N N 459 120.000 120.000 125.578 -5.578 19685 7997 1 15 . 1 1 459 459 ALA HA H 459 3.750 3.750 4.034 -0.284 19685 7998 1 15 . 1 1 459 459 ALA C C 459 178.100 178.100 177.735 0.365 19685 7999 1 15 . 1 1 459 459 ALA CA C 459 54.500 54.500 53.824 0.676 19685 8000 1 15 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.191 -0.291 19685 8001 1 15 . 1 1 459 459 ALA H H 459 6.370 6.370 7.838 -1.468 19685 8002 1 15 . 1 1 460 460 GLN N N 460 116.100 116.100 118.644 -2.544 19685 8003 1 15 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.055 -0.225 19685 8004 1 15 . 1 1 460 460 GLN C C 460 178.000 178.000 176.857 1.143 19685 8005 1 15 . 1 1 460 460 GLN CA C 460 58.500 58.500 58.298 0.202 19685 8006 1 15 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.531 -1.131 19685 8007 1 15 . 1 1 460 460 GLN H H 460 7.710 7.710 8.328 -0.618 19685 8008 1 15 . 1 1 461 461 ALA N N 461 122.800 122.800 118.384 4.416 19685 8009 1 15 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.334 -0.374 19685 8010 1 15 . 1 1 461 461 ALA C C 461 179.500 179.500 177.378 2.122 19685 8011 1 15 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.692 1.808 19685 8012 1 15 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.151 -1.651 19685 8013 1 15 . 1 1 461 461 ALA H H 461 7.880 7.880 7.372 0.508 19685 8014 1 15 . 1 1 462 462 ALA N N 462 121.400 121.400 119.425 1.975 19685 8015 1 15 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.632 -1.232 19685 8016 1 15 . 1 1 462 462 ALA C C 462 179.400 179.400 177.604 1.796 19685 8017 1 15 . 1 1 462 462 ALA CA C 462 54.100 54.100 51.988 2.112 19685 8018 1 15 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.543 -1.843 19685 8019 1 15 . 1 1 462 462 ALA H H 462 7.860 7.860 7.470 0.390 19685 8020 1 15 . 1 1 463 463 ILE N N 463 118.600 118.600 117.760 0.840 19685 8021 1 15 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.808 -0.568 19685 8022 1 15 . 1 1 463 463 ILE C C 463 177.500 177.500 176.100 1.400 19685 8023 1 15 . 1 1 463 463 ILE CA C 463 66.000 66.000 63.292 2.708 19685 8024 1 15 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.362 -0.062 19685 8025 1 15 . 1 1 463 463 ILE H H 463 8.090 8.090 8.069 0.021 19685 8026 1 15 . 1 1 464 464 GLN N N 464 117.000 117.000 115.534 1.466 19685 8027 1 15 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.562 -0.692 19685 8028 1 15 . 1 1 464 464 GLN C C 464 177.700 177.700 175.330 2.370 19685 8029 1 15 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.382 2.818 19685 8030 1 15 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.693 -1.793 19685 8031 1 15 . 1 1 464 464 GLN H H 464 7.780 7.780 7.758 0.022 19685 8032 1 15 . 1 1 465 465 ALA N N 465 117.200 117.200 121.049 -3.849 19685 8033 1 15 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.456 -0.226 19685 8034 1 15 . 1 1 465 465 ALA C C 465 179.200 179.200 176.864 2.336 19685 8035 1 15 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.960 0.840 19685 8036 1 15 . 1 1 465 465 ALA CB C 465 21.100 21.100 20.062 1.038 19685 8037 1 15 . 1 1 465 465 ALA H H 465 7.540 7.540 7.181 0.359 19685 8038 1 15 . 1 1 466 466 MET N N 466 110.800 110.800 116.260 -5.460 19685 8039 1 15 . 1 1 466 466 MET HA H 466 4.820 4.820 4.801 0.019 19685 8040 1 15 . 1 1 466 466 MET C C 466 177.600 177.600 175.923 1.677 19685 8041 1 15 . 1 1 466 466 MET CA C 466 53.300 53.300 55.179 -1.879 19685 8042 1 15 . 1 1 466 466 MET CB C 466 31.600 31.600 34.030 -2.430 19685 8043 1 15 . 1 1 466 466 MET H H 466 8.230 8.230 7.699 0.531 19685 8044 1 15 . 1 1 467 467 ASN N N 467 119.100 119.100 118.304 0.796 19685 8045 1 15 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.614 -0.124 19685 8046 1 15 . 1 1 467 467 ASN C C 467 176.300 176.300 176.118 0.182 19685 8047 1 15 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.144 2.056 19685 8048 1 15 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.020 0.180 19685 8049 1 15 . 1 1 467 467 ASN H H 467 8.560 8.560 8.025 0.535 19685 8050 1 15 . 1 1 468 468 GLY N N 468 117.900 117.900 105.976 11.924 19685 8051 1 15 . 1 1 468 468 GLY C C 468 172.800 172.800 173.882 -1.082 19685 8052 1 15 . 1 1 468 468 GLY CA C 468 45.300 45.300 45.088 0.212 19685 8053 1 15 . 1 1 468 468 GLY H H 468 8.930 8.930 7.935 0.995 19685 8054 1 15 . 1 1 469 469 PHE N N 469 123.300 123.300 121.817 1.483 19685 8055 1 15 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.647 -0.457 19685 8056 1 15 . 1 1 469 469 PHE C C 469 174.400 174.400 175.239 -0.839 19685 8057 1 15 . 1 1 469 469 PHE CA C 469 58.700 58.700 57.558 1.142 19685 8058 1 15 . 1 1 469 469 PHE CB C 469 40.600 40.600 40.535 0.065 19685 8059 1 15 . 1 1 469 469 PHE H H 469 7.950 7.950 7.478 0.472 19685 8060 1 15 . 1 1 470 470 GLN N N 470 129.200 129.200 119.112 10.088 19685 8061 1 15 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.016 0.574 19685 8062 1 15 . 1 1 470 470 GLN C C 470 174.100 174.100 173.889 0.211 19685 8063 1 15 . 1 1 470 470 GLN CA C 470 55.500 55.500 56.578 -1.078 19685 8064 1 15 . 1 1 470 470 GLN CB C 470 28.800 28.800 27.995 0.805 19685 8065 1 15 . 1 1 470 470 GLN H H 470 8.330 8.330 8.333 -0.003 19685 8066 1 15 . 1 1 471 471 ILE N N 471 126.300 126.300 122.329 3.971 19685 8067 1 15 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.202 -0.032 19685 8068 1 15 . 1 1 471 471 ILE C C 471 175.400 175.400 175.745 -0.345 19685 8069 1 15 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.095 -0.495 19685 8070 1 15 . 1 1 471 471 ILE CB C 471 39.100 39.100 40.084 -0.984 19685 8071 1 15 . 1 1 471 471 ILE H H 471 8.440 8.440 8.739 -0.299 19685 8072 1 15 . 1 1 472 472 GLY N N 472 117.500 117.500 116.208 1.292 19685 8073 1 15 . 1 1 472 472 GLY C C 472 174.700 174.700 175.398 -0.698 19685 8074 1 15 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.433 1.067 19685 8075 1 15 . 1 1 472 472 GLY H H 472 8.980 8.980 8.721 0.259 19685 8076 1 15 . 1 1 473 473 MET N N 473 124.100 124.100 112.450 11.650 19685 8077 1 15 . 1 1 473 473 MET HA H 473 4.380 4.380 4.000 0.380 19685 8078 1 15 . 1 1 473 473 MET C C 473 175.700 175.700 174.950 0.750 19685 8079 1 15 . 1 1 473 473 MET CA C 473 55.000 55.000 56.967 -1.967 19685 8080 1 15 . 1 1 473 473 MET CB C 473 32.900 32.900 30.234 2.666 19685 8081 1 15 . 1 1 473 473 MET H H 473 9.070 9.070 8.440 0.630 19685 8082 1 15 . 1 1 474 474 LYS N N 474 118.700 118.700 116.931 1.769 19685 8083 1 15 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.532 -0.052 19685 8084 1 15 . 1 1 474 474 LYS C C 474 174.300 174.300 174.050 0.250 19685 8085 1 15 . 1 1 474 474 LYS CA C 474 54.600 54.600 55.308 -0.708 19685 8086 1 15 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.785 -0.685 19685 8087 1 15 . 1 1 474 474 LYS H H 474 7.770 7.770 7.620 0.150 19685 8088 1 15 . 1 1 475 475 ARG N N 475 119.600 119.600 119.174 0.426 19685 8089 1 15 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.467 0.333 19685 8090 1 15 . 1 1 475 475 ARG C C 475 175.700 175.700 174.944 0.756 19685 8091 1 15 . 1 1 475 475 ARG CA C 475 54.000 54.000 54.908 -0.908 19685 8092 1 15 . 1 1 475 475 ARG CB C 475 31.300 31.300 31.152 0.147 19685 8093 1 15 . 1 1 475 475 ARG H H 475 8.350 8.350 7.971 0.379 19685 8094 1 15 . 1 1 476 476 LEU N N 476 123.500 123.500 120.096 3.404 19685 8095 1 15 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.218 0.212 19685 8096 1 15 . 1 1 476 476 LEU C C 476 177.600 177.600 177.476 0.124 19685 8097 1 15 . 1 1 476 476 LEU CA C 476 55.500 55.500 56.410 -0.910 19685 8098 1 15 . 1 1 476 476 LEU CB C 476 42.800 42.800 42.200 0.600 19685 8099 1 15 . 1 1 476 476 LEU H H 476 9.130 9.130 8.458 0.672 19685 8100 1 15 . 1 1 477 477 LYS N N 477 123.200 123.200 114.936 8.264 19685 8101 1 15 . 1 1 477 477 LYS HA H 477 5.160 5.160 3.800 1.360 19685 8102 1 15 . 1 1 477 477 LYS C C 477 174.100 174.100 174.656 -0.556 19685 8103 1 15 . 1 1 477 477 LYS CA C 477 54.500 54.500 56.130 -1.630 19685 8104 1 15 . 1 1 477 477 LYS CB C 477 34.900 34.900 30.772 4.128 19685 8105 1 15 . 1 1 477 477 LYS H H 477 8.090 8.090 8.212 -0.122 19685 8106 1 15 . 1 1 478 478 VAL N N 478 127.100 127.100 117.515 9.585 19685 8107 1 15 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.216 0.684 19685 8108 1 15 . 1 1 478 478 VAL C C 478 173.700 173.700 174.779 -1.079 19685 8109 1 15 . 1 1 478 478 VAL CA C 478 61.000 61.000 62.628 -1.628 19685 8110 1 15 . 1 1 478 478 VAL CB C 478 33.700 33.700 32.673 1.026 19685 8111 1 15 . 1 1 478 478 VAL H H 478 8.820 8.820 7.857 0.963 19685 8112 1 15 . 1 1 479 479 GLN N N 479 123.600 123.600 122.950 0.650 19685 8113 1 15 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.499 0.311 19685 8114 1 15 . 1 1 479 479 GLN C C 479 173.600 173.600 173.700 -0.100 19685 8115 1 15 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.053 -0.853 19685 8116 1 15 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.372 1.128 19685 8117 1 15 . 1 1 479 479 GLN H H 479 9.130 9.130 8.514 0.616 19685 8118 1 15 . 1 1 480 480 LEU N N 480 123.200 123.200 121.512 1.688 19685 8119 1 15 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.466 -0.026 19685 8120 1 15 . 1 1 480 480 LEU C C 480 177.100 177.100 177.259 -0.159 19685 8121 1 15 . 1 1 480 480 LEU CA C 480 54.600 54.600 54.309 0.291 19685 8122 1 15 . 1 1 480 480 LEU CB C 480 42.400 42.400 43.599 -1.198 19685 8123 1 15 . 1 1 480 480 LEU H H 480 8.840 8.840 8.279 0.561 19685 8124 1 15 . 1 1 481 481 LYS N N 481 124.500 124.500 125.175 -0.675 19685 8125 1 15 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.061 0.249 19685 8126 1 15 . 1 1 481 481 LYS C C 481 175.200 175.200 178.314 -3.114 19685 8127 1 15 . 1 1 481 481 LYS CA C 481 56.700 56.700 58.617 -1.917 19685 8128 1 15 . 1 1 481 481 LYS CB C 481 33.100 33.100 31.404 1.696 19685 8129 1 15 . 1 1 481 481 LYS H H 481 8.400 8.400 8.544 -0.144 19685 8130 1 15 . 1 1 482 482 ARG N N 482 126.600 126.600 118.478 8.122 19685 8131 1 15 . 1 1 482 482 ARG HA H 482 4.350 4.350 3.936 0.414 19685 8132 1 15 . 1 1 482 482 ARG C C 482 175.800 175.800 176.262 -0.462 19685 8133 1 15 . 1 1 482 482 ARG CA C 482 55.600 55.600 58.377 -2.777 19685 8134 1 15 . 1 1 482 482 ARG CB C 482 31.100 31.100 28.590 2.510 19685 8135 1 15 . 1 1 482 482 ARG H H 482 8.770 8.770 8.386 0.384 19685 8136 1 15 . 1 1 483 483 SER N N 483 118.100 118.100 114.275 3.825 19685 8137 1 15 . 1 1 483 483 SER HA H 483 4.400 4.400 4.520 -0.120 19685 8138 1 15 . 1 1 483 483 SER C C 483 174.200 174.200 174.421 -0.221 19685 8139 1 15 . 1 1 483 483 SER CA C 483 58.000 58.000 58.614 -0.614 19685 8140 1 15 . 1 1 483 483 SER CB C 483 63.500 63.500 65.832 -2.332 19685 8141 1 15 . 1 1 483 483 SER H H 483 8.610 8.610 7.950 0.660 19685 8142 1 15 . 1 1 484 484 LYS N N 484 123.000 123.000 122.334 0.666 19685 8143 1 15 . 1 1 484 484 LYS HA H 484 4.210 4.210 3.860 0.350 19685 8144 1 15 . 1 1 484 484 LYS C C 484 175.900 175.900 174.496 1.404 19685 8145 1 15 . 1 1 484 484 LYS CA C 484 56.300 56.300 57.340 -1.040 19685 8146 1 15 . 1 1 484 484 LYS CB C 484 32.500 32.500 31.313 1.187 19685 8147 1 15 . 1 1 484 484 LYS H H 484 8.560 8.560 8.439 0.121 19685 8148 1 15 . 1 1 485 485 ASN N N 485 119.600 119.600 116.292 3.308 19685 8149 1 15 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.828 -0.228 19685 8150 1 15 . 1 1 485 485 ASN C C 485 174.400 174.400 173.652 0.748 19685 8151 1 15 . 1 1 485 485 ASN CA C 485 52.900 52.900 52.397 0.503 19685 8152 1 15 . 1 1 485 485 ASN CB C 485 38.400 38.400 40.527 -2.127 19685 8153 1 15 . 1 1 485 485 ASN H H 485 8.560 8.560 7.896 0.664 19685 8154 1 15 . 1 1 486 486 ASP N N 486 121.100 121.100 119.566 1.534 19685 8155 1 15 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.740 -0.220 19685 8156 1 15 . 1 1 486 486 ASP C C 486 175.700 175.700 174.655 1.045 19685 8157 1 15 . 1 1 486 486 ASP CA C 486 54.000 54.000 53.333 0.667 19685 8158 1 15 . 1 1 486 486 ASP CB C 486 40.800 40.800 42.642 -1.842 19685 8159 1 15 . 1 1 486 486 ASP H H 486 8.250 8.250 8.316 -0.066 19685 8160 1 15 . 1 1 487 487 SER N N 487 115.400 115.400 116.090 -0.690 19685 8161 1 15 . 1 1 487 487 SER HA H 487 4.310 4.310 4.610 -0.300 19685 8162 1 15 . 1 1 487 487 SER C C 487 172.800 172.800 172.890 -0.090 19685 8163 1 15 . 1 1 487 487 SER CA C 487 57.700 57.700 57.629 0.071 19685 8164 1 15 . 1 1 487 487 SER CB C 487 63.600 63.600 66.326 -2.726 19685 8165 1 15 . 1 1 487 487 SER H H 487 8.090 8.090 8.295 -0.205 19685 8166 1 15 . 1 1 488 488 LYS N N 488 122.300 122.300 121.852 0.448 19685 8167 1 15 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.600 -0.550 19685 8168 1 15 . 1 1 488 488 LYS C C 488 174.500 174.500 174.192 0.308 19685 8169 1 15 . 1 1 488 488 LYS CA C 488 54.000 54.000 52.410 1.590 19685 8170 1 15 . 1 1 488 488 LYS CB C 488 32.400 32.400 32.559 -0.159 19685 8171 1 15 . 1 1 488 488 LYS H H 488 8.090 8.090 8.399 -0.309 19685 8172 1 15 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.345 -0.065 19685 8173 1 15 . 1 1 489 489 PRO C C 489 175.000 175.000 175.134 -0.134 19685 8174 1 15 . 1 1 489 489 PRO CA C 489 63.200 63.200 62.433 0.767 19685 8175 1 15 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.247 -1.147 19685 8176 1 16 . 1 1 395 395 SER N N 395 115.500 115.500 113.696 1.804 19685 8177 1 16 . 1 1 395 395 SER HA H 395 4.300 4.300 4.512 -0.212 19685 8178 1 16 . 1 1 395 395 SER C C 395 173.900 173.900 173.613 0.287 19685 8179 1 16 . 1 1 395 395 SER CA C 395 57.900 57.900 57.398 0.502 19685 8180 1 16 . 1 1 395 395 SER CB C 395 63.400 63.400 65.151 -1.752 19685 8181 1 16 . 1 1 395 395 SER H H 395 8.200 8.200 8.055 0.145 19685 8182 1 16 . 1 1 396 396 HIS N N 396 123.500 123.500 118.343 5.157 19685 8183 1 16 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.823 -0.263 19685 8184 1 16 . 1 1 396 396 HIS C C 396 174.100 174.100 175.575 -1.475 19685 8185 1 16 . 1 1 396 396 HIS CA C 396 53.700 53.700 55.948 -2.248 19685 8186 1 16 . 1 1 396 396 HIS CB C 396 32.200 32.200 30.802 1.398 19685 8187 1 16 . 1 1 396 396 HIS H H 396 8.120 8.120 8.799 -0.679 19685 8188 1 16 . 1 1 397 397 MET N N 397 121.200 121.200 119.831 1.369 19685 8189 1 16 . 1 1 397 397 MET HA H 397 4.320 4.320 3.988 0.332 19685 8190 1 16 . 1 1 397 397 MET C C 397 175.400 175.400 174.876 0.524 19685 8191 1 16 . 1 1 397 397 MET CA C 397 55.000 55.000 56.528 -1.528 19685 8192 1 16 . 1 1 397 397 MET CB C 397 32.500 32.500 31.379 1.121 19685 8193 1 16 . 1 1 397 397 MET H H 397 8.300 8.300 8.342 -0.042 19685 8194 1 16 . 1 1 398 398 GLN N N 398 122.100 122.100 112.475 9.625 19685 8195 1 16 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.019 0.171 19685 8196 1 16 . 1 1 398 398 GLN C C 398 174.800 174.800 175.238 -0.438 19685 8197 1 16 . 1 1 398 398 GLN CA C 398 55.200 55.200 57.520 -2.320 19685 8198 1 16 . 1 1 398 398 GLN CB C 398 28.900 28.900 27.471 1.429 19685 8199 1 16 . 1 1 398 398 GLN H H 398 8.540 8.540 8.789 -0.249 19685 8200 1 16 . 1 1 399 399 LYS N N 399 123.000 123.000 117.746 5.254 19685 8201 1 16 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.603 -0.383 19685 8202 1 16 . 1 1 399 399 LYS C C 399 174.800 174.800 175.422 -0.622 19685 8203 1 16 . 1 1 399 399 LYS CA C 399 55.600 55.600 53.603 1.996 19685 8204 1 16 . 1 1 399 399 LYS CB C 399 33.000 33.000 34.728 -1.728 19685 8205 1 16 . 1 1 399 399 LYS H H 399 8.180 8.180 7.924 0.256 19685 8206 1 16 . 1 1 400 400 GLU N N 400 122.000 122.000 115.390 6.610 19685 8207 1 16 . 1 1 400 400 GLU HA H 400 4.430 4.430 3.915 0.515 19685 8208 1 16 . 1 1 400 400 GLU C C 400 176.400 176.400 175.754 0.646 19685 8209 1 16 . 1 1 400 400 GLU CA C 400 55.400 55.400 57.596 -2.196 19685 8210 1 16 . 1 1 400 400 GLU CB C 400 31.400 31.400 29.062 2.338 19685 8211 1 16 . 1 1 400 400 GLU H H 400 8.350 8.350 8.696 -0.346 19685 8212 1 16 . 1 1 401 401 GLY N N 401 109.500 109.500 105.997 3.503 19685 8213 1 16 . 1 1 401 401 GLY C C 401 171.500 171.500 172.242 -0.742 19685 8214 1 16 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.688 -0.988 19685 8215 1 16 . 1 1 401 401 GLY H H 401 9.050 9.050 7.374 1.676 19685 8216 1 16 . 1 1 402 402 PRO HA H 402 4.420 4.420 3.967 0.453 19685 8217 1 16 . 1 1 402 402 PRO C C 402 173.900 173.900 175.311 -1.411 19685 8218 1 16 . 1 1 402 402 PRO CA C 402 61.900 61.900 63.864 -1.964 19685 8219 1 16 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.502 -0.302 19685 8220 1 16 . 1 1 403 403 GLU N N 403 119.600 119.600 116.204 3.396 19685 8221 1 16 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.310 -0.350 19685 8222 1 16 . 1 1 403 403 GLU C C 403 177.300 177.300 175.331 1.969 19685 8223 1 16 . 1 1 403 403 GLU CA C 403 58.100 58.100 57.024 1.076 19685 8224 1 16 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.409 -1.409 19685 8225 1 16 . 1 1 403 403 GLU H H 403 8.420 8.420 8.022 0.398 19685 8226 1 16 . 1 1 404 404 GLY N N 404 112.800 112.800 107.211 5.589 19685 8227 1 16 . 1 1 404 404 GLY C C 404 173.300 173.300 173.635 -0.335 19685 8228 1 16 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.817 -0.917 19685 8229 1 16 . 1 1 404 404 GLY H H 404 8.500 8.500 8.261 0.239 19685 8230 1 16 . 1 1 405 405 ALA N N 405 120.000 120.000 124.514 -4.514 19685 8231 1 16 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.271 0.279 19685 8232 1 16 . 1 1 405 405 ALA C C 405 174.100 174.100 175.715 -1.615 19685 8233 1 16 . 1 1 405 405 ALA CA C 405 50.500 50.500 52.195 -1.695 19685 8234 1 16 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.170 3.630 19685 8235 1 16 . 1 1 405 405 ALA H H 405 8.360 8.360 8.289 0.071 19685 8236 1 16 . 1 1 406 406 ASN N N 406 115.500 115.500 118.150 -2.650 19685 8237 1 16 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.025 0.165 19685 8238 1 16 . 1 1 406 406 ASN C C 406 172.900 172.900 174.876 -1.976 19685 8239 1 16 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.572 1.028 19685 8240 1 16 . 1 1 406 406 ASN CB C 406 40.900 40.900 39.109 1.791 19685 8241 1 16 . 1 1 406 406 ASN H H 406 7.690 7.690 8.074 -0.384 19685 8242 1 16 . 1 1 407 407 LEU N N 407 123.400 123.400 120.770 2.630 19685 8243 1 16 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.286 0.674 19685 8244 1 16 . 1 1 407 407 LEU C C 407 174.900 174.900 176.444 -1.544 19685 8245 1 16 . 1 1 407 407 LEU CA C 407 53.100 53.100 56.359 -3.259 19685 8246 1 16 . 1 1 407 407 LEU CB C 407 45.400 45.400 41.318 4.082 19685 8247 1 16 . 1 1 407 407 LEU H H 407 9.290 9.290 7.455 1.835 19685 8248 1 16 . 1 1 408 408 PHE N N 408 118.700 118.700 123.370 -4.670 19685 8249 1 16 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.701 0.599 19685 8250 1 16 . 1 1 408 408 PHE C C 408 174.200 174.200 175.309 -1.109 19685 8251 1 16 . 1 1 408 408 PHE CA C 408 56.300 56.300 57.522 -1.222 19685 8252 1 16 . 1 1 408 408 PHE CB C 408 42.700 42.700 37.913 4.787 19685 8253 1 16 . 1 1 408 408 PHE H H 408 9.150 9.150 8.306 0.844 19685 8254 1 16 . 1 1 409 409 ILE N N 409 120.800 120.800 121.546 -0.746 19685 8255 1 16 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.452 0.518 19685 8256 1 16 . 1 1 409 409 ILE C C 409 173.900 173.900 175.155 -1.255 19685 8257 1 16 . 1 1 409 409 ILE CA C 409 59.000 59.000 61.019 -2.019 19685 8258 1 16 . 1 1 409 409 ILE CB C 409 40.400 40.400 38.708 1.692 19685 8259 1 16 . 1 1 409 409 ILE H H 409 8.380 8.380 7.712 0.668 19685 8260 1 16 . 1 1 410 410 TYR N N 410 123.200 123.200 123.828 -0.628 19685 8261 1 16 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.852 0.088 19685 8262 1 16 . 1 1 410 410 TYR C C 410 174.300 174.300 174.935 -0.635 19685 8263 1 16 . 1 1 410 410 TYR CA C 410 56.200 56.200 57.343 -1.143 19685 8264 1 16 . 1 1 410 410 TYR CB C 410 40.800 40.800 38.976 1.824 19685 8265 1 16 . 1 1 410 410 TYR H H 410 9.440 9.440 8.606 0.834 19685 8266 1 16 . 1 1 411 411 HIS N N 411 112.100 112.100 119.280 -7.180 19685 8267 1 16 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.224 0.226 19685 8268 1 16 . 1 1 411 411 HIS C C 411 173.300 173.300 175.433 -2.133 19685 8269 1 16 . 1 1 411 411 HIS CA C 411 55.900 55.900 58.355 -2.455 19685 8270 1 16 . 1 1 411 411 HIS CB C 411 26.200 26.200 29.443 -3.243 19685 8271 1 16 . 1 1 411 411 HIS H H 411 8.580 8.580 8.106 0.474 19685 8272 1 16 . 1 1 412 412 LEU N N 412 115.100 115.100 118.526 -3.426 19685 8273 1 16 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.061 -0.101 19685 8274 1 16 . 1 1 412 412 LEU C C 412 175.100 175.100 174.722 0.378 19685 8275 1 16 . 1 1 412 412 LEU CA C 412 52.400 52.400 54.184 -1.784 19685 8276 1 16 . 1 1 412 412 LEU CB C 412 42.000 42.000 42.558 -0.558 19685 8277 1 16 . 1 1 412 412 LEU H H 412 7.560 7.560 8.041 -0.481 19685 8278 1 16 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.436 -0.166 19685 8279 1 16 . 1 1 413 413 PRO C C 413 177.600 177.600 177.433 0.167 19685 8280 1 16 . 1 1 413 413 PRO CA C 413 62.300 62.300 63.309 -1.009 19685 8281 1 16 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.374 -0.174 19685 8282 1 16 . 1 1 414 414 GLN N N 414 125.500 125.500 117.631 7.869 19685 8283 1 16 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.239 -0.159 19685 8284 1 16 . 1 1 414 414 GLN C C 414 175.400 175.400 176.013 -0.613 19685 8285 1 16 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.611 -0.611 19685 8286 1 16 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.644 -0.144 19685 8287 1 16 . 1 1 414 414 GLN H H 414 9.170 9.170 8.876 0.294 19685 8288 1 16 . 1 1 415 415 GLU N N 415 115.300 115.300 118.546 -3.246 19685 8289 1 16 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.280 -0.020 19685 8290 1 16 . 1 1 415 415 GLU C C 415 176.700 176.700 174.871 1.829 19685 8291 1 16 . 1 1 415 415 GLU CA C 415 58.700 58.700 55.886 2.814 19685 8292 1 16 . 1 1 415 415 GLU CB C 415 28.300 28.300 29.532 -1.232 19685 8293 1 16 . 1 1 415 415 GLU H H 415 9.390 9.390 8.249 1.141 19685 8294 1 16 . 1 1 416 416 PHE N N 416 121.700 121.700 116.634 5.066 19685 8295 1 16 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.199 -0.589 19685 8296 1 16 . 1 1 416 416 PHE C C 416 176.400 176.400 175.487 0.913 19685 8297 1 16 . 1 1 416 416 PHE CA C 416 57.400 57.400 56.301 1.099 19685 8298 1 16 . 1 1 416 416 PHE CB C 416 38.700 38.700 42.625 -3.925 19685 8299 1 16 . 1 1 416 416 PHE H H 416 7.610 7.610 7.273 0.337 19685 8300 1 16 . 1 1 417 417 GLY N N 417 113.000 113.000 107.536 5.464 19685 8301 1 16 . 1 1 417 417 GLY C C 417 174.300 174.300 172.688 1.612 19685 8302 1 16 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.295 -3.395 19685 8303 1 16 . 1 1 417 417 GLY H H 417 9.740 9.740 9.417 0.323 19685 8304 1 16 . 1 1 418 418 ASP N N 418 121.500 121.500 116.910 4.590 19685 8305 1 16 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.672 -0.732 19685 8306 1 16 . 1 1 418 418 ASP C C 418 177.900 177.900 176.620 1.280 19685 8307 1 16 . 1 1 418 418 ASP CA C 418 57.600 57.600 54.650 2.950 19685 8308 1 16 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.138 -1.438 19685 8309 1 16 . 1 1 418 418 ASP H H 418 8.680 8.680 8.071 0.609 19685 8310 1 16 . 1 1 419 419 GLN N N 419 116.400 116.400 120.847 -4.447 19685 8311 1 16 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.279 -0.369 19685 8312 1 16 . 1 1 419 419 GLN C C 419 177.600 177.600 175.672 1.928 19685 8313 1 16 . 1 1 419 419 GLN CA C 419 58.000 58.000 58.166 -0.166 19685 8314 1 16 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.587 -1.188 19685 8315 1 16 . 1 1 419 419 GLN H H 419 8.780 8.780 8.431 0.349 19685 8316 1 16 . 1 1 420 420 ASP N N 420 117.500 117.500 116.704 0.796 19685 8317 1 16 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.712 -0.702 19685 8318 1 16 . 1 1 420 420 ASP C C 420 178.000 178.000 177.572 0.428 19685 8319 1 16 . 1 1 420 420 ASP CA C 420 56.700 56.700 54.473 2.227 19685 8320 1 16 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.180 -0.380 19685 8321 1 16 . 1 1 420 420 ASP H H 420 7.210 7.210 8.443 -1.233 19685 8322 1 16 . 1 1 421 421 ILE N N 421 117.000 117.000 121.412 -4.412 19685 8323 1 16 . 1 1 421 421 ILE HA H 421 4.080 4.080 3.833 0.247 19685 8324 1 16 . 1 1 421 421 ILE C C 421 176.500 176.500 176.007 0.493 19685 8325 1 16 . 1 1 421 421 ILE CA C 421 64.000 64.000 63.197 0.803 19685 8326 1 16 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.061 -0.761 19685 8327 1 16 . 1 1 421 421 ILE H H 421 7.610 7.610 7.638 -0.028 19685 8328 1 16 . 1 1 422 422 LEU N N 422 123.200 123.200 118.918 4.282 19685 8329 1 16 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.159 -0.399 19685 8330 1 16 . 1 1 422 422 LEU C C 422 177.800 177.800 177.007 0.793 19685 8331 1 16 . 1 1 422 422 LEU CA C 422 58.600 58.600 56.361 2.239 19685 8332 1 16 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.856 -0.656 19685 8333 1 16 . 1 1 422 422 LEU H H 422 7.870 7.870 8.050 -0.180 19685 8334 1 16 . 1 1 423 423 GLN N N 423 115.600 115.600 117.669 -2.069 19685 8335 1 16 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.400 -0.520 19685 8336 1 16 . 1 1 423 423 GLN C C 423 177.800 177.800 175.795 2.005 19685 8337 1 16 . 1 1 423 423 GLN CA C 423 58.600 58.600 55.953 2.647 19685 8338 1 16 . 1 1 423 423 GLN CB C 423 27.900 27.900 30.505 -2.605 19685 8339 1 16 . 1 1 423 423 GLN H H 423 7.860 7.860 7.889 -0.029 19685 8340 1 16 . 1 1 424 424 MET N N 424 115.500 115.500 117.692 -2.192 19685 8341 1 16 . 1 1 424 424 MET HA H 424 3.910 3.910 4.529 -0.619 19685 8342 1 16 . 1 1 424 424 MET C C 424 175.500 175.500 175.383 0.117 19685 8343 1 16 . 1 1 424 424 MET CA C 424 57.800 57.800 56.200 1.600 19685 8344 1 16 . 1 1 424 424 MET CB C 424 34.300 34.300 34.611 -0.311 19685 8345 1 16 . 1 1 424 424 MET H H 424 7.560 7.560 7.875 -0.315 19685 8346 1 16 . 1 1 425 425 PHE N N 425 112.300 112.300 118.663 -6.363 19685 8347 1 16 . 1 1 425 425 PHE HA H 425 4.700 4.700 5.006 -0.306 19685 8348 1 16 . 1 1 425 425 PHE C C 425 177.300 177.300 177.837 -0.537 19685 8349 1 16 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.898 1.002 19685 8350 1 16 . 1 1 425 425 PHE CB C 425 38.500 38.500 39.725 -1.225 19685 8351 1 16 . 1 1 425 425 PHE H H 425 7.680 7.680 8.116 -0.436 19685 8352 1 16 . 1 1 426 426 MET N N 426 127.400 127.400 120.232 7.168 19685 8353 1 16 . 1 1 426 426 MET HA H 426 4.630 4.630 4.241 0.389 19685 8354 1 16 . 1 1 426 426 MET C C 426 173.800 173.800 175.084 -1.284 19685 8355 1 16 . 1 1 426 426 MET CA C 426 59.100 59.100 60.420 -1.320 19685 8356 1 16 . 1 1 426 426 MET CB C 426 31.800 31.800 29.875 1.925 19685 8357 1 16 . 1 1 426 426 MET H H 426 8.540 8.540 8.685 -0.145 19685 8358 1 16 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.220 -0.210 19685 8359 1 16 . 1 1 427 427 PRO C C 427 176.800 176.800 177.282 -0.482 19685 8360 1 16 . 1 1 427 427 PRO CA C 427 65.200 65.200 64.145 1.054 19685 8361 1 16 . 1 1 427 427 PRO CB C 427 30.600 30.600 30.995 -0.395 19685 8362 1 16 . 1 1 428 428 PHE N N 428 110.000 110.000 118.335 -8.335 19685 8363 1 16 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.451 -0.181 19685 8364 1 16 . 1 1 428 428 PHE C C 428 174.600 174.600 175.371 -0.771 19685 8365 1 16 . 1 1 428 428 PHE CA C 428 57.700 57.700 59.753 -2.053 19685 8366 1 16 . 1 1 428 428 PHE CB C 428 38.000 38.000 40.462 -2.462 19685 8367 1 16 . 1 1 428 428 PHE H H 428 6.560 6.560 7.464 -0.904 19685 8368 1 16 . 1 1 429 429 GLY N N 429 105.500 105.500 103.522 1.978 19685 8369 1 16 . 1 1 429 429 GLY C C 429 170.100 170.100 172.984 -2.884 19685 8370 1 16 . 1 1 429 429 GLY CA C 429 44.400 44.400 44.701 -0.301 19685 8371 1 16 . 1 1 429 429 GLY H H 429 7.650 7.650 7.007 0.643 19685 8372 1 16 . 1 1 430 430 ASN N N 430 117.400 117.400 120.086 -2.686 19685 8373 1 16 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.290 0.340 19685 8374 1 16 . 1 1 430 430 ASN C C 430 173.200 173.200 173.985 -0.785 19685 8375 1 16 . 1 1 430 430 ASN CA C 430 52.600 52.600 55.254 -2.654 19685 8376 1 16 . 1 1 430 430 ASN CB C 430 37.200 37.200 38.327 -1.127 19685 8377 1 16 . 1 1 430 430 ASN H H 430 9.020 9.020 7.837 1.183 19685 8378 1 16 . 1 1 431 431 VAL N N 431 128.000 128.000 114.259 13.741 19685 8379 1 16 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.569 -0.819 19685 8380 1 16 . 1 1 431 431 VAL C C 431 176.400 176.400 177.408 -1.008 19685 8381 1 16 . 1 1 431 431 VAL CA C 431 61.800 61.800 62.740 -0.940 19685 8382 1 16 . 1 1 431 431 VAL CB C 431 31.900 31.900 33.570 -1.670 19685 8383 1 16 . 1 1 431 431 VAL H H 431 8.480 8.480 8.166 0.314 19685 8384 1 16 . 1 1 432 432 ILE N N 432 128.000 128.000 117.821 10.179 19685 8385 1 16 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.647 0.273 19685 8386 1 16 . 1 1 432 432 ILE C C 432 176.100 176.100 175.984 0.116 19685 8387 1 16 . 1 1 432 432 ILE CA C 432 62.500 62.500 63.497 -0.997 19685 8388 1 16 . 1 1 432 432 ILE CB C 432 37.400 37.400 37.250 0.150 19685 8389 1 16 . 1 1 432 432 ILE H H 432 8.840 8.840 8.227 0.613 19685 8390 1 16 . 1 1 433 433 SER N N 433 113.600 113.600 112.639 0.961 19685 8391 1 16 . 1 1 433 433 SER HA H 433 4.440 4.440 4.466 -0.026 19685 8392 1 16 . 1 1 433 433 SER C C 433 171.000 171.000 174.108 -3.108 19685 8393 1 16 . 1 1 433 433 SER CA C 433 57.300 57.300 58.487 -1.187 19685 8394 1 16 . 1 1 433 433 SER CB C 433 65.200 65.200 65.195 0.005 19685 8395 1 16 . 1 1 433 433 SER H H 433 7.280 7.280 7.816 -0.536 19685 8396 1 16 . 1 1 434 434 ALA N N 434 125.700 125.700 125.549 0.151 19685 8397 1 16 . 1 1 434 434 ALA HA H 434 4.910 4.910 3.813 1.097 19685 8398 1 16 . 1 1 434 434 ALA C C 434 174.600 174.600 176.265 -1.665 19685 8399 1 16 . 1 1 434 434 ALA CA C 434 51.000 51.000 52.940 -1.940 19685 8400 1 16 . 1 1 434 434 ALA CB C 434 21.200 21.200 17.656 3.544 19685 8401 1 16 . 1 1 434 434 ALA H H 434 8.270 8.270 7.889 0.381 19685 8402 1 16 . 1 1 435 435 LYS N N 435 120.900 120.900 114.899 6.001 19685 8403 1 16 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.079 0.391 19685 8404 1 16 . 1 1 435 435 LYS C C 435 173.800 173.800 175.723 -1.923 19685 8405 1 16 . 1 1 435 435 LYS CA C 435 53.700 53.700 56.337 -2.637 19685 8406 1 16 . 1 1 435 435 LYS CB C 435 36.400 36.400 33.090 3.310 19685 8407 1 16 . 1 1 435 435 LYS H H 435 8.490 8.490 7.069 1.421 19685 8408 1 16 . 1 1 436 436 VAL N N 436 122.200 122.200 118.297 3.903 19685 8409 1 16 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.270 -0.350 19685 8410 1 16 . 1 1 436 436 VAL C C 436 175.100 175.100 174.690 0.410 19685 8411 1 16 . 1 1 436 436 VAL CA C 436 63.600 63.600 62.371 1.229 19685 8412 1 16 . 1 1 436 436 VAL CB C 436 33.500 33.500 32.508 0.992 19685 8413 1 16 . 1 1 436 436 VAL H H 436 8.390 8.390 8.710 -0.320 19685 8414 1 16 . 1 1 437 437 PHE N N 437 125.900 125.900 118.778 7.122 19685 8415 1 16 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.418 -0.018 19685 8416 1 16 . 1 1 437 437 PHE C C 437 173.600 173.600 173.440 0.160 19685 8417 1 16 . 1 1 437 437 PHE CA C 437 57.700 57.700 58.337 -0.637 19685 8418 1 16 . 1 1 437 437 PHE CB C 437 39.000 39.000 40.993 -1.993 19685 8419 1 16 . 1 1 437 437 PHE H H 437 8.250 8.250 7.745 0.505 19685 8420 1 16 . 1 1 438 438 ILE N N 438 121.900 121.900 118.847 3.053 19685 8421 1 16 . 1 1 438 438 ILE HA H 438 4.460 4.460 4.299 0.161 19685 8422 1 16 . 1 1 438 438 ILE C C 438 175.700 175.700 174.329 1.371 19685 8423 1 16 . 1 1 438 438 ILE CA C 438 58.300 58.300 59.404 -1.104 19685 8424 1 16 . 1 1 438 438 ILE CB C 438 39.700 39.700 41.671 -1.971 19685 8425 1 16 . 1 1 438 438 ILE H H 438 8.520 8.520 7.590 0.930 19685 8426 1 16 . 1 1 439 439 ASP N N 439 126.500 126.500 123.983 2.517 19685 8427 1 16 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.388 0.192 19685 8428 1 16 . 1 1 439 439 ASP C C 439 176.300 176.300 177.176 -0.876 19685 8429 1 16 . 1 1 439 439 ASP CA C 439 53.600 53.600 54.630 -1.030 19685 8430 1 16 . 1 1 439 439 ASP CB C 439 42.300 42.300 42.670 -0.370 19685 8431 1 16 . 1 1 439 439 ASP H H 439 8.730 8.730 8.440 0.290 19685 8432 1 16 . 1 1 440 440 LYS N N 440 127.300 127.300 122.679 4.621 19685 8433 1 16 . 1 1 440 440 LYS HA H 440 4.070 4.070 4.209 -0.139 19685 8434 1 16 . 1 1 440 440 LYS C C 440 176.900 176.900 176.893 0.007 19685 8435 1 16 . 1 1 440 440 LYS CA C 440 57.800 57.800 57.366 0.434 19685 8436 1 16 . 1 1 440 440 LYS CB C 440 32.100 32.100 32.198 -0.098 19685 8437 1 16 . 1 1 440 440 LYS H H 440 8.930 8.930 8.535 0.395 19685 8438 1 16 . 1 1 441 441 GLN N N 441 117.400 117.400 115.049 2.351 19685 8439 1 16 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.589 -0.359 19685 8440 1 16 . 1 1 441 441 GLN C C 441 177.200 177.200 175.747 1.453 19685 8441 1 16 . 1 1 441 441 GLN CA C 441 57.600 57.600 56.245 1.355 19685 8442 1 16 . 1 1 441 441 GLN CB C 441 28.800 28.800 30.544 -1.744 19685 8443 1 16 . 1 1 441 441 GLN H H 441 8.650 8.650 8.638 0.012 19685 8444 1 16 . 1 1 442 442 THR N N 442 107.300 107.300 111.639 -4.339 19685 8445 1 16 . 1 1 442 442 THR HA H 442 4.290 4.290 4.507 -0.217 19685 8446 1 16 . 1 1 442 442 THR C C 442 175.100 175.100 174.726 0.374 19685 8447 1 16 . 1 1 442 442 THR CA C 442 61.200 61.200 61.612 -0.412 19685 8448 1 16 . 1 1 442 442 THR CB C 442 70.300 70.300 70.156 0.144 19685 8449 1 16 . 1 1 442 442 THR H H 442 7.830 7.830 7.929 -0.099 19685 8450 1 16 . 1 1 443 443 ASN N N 443 117.300 117.300 116.537 0.763 19685 8451 1 16 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.167 0.133 19685 8452 1 16 . 1 1 443 443 ASN C C 443 173.400 173.400 174.569 -1.169 19685 8453 1 16 . 1 1 443 443 ASN CA C 443 54.300 54.300 54.328 -0.028 19685 8454 1 16 . 1 1 443 443 ASN CB C 443 37.600 37.600 37.282 0.318 19685 8455 1 16 . 1 1 443 443 ASN H H 443 8.470 8.470 8.051 0.419 19685 8456 1 16 . 1 1 444 444 LEU N N 444 118.000 118.000 115.240 2.760 19685 8457 1 16 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.495 0.065 19685 8458 1 16 . 1 1 444 444 LEU C C 444 176.700 176.700 176.847 -0.147 19685 8459 1 16 . 1 1 444 444 LEU CA C 444 53.300 53.300 54.528 -1.228 19685 8460 1 16 . 1 1 444 444 LEU CB C 444 43.500 43.500 43.215 0.285 19685 8461 1 16 . 1 1 444 444 LEU H H 444 7.660 7.660 7.219 0.441 19685 8462 1 16 . 1 1 445 445 SER N N 445 115.500 115.500 113.323 2.177 19685 8463 1 16 . 1 1 445 445 SER HA H 445 4.460 4.460 3.960 0.500 19685 8464 1 16 . 1 1 445 445 SER C C 445 176.500 176.500 173.952 2.548 19685 8465 1 16 . 1 1 445 445 SER CA C 445 57.900 57.900 59.960 -2.060 19685 8466 1 16 . 1 1 445 445 SER CB C 445 63.500 63.500 62.819 0.681 19685 8467 1 16 . 1 1 445 445 SER H H 445 8.840 8.840 8.721 0.119 19685 8468 1 16 . 1 1 446 446 LYS N N 446 125.200 125.200 120.644 4.556 19685 8469 1 16 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.110 0.390 19685 8470 1 16 . 1 1 446 446 LYS C C 446 176.100 176.100 175.346 0.754 19685 8471 1 16 . 1 1 446 446 LYS CA C 446 56.300 56.300 55.944 0.356 19685 8472 1 16 . 1 1 446 446 LYS CB C 446 32.200 32.200 35.082 -2.882 19685 8473 1 16 . 1 1 446 446 LYS H H 446 9.230 9.230 8.266 0.964 19685 8474 1 16 . 1 1 447 447 CYS N N 447 113.000 113.000 117.325 -4.325 19685 8475 1 16 . 1 1 447 447 CYS C C 447 172.500 172.500 173.155 -0.655 19685 8476 1 16 . 1 1 447 447 CYS CA C 447 60.400 60.400 57.176 3.224 19685 8477 1 16 . 1 1 447 447 CYS CB C 447 24.900 24.900 30.442 -5.542 19685 8478 1 16 . 1 1 447 447 CYS H H 447 10.020 10.020 7.090 2.930 19685 8479 1 16 . 1 1 448 448 PHE N N 448 115.200 115.200 116.319 -1.119 19685 8480 1 16 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.224 1.116 19685 8481 1 16 . 1 1 448 448 PHE C C 448 172.400 172.400 173.554 -1.154 19685 8482 1 16 . 1 1 448 448 PHE CA C 448 54.700 54.700 58.487 -3.787 19685 8483 1 16 . 1 1 448 448 PHE CB C 448 42.000 42.000 37.534 4.466 19685 8484 1 16 . 1 1 448 448 PHE H H 448 7.810 7.810 8.605 -0.795 19685 8485 1 16 . 1 1 449 449 GLY N N 449 107.700 107.700 106.581 1.119 19685 8486 1 16 . 1 1 449 449 GLY C C 449 170.100 170.100 172.608 -2.508 19685 8487 1 16 . 1 1 449 449 GLY CA C 449 45.200 45.200 44.225 0.975 19685 8488 1 16 . 1 1 449 449 GLY H H 449 9.310 9.310 8.221 1.089 19685 8489 1 16 . 1 1 450 450 PHE N N 450 119.900 119.900 113.981 5.919 19685 8490 1 16 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.186 0.244 19685 8491 1 16 . 1 1 450 450 PHE C C 450 172.800 172.800 172.916 -0.116 19685 8492 1 16 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.890 -1.890 19685 8493 1 16 . 1 1 450 450 PHE CB C 450 43.600 43.600 41.093 2.507 19685 8494 1 16 . 1 1 450 450 PHE H H 450 8.760 8.760 8.631 0.129 19685 8495 1 16 . 1 1 451 451 VAL N N 451 123.800 123.800 118.249 5.551 19685 8496 1 16 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.249 0.041 19685 8497 1 16 . 1 1 451 451 VAL C C 451 172.400 172.400 175.863 -3.463 19685 8498 1 16 . 1 1 451 451 VAL CA C 451 59.800 59.800 61.289 -1.489 19685 8499 1 16 . 1 1 451 451 VAL CB C 451 36.100 36.100 35.296 0.804 19685 8500 1 16 . 1 1 451 451 VAL H H 451 7.930 7.930 8.133 -0.203 19685 8501 1 16 . 1 1 452 452 SER N N 452 119.600 119.600 122.935 -3.335 19685 8502 1 16 . 1 1 452 452 SER HA H 452 5.120 5.120 4.953 0.167 19685 8503 1 16 . 1 1 452 452 SER C C 452 173.200 173.200 173.789 -0.589 19685 8504 1 16 . 1 1 452 452 SER CA C 452 55.700 55.700 57.222 -1.522 19685 8505 1 16 . 1 1 452 452 SER CB C 452 66.100 66.100 62.489 3.611 19685 8506 1 16 . 1 1 452 452 SER H H 452 8.540 8.540 8.310 0.230 19685 8507 1 16 . 1 1 453 453 TYR N N 453 121.400 121.400 122.380 -0.980 19685 8508 1 16 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.370 1.010 19685 8509 1 16 . 1 1 453 453 TYR C C 453 173.600 173.600 177.113 -3.513 19685 8510 1 16 . 1 1 453 453 TYR CA C 453 56.500 56.500 58.268 -1.768 19685 8511 1 16 . 1 1 453 453 TYR CB C 453 42.200 42.200 38.212 3.988 19685 8512 1 16 . 1 1 453 453 TYR H H 453 8.380 8.380 7.497 0.883 19685 8513 1 16 . 1 1 454 454 ASP N N 454 113.300 113.300 122.603 -9.303 19685 8514 1 16 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.437 0.053 19685 8515 1 16 . 1 1 454 454 ASP C C 454 176.100 176.100 175.429 0.671 19685 8516 1 16 . 1 1 454 454 ASP CA C 454 52.800 52.800 55.724 -2.924 19685 8517 1 16 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.582 -1.182 19685 8518 1 16 . 1 1 454 454 ASP H H 454 7.860 7.860 8.593 -0.733 19685 8519 1 16 . 1 1 455 455 ASN N N 455 113.800 113.800 113.543 0.257 19685 8520 1 16 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.044 0.006 19685 8521 1 16 . 1 1 455 455 ASN C C 455 173.100 173.100 173.766 -0.666 19685 8522 1 16 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.329 -0.629 19685 8523 1 16 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.482 0.618 19685 8524 1 16 . 1 1 455 455 ASN H H 455 7.200 7.200 7.784 -0.584 19685 8525 1 16 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.540 -0.370 19685 8526 1 16 . 1 1 456 456 PRO C C 456 177.300 177.300 177.047 0.253 19685 8527 1 16 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.976 -0.776 19685 8528 1 16 . 1 1 456 456 PRO CB C 456 32.300 32.300 31.890 0.410 19685 8529 1 16 . 1 1 457 457 VAL N N 457 120.900 120.900 111.582 9.318 19685 8530 1 16 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.332 -0.712 19685 8531 1 16 . 1 1 457 457 VAL C C 457 179.000 179.000 176.370 2.630 19685 8532 1 16 . 1 1 457 457 VAL CA C 457 65.900 65.900 63.889 2.011 19685 8533 1 16 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.225 -0.425 19685 8534 1 16 . 1 1 457 457 VAL H H 457 8.120 8.120 7.974 0.146 19685 8535 1 16 . 1 1 458 458 SER N N 458 117.800 117.800 117.317 0.483 19685 8536 1 16 . 1 1 458 458 SER HA H 458 3.940 3.940 4.456 -0.516 19685 8537 1 16 . 1 1 458 458 SER C C 458 173.600 173.600 175.456 -1.856 19685 8538 1 16 . 1 1 458 458 SER CA C 458 61.100 61.100 61.125 -0.025 19685 8539 1 16 . 1 1 458 458 SER CB C 458 62.400 62.400 63.845 -1.445 19685 8540 1 16 . 1 1 458 458 SER H H 458 7.830 7.830 7.633 0.197 19685 8541 1 16 . 1 1 459 459 ALA N N 459 120.000 120.000 123.971 -3.971 19685 8542 1 16 . 1 1 459 459 ALA HA H 459 3.750 3.750 4.631 -0.881 19685 8543 1 16 . 1 1 459 459 ALA C C 459 178.100 178.100 178.497 -0.397 19685 8544 1 16 . 1 1 459 459 ALA CA C 459 54.500 54.500 54.388 0.112 19685 8545 1 16 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.967 -1.067 19685 8546 1 16 . 1 1 459 459 ALA H H 459 6.370 6.370 8.075 -1.705 19685 8547 1 16 . 1 1 460 460 GLN N N 460 116.100 116.100 118.909 -2.809 19685 8548 1 16 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.146 -0.316 19685 8549 1 16 . 1 1 460 460 GLN C C 460 178.000 178.000 176.554 1.446 19685 8550 1 16 . 1 1 460 460 GLN CA C 460 58.500 58.500 57.921 0.579 19685 8551 1 16 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.484 -1.084 19685 8552 1 16 . 1 1 460 460 GLN H H 460 7.710 7.710 8.378 -0.668 19685 8553 1 16 . 1 1 461 461 ALA N N 461 122.800 122.800 119.868 2.932 19685 8554 1 16 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.504 -0.544 19685 8555 1 16 . 1 1 461 461 ALA C C 461 179.500 179.500 176.874 2.626 19685 8556 1 16 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.469 2.031 19685 8557 1 16 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.125 -1.625 19685 8558 1 16 . 1 1 461 461 ALA H H 461 7.880 7.880 7.583 0.297 19685 8559 1 16 . 1 1 462 462 ALA N N 462 121.400 121.400 120.165 1.235 19685 8560 1 16 . 1 1 462 462 ALA HA H 462 2.400 2.400 4.104 -1.704 19685 8561 1 16 . 1 1 462 462 ALA C C 462 179.400 179.400 178.011 1.389 19685 8562 1 16 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.798 1.302 19685 8563 1 16 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.379 -1.679 19685 8564 1 16 . 1 1 462 462 ALA H H 462 7.860 7.860 7.693 0.167 19685 8565 1 16 . 1 1 463 463 ILE N N 463 118.600 118.600 118.738 -0.138 19685 8566 1 16 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.953 -0.713 19685 8567 1 16 . 1 1 463 463 ILE C C 463 177.500 177.500 176.157 1.343 19685 8568 1 16 . 1 1 463 463 ILE CA C 463 66.000 66.000 62.601 3.399 19685 8569 1 16 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.087 0.213 19685 8570 1 16 . 1 1 463 463 ILE H H 463 8.090 8.090 8.402 -0.312 19685 8571 1 16 . 1 1 464 464 GLN N N 464 117.000 117.000 116.187 0.813 19685 8572 1 16 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.439 -0.569 19685 8573 1 16 . 1 1 464 464 GLN C C 464 177.700 177.700 174.973 2.727 19685 8574 1 16 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.794 2.406 19685 8575 1 16 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.173 -1.273 19685 8576 1 16 . 1 1 464 464 GLN H H 464 7.780 7.780 8.253 -0.473 19685 8577 1 16 . 1 1 465 465 ALA N N 465 117.200 117.200 120.463 -3.263 19685 8578 1 16 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.411 -0.181 19685 8579 1 16 . 1 1 465 465 ALA C C 465 179.200 179.200 176.810 2.390 19685 8580 1 16 . 1 1 465 465 ALA CA C 465 53.800 53.800 53.289 0.511 19685 8581 1 16 . 1 1 465 465 ALA CB C 465 21.100 21.100 20.709 0.391 19685 8582 1 16 . 1 1 465 465 ALA H H 465 7.540 7.540 7.385 0.155 19685 8583 1 16 . 1 1 466 466 MET N N 466 110.800 110.800 115.110 -4.310 19685 8584 1 16 . 1 1 466 466 MET HA H 466 4.820 4.820 4.649 0.171 19685 8585 1 16 . 1 1 466 466 MET C C 466 177.600 177.600 175.462 2.138 19685 8586 1 16 . 1 1 466 466 MET CA C 466 53.300 53.300 55.115 -1.815 19685 8587 1 16 . 1 1 466 466 MET CB C 466 31.600 31.600 35.257 -3.657 19685 8588 1 16 . 1 1 466 466 MET H H 466 8.230 8.230 7.849 0.381 19685 8589 1 16 . 1 1 467 467 ASN N N 467 119.100 119.100 118.738 0.362 19685 8590 1 16 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.639 -0.149 19685 8591 1 16 . 1 1 467 467 ASN C C 467 176.300 176.300 176.784 -0.484 19685 8592 1 16 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.513 1.687 19685 8593 1 16 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.825 -0.625 19685 8594 1 16 . 1 1 467 467 ASN H H 467 8.560 8.560 7.543 1.017 19685 8595 1 16 . 1 1 468 468 GLY N N 468 117.900 117.900 112.330 5.570 19685 8596 1 16 . 1 1 468 468 GLY C C 468 172.800 172.800 174.015 -1.215 19685 8597 1 16 . 1 1 468 468 GLY CA C 468 45.300 45.300 45.804 -0.504 19685 8598 1 16 . 1 1 468 468 GLY H H 468 8.930 8.930 8.279 0.651 19685 8599 1 16 . 1 1 469 469 PHE N N 469 123.300 123.300 119.787 3.513 19685 8600 1 16 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.768 -0.578 19685 8601 1 16 . 1 1 469 469 PHE C C 469 174.400 174.400 173.606 0.794 19685 8602 1 16 . 1 1 469 469 PHE CA C 469 58.700 58.700 55.697 3.003 19685 8603 1 16 . 1 1 469 469 PHE CB C 469 40.600 40.600 41.329 -0.729 19685 8604 1 16 . 1 1 469 469 PHE H H 469 7.950 7.950 7.719 0.231 19685 8605 1 16 . 1 1 470 470 GLN N N 470 129.200 129.200 120.276 8.924 19685 8606 1 16 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.287 0.303 19685 8607 1 16 . 1 1 470 470 GLN C C 470 174.100 174.100 174.140 -0.040 19685 8608 1 16 . 1 1 470 470 GLN CA C 470 55.500 55.500 54.678 0.822 19685 8609 1 16 . 1 1 470 470 GLN CB C 470 28.800 28.800 31.632 -2.832 19685 8610 1 16 . 1 1 470 470 GLN H H 470 8.330 8.330 7.471 0.859 19685 8611 1 16 . 1 1 471 471 ILE N N 471 126.300 126.300 125.515 0.785 19685 8612 1 16 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.178 -0.008 19685 8613 1 16 . 1 1 471 471 ILE C C 471 175.400 175.400 175.268 0.132 19685 8614 1 16 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.271 -0.671 19685 8615 1 16 . 1 1 471 471 ILE CB C 471 39.100 39.100 38.468 0.631 19685 8616 1 16 . 1 1 471 471 ILE H H 471 8.440 8.440 8.700 -0.260 19685 8617 1 16 . 1 1 472 472 GLY N N 472 117.500 117.500 115.742 1.758 19685 8618 1 16 . 1 1 472 472 GLY C C 472 174.700 174.700 174.537 0.163 19685 8619 1 16 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.616 0.884 19685 8620 1 16 . 1 1 472 472 GLY H H 472 8.980 8.980 8.316 0.664 19685 8621 1 16 . 1 1 473 473 MET N N 473 124.100 124.100 119.765 4.335 19685 8622 1 16 . 1 1 473 473 MET HA H 473 4.380 4.380 4.440 -0.060 19685 8623 1 16 . 1 1 473 473 MET C C 473 175.700 175.700 175.250 0.450 19685 8624 1 16 . 1 1 473 473 MET CA C 473 55.000 55.000 56.073 -1.073 19685 8625 1 16 . 1 1 473 473 MET CB C 473 32.900 32.900 31.856 1.044 19685 8626 1 16 . 1 1 473 473 MET H H 473 9.070 9.070 8.084 0.986 19685 8627 1 16 . 1 1 474 474 LYS N N 474 118.700 118.700 117.784 0.916 19685 8628 1 16 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.607 -0.127 19685 8629 1 16 . 1 1 474 474 LYS C C 474 174.300 174.300 174.828 -0.528 19685 8630 1 16 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.932 -0.332 19685 8631 1 16 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.315 -0.215 19685 8632 1 16 . 1 1 474 474 LYS H H 474 7.770 7.770 7.130 0.640 19685 8633 1 16 . 1 1 475 475 ARG N N 475 119.600 119.600 120.748 -1.148 19685 8634 1 16 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.819 -0.019 19685 8635 1 16 . 1 1 475 475 ARG C C 475 175.700 175.700 174.811 0.889 19685 8636 1 16 . 1 1 475 475 ARG CA C 475 54.000 54.000 55.561 -1.561 19685 8637 1 16 . 1 1 475 475 ARG CB C 475 31.300 31.300 31.376 -0.076 19685 8638 1 16 . 1 1 475 475 ARG H H 475 8.350 8.350 8.496 -0.146 19685 8639 1 16 . 1 1 476 476 LEU N N 476 123.500 123.500 120.652 2.848 19685 8640 1 16 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.586 -0.156 19685 8641 1 16 . 1 1 476 476 LEU C C 476 177.600 177.600 174.711 2.889 19685 8642 1 16 . 1 1 476 476 LEU CA C 476 55.500 55.500 53.547 1.953 19685 8643 1 16 . 1 1 476 476 LEU CB C 476 42.800 42.800 45.640 -2.840 19685 8644 1 16 . 1 1 476 476 LEU H H 476 9.130 9.130 8.639 0.491 19685 8645 1 16 . 1 1 477 477 LYS N N 477 123.200 123.200 123.191 0.009 19685 8646 1 16 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.629 0.531 19685 8647 1 16 . 1 1 477 477 LYS C C 477 174.100 174.100 174.489 -0.389 19685 8648 1 16 . 1 1 477 477 LYS CA C 477 54.500 54.500 55.256 -0.756 19685 8649 1 16 . 1 1 477 477 LYS CB C 477 34.900 34.900 36.085 -1.185 19685 8650 1 16 . 1 1 477 477 LYS H H 477 8.090 8.090 8.189 -0.099 19685 8651 1 16 . 1 1 478 478 VAL N N 478 127.100 127.100 120.845 6.255 19685 8652 1 16 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.601 0.299 19685 8653 1 16 . 1 1 478 478 VAL C C 478 173.700 173.700 173.931 -0.231 19685 8654 1 16 . 1 1 478 478 VAL CA C 478 61.000 61.000 60.419 0.581 19685 8655 1 16 . 1 1 478 478 VAL CB C 478 33.700 33.700 35.536 -1.836 19685 8656 1 16 . 1 1 478 478 VAL H H 478 8.820 8.820 8.154 0.666 19685 8657 1 16 . 1 1 479 479 GLN N N 479 123.600 123.600 122.383 1.217 19685 8658 1 16 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.711 0.099 19685 8659 1 16 . 1 1 479 479 GLN C C 479 173.600 173.600 173.425 0.175 19685 8660 1 16 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.602 -1.402 19685 8661 1 16 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.556 0.944 19685 8662 1 16 . 1 1 479 479 GLN H H 479 9.130 9.130 8.431 0.699 19685 8663 1 16 . 1 1 480 480 LEU N N 480 123.200 123.200 117.435 5.765 19685 8664 1 16 . 1 1 480 480 LEU HA H 480 4.440 4.440 5.134 -0.694 19685 8665 1 16 . 1 1 480 480 LEU C C 480 177.100 177.100 176.647 0.453 19685 8666 1 16 . 1 1 480 480 LEU CA C 480 54.600 54.600 53.370 1.230 19685 8667 1 16 . 1 1 480 480 LEU CB C 480 42.400 42.400 45.326 -2.926 19685 8668 1 16 . 1 1 480 480 LEU H H 480 8.840 8.840 8.361 0.479 19685 8669 1 16 . 1 1 481 481 LYS N N 481 124.500 124.500 121.242 3.258 19685 8670 1 16 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.026 0.284 19685 8671 1 16 . 1 1 481 481 LYS C C 481 175.200 175.200 176.604 -1.404 19685 8672 1 16 . 1 1 481 481 LYS CA C 481 56.700 56.700 58.689 -1.989 19685 8673 1 16 . 1 1 481 481 LYS CB C 481 33.100 33.100 31.522 1.578 19685 8674 1 16 . 1 1 481 481 LYS H H 481 8.400 8.400 8.901 -0.501 19685 8675 1 16 . 1 1 482 482 ARG N N 482 126.600 126.600 119.591 7.009 19685 8676 1 16 . 1 1 482 482 ARG HA H 482 4.350 4.350 3.923 0.427 19685 8677 1 16 . 1 1 482 482 ARG C C 482 175.800 175.800 175.167 0.633 19685 8678 1 16 . 1 1 482 482 ARG CA C 482 55.600 55.600 57.289 -1.689 19685 8679 1 16 . 1 1 482 482 ARG CB C 482 31.100 31.100 29.012 2.088 19685 8680 1 16 . 1 1 482 482 ARG H H 482 8.770 8.770 8.153 0.617 19685 8681 1 16 . 1 1 483 483 SER N N 483 118.100 118.100 118.396 -0.296 19685 8682 1 16 . 1 1 483 483 SER HA H 483 4.400 4.400 4.466 -0.066 19685 8683 1 16 . 1 1 483 483 SER C C 483 174.200 174.200 174.026 0.174 19685 8684 1 16 . 1 1 483 483 SER CA C 483 58.000 58.000 58.273 -0.273 19685 8685 1 16 . 1 1 483 483 SER CB C 483 63.500 63.500 63.621 -0.121 19685 8686 1 16 . 1 1 483 483 SER H H 483 8.610 8.610 8.297 0.313 19685 8687 1 16 . 1 1 484 484 LYS N N 484 123.000 123.000 123.233 -0.233 19685 8688 1 16 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.638 -0.428 19685 8689 1 16 . 1 1 484 484 LYS C C 484 175.900 175.900 175.598 0.302 19685 8690 1 16 . 1 1 484 484 LYS CA C 484 56.300 56.300 56.026 0.274 19685 8691 1 16 . 1 1 484 484 LYS CB C 484 32.500 32.500 33.875 -1.375 19685 8692 1 16 . 1 1 484 484 LYS H H 484 8.560 8.560 8.337 0.223 19685 8693 1 16 . 1 1 485 485 ASN N N 485 119.600 119.600 119.502 0.098 19685 8694 1 16 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.970 -0.370 19685 8695 1 16 . 1 1 485 485 ASN C C 485 174.400 174.400 173.703 0.697 19685 8696 1 16 . 1 1 485 485 ASN CA C 485 52.900 52.900 52.311 0.589 19685 8697 1 16 . 1 1 485 485 ASN CB C 485 38.400 38.400 40.473 -2.073 19685 8698 1 16 . 1 1 485 485 ASN H H 485 8.560 8.560 8.520 0.040 19685 8699 1 16 . 1 1 486 486 ASP N N 486 121.100 121.100 120.768 0.332 19685 8700 1 16 . 1 1 486 486 ASP HA H 486 4.520 4.520 5.087 -0.567 19685 8701 1 16 . 1 1 486 486 ASP C C 486 175.700 175.700 174.719 0.981 19685 8702 1 16 . 1 1 486 486 ASP CA C 486 54.000 54.000 53.493 0.507 19685 8703 1 16 . 1 1 486 486 ASP CB C 486 40.800 40.800 43.886 -3.086 19685 8704 1 16 . 1 1 486 486 ASP H H 486 8.250 8.250 8.590 -0.340 19685 8705 1 16 . 1 1 487 487 SER N N 487 115.400 115.400 114.785 0.615 19685 8706 1 16 . 1 1 487 487 SER HA H 487 4.310 4.310 4.691 -0.381 19685 8707 1 16 . 1 1 487 487 SER C C 487 172.800 172.800 173.172 -0.372 19685 8708 1 16 . 1 1 487 487 SER CA C 487 57.700 57.700 57.513 0.187 19685 8709 1 16 . 1 1 487 487 SER CB C 487 63.600 63.600 65.144 -1.544 19685 8710 1 16 . 1 1 487 487 SER H H 487 8.090 8.090 8.271 -0.181 19685 8711 1 16 . 1 1 488 488 LYS N N 488 122.300 122.300 117.391 4.909 19685 8712 1 16 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.638 -0.588 19685 8713 1 16 . 1 1 488 488 LYS C C 488 174.500 174.500 174.076 0.424 19685 8714 1 16 . 1 1 488 488 LYS CA C 488 54.000 54.000 54.556 -0.556 19685 8715 1 16 . 1 1 488 488 LYS CB C 488 32.400 32.400 34.373 -1.972 19685 8716 1 16 . 1 1 488 488 LYS H H 488 8.090 8.090 8.177 -0.087 19685 8717 1 16 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.287 -0.007 19685 8718 1 16 . 1 1 489 489 PRO C C 489 175.000 175.000 175.172 -0.172 19685 8719 1 16 . 1 1 489 489 PRO CA C 489 63.200 63.200 63.233 -0.033 19685 8720 1 16 . 1 1 489 489 PRO CB C 489 31.100 31.100 31.472 -0.372 19685 8721 1 17 . 1 1 395 395 SER N N 395 115.500 115.500 114.920 0.580 19685 8722 1 17 . 1 1 395 395 SER HA H 395 4.300 4.300 4.678 -0.378 19685 8723 1 17 . 1 1 395 395 SER C C 395 173.900 173.900 173.992 -0.092 19685 8724 1 17 . 1 1 395 395 SER CA C 395 57.900 57.900 56.687 1.214 19685 8725 1 17 . 1 1 395 395 SER CB C 395 63.400 63.400 64.577 -1.177 19685 8726 1 17 . 1 1 395 395 SER H H 395 8.200 8.200 8.365 -0.165 19685 8727 1 17 . 1 1 396 396 HIS N N 396 123.500 123.500 117.661 5.839 19685 8728 1 17 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.240 0.320 19685 8729 1 17 . 1 1 396 396 HIS C C 396 174.100 174.100 174.308 -0.208 19685 8730 1 17 . 1 1 396 396 HIS CA C 396 53.700 53.700 57.672 -3.973 19685 8731 1 17 . 1 1 396 396 HIS CB C 396 32.200 32.200 27.914 4.286 19685 8732 1 17 . 1 1 396 396 HIS H H 396 8.120 8.120 8.127 -0.007 19685 8733 1 17 . 1 1 397 397 MET N N 397 121.200 121.200 117.709 3.491 19685 8734 1 17 . 1 1 397 397 MET HA H 397 4.320 4.320 4.663 -0.343 19685 8735 1 17 . 1 1 397 397 MET C C 397 175.400 175.400 176.469 -1.069 19685 8736 1 17 . 1 1 397 397 MET CA C 397 55.000 55.000 54.827 0.173 19685 8737 1 17 . 1 1 397 397 MET CB C 397 32.500 32.500 33.518 -1.018 19685 8738 1 17 . 1 1 397 397 MET H H 397 8.300 8.300 7.578 0.722 19685 8739 1 17 . 1 1 398 398 GLN N N 398 122.100 122.100 117.832 4.268 19685 8740 1 17 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.417 -0.227 19685 8741 1 17 . 1 1 398 398 GLN C C 398 174.800 174.800 175.131 -0.331 19685 8742 1 17 . 1 1 398 398 GLN CA C 398 55.200 55.200 56.075 -0.875 19685 8743 1 17 . 1 1 398 398 GLN CB C 398 28.900 28.900 28.946 -0.046 19685 8744 1 17 . 1 1 398 398 GLN H H 398 8.540 8.540 8.587 -0.047 19685 8745 1 17 . 1 1 399 399 LYS N N 399 123.000 123.000 117.828 5.172 19685 8746 1 17 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.530 -0.310 19685 8747 1 17 . 1 1 399 399 LYS C C 399 174.800 174.800 175.826 -1.026 19685 8748 1 17 . 1 1 399 399 LYS CA C 399 55.600 55.600 56.544 -0.944 19685 8749 1 17 . 1 1 399 399 LYS CB C 399 33.000 33.000 32.763 0.237 19685 8750 1 17 . 1 1 399 399 LYS H H 399 8.180 8.180 8.222 -0.042 19685 8751 1 17 . 1 1 400 400 GLU N N 400 122.000 122.000 118.501 3.499 19685 8752 1 17 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.549 -0.119 19685 8753 1 17 . 1 1 400 400 GLU C C 400 176.400 176.400 175.573 0.827 19685 8754 1 17 . 1 1 400 400 GLU CA C 400 55.400 55.400 55.675 -0.275 19685 8755 1 17 . 1 1 400 400 GLU CB C 400 31.400 31.400 31.224 0.176 19685 8756 1 17 . 1 1 400 400 GLU H H 400 8.350 8.350 8.072 0.278 19685 8757 1 17 . 1 1 401 401 GLY N N 401 109.500 109.500 108.093 1.407 19685 8758 1 17 . 1 1 401 401 GLY C C 401 171.500 171.500 173.084 -1.584 19685 8759 1 17 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.539 -0.839 19685 8760 1 17 . 1 1 401 401 GLY H H 401 9.050 9.050 7.915 1.135 19685 8761 1 17 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.510 -0.090 19685 8762 1 17 . 1 1 402 402 PRO C C 402 173.900 173.900 176.932 -3.032 19685 8763 1 17 . 1 1 402 402 PRO CA C 402 61.900 61.900 64.648 -2.748 19685 8764 1 17 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.437 -0.237 19685 8765 1 17 . 1 1 403 403 GLU N N 403 119.600 119.600 117.392 2.208 19685 8766 1 17 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.366 -0.406 19685 8767 1 17 . 1 1 403 403 GLU C C 403 177.300 177.300 174.945 2.355 19685 8768 1 17 . 1 1 403 403 GLU CA C 403 58.100 58.100 57.174 0.926 19685 8769 1 17 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.483 -1.483 19685 8770 1 17 . 1 1 403 403 GLU H H 403 8.420 8.420 8.491 -0.071 19685 8771 1 17 . 1 1 404 404 GLY N N 404 112.800 112.800 106.608 6.192 19685 8772 1 17 . 1 1 404 404 GLY C C 404 173.300 173.300 173.986 -0.686 19685 8773 1 17 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.292 -0.392 19685 8774 1 17 . 1 1 404 404 GLY H H 404 8.500 8.500 8.297 0.203 19685 8775 1 17 . 1 1 405 405 ALA N N 405 120.000 120.000 124.191 -4.191 19685 8776 1 17 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.303 0.247 19685 8777 1 17 . 1 1 405 405 ALA C C 405 174.100 174.100 175.757 -1.657 19685 8778 1 17 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.791 -1.291 19685 8779 1 17 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.082 3.718 19685 8780 1 17 . 1 1 405 405 ALA H H 405 8.360 8.360 8.293 0.067 19685 8781 1 17 . 1 1 406 406 ASN N N 406 115.500 115.500 116.955 -1.455 19685 8782 1 17 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.241 -0.051 19685 8783 1 17 . 1 1 406 406 ASN C C 406 172.900 172.900 174.624 -1.724 19685 8784 1 17 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.506 1.094 19685 8785 1 17 . 1 1 406 406 ASN CB C 406 40.900 40.900 38.607 2.293 19685 8786 1 17 . 1 1 406 406 ASN H H 406 7.690 7.690 7.958 -0.268 19685 8787 1 17 . 1 1 407 407 LEU N N 407 123.400 123.400 120.571 2.829 19685 8788 1 17 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.253 0.707 19685 8789 1 17 . 1 1 407 407 LEU C C 407 174.900 174.900 176.639 -1.739 19685 8790 1 17 . 1 1 407 407 LEU CA C 407 53.100 53.100 56.384 -3.284 19685 8791 1 17 . 1 1 407 407 LEU CB C 407 45.400 45.400 41.465 3.935 19685 8792 1 17 . 1 1 407 407 LEU H H 407 9.290 9.290 7.681 1.609 19685 8793 1 17 . 1 1 408 408 PHE N N 408 118.700 118.700 123.119 -4.419 19685 8794 1 17 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.497 0.803 19685 8795 1 17 . 1 1 408 408 PHE C C 408 174.200 174.200 175.664 -1.464 19685 8796 1 17 . 1 1 408 408 PHE CA C 408 56.300 56.300 57.675 -1.375 19685 8797 1 17 . 1 1 408 408 PHE CB C 408 42.700 42.700 37.730 4.970 19685 8798 1 17 . 1 1 408 408 PHE H H 408 9.150 9.150 8.036 1.114 19685 8799 1 17 . 1 1 409 409 ILE N N 409 120.800 120.800 122.351 -1.551 19685 8800 1 17 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.495 0.475 19685 8801 1 17 . 1 1 409 409 ILE C C 409 173.900 173.900 175.239 -1.339 19685 8802 1 17 . 1 1 409 409 ILE CA C 409 59.000 59.000 61.188 -2.188 19685 8803 1 17 . 1 1 409 409 ILE CB C 409 40.400 40.400 38.308 2.092 19685 8804 1 17 . 1 1 409 409 ILE H H 409 8.380 8.380 8.323 0.057 19685 8805 1 17 . 1 1 410 410 TYR N N 410 123.200 123.200 123.929 -0.729 19685 8806 1 17 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.890 0.050 19685 8807 1 17 . 1 1 410 410 TYR C C 410 174.300 174.300 174.340 -0.040 19685 8808 1 17 . 1 1 410 410 TYR CA C 410 56.200 56.200 56.819 -0.619 19685 8809 1 17 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.025 1.775 19685 8810 1 17 . 1 1 410 410 TYR H H 410 9.440 9.440 8.577 0.863 19685 8811 1 17 . 1 1 411 411 HIS N N 411 112.100 112.100 119.345 -7.245 19685 8812 1 17 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.463 -0.013 19685 8813 1 17 . 1 1 411 411 HIS C C 411 173.300 173.300 175.987 -2.687 19685 8814 1 17 . 1 1 411 411 HIS CA C 411 55.900 55.900 56.421 -0.521 19685 8815 1 17 . 1 1 411 411 HIS CB C 411 26.200 26.200 29.394 -3.194 19685 8816 1 17 . 1 1 411 411 HIS H H 411 8.580 8.580 8.186 0.394 19685 8817 1 17 . 1 1 412 412 LEU N N 412 115.100 115.100 117.754 -2.654 19685 8818 1 17 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.468 -0.508 19685 8819 1 17 . 1 1 412 412 LEU C C 412 175.100 175.100 175.188 -0.088 19685 8820 1 17 . 1 1 412 412 LEU CA C 412 52.400 52.400 53.837 -1.437 19685 8821 1 17 . 1 1 412 412 LEU CB C 412 42.000 42.000 41.363 0.637 19685 8822 1 17 . 1 1 412 412 LEU H H 412 7.560 7.560 7.586 -0.026 19685 8823 1 17 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.397 -0.127 19685 8824 1 17 . 1 1 413 413 PRO C C 413 177.600 177.600 177.979 -0.379 19685 8825 1 17 . 1 1 413 413 PRO CA C 413 62.300 62.300 63.159 -0.859 19685 8826 1 17 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.260 -0.060 19685 8827 1 17 . 1 1 414 414 GLN N N 414 125.500 125.500 118.557 6.943 19685 8828 1 17 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.286 -0.206 19685 8829 1 17 . 1 1 414 414 GLN C C 414 175.400 175.400 175.849 -0.449 19685 8830 1 17 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.860 -0.860 19685 8831 1 17 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.780 -0.280 19685 8832 1 17 . 1 1 414 414 GLN H H 414 9.170 9.170 8.794 0.376 19685 8833 1 17 . 1 1 415 415 GLU N N 415 115.300 115.300 118.526 -3.226 19685 8834 1 17 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.624 -0.364 19685 8835 1 17 . 1 1 415 415 GLU C C 415 176.700 176.700 175.232 1.468 19685 8836 1 17 . 1 1 415 415 GLU CA C 415 58.700 58.700 55.853 2.847 19685 8837 1 17 . 1 1 415 415 GLU CB C 415 28.300 28.300 30.827 -2.527 19685 8838 1 17 . 1 1 415 415 GLU H H 415 9.390 9.390 8.783 0.607 19685 8839 1 17 . 1 1 416 416 PHE N N 416 121.700 121.700 118.460 3.240 19685 8840 1 17 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.085 -0.475 19685 8841 1 17 . 1 1 416 416 PHE C C 416 176.400 176.400 175.691 0.709 19685 8842 1 17 . 1 1 416 416 PHE CA C 416 57.400 57.400 56.753 0.647 19685 8843 1 17 . 1 1 416 416 PHE CB C 416 38.700 38.700 43.084 -4.384 19685 8844 1 17 . 1 1 416 416 PHE H H 416 7.610 7.610 7.623 -0.013 19685 8845 1 17 . 1 1 417 417 GLY N N 417 113.000 113.000 107.821 5.179 19685 8846 1 17 . 1 1 417 417 GLY C C 417 174.300 174.300 172.928 1.372 19685 8847 1 17 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.320 -3.420 19685 8848 1 17 . 1 1 417 417 GLY H H 417 9.740 9.740 9.511 0.229 19685 8849 1 17 . 1 1 418 418 ASP N N 418 121.500 121.500 117.566 3.934 19685 8850 1 17 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.728 -0.788 19685 8851 1 17 . 1 1 418 418 ASP C C 418 177.900 177.900 177.087 0.813 19685 8852 1 17 . 1 1 418 418 ASP CA C 418 57.600 57.600 54.905 2.695 19685 8853 1 17 . 1 1 418 418 ASP CB C 418 39.700 39.700 40.982 -1.282 19685 8854 1 17 . 1 1 418 418 ASP H H 418 8.680 8.680 8.179 0.501 19685 8855 1 17 . 1 1 419 419 GLN N N 419 116.400 116.400 120.535 -4.135 19685 8856 1 17 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.183 -0.273 19685 8857 1 17 . 1 1 419 419 GLN C C 419 177.600 177.600 175.680 1.920 19685 8858 1 17 . 1 1 419 419 GLN CA C 419 58.000 58.000 58.249 -0.249 19685 8859 1 17 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.563 -1.163 19685 8860 1 17 . 1 1 419 419 GLN H H 419 8.780 8.780 8.538 0.242 19685 8861 1 17 . 1 1 420 420 ASP N N 420 117.500 117.500 116.069 1.431 19685 8862 1 17 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.650 -0.640 19685 8863 1 17 . 1 1 420 420 ASP C C 420 178.000 178.000 177.652 0.348 19685 8864 1 17 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.658 3.042 19685 8865 1 17 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.232 -0.432 19685 8866 1 17 . 1 1 420 420 ASP H H 420 7.210 7.210 8.287 -1.077 19685 8867 1 17 . 1 1 421 421 ILE N N 421 117.000 117.000 121.227 -4.227 19685 8868 1 17 . 1 1 421 421 ILE HA H 421 4.080 4.080 4.147 -0.067 19685 8869 1 17 . 1 1 421 421 ILE C C 421 176.500 176.500 177.040 -0.540 19685 8870 1 17 . 1 1 421 421 ILE CA C 421 64.000 64.000 63.788 0.212 19685 8871 1 17 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.094 -0.794 19685 8872 1 17 . 1 1 421 421 ILE H H 421 7.610 7.610 7.876 -0.266 19685 8873 1 17 . 1 1 422 422 LEU N N 422 123.200 123.200 119.660 3.540 19685 8874 1 17 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.149 -0.389 19685 8875 1 17 . 1 1 422 422 LEU C C 422 177.800 177.800 178.244 -0.444 19685 8876 1 17 . 1 1 422 422 LEU CA C 422 58.600 58.600 57.805 0.795 19685 8877 1 17 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.152 0.048 19685 8878 1 17 . 1 1 422 422 LEU H H 422 7.870 7.870 8.129 -0.259 19685 8879 1 17 . 1 1 423 423 GLN N N 423 115.600 115.600 116.526 -0.926 19685 8880 1 17 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.299 -0.419 19685 8881 1 17 . 1 1 423 423 GLN C C 423 177.800 177.800 176.728 1.072 19685 8882 1 17 . 1 1 423 423 GLN CA C 423 58.600 58.600 57.564 1.036 19685 8883 1 17 . 1 1 423 423 GLN CB C 423 27.900 27.900 28.834 -0.934 19685 8884 1 17 . 1 1 423 423 GLN H H 423 7.860 7.860 7.707 0.153 19685 8885 1 17 . 1 1 424 424 MET N N 424 115.500 115.500 118.355 -2.855 19685 8886 1 17 . 1 1 424 424 MET HA H 424 3.910 3.910 4.532 -0.622 19685 8887 1 17 . 1 1 424 424 MET C C 424 175.500 175.500 175.752 -0.252 19685 8888 1 17 . 1 1 424 424 MET CA C 424 57.800 57.800 55.901 1.899 19685 8889 1 17 . 1 1 424 424 MET CB C 424 34.300 34.300 34.255 0.044 19685 8890 1 17 . 1 1 424 424 MET H H 424 7.560 7.560 7.947 -0.387 19685 8891 1 17 . 1 1 425 425 PHE N N 425 112.300 112.300 115.627 -3.327 19685 8892 1 17 . 1 1 425 425 PHE HA H 425 4.700 4.700 4.893 -0.193 19685 8893 1 17 . 1 1 425 425 PHE C C 425 177.300 177.300 177.195 0.105 19685 8894 1 17 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.954 0.946 19685 8895 1 17 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.903 -2.403 19685 8896 1 17 . 1 1 425 425 PHE H H 425 7.680 7.680 7.783 -0.103 19685 8897 1 17 . 1 1 426 426 MET N N 426 127.400 127.400 120.192 7.208 19685 8898 1 17 . 1 1 426 426 MET HA H 426 4.630 4.630 4.571 0.059 19685 8899 1 17 . 1 1 426 426 MET C C 426 173.800 173.800 175.006 -1.206 19685 8900 1 17 . 1 1 426 426 MET CA C 426 59.100 59.100 58.382 0.718 19685 8901 1 17 . 1 1 426 426 MET CB C 426 31.800 31.800 30.385 1.415 19685 8902 1 17 . 1 1 426 426 MET H H 426 8.540 8.540 7.678 0.862 19685 8903 1 17 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.209 -0.199 19685 8904 1 17 . 1 1 427 427 PRO C C 427 176.800 176.800 176.122 0.678 19685 8905 1 17 . 1 1 427 427 PRO CA C 427 65.200 65.200 63.743 1.457 19685 8906 1 17 . 1 1 427 427 PRO CB C 427 30.600 30.600 31.159 -0.559 19685 8907 1 17 . 1 1 428 428 PHE N N 428 110.000 110.000 117.349 -7.349 19685 8908 1 17 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.693 -0.423 19685 8909 1 17 . 1 1 428 428 PHE C C 428 174.600 174.600 175.613 -1.013 19685 8910 1 17 . 1 1 428 428 PHE CA C 428 57.700 57.700 59.024 -1.324 19685 8911 1 17 . 1 1 428 428 PHE CB C 428 38.000 38.000 41.811 -3.811 19685 8912 1 17 . 1 1 428 428 PHE H H 428 6.560 6.560 7.868 -1.308 19685 8913 1 17 . 1 1 429 429 GLY N N 429 105.500 105.500 105.722 -0.222 19685 8914 1 17 . 1 1 429 429 GLY C C 429 170.100 170.100 171.943 -1.843 19685 8915 1 17 . 1 1 429 429 GLY CA C 429 44.400 44.400 45.010 -0.610 19685 8916 1 17 . 1 1 429 429 GLY H H 429 7.650 7.650 7.878 -0.228 19685 8917 1 17 . 1 1 430 430 ASN N N 430 117.400 117.400 118.428 -1.028 19685 8918 1 17 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.536 0.094 19685 8919 1 17 . 1 1 430 430 ASN C C 430 173.200 173.200 176.281 -3.081 19685 8920 1 17 . 1 1 430 430 ASN CA C 430 52.600 52.600 52.657 -0.057 19685 8921 1 17 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.250 -2.050 19685 8922 1 17 . 1 1 430 430 ASN H H 430 9.020 9.020 8.489 0.531 19685 8923 1 17 . 1 1 431 431 VAL N N 431 128.000 128.000 123.150 4.850 19685 8924 1 17 . 1 1 431 431 VAL HA H 431 3.750 3.750 3.815 -0.065 19685 8925 1 17 . 1 1 431 431 VAL C C 431 176.400 176.400 176.853 -0.453 19685 8926 1 17 . 1 1 431 431 VAL CA C 431 61.800 61.800 62.214 -0.414 19685 8927 1 17 . 1 1 431 431 VAL CB C 431 31.900 31.900 32.224 -0.324 19685 8928 1 17 . 1 1 431 431 VAL H H 431 8.480 8.480 8.462 0.018 19685 8929 1 17 . 1 1 432 432 ILE N N 432 128.000 128.000 118.669 9.331 19685 8930 1 17 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.582 0.338 19685 8931 1 17 . 1 1 432 432 ILE C C 432 176.100 176.100 176.065 0.035 19685 8932 1 17 . 1 1 432 432 ILE CA C 432 62.500 62.500 64.188 -1.688 19685 8933 1 17 . 1 1 432 432 ILE CB C 432 37.400 37.400 36.937 0.463 19685 8934 1 17 . 1 1 432 432 ILE H H 432 8.840 8.840 8.600 0.240 19685 8935 1 17 . 1 1 433 433 SER N N 433 113.600 113.600 114.492 -0.892 19685 8936 1 17 . 1 1 433 433 SER HA H 433 4.440 4.440 4.637 -0.197 19685 8937 1 17 . 1 1 433 433 SER C C 433 171.000 171.000 172.060 -1.060 19685 8938 1 17 . 1 1 433 433 SER CA C 433 57.300 57.300 57.400 -0.100 19685 8939 1 17 . 1 1 433 433 SER CB C 433 65.200 65.200 65.254 -0.054 19685 8940 1 17 . 1 1 433 433 SER H H 433 7.280 7.280 8.005 -0.725 19685 8941 1 17 . 1 1 434 434 ALA N N 434 125.700 125.700 127.479 -1.779 19685 8942 1 17 . 1 1 434 434 ALA HA H 434 4.910 4.910 4.660 0.250 19685 8943 1 17 . 1 1 434 434 ALA C C 434 174.600 174.600 176.153 -1.553 19685 8944 1 17 . 1 1 434 434 ALA CA C 434 51.000 51.000 50.932 0.068 19685 8945 1 17 . 1 1 434 434 ALA CB C 434 21.200 21.200 21.209 -0.008 19685 8946 1 17 . 1 1 434 434 ALA H H 434 8.270 8.270 8.339 -0.069 19685 8947 1 17 . 1 1 435 435 LYS N N 435 120.900 120.900 122.319 -1.419 19685 8948 1 17 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.663 -0.193 19685 8949 1 17 . 1 1 435 435 LYS C C 435 173.800 173.800 173.952 -0.152 19685 8950 1 17 . 1 1 435 435 LYS CA C 435 53.700 53.700 54.722 -1.022 19685 8951 1 17 . 1 1 435 435 LYS CB C 435 36.400 36.400 36.002 0.399 19685 8952 1 17 . 1 1 435 435 LYS H H 435 8.490 8.490 7.830 0.660 19685 8953 1 17 . 1 1 436 436 VAL N N 436 122.200 122.200 119.279 2.921 19685 8954 1 17 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.412 -0.492 19685 8955 1 17 . 1 1 436 436 VAL C C 436 175.100 175.100 174.630 0.470 19685 8956 1 17 . 1 1 436 436 VAL CA C 436 63.600 63.600 62.440 1.160 19685 8957 1 17 . 1 1 436 436 VAL CB C 436 33.500 33.500 34.609 -1.109 19685 8958 1 17 . 1 1 436 436 VAL H H 436 8.390 8.390 8.251 0.139 19685 8959 1 17 . 1 1 437 437 PHE N N 437 125.900 125.900 126.508 -0.608 19685 8960 1 17 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.734 -0.334 19685 8961 1 17 . 1 1 437 437 PHE C C 437 173.600 173.600 174.960 -1.360 19685 8962 1 17 . 1 1 437 437 PHE CA C 437 57.700 57.700 57.846 -0.146 19685 8963 1 17 . 1 1 437 437 PHE CB C 437 39.000 39.000 40.757 -1.757 19685 8964 1 17 . 1 1 437 437 PHE H H 437 8.250 8.250 8.850 -0.600 19685 8965 1 17 . 1 1 438 438 ILE N N 438 121.900 121.900 120.065 1.835 19685 8966 1 17 . 1 1 438 438 ILE HA H 438 4.460 4.460 4.487 -0.027 19685 8967 1 17 . 1 1 438 438 ILE C C 438 175.700 175.700 174.943 0.757 19685 8968 1 17 . 1 1 438 438 ILE CA C 438 58.300 58.300 61.041 -2.741 19685 8969 1 17 . 1 1 438 438 ILE CB C 438 39.700 39.700 38.041 1.659 19685 8970 1 17 . 1 1 438 438 ILE H H 438 8.520 8.520 7.833 0.687 19685 8971 1 17 . 1 1 439 439 ASP N N 439 126.500 126.500 119.196 7.304 19685 8972 1 17 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.283 0.297 19685 8973 1 17 . 1 1 439 439 ASP C C 439 176.300 176.300 176.277 0.023 19685 8974 1 17 . 1 1 439 439 ASP CA C 439 53.600 53.600 55.463 -1.863 19685 8975 1 17 . 1 1 439 439 ASP CB C 439 42.300 42.300 39.721 2.579 19685 8976 1 17 . 1 1 439 439 ASP H H 439 8.730 8.730 8.286 0.444 19685 8977 1 17 . 1 1 440 440 LYS N N 440 127.300 127.300 113.266 14.034 19685 8978 1 17 . 1 1 440 440 LYS HA H 440 4.070 4.070 3.883 0.187 19685 8979 1 17 . 1 1 440 440 LYS C C 440 176.900 176.900 176.144 0.756 19685 8980 1 17 . 1 1 440 440 LYS CA C 440 57.800 57.800 59.225 -1.425 19685 8981 1 17 . 1 1 440 440 LYS CB C 440 32.100 32.100 31.206 0.894 19685 8982 1 17 . 1 1 440 440 LYS H H 440 8.930 8.930 8.387 0.543 19685 8983 1 17 . 1 1 441 441 GLN N N 441 117.400 117.400 115.113 2.287 19685 8984 1 17 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.605 -0.375 19685 8985 1 17 . 1 1 441 441 GLN C C 441 177.200 177.200 176.111 1.089 19685 8986 1 17 . 1 1 441 441 GLN CA C 441 57.600 57.600 55.752 1.848 19685 8987 1 17 . 1 1 441 441 GLN CB C 441 28.800 28.800 30.691 -1.891 19685 8988 1 17 . 1 1 441 441 GLN H H 441 8.650 8.650 8.153 0.497 19685 8989 1 17 . 1 1 442 442 THR N N 442 107.300 107.300 115.879 -8.579 19685 8990 1 17 . 1 1 442 442 THR HA H 442 4.290 4.290 4.235 0.055 19685 8991 1 17 . 1 1 442 442 THR C C 442 175.100 175.100 174.517 0.583 19685 8992 1 17 . 1 1 442 442 THR CA C 442 61.200 61.200 63.800 -2.600 19685 8993 1 17 . 1 1 442 442 THR CB C 442 70.300 70.300 68.920 1.380 19685 8994 1 17 . 1 1 442 442 THR H H 442 7.830 7.830 7.642 0.188 19685 8995 1 17 . 1 1 443 443 ASN N N 443 117.300 117.300 118.451 -1.151 19685 8996 1 17 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.262 0.038 19685 8997 1 17 . 1 1 443 443 ASN C C 443 173.400 173.400 173.392 0.008 19685 8998 1 17 . 1 1 443 443 ASN CA C 443 54.300 54.300 53.923 0.377 19685 8999 1 17 . 1 1 443 443 ASN CB C 443 37.600 37.600 36.708 0.892 19685 9000 1 17 . 1 1 443 443 ASN H H 443 8.470 8.470 7.871 0.599 19685 9001 1 17 . 1 1 444 444 LEU N N 444 118.000 118.000 119.546 -1.546 19685 9002 1 17 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.527 0.033 19685 9003 1 17 . 1 1 444 444 LEU C C 444 176.700 176.700 177.881 -1.181 19685 9004 1 17 . 1 1 444 444 LEU CA C 444 53.300 53.300 54.072 -0.772 19685 9005 1 17 . 1 1 444 444 LEU CB C 444 43.500 43.500 43.254 0.246 19685 9006 1 17 . 1 1 444 444 LEU H H 444 7.660 7.660 7.263 0.397 19685 9007 1 17 . 1 1 445 445 SER N N 445 115.500 115.500 114.251 1.249 19685 9008 1 17 . 1 1 445 445 SER HA H 445 4.460 4.460 3.864 0.596 19685 9009 1 17 . 1 1 445 445 SER C C 445 176.500 176.500 173.599 2.901 19685 9010 1 17 . 1 1 445 445 SER CA C 445 57.900 57.900 60.349 -2.449 19685 9011 1 17 . 1 1 445 445 SER CB C 445 63.500 63.500 62.680 0.820 19685 9012 1 17 . 1 1 445 445 SER H H 445 8.840 8.840 8.894 -0.054 19685 9013 1 17 . 1 1 446 446 LYS N N 446 125.200 125.200 117.883 7.317 19685 9014 1 17 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.295 0.205 19685 9015 1 17 . 1 1 446 446 LYS C C 446 176.100 176.100 174.397 1.703 19685 9016 1 17 . 1 1 446 446 LYS CA C 446 56.300 56.300 55.318 0.982 19685 9017 1 17 . 1 1 446 446 LYS CB C 446 32.200 32.200 35.389 -3.189 19685 9018 1 17 . 1 1 446 446 LYS H H 446 9.230 9.230 7.716 1.514 19685 9019 1 17 . 1 1 447 447 CYS N N 447 113.000 113.000 116.497 -3.497 19685 9020 1 17 . 1 1 447 447 CYS C C 447 172.500 172.500 173.470 -0.970 19685 9021 1 17 . 1 1 447 447 CYS CA C 447 60.400 60.400 57.267 3.134 19685 9022 1 17 . 1 1 447 447 CYS CB C 447 24.900 24.900 28.057 -3.157 19685 9023 1 17 . 1 1 447 447 CYS H H 447 10.020 10.020 8.348 1.672 19685 9024 1 17 . 1 1 448 448 PHE N N 448 115.200 115.200 115.529 -0.329 19685 9025 1 17 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.411 0.929 19685 9026 1 17 . 1 1 448 448 PHE C C 448 172.400 172.400 173.656 -1.256 19685 9027 1 17 . 1 1 448 448 PHE CA C 448 54.700 54.700 55.447 -0.747 19685 9028 1 17 . 1 1 448 448 PHE CB C 448 42.000 42.000 40.278 1.722 19685 9029 1 17 . 1 1 448 448 PHE H H 448 7.810 7.810 6.864 0.946 19685 9030 1 17 . 1 1 449 449 GLY N N 449 107.700 107.700 106.182 1.518 19685 9031 1 17 . 1 1 449 449 GLY C C 449 170.100 170.100 172.340 -2.240 19685 9032 1 17 . 1 1 449 449 GLY CA C 449 45.200 45.200 43.583 1.617 19685 9033 1 17 . 1 1 449 449 GLY H H 449 9.310 9.310 8.443 0.867 19685 9034 1 17 . 1 1 450 450 PHE N N 450 119.900 119.900 114.285 5.615 19685 9035 1 17 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.345 0.085 19685 9036 1 17 . 1 1 450 450 PHE C C 450 172.800 172.800 172.978 -0.178 19685 9037 1 17 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.605 -1.605 19685 9038 1 17 . 1 1 450 450 PHE CB C 450 43.600 43.600 41.124 2.476 19685 9039 1 17 . 1 1 450 450 PHE H H 450 8.760 8.760 8.065 0.695 19685 9040 1 17 . 1 1 451 451 VAL N N 451 123.800 123.800 117.820 5.980 19685 9041 1 17 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.378 -0.088 19685 9042 1 17 . 1 1 451 451 VAL C C 451 172.400 172.400 175.991 -3.591 19685 9043 1 17 . 1 1 451 451 VAL CA C 451 59.800 59.800 61.054 -1.254 19685 9044 1 17 . 1 1 451 451 VAL CB C 451 36.100 36.100 36.082 0.018 19685 9045 1 17 . 1 1 451 451 VAL H H 451 7.930 7.930 8.312 -0.382 19685 9046 1 17 . 1 1 452 452 SER N N 452 119.600 119.600 121.337 -1.737 19685 9047 1 17 . 1 1 452 452 SER HA H 452 5.120 5.120 5.028 0.092 19685 9048 1 17 . 1 1 452 452 SER C C 452 173.200 173.200 173.670 -0.470 19685 9049 1 17 . 1 1 452 452 SER CA C 452 55.700 55.700 57.448 -1.748 19685 9050 1 17 . 1 1 452 452 SER CB C 452 66.100 66.100 62.119 3.981 19685 9051 1 17 . 1 1 452 452 SER H H 452 8.540 8.540 8.706 -0.166 19685 9052 1 17 . 1 1 453 453 TYR N N 453 121.400 121.400 122.258 -0.858 19685 9053 1 17 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.386 0.994 19685 9054 1 17 . 1 1 453 453 TYR C C 453 173.600 173.600 176.954 -3.354 19685 9055 1 17 . 1 1 453 453 TYR CA C 453 56.500 56.500 60.777 -4.277 19685 9056 1 17 . 1 1 453 453 TYR CB C 453 42.200 42.200 39.066 3.134 19685 9057 1 17 . 1 1 453 453 TYR H H 453 8.380 8.380 7.585 0.795 19685 9058 1 17 . 1 1 454 454 ASP N N 454 113.300 113.300 122.478 -9.178 19685 9059 1 17 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.447 0.043 19685 9060 1 17 . 1 1 454 454 ASP C C 454 176.100 176.100 175.398 0.702 19685 9061 1 17 . 1 1 454 454 ASP CA C 454 52.800 52.800 55.886 -3.086 19685 9062 1 17 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.621 -1.221 19685 9063 1 17 . 1 1 454 454 ASP H H 454 7.860 7.860 8.382 -0.522 19685 9064 1 17 . 1 1 455 455 ASN N N 455 113.800 113.800 112.715 1.085 19685 9065 1 17 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.113 -0.063 19685 9066 1 17 . 1 1 455 455 ASN C C 455 173.100 173.100 173.428 -0.328 19685 9067 1 17 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.595 -0.895 19685 9068 1 17 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.253 0.847 19685 9069 1 17 . 1 1 455 455 ASN H H 455 7.200 7.200 7.957 -0.757 19685 9070 1 17 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.461 -0.291 19685 9071 1 17 . 1 1 456 456 PRO C C 456 177.300 177.300 178.513 -1.213 19685 9072 1 17 . 1 1 456 456 PRO CA C 456 64.200 64.200 65.219 -1.019 19685 9073 1 17 . 1 1 456 456 PRO CB C 456 32.300 32.300 32.289 0.011 19685 9074 1 17 . 1 1 457 457 VAL N N 457 120.900 120.900 116.683 4.217 19685 9075 1 17 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.091 -0.471 19685 9076 1 17 . 1 1 457 457 VAL C C 457 179.000 179.000 176.929 2.071 19685 9077 1 17 . 1 1 457 457 VAL CA C 457 65.900 65.900 63.504 2.396 19685 9078 1 17 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.674 -0.874 19685 9079 1 17 . 1 1 457 457 VAL H H 457 8.120 8.120 7.914 0.206 19685 9080 1 17 . 1 1 458 458 SER N N 458 117.800 117.800 114.807 2.993 19685 9081 1 17 . 1 1 458 458 SER HA H 458 3.940 3.940 4.456 -0.516 19685 9082 1 17 . 1 1 458 458 SER C C 458 173.600 173.600 175.687 -2.087 19685 9083 1 17 . 1 1 458 458 SER CA C 458 61.100 61.100 59.891 1.209 19685 9084 1 17 . 1 1 458 458 SER CB C 458 62.400 62.400 63.329 -0.929 19685 9085 1 17 . 1 1 458 458 SER H H 458 7.830 7.830 7.349 0.481 19685 9086 1 17 . 1 1 459 459 ALA N N 459 120.000 120.000 123.847 -3.847 19685 9087 1 17 . 1 1 459 459 ALA HA H 459 3.750 3.750 3.527 0.223 19685 9088 1 17 . 1 1 459 459 ALA C C 459 178.100 178.100 178.682 -0.582 19685 9089 1 17 . 1 1 459 459 ALA CA C 459 54.500 54.500 53.128 1.372 19685 9090 1 17 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.611 -0.712 19685 9091 1 17 . 1 1 459 459 ALA H H 459 6.370 6.370 7.524 -1.154 19685 9092 1 17 . 1 1 460 460 GLN N N 460 116.100 116.100 120.143 -4.043 19685 9093 1 17 . 1 1 460 460 GLN HA H 460 3.830 3.830 3.992 -0.162 19685 9094 1 17 . 1 1 460 460 GLN C C 460 178.000 178.000 176.990 1.010 19685 9095 1 17 . 1 1 460 460 GLN CA C 460 58.500 58.500 58.693 -0.193 19685 9096 1 17 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.633 -1.233 19685 9097 1 17 . 1 1 460 460 GLN H H 460 7.710 7.710 7.935 -0.225 19685 9098 1 17 . 1 1 461 461 ALA N N 461 122.800 122.800 118.554 4.246 19685 9099 1 17 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.342 -0.382 19685 9100 1 17 . 1 1 461 461 ALA C C 461 179.500 179.500 177.280 2.220 19685 9101 1 17 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.914 1.586 19685 9102 1 17 . 1 1 461 461 ALA CB C 461 17.500 17.500 18.371 -0.871 19685 9103 1 17 . 1 1 461 461 ALA H H 461 7.880 7.880 7.472 0.408 19685 9104 1 17 . 1 1 462 462 ALA N N 462 121.400 121.400 118.712 2.688 19685 9105 1 17 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.779 -1.379 19685 9106 1 17 . 1 1 462 462 ALA C C 462 179.400 179.400 176.988 2.412 19685 9107 1 17 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.324 1.776 19685 9108 1 17 . 1 1 462 462 ALA CB C 462 18.700 18.700 19.922 -1.222 19685 9109 1 17 . 1 1 462 462 ALA H H 462 7.860 7.860 7.600 0.260 19685 9110 1 17 . 1 1 463 463 ILE N N 463 118.600 118.600 118.728 -0.128 19685 9111 1 17 . 1 1 463 463 ILE HA H 463 3.240 3.240 4.130 -0.890 19685 9112 1 17 . 1 1 463 463 ILE C C 463 177.500 177.500 177.181 0.319 19685 9113 1 17 . 1 1 463 463 ILE CA C 463 66.000 66.000 62.969 3.031 19685 9114 1 17 . 1 1 463 463 ILE CB C 463 38.300 38.300 39.425 -1.125 19685 9115 1 17 . 1 1 463 463 ILE H H 463 8.090 8.090 7.550 0.540 19685 9116 1 17 . 1 1 464 464 GLN N N 464 117.000 117.000 118.168 -1.168 19685 9117 1 17 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.180 -0.310 19685 9118 1 17 . 1 1 464 464 GLN C C 464 177.700 177.700 176.177 1.523 19685 9119 1 17 . 1 1 464 464 GLN CA C 464 58.200 58.200 56.834 1.366 19685 9120 1 17 . 1 1 464 464 GLN CB C 464 27.900 27.900 28.279 -0.379 19685 9121 1 17 . 1 1 464 464 GLN H H 464 7.780 7.780 7.812 -0.032 19685 9122 1 17 . 1 1 465 465 ALA N N 465 117.200 117.200 119.090 -1.890 19685 9123 1 17 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.485 -0.255 19685 9124 1 17 . 1 1 465 465 ALA C C 465 179.200 179.200 175.990 3.210 19685 9125 1 17 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.265 1.535 19685 9126 1 17 . 1 1 465 465 ALA CB C 465 21.100 21.100 19.591 1.509 19685 9127 1 17 . 1 1 465 465 ALA H H 465 7.540 7.540 7.847 -0.307 19685 9128 1 17 . 1 1 466 466 MET N N 466 110.800 110.800 117.649 -6.849 19685 9129 1 17 . 1 1 466 466 MET HA H 466 4.820 4.820 4.628 0.192 19685 9130 1 17 . 1 1 466 466 MET C C 466 177.600 177.600 176.176 1.424 19685 9131 1 17 . 1 1 466 466 MET CA C 466 53.300 53.300 56.002 -2.703 19685 9132 1 17 . 1 1 466 466 MET CB C 466 31.600 31.600 34.353 -2.753 19685 9133 1 17 . 1 1 466 466 MET H H 466 8.230 8.230 7.629 0.601 19685 9134 1 17 . 1 1 467 467 ASN N N 467 119.100 119.100 119.818 -0.718 19685 9135 1 17 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.651 -0.161 19685 9136 1 17 . 1 1 467 467 ASN C C 467 176.300 176.300 175.410 0.890 19685 9137 1 17 . 1 1 467 467 ASN CA C 467 56.200 56.200 53.813 2.387 19685 9138 1 17 . 1 1 467 467 ASN CB C 467 38.200 38.200 37.715 0.485 19685 9139 1 17 . 1 1 467 467 ASN H H 467 8.560 8.560 8.065 0.495 19685 9140 1 17 . 1 1 468 468 GLY N N 468 117.900 117.900 103.079 14.821 19685 9141 1 17 . 1 1 468 468 GLY C C 468 172.800 172.800 173.063 -0.263 19685 9142 1 17 . 1 1 468 468 GLY CA C 468 45.300 45.300 44.965 0.335 19685 9143 1 17 . 1 1 468 468 GLY H H 468 8.930 8.930 7.767 1.163 19685 9144 1 17 . 1 1 469 469 PHE N N 469 123.300 123.300 121.042 2.258 19685 9145 1 17 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.683 -0.493 19685 9146 1 17 . 1 1 469 469 PHE C C 469 174.400 174.400 174.587 -0.187 19685 9147 1 17 . 1 1 469 469 PHE CA C 469 58.700 58.700 57.871 0.829 19685 9148 1 17 . 1 1 469 469 PHE CB C 469 40.600 40.600 40.697 -0.097 19685 9149 1 17 . 1 1 469 469 PHE H H 469 7.950 7.950 7.617 0.333 19685 9150 1 17 . 1 1 470 470 GLN N N 470 129.200 129.200 119.503 9.697 19685 9151 1 17 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.108 0.482 19685 9152 1 17 . 1 1 470 470 GLN C C 470 174.100 174.100 174.017 0.083 19685 9153 1 17 . 1 1 470 470 GLN CA C 470 55.500 55.500 56.746 -1.246 19685 9154 1 17 . 1 1 470 470 GLN CB C 470 28.800 28.800 28.236 0.564 19685 9155 1 17 . 1 1 470 470 GLN H H 470 8.330 8.330 8.312 0.018 19685 9156 1 17 . 1 1 471 471 ILE N N 471 126.300 126.300 123.934 2.366 19685 9157 1 17 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.359 -0.189 19685 9158 1 17 . 1 1 471 471 ILE C C 471 175.400 175.400 175.194 0.206 19685 9159 1 17 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.230 -0.630 19685 9160 1 17 . 1 1 471 471 ILE CB C 471 39.100 39.100 40.810 -1.710 19685 9161 1 17 . 1 1 471 471 ILE H H 471 8.440 8.440 7.929 0.511 19685 9162 1 17 . 1 1 472 472 GLY N N 472 117.500 117.500 114.232 3.268 19685 9163 1 17 . 1 1 472 472 GLY C C 472 174.700 174.700 174.615 0.085 19685 9164 1 17 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.461 1.039 19685 9165 1 17 . 1 1 472 472 GLY H H 472 8.980 8.980 8.492 0.488 19685 9166 1 17 . 1 1 473 473 MET N N 473 124.100 124.100 118.978 5.122 19685 9167 1 17 . 1 1 473 473 MET HA H 473 4.380 4.380 4.501 -0.121 19685 9168 1 17 . 1 1 473 473 MET C C 473 175.700 175.700 176.099 -0.399 19685 9169 1 17 . 1 1 473 473 MET CA C 473 55.000 55.000 56.478 -1.478 19685 9170 1 17 . 1 1 473 473 MET CB C 473 32.900 32.900 32.102 0.798 19685 9171 1 17 . 1 1 473 473 MET H H 473 9.070 9.070 8.396 0.674 19685 9172 1 17 . 1 1 474 474 LYS N N 474 118.700 118.700 118.105 0.595 19685 9173 1 17 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.575 -0.095 19685 9174 1 17 . 1 1 474 474 LYS C C 474 174.300 174.300 174.542 -0.242 19685 9175 1 17 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.669 -0.069 19685 9176 1 17 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.360 -0.260 19685 9177 1 17 . 1 1 474 474 LYS H H 474 7.770 7.770 7.260 0.510 19685 9178 1 17 . 1 1 475 475 ARG N N 475 119.600 119.600 119.184 0.416 19685 9179 1 17 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.372 0.428 19685 9180 1 17 . 1 1 475 475 ARG C C 475 175.700 175.700 174.287 1.413 19685 9181 1 17 . 1 1 475 475 ARG CA C 475 54.000 54.000 55.362 -1.362 19685 9182 1 17 . 1 1 475 475 ARG CB C 475 31.300 31.300 30.712 0.588 19685 9183 1 17 . 1 1 475 475 ARG H H 475 8.350 8.350 8.426 -0.076 19685 9184 1 17 . 1 1 476 476 LEU N N 476 123.500 123.500 122.310 1.190 19685 9185 1 17 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.414 0.016 19685 9186 1 17 . 1 1 476 476 LEU C C 476 177.600 177.600 175.655 1.945 19685 9187 1 17 . 1 1 476 476 LEU CA C 476 55.500 55.500 54.148 1.352 19685 9188 1 17 . 1 1 476 476 LEU CB C 476 42.800 42.800 42.675 0.125 19685 9189 1 17 . 1 1 476 476 LEU H H 476 9.130 9.130 8.455 0.675 19685 9190 1 17 . 1 1 477 477 LYS N N 477 123.200 123.200 126.036 -2.836 19685 9191 1 17 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.577 0.583 19685 9192 1 17 . 1 1 477 477 LYS C C 477 174.100 174.100 174.039 0.061 19685 9193 1 17 . 1 1 477 477 LYS CA C 477 54.500 54.500 54.818 -0.318 19685 9194 1 17 . 1 1 477 477 LYS CB C 477 34.900 34.900 35.472 -0.572 19685 9195 1 17 . 1 1 477 477 LYS H H 477 8.090 8.090 8.422 -0.332 19685 9196 1 17 . 1 1 478 478 VAL N N 478 127.100 127.100 122.936 4.164 19685 9197 1 17 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.710 0.190 19685 9198 1 17 . 1 1 478 478 VAL C C 478 173.700 173.700 173.434 0.266 19685 9199 1 17 . 1 1 478 478 VAL CA C 478 61.000 61.000 60.184 0.817 19685 9200 1 17 . 1 1 478 478 VAL CB C 478 33.700 33.700 34.560 -0.860 19685 9201 1 17 . 1 1 478 478 VAL H H 478 8.820 8.820 8.520 0.300 19685 9202 1 17 . 1 1 479 479 GLN N N 479 123.600 123.600 121.371 2.229 19685 9203 1 17 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.676 0.134 19685 9204 1 17 . 1 1 479 479 GLN C C 479 173.600 173.600 173.884 -0.284 19685 9205 1 17 . 1 1 479 479 GLN CA C 479 53.200 53.200 53.794 -0.594 19685 9206 1 17 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.631 0.869 19685 9207 1 17 . 1 1 479 479 GLN H H 479 9.130 9.130 8.553 0.577 19685 9208 1 17 . 1 1 480 480 LEU N N 480 123.200 123.200 121.897 1.303 19685 9209 1 17 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.673 -0.233 19685 9210 1 17 . 1 1 480 480 LEU C C 480 177.100 177.100 176.305 0.795 19685 9211 1 17 . 1 1 480 480 LEU CA C 480 54.600 54.600 53.825 0.775 19685 9212 1 17 . 1 1 480 480 LEU CB C 480 42.400 42.400 43.876 -1.476 19685 9213 1 17 . 1 1 480 480 LEU H H 480 8.840 8.840 8.235 0.605 19685 9214 1 17 . 1 1 481 481 LYS N N 481 124.500 124.500 119.683 4.817 19685 9215 1 17 . 1 1 481 481 LYS HA H 481 4.310 4.310 3.998 0.312 19685 9216 1 17 . 1 1 481 481 LYS C C 481 175.200 175.200 176.662 -1.462 19685 9217 1 17 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.827 -1.127 19685 9218 1 17 . 1 1 481 481 LYS CB C 481 33.100 33.100 30.290 2.810 19685 9219 1 17 . 1 1 481 481 LYS H H 481 8.400 8.400 8.518 -0.118 19685 9220 1 17 . 1 1 482 482 ARG N N 482 126.600 126.600 117.225 9.375 19685 9221 1 17 . 1 1 482 482 ARG HA H 482 4.350 4.350 4.052 0.298 19685 9222 1 17 . 1 1 482 482 ARG C C 482 175.800 175.800 175.892 -0.092 19685 9223 1 17 . 1 1 482 482 ARG CA C 482 55.600 55.600 57.230 -1.631 19685 9224 1 17 . 1 1 482 482 ARG CB C 482 31.100 31.100 29.941 1.159 19685 9225 1 17 . 1 1 482 482 ARG H H 482 8.770 8.770 8.185 0.585 19685 9226 1 17 . 1 1 483 483 SER N N 483 118.100 118.100 112.372 5.728 19685 9227 1 17 . 1 1 483 483 SER HA H 483 4.400 4.400 4.646 -0.246 19685 9228 1 17 . 1 1 483 483 SER C C 483 174.200 174.200 172.369 1.831 19685 9229 1 17 . 1 1 483 483 SER CA C 483 58.000 58.000 57.661 0.339 19685 9230 1 17 . 1 1 483 483 SER CB C 483 63.500 63.500 65.877 -2.377 19685 9231 1 17 . 1 1 483 483 SER H H 483 8.610 8.610 7.695 0.915 19685 9232 1 17 . 1 1 484 484 LYS N N 484 123.000 123.000 120.036 2.964 19685 9233 1 17 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.443 -0.233 19685 9234 1 17 . 1 1 484 484 LYS C C 484 175.900 175.900 174.948 0.952 19685 9235 1 17 . 1 1 484 484 LYS CA C 484 56.300 56.300 56.276 0.024 19685 9236 1 17 . 1 1 484 484 LYS CB C 484 32.500 32.500 33.528 -1.028 19685 9237 1 17 . 1 1 484 484 LYS H H 484 8.560 8.560 8.526 0.034 19685 9238 1 17 . 1 1 485 485 ASN N N 485 119.600 119.600 118.509 1.091 19685 9239 1 17 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.925 -0.325 19685 9240 1 17 . 1 1 485 485 ASN C C 485 174.400 174.400 175.187 -0.787 19685 9241 1 17 . 1 1 485 485 ASN CA C 485 52.900 52.900 52.599 0.301 19685 9242 1 17 . 1 1 485 485 ASN CB C 485 38.400 38.400 40.281 -1.881 19685 9243 1 17 . 1 1 485 485 ASN H H 485 8.560 8.560 7.890 0.670 19685 9244 1 17 . 1 1 486 486 ASP N N 486 121.100 121.100 119.725 1.375 19685 9245 1 17 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.462 0.058 19685 9246 1 17 . 1 1 486 486 ASP C C 486 175.700 175.700 176.672 -0.972 19685 9247 1 17 . 1 1 486 486 ASP CA C 486 54.000 54.000 55.245 -1.245 19685 9248 1 17 . 1 1 486 486 ASP CB C 486 40.800 40.800 40.886 -0.086 19685 9249 1 17 . 1 1 486 486 ASP H H 486 8.250 8.250 8.701 -0.451 19685 9250 1 17 . 1 1 487 487 SER N N 487 115.400 115.400 113.170 2.230 19685 9251 1 17 . 1 1 487 487 SER HA H 487 4.310 4.310 4.044 0.266 19685 9252 1 17 . 1 1 487 487 SER C C 487 172.800 172.800 173.351 -0.551 19685 9253 1 17 . 1 1 487 487 SER CA C 487 57.700 57.700 59.843 -2.143 19685 9254 1 17 . 1 1 487 487 SER CB C 487 63.600 63.600 62.964 0.636 19685 9255 1 17 . 1 1 487 487 SER H H 487 8.090 8.090 8.347 -0.257 19685 9256 1 17 . 1 1 488 488 LYS N N 488 122.300 122.300 120.308 1.992 19685 9257 1 17 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.589 -0.539 19685 9258 1 17 . 1 1 488 488 LYS C C 488 174.500 174.500 173.257 1.243 19685 9259 1 17 . 1 1 488 488 LYS CA C 488 54.000 54.000 52.422 1.578 19685 9260 1 17 . 1 1 488 488 LYS CB C 488 32.400 32.400 35.272 -2.872 19685 9261 1 17 . 1 1 488 488 LYS H H 488 8.090 8.090 8.189 -0.099 19685 9262 1 17 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.130 0.150 19685 9263 1 17 . 1 1 489 489 PRO C C 489 175.000 175.000 175.251 -0.251 19685 9264 1 17 . 1 1 489 489 PRO CA C 489 63.200 63.200 62.775 0.425 19685 9265 1 17 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.111 -1.011 19685 9266 1 18 . 1 1 395 395 SER N N 395 115.500 115.500 113.635 1.865 19685 9267 1 18 . 1 1 395 395 SER HA H 395 4.300 4.300 4.671 -0.371 19685 9268 1 18 . 1 1 395 395 SER C C 395 173.900 173.900 173.685 0.215 19685 9269 1 18 . 1 1 395 395 SER CA C 395 57.900 57.900 57.442 0.458 19685 9270 1 18 . 1 1 395 395 SER CB C 395 63.400 63.400 65.085 -1.685 19685 9271 1 18 . 1 1 395 395 SER H H 395 8.200 8.200 8.187 0.013 19685 9272 1 18 . 1 1 396 396 HIS N N 396 123.500 123.500 117.374 6.126 19685 9273 1 18 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.770 -0.210 19685 9274 1 18 . 1 1 396 396 HIS C C 396 174.100 174.100 174.078 0.022 19685 9275 1 18 . 1 1 396 396 HIS CA C 396 53.700 53.700 56.214 -2.514 19685 9276 1 18 . 1 1 396 396 HIS CB C 396 32.200 32.200 29.919 2.281 19685 9277 1 18 . 1 1 396 396 HIS H H 396 8.120 8.120 8.480 -0.360 19685 9278 1 18 . 1 1 397 397 MET N N 397 121.200 121.200 118.583 2.617 19685 9279 1 18 . 1 1 397 397 MET HA H 397 4.320 4.320 4.562 -0.242 19685 9280 1 18 . 1 1 397 397 MET C C 397 175.400 175.400 175.479 -0.079 19685 9281 1 18 . 1 1 397 397 MET CA C 397 55.000 55.000 55.069 -0.069 19685 9282 1 18 . 1 1 397 397 MET CB C 397 32.500 32.500 34.818 -2.317 19685 9283 1 18 . 1 1 397 397 MET H H 397 8.300 8.300 7.437 0.863 19685 9284 1 18 . 1 1 398 398 GLN N N 398 122.100 122.100 116.773 5.327 19685 9285 1 18 . 1 1 398 398 GLN HA H 398 4.190 4.190 3.883 0.307 19685 9286 1 18 . 1 1 398 398 GLN C C 398 174.800 174.800 175.693 -0.893 19685 9287 1 18 . 1 1 398 398 GLN CA C 398 55.200 55.200 57.117 -1.917 19685 9288 1 18 . 1 1 398 398 GLN CB C 398 28.900 28.900 26.374 2.526 19685 9289 1 18 . 1 1 398 398 GLN H H 398 8.540 8.540 8.165 0.375 19685 9290 1 18 . 1 1 399 399 LYS N N 399 123.000 123.000 116.851 6.149 19685 9291 1 18 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.543 -0.323 19685 9292 1 18 . 1 1 399 399 LYS C C 399 174.800 174.800 175.061 -0.261 19685 9293 1 18 . 1 1 399 399 LYS CA C 399 55.600 55.600 56.027 -0.427 19685 9294 1 18 . 1 1 399 399 LYS CB C 399 33.000 33.000 34.598 -1.598 19685 9295 1 18 . 1 1 399 399 LYS H H 399 8.180 8.180 8.208 -0.028 19685 9296 1 18 . 1 1 400 400 GLU N N 400 122.000 122.000 118.487 3.513 19685 9297 1 18 . 1 1 400 400 GLU HA H 400 4.430 4.430 5.060 -0.630 19685 9298 1 18 . 1 1 400 400 GLU C C 400 176.400 176.400 176.378 0.022 19685 9299 1 18 . 1 1 400 400 GLU CA C 400 55.400 55.400 54.011 1.389 19685 9300 1 18 . 1 1 400 400 GLU CB C 400 31.400 31.400 32.959 -1.559 19685 9301 1 18 . 1 1 400 400 GLU H H 400 8.350 8.350 7.945 0.405 19685 9302 1 18 . 1 1 401 401 GLY N N 401 109.500 109.500 107.056 2.444 19685 9303 1 18 . 1 1 401 401 GLY C C 401 171.500 171.500 174.426 -2.926 19685 9304 1 18 . 1 1 401 401 GLY CA C 401 43.700 43.700 43.414 0.286 19685 9305 1 18 . 1 1 401 401 GLY H H 401 9.050 9.050 8.669 0.381 19685 9306 1 18 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.467 -0.047 19685 9307 1 18 . 1 1 402 402 PRO C C 402 173.900 173.900 176.208 -2.308 19685 9308 1 18 . 1 1 402 402 PRO CA C 402 61.900 61.900 64.048 -2.148 19685 9309 1 18 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.263 -0.063 19685 9310 1 18 . 1 1 403 403 GLU N N 403 119.600 119.600 117.607 1.993 19685 9311 1 18 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.504 -0.544 19685 9312 1 18 . 1 1 403 403 GLU C C 403 177.300 177.300 175.993 1.307 19685 9313 1 18 . 1 1 403 403 GLU CA C 403 58.100 58.100 56.513 1.587 19685 9314 1 18 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.393 -1.393 19685 9315 1 18 . 1 1 403 403 GLU H H 403 8.420 8.420 8.253 0.167 19685 9316 1 18 . 1 1 404 404 GLY N N 404 112.800 112.800 106.688 6.112 19685 9317 1 18 . 1 1 404 404 GLY C C 404 173.300 173.300 173.938 -0.638 19685 9318 1 18 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.268 -0.368 19685 9319 1 18 . 1 1 404 404 GLY H H 404 8.500 8.500 8.440 0.060 19685 9320 1 18 . 1 1 405 405 ALA N N 405 120.000 120.000 123.948 -3.948 19685 9321 1 18 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.260 0.290 19685 9322 1 18 . 1 1 405 405 ALA C C 405 174.100 174.100 175.818 -1.718 19685 9323 1 18 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.993 -1.493 19685 9324 1 18 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.134 3.666 19685 9325 1 18 . 1 1 405 405 ALA H H 405 8.360 8.360 8.388 -0.028 19685 9326 1 18 . 1 1 406 406 ASN N N 406 115.500 115.500 117.029 -1.529 19685 9327 1 18 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.030 0.160 19685 9328 1 18 . 1 1 406 406 ASN C C 406 172.900 172.900 174.499 -1.599 19685 9329 1 18 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.072 1.528 19685 9330 1 18 . 1 1 406 406 ASN CB C 406 40.900 40.900 38.592 2.308 19685 9331 1 18 . 1 1 406 406 ASN H H 406 7.690 7.690 8.077 -0.387 19685 9332 1 18 . 1 1 407 407 LEU N N 407 123.400 123.400 120.286 3.114 19685 9333 1 18 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.045 0.915 19685 9334 1 18 . 1 1 407 407 LEU C C 407 174.900 174.900 176.269 -1.369 19685 9335 1 18 . 1 1 407 407 LEU CA C 407 53.100 53.100 55.967 -2.867 19685 9336 1 18 . 1 1 407 407 LEU CB C 407 45.400 45.400 41.595 3.805 19685 9337 1 18 . 1 1 407 407 LEU H H 407 9.290 9.290 7.634 1.656 19685 9338 1 18 . 1 1 408 408 PHE N N 408 118.700 118.700 122.633 -3.933 19685 9339 1 18 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.820 0.480 19685 9340 1 18 . 1 1 408 408 PHE C C 408 174.200 174.200 175.537 -1.337 19685 9341 1 18 . 1 1 408 408 PHE CA C 408 56.300 56.300 57.193 -0.893 19685 9342 1 18 . 1 1 408 408 PHE CB C 408 42.700 42.700 37.849 4.851 19685 9343 1 18 . 1 1 408 408 PHE H H 408 9.150 9.150 8.570 0.580 19685 9344 1 18 . 1 1 409 409 ILE N N 409 120.800 120.800 120.121 0.679 19685 9345 1 18 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.046 0.924 19685 9346 1 18 . 1 1 409 409 ILE C C 409 173.900 173.900 175.577 -1.677 19685 9347 1 18 . 1 1 409 409 ILE CA C 409 59.000 59.000 62.075 -3.075 19685 9348 1 18 . 1 1 409 409 ILE CB C 409 40.400 40.400 37.856 2.544 19685 9349 1 18 . 1 1 409 409 ILE H H 409 8.380 8.380 7.463 0.917 19685 9350 1 18 . 1 1 410 410 TYR N N 410 123.200 123.200 123.342 -0.142 19685 9351 1 18 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.737 0.203 19685 9352 1 18 . 1 1 410 410 TYR C C 410 174.300 174.300 175.019 -0.719 19685 9353 1 18 . 1 1 410 410 TYR CA C 410 56.200 56.200 58.174 -1.974 19685 9354 1 18 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.297 1.503 19685 9355 1 18 . 1 1 410 410 TYR H H 410 9.440 9.440 8.758 0.682 19685 9356 1 18 . 1 1 411 411 HIS N N 411 112.100 112.100 119.194 -7.094 19685 9357 1 18 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.201 0.249 19685 9358 1 18 . 1 1 411 411 HIS C C 411 173.300 173.300 174.914 -1.614 19685 9359 1 18 . 1 1 411 411 HIS CA C 411 55.900 55.900 58.996 -3.096 19685 9360 1 18 . 1 1 411 411 HIS CB C 411 26.200 26.200 30.163 -3.963 19685 9361 1 18 . 1 1 411 411 HIS H H 411 8.580 8.580 8.167 0.413 19685 9362 1 18 . 1 1 412 412 LEU N N 412 115.100 115.100 115.460 -0.360 19685 9363 1 18 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.087 -0.127 19685 9364 1 18 . 1 1 412 412 LEU C C 412 175.100 175.100 174.703 0.397 19685 9365 1 18 . 1 1 412 412 LEU CA C 412 52.400 52.400 55.047 -2.647 19685 9366 1 18 . 1 1 412 412 LEU CB C 412 42.000 42.000 41.941 0.059 19685 9367 1 18 . 1 1 412 412 LEU H H 412 7.560 7.560 8.030 -0.470 19685 9368 1 18 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.465 -0.195 19685 9369 1 18 . 1 1 413 413 PRO C C 413 177.600 177.600 177.358 0.242 19685 9370 1 18 . 1 1 413 413 PRO CA C 413 62.300 62.300 62.628 -0.328 19685 9371 1 18 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.188 0.012 19685 9372 1 18 . 1 1 414 414 GLN N N 414 125.500 125.500 118.586 6.914 19685 9373 1 18 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.320 -0.240 19685 9374 1 18 . 1 1 414 414 GLN C C 414 175.400 175.400 175.965 -0.565 19685 9375 1 18 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.452 -0.452 19685 9376 1 18 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.740 -0.240 19685 9377 1 18 . 1 1 414 414 GLN H H 414 9.170 9.170 8.694 0.476 19685 9378 1 18 . 1 1 415 415 GLU N N 415 115.300 115.300 119.036 -3.736 19685 9379 1 18 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.664 -0.404 19685 9380 1 18 . 1 1 415 415 GLU C C 415 176.700 176.700 175.042 1.658 19685 9381 1 18 . 1 1 415 415 GLU CA C 415 58.700 58.700 55.942 2.758 19685 9382 1 18 . 1 1 415 415 GLU CB C 415 28.300 28.300 30.830 -2.530 19685 9383 1 18 . 1 1 415 415 GLU H H 415 9.390 9.390 8.652 0.738 19685 9384 1 18 . 1 1 416 416 PHE N N 416 121.700 121.700 117.842 3.858 19685 9385 1 18 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.203 -0.593 19685 9386 1 18 . 1 1 416 416 PHE C C 416 176.400 176.400 175.515 0.885 19685 9387 1 18 . 1 1 416 416 PHE CA C 416 57.400 57.400 56.768 0.632 19685 9388 1 18 . 1 1 416 416 PHE CB C 416 38.700 38.700 43.003 -4.303 19685 9389 1 18 . 1 1 416 416 PHE H H 416 7.610 7.610 7.793 -0.183 19685 9390 1 18 . 1 1 417 417 GLY N N 417 113.000 113.000 108.003 4.997 19685 9391 1 18 . 1 1 417 417 GLY C C 417 174.300 174.300 172.726 1.574 19685 9392 1 18 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.412 -3.512 19685 9393 1 18 . 1 1 417 417 GLY H H 417 9.740 9.740 9.657 0.083 19685 9394 1 18 . 1 1 418 418 ASP N N 418 121.500 121.500 116.951 4.549 19685 9395 1 18 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.845 -0.905 19685 9396 1 18 . 1 1 418 418 ASP C C 418 177.900 177.900 176.970 0.930 19685 9397 1 18 . 1 1 418 418 ASP CA C 418 57.600 57.600 54.974 2.626 19685 9398 1 18 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.358 -1.658 19685 9399 1 18 . 1 1 418 418 ASP H H 418 8.680 8.680 8.234 0.446 19685 9400 1 18 . 1 1 419 419 GLN N N 419 116.400 116.400 120.085 -3.685 19685 9401 1 18 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.244 -0.334 19685 9402 1 18 . 1 1 419 419 GLN C C 419 177.600 177.600 175.690 1.910 19685 9403 1 18 . 1 1 419 419 GLN CA C 419 58.000 58.000 58.146 -0.146 19685 9404 1 18 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.731 -1.331 19685 9405 1 18 . 1 1 419 419 GLN H H 419 8.780 8.780 8.513 0.267 19685 9406 1 18 . 1 1 420 420 ASP N N 420 117.500 117.500 115.766 1.734 19685 9407 1 18 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.700 -0.690 19685 9408 1 18 . 1 1 420 420 ASP C C 420 178.000 178.000 176.830 1.170 19685 9409 1 18 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.743 2.957 19685 9410 1 18 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.054 -0.255 19685 9411 1 18 . 1 1 420 420 ASP H H 420 7.210 7.210 8.086 -0.876 19685 9412 1 18 . 1 1 421 421 ILE N N 421 117.000 117.000 120.092 -3.092 19685 9413 1 18 . 1 1 421 421 ILE HA H 421 4.080 4.080 4.148 -0.068 19685 9414 1 18 . 1 1 421 421 ILE C C 421 176.500 176.500 177.485 -0.985 19685 9415 1 18 . 1 1 421 421 ILE CA C 421 64.000 64.000 62.203 1.798 19685 9416 1 18 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.348 -1.048 19685 9417 1 18 . 1 1 421 421 ILE H H 421 7.610 7.610 7.940 -0.330 19685 9418 1 18 . 1 1 422 422 LEU N N 422 123.200 123.200 121.073 2.127 19685 9419 1 18 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.141 -0.381 19685 9420 1 18 . 1 1 422 422 LEU C C 422 177.800 177.800 177.789 0.011 19685 9421 1 18 . 1 1 422 422 LEU CA C 422 58.600 58.600 58.374 0.225 19685 9422 1 18 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.640 -0.440 19685 9423 1 18 . 1 1 422 422 LEU H H 422 7.870 7.870 7.908 -0.038 19685 9424 1 18 . 1 1 423 423 GLN N N 423 115.600 115.600 117.921 -2.321 19685 9425 1 18 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.233 -0.353 19685 9426 1 18 . 1 1 423 423 GLN C C 423 177.800 177.800 176.361 1.439 19685 9427 1 18 . 1 1 423 423 GLN CA C 423 58.600 58.600 58.231 0.369 19685 9428 1 18 . 1 1 423 423 GLN CB C 423 27.900 27.900 28.690 -0.790 19685 9429 1 18 . 1 1 423 423 GLN H H 423 7.860 7.860 8.812 -0.952 19685 9430 1 18 . 1 1 424 424 MET N N 424 115.500 115.500 115.936 -0.436 19685 9431 1 18 . 1 1 424 424 MET HA H 424 3.910 3.910 4.556 -0.646 19685 9432 1 18 . 1 1 424 424 MET C C 424 175.500 175.500 175.958 -0.458 19685 9433 1 18 . 1 1 424 424 MET CA C 424 57.800 57.800 55.160 2.640 19685 9434 1 18 . 1 1 424 424 MET CB C 424 34.300 34.300 34.837 -0.537 19685 9435 1 18 . 1 1 424 424 MET H H 424 7.560 7.560 7.780 -0.220 19685 9436 1 18 . 1 1 425 425 PHE N N 425 112.300 112.300 116.094 -3.794 19685 9437 1 18 . 1 1 425 425 PHE HA H 425 4.700 4.700 5.029 -0.329 19685 9438 1 18 . 1 1 425 425 PHE C C 425 177.300 177.300 177.755 -0.455 19685 9439 1 18 . 1 1 425 425 PHE CA C 425 59.900 59.900 57.634 2.266 19685 9440 1 18 . 1 1 425 425 PHE CB C 425 38.500 38.500 41.715 -3.215 19685 9441 1 18 . 1 1 425 425 PHE H H 425 7.680 7.680 7.857 -0.177 19685 9442 1 18 . 1 1 426 426 MET N N 426 127.400 127.400 120.823 6.577 19685 9443 1 18 . 1 1 426 426 MET HA H 426 4.630 4.630 4.422 0.208 19685 9444 1 18 . 1 1 426 426 MET C C 426 173.800 173.800 175.279 -1.479 19685 9445 1 18 . 1 1 426 426 MET CA C 426 59.100 59.100 59.247 -0.147 19685 9446 1 18 . 1 1 426 426 MET CB C 426 31.800 31.800 30.395 1.405 19685 9447 1 18 . 1 1 426 426 MET H H 426 8.540 8.540 8.189 0.351 19685 9448 1 18 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.177 -0.167 19685 9449 1 18 . 1 1 427 427 PRO C C 427 176.800 176.800 175.909 0.891 19685 9450 1 18 . 1 1 427 427 PRO CA C 427 65.200 65.200 63.901 1.299 19685 9451 1 18 . 1 1 427 427 PRO CB C 427 30.600 30.600 31.054 -0.454 19685 9452 1 18 . 1 1 428 428 PHE N N 428 110.000 110.000 117.728 -7.728 19685 9453 1 18 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.722 -0.452 19685 9454 1 18 . 1 1 428 428 PHE C C 428 174.600 174.600 176.283 -1.683 19685 9455 1 18 . 1 1 428 428 PHE CA C 428 57.700 57.700 58.889 -1.189 19685 9456 1 18 . 1 1 428 428 PHE CB C 428 38.000 38.000 39.783 -1.783 19685 9457 1 18 . 1 1 428 428 PHE H H 428 6.560 6.560 7.344 -0.784 19685 9458 1 18 . 1 1 429 429 GLY N N 429 105.500 105.500 105.696 -0.196 19685 9459 1 18 . 1 1 429 429 GLY C C 429 170.100 170.100 172.595 -2.495 19685 9460 1 18 . 1 1 429 429 GLY CA C 429 44.400 44.400 43.561 0.839 19685 9461 1 18 . 1 1 429 429 GLY H H 429 7.650 7.650 6.857 0.793 19685 9462 1 18 . 1 1 430 430 ASN N N 430 117.400 117.400 118.068 -0.668 19685 9463 1 18 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.607 0.022 19685 9464 1 18 . 1 1 430 430 ASN C C 430 173.200 173.200 176.772 -3.572 19685 9465 1 18 . 1 1 430 430 ASN CA C 430 52.600 52.600 53.563 -0.963 19685 9466 1 18 . 1 1 430 430 ASN CB C 430 37.200 37.200 38.899 -1.699 19685 9467 1 18 . 1 1 430 430 ASN H H 430 9.020 9.020 8.466 0.554 19685 9468 1 18 . 1 1 431 431 VAL N N 431 128.000 128.000 114.778 13.222 19685 9469 1 18 . 1 1 431 431 VAL HA H 431 3.750 3.750 3.777 -0.027 19685 9470 1 18 . 1 1 431 431 VAL C C 431 176.400 176.400 175.798 0.602 19685 9471 1 18 . 1 1 431 431 VAL CA C 431 61.800 61.800 64.855 -3.055 19685 9472 1 18 . 1 1 431 431 VAL CB C 431 31.900 31.900 30.865 1.035 19685 9473 1 18 . 1 1 431 431 VAL H H 431 8.480 8.480 8.126 0.354 19685 9474 1 18 . 1 1 432 432 ILE N N 432 128.000 128.000 117.418 10.582 19685 9475 1 18 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.593 0.327 19685 9476 1 18 . 1 1 432 432 ILE C C 432 176.100 176.100 176.806 -0.706 19685 9477 1 18 . 1 1 432 432 ILE CA C 432 62.500 62.500 63.874 -1.374 19685 9478 1 18 . 1 1 432 432 ILE CB C 432 37.400 37.400 36.993 0.407 19685 9479 1 18 . 1 1 432 432 ILE H H 432 8.840 8.840 8.296 0.544 19685 9480 1 18 . 1 1 433 433 SER N N 433 113.600 113.600 114.730 -1.130 19685 9481 1 18 . 1 1 433 433 SER HA H 433 4.440 4.440 4.556 -0.116 19685 9482 1 18 . 1 1 433 433 SER C C 433 171.000 171.000 173.188 -2.188 19685 9483 1 18 . 1 1 433 433 SER CA C 433 57.300 57.300 57.032 0.268 19685 9484 1 18 . 1 1 433 433 SER CB C 433 65.200 65.200 64.391 0.809 19685 9485 1 18 . 1 1 433 433 SER H H 433 7.280 7.280 8.152 -0.872 19685 9486 1 18 . 1 1 434 434 ALA N N 434 125.700 125.700 124.595 1.105 19685 9487 1 18 . 1 1 434 434 ALA HA H 434 4.910 4.910 4.042 0.868 19685 9488 1 18 . 1 1 434 434 ALA C C 434 174.600 174.600 177.152 -2.552 19685 9489 1 18 . 1 1 434 434 ALA CA C 434 51.000 51.000 52.851 -1.851 19685 9490 1 18 . 1 1 434 434 ALA CB C 434 21.200 21.200 19.126 2.074 19685 9491 1 18 . 1 1 434 434 ALA H H 434 8.270 8.270 7.531 0.739 19685 9492 1 18 . 1 1 435 435 LYS N N 435 120.900 120.900 121.063 -0.163 19685 9493 1 18 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.585 -0.115 19685 9494 1 18 . 1 1 435 435 LYS C C 435 173.800 173.800 174.412 -0.612 19685 9495 1 18 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.217 -1.517 19685 9496 1 18 . 1 1 435 435 LYS CB C 435 36.400 36.400 35.171 1.229 19685 9497 1 18 . 1 1 435 435 LYS H H 435 8.490 8.490 7.664 0.826 19685 9498 1 18 . 1 1 436 436 VAL N N 436 122.200 122.200 117.523 4.677 19685 9499 1 18 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.162 -0.242 19685 9500 1 18 . 1 1 436 436 VAL C C 436 175.100 175.100 173.464 1.636 19685 9501 1 18 . 1 1 436 436 VAL CA C 436 63.600 63.600 61.987 1.613 19685 9502 1 18 . 1 1 436 436 VAL CB C 436 33.500 33.500 31.941 1.559 19685 9503 1 18 . 1 1 436 436 VAL H H 436 8.390 8.390 8.491 -0.101 19685 9504 1 18 . 1 1 437 437 PHE N N 437 125.900 125.900 115.751 10.149 19685 9505 1 18 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.999 -0.599 19685 9506 1 18 . 1 1 437 437 PHE C C 437 173.600 173.600 174.636 -1.036 19685 9507 1 18 . 1 1 437 437 PHE CA C 437 57.700 57.700 57.251 0.449 19685 9508 1 18 . 1 1 437 437 PHE CB C 437 39.000 39.000 41.768 -2.768 19685 9509 1 18 . 1 1 437 437 PHE H H 437 8.250 8.250 7.507 0.743 19685 9510 1 18 . 1 1 438 438 ILE N N 438 121.900 121.900 120.153 1.747 19685 9511 1 18 . 1 1 438 438 ILE HA H 438 4.460 4.460 4.234 0.226 19685 9512 1 18 . 1 1 438 438 ILE C C 438 175.700 175.700 175.109 0.591 19685 9513 1 18 . 1 1 438 438 ILE CA C 438 58.300 58.300 63.293 -4.993 19685 9514 1 18 . 1 1 438 438 ILE CB C 438 39.700 39.700 39.466 0.234 19685 9515 1 18 . 1 1 438 438 ILE H H 438 8.520 8.520 8.587 -0.067 19685 9516 1 18 . 1 1 439 439 ASP N N 439 126.500 126.500 120.978 5.522 19685 9517 1 18 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.708 -0.128 19685 9518 1 18 . 1 1 439 439 ASP C C 439 176.300 176.300 176.470 -0.170 19685 9519 1 18 . 1 1 439 439 ASP CA C 439 53.600 53.600 53.460 0.140 19685 9520 1 18 . 1 1 439 439 ASP CB C 439 42.300 42.300 40.879 1.421 19685 9521 1 18 . 1 1 439 439 ASP H H 439 8.730 8.730 8.667 0.063 19685 9522 1 18 . 1 1 440 440 LYS N N 440 127.300 127.300 117.437 9.863 19685 9523 1 18 . 1 1 440 440 LYS HA H 440 4.070 4.070 3.591 0.479 19685 9524 1 18 . 1 1 440 440 LYS C C 440 176.900 176.900 175.715 1.185 19685 9525 1 18 . 1 1 440 440 LYS CA C 440 57.800 57.800 58.006 -0.206 19685 9526 1 18 . 1 1 440 440 LYS CB C 440 32.100 32.100 30.740 1.360 19685 9527 1 18 . 1 1 440 440 LYS H H 440 8.930 8.930 8.617 0.313 19685 9528 1 18 . 1 1 441 441 GLN N N 441 117.400 117.400 115.645 1.755 19685 9529 1 18 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.414 -0.184 19685 9530 1 18 . 1 1 441 441 GLN C C 441 177.200 177.200 175.067 2.133 19685 9531 1 18 . 1 1 441 441 GLN CA C 441 57.600 57.600 55.882 1.718 19685 9532 1 18 . 1 1 441 441 GLN CB C 441 28.800 28.800 30.501 -1.701 19685 9533 1 18 . 1 1 441 441 GLN H H 441 8.650 8.650 7.891 0.759 19685 9534 1 18 . 1 1 442 442 THR N N 442 107.300 107.300 113.993 -6.693 19685 9535 1 18 . 1 1 442 442 THR HA H 442 4.290 4.290 4.415 -0.125 19685 9536 1 18 . 1 1 442 442 THR C C 442 175.100 175.100 174.301 0.799 19685 9537 1 18 . 1 1 442 442 THR CA C 442 61.200 61.200 62.641 -1.441 19685 9538 1 18 . 1 1 442 442 THR CB C 442 70.300 70.300 69.533 0.767 19685 9539 1 18 . 1 1 442 442 THR H H 442 7.830 7.830 7.867 -0.037 19685 9540 1 18 . 1 1 443 443 ASN N N 443 117.300 117.300 118.577 -1.277 19685 9541 1 18 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.488 -0.188 19685 9542 1 18 . 1 1 443 443 ASN C C 443 173.400 173.400 175.099 -1.699 19685 9543 1 18 . 1 1 443 443 ASN CA C 443 54.300 54.300 53.651 0.649 19685 9544 1 18 . 1 1 443 443 ASN CB C 443 37.600 37.600 37.616 -0.016 19685 9545 1 18 . 1 1 443 443 ASN H H 443 8.470 8.470 8.298 0.172 19685 9546 1 18 . 1 1 444 444 LEU N N 444 118.000 118.000 112.131 5.869 19685 9547 1 18 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.348 0.212 19685 9548 1 18 . 1 1 444 444 LEU C C 444 176.700 176.700 177.261 -0.561 19685 9549 1 18 . 1 1 444 444 LEU CA C 444 53.300 53.300 56.353 -3.053 19685 9550 1 18 . 1 1 444 444 LEU CB C 444 43.500 43.500 41.674 1.826 19685 9551 1 18 . 1 1 444 444 LEU H H 444 7.660 7.660 7.994 -0.334 19685 9552 1 18 . 1 1 445 445 SER N N 445 115.500 115.500 110.115 5.385 19685 9553 1 18 . 1 1 445 445 SER HA H 445 4.460 4.460 4.472 -0.012 19685 9554 1 18 . 1 1 445 445 SER C C 445 176.500 176.500 173.488 3.012 19685 9555 1 18 . 1 1 445 445 SER CA C 445 57.900 57.900 57.953 -0.053 19685 9556 1 18 . 1 1 445 445 SER CB C 445 63.500 63.500 64.777 -1.277 19685 9557 1 18 . 1 1 445 445 SER H H 445 8.840 8.840 8.208 0.632 19685 9558 1 18 . 1 1 446 446 LYS N N 446 125.200 125.200 118.753 6.447 19685 9559 1 18 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.504 -0.004 19685 9560 1 18 . 1 1 446 446 LYS C C 446 176.100 176.100 174.324 1.776 19685 9561 1 18 . 1 1 446 446 LYS CA C 446 56.300 56.300 55.817 0.483 19685 9562 1 18 . 1 1 446 446 LYS CB C 446 32.200 32.200 34.470 -2.270 19685 9563 1 18 . 1 1 446 446 LYS H H 446 9.230 9.230 7.537 1.693 19685 9564 1 18 . 1 1 447 447 CYS N N 447 113.000 113.000 118.783 -5.783 19685 9565 1 18 . 1 1 447 447 CYS C C 447 172.500 172.500 173.575 -1.075 19685 9566 1 18 . 1 1 447 447 CYS CA C 447 60.400 60.400 58.037 2.363 19685 9567 1 18 . 1 1 447 447 CYS CB C 447 24.900 24.900 28.407 -3.507 19685 9568 1 18 . 1 1 447 447 CYS H H 447 10.020 10.020 8.883 1.137 19685 9569 1 18 . 1 1 448 448 PHE N N 448 115.200 115.200 116.793 -1.593 19685 9570 1 18 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.676 0.664 19685 9571 1 18 . 1 1 448 448 PHE C C 448 172.400 172.400 174.337 -1.937 19685 9572 1 18 . 1 1 448 448 PHE CA C 448 54.700 54.700 55.714 -1.014 19685 9573 1 18 . 1 1 448 448 PHE CB C 448 42.000 42.000 39.668 2.332 19685 9574 1 18 . 1 1 448 448 PHE H H 448 7.810 7.810 6.922 0.888 19685 9575 1 18 . 1 1 449 449 GLY N N 449 107.700 107.700 107.554 0.146 19685 9576 1 18 . 1 1 449 449 GLY C C 449 170.100 170.100 172.358 -2.258 19685 9577 1 18 . 1 1 449 449 GLY CA C 449 45.200 45.200 44.060 1.140 19685 9578 1 18 . 1 1 449 449 GLY H H 449 9.310 9.310 8.309 1.001 19685 9579 1 18 . 1 1 450 450 PHE N N 450 119.900 119.900 113.119 6.781 19685 9580 1 18 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.389 0.041 19685 9581 1 18 . 1 1 450 450 PHE C C 450 172.800 172.800 172.597 0.203 19685 9582 1 18 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.757 -1.757 19685 9583 1 18 . 1 1 450 450 PHE CB C 450 43.600 43.600 41.379 2.221 19685 9584 1 18 . 1 1 450 450 PHE H H 450 8.760 8.760 8.527 0.233 19685 9585 1 18 . 1 1 451 451 VAL N N 451 123.800 123.800 119.395 4.405 19685 9586 1 18 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.146 0.144 19685 9587 1 18 . 1 1 451 451 VAL C C 451 172.400 172.400 174.081 -1.681 19685 9588 1 18 . 1 1 451 451 VAL CA C 451 59.800 59.800 60.764 -0.965 19685 9589 1 18 . 1 1 451 451 VAL CB C 451 36.100 36.100 34.662 1.438 19685 9590 1 18 . 1 1 451 451 VAL H H 451 7.930 7.930 7.985 -0.055 19685 9591 1 18 . 1 1 452 452 SER N N 452 119.600 119.600 124.637 -5.037 19685 9592 1 18 . 1 1 452 452 SER HA H 452 5.120 5.120 5.121 -0.001 19685 9593 1 18 . 1 1 452 452 SER C C 452 173.200 173.200 173.890 -0.690 19685 9594 1 18 . 1 1 452 452 SER CA C 452 55.700 55.700 58.634 -2.934 19685 9595 1 18 . 1 1 452 452 SER CB C 452 66.100 66.100 64.058 2.042 19685 9596 1 18 . 1 1 452 452 SER H H 452 8.540 8.540 8.452 0.088 19685 9597 1 18 . 1 1 453 453 TYR N N 453 121.400 121.400 125.630 -4.230 19685 9598 1 18 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.726 0.654 19685 9599 1 18 . 1 1 453 453 TYR C C 453 173.600 173.600 175.865 -2.265 19685 9600 1 18 . 1 1 453 453 TYR CA C 453 56.500 56.500 56.849 -0.349 19685 9601 1 18 . 1 1 453 453 TYR CB C 453 42.200 42.200 42.144 0.056 19685 9602 1 18 . 1 1 453 453 TYR H H 453 8.380 8.380 8.735 -0.355 19685 9603 1 18 . 1 1 454 454 ASP N N 454 113.300 113.300 121.838 -8.538 19685 9604 1 18 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.399 0.091 19685 9605 1 18 . 1 1 454 454 ASP C C 454 176.100 176.100 175.499 0.601 19685 9606 1 18 . 1 1 454 454 ASP CA C 454 52.800 52.800 56.001 -3.201 19685 9607 1 18 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.343 -0.943 19685 9608 1 18 . 1 1 454 454 ASP H H 454 7.860 7.860 8.673 -0.813 19685 9609 1 18 . 1 1 455 455 ASN N N 455 113.800 113.800 112.696 1.104 19685 9610 1 18 . 1 1 455 455 ASN HA H 455 5.050 5.050 4.951 0.099 19685 9611 1 18 . 1 1 455 455 ASN C C 455 173.100 173.100 173.375 -0.275 19685 9612 1 18 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.777 -1.077 19685 9613 1 18 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.013 1.087 19685 9614 1 18 . 1 1 455 455 ASN H H 455 7.200 7.200 7.738 -0.538 19685 9615 1 18 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.579 -0.409 19685 9616 1 18 . 1 1 456 456 PRO C C 456 177.300 177.300 177.794 -0.494 19685 9617 1 18 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.887 -0.687 19685 9618 1 18 . 1 1 456 456 PRO CB C 456 32.300 32.300 32.253 0.047 19685 9619 1 18 . 1 1 457 457 VAL N N 457 120.900 120.900 117.917 2.983 19685 9620 1 18 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.069 -0.449 19685 9621 1 18 . 1 1 457 457 VAL C C 457 179.000 179.000 176.834 2.166 19685 9622 1 18 . 1 1 457 457 VAL CA C 457 65.900 65.900 64.371 1.529 19685 9623 1 18 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.255 -0.455 19685 9624 1 18 . 1 1 457 457 VAL H H 457 8.120 8.120 8.245 -0.125 19685 9625 1 18 . 1 1 458 458 SER N N 458 117.800 117.800 116.213 1.587 19685 9626 1 18 . 1 1 458 458 SER HA H 458 3.940 3.940 4.456 -0.516 19685 9627 1 18 . 1 1 458 458 SER C C 458 173.600 173.600 175.007 -1.407 19685 9628 1 18 . 1 1 458 458 SER CA C 458 61.100 61.100 60.684 0.416 19685 9629 1 18 . 1 1 458 458 SER CB C 458 62.400 62.400 63.716 -1.316 19685 9630 1 18 . 1 1 458 458 SER H H 458 7.830 7.830 7.689 0.141 19685 9631 1 18 . 1 1 459 459 ALA N N 459 120.000 120.000 123.091 -3.091 19685 9632 1 18 . 1 1 459 459 ALA HA H 459 3.750 3.750 4.666 -0.916 19685 9633 1 18 . 1 1 459 459 ALA C C 459 178.100 178.100 178.503 -0.403 19685 9634 1 18 . 1 1 459 459 ALA CA C 459 54.500 54.500 53.873 0.626 19685 9635 1 18 . 1 1 459 459 ALA CB C 459 17.900 17.900 19.095 -1.195 19685 9636 1 18 . 1 1 459 459 ALA H H 459 6.370 6.370 7.626 -1.256 19685 9637 1 18 . 1 1 460 460 GLN N N 460 116.100 116.100 119.697 -3.597 19685 9638 1 18 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.029 -0.199 19685 9639 1 18 . 1 1 460 460 GLN C C 460 178.000 178.000 176.457 1.543 19685 9640 1 18 . 1 1 460 460 GLN CA C 460 58.500 58.500 58.596 -0.096 19685 9641 1 18 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.304 -0.904 19685 9642 1 18 . 1 1 460 460 GLN H H 460 7.710 7.710 7.905 -0.195 19685 9643 1 18 . 1 1 461 461 ALA N N 461 122.800 122.800 118.719 4.081 19685 9644 1 18 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.006 -0.046 19685 9645 1 18 . 1 1 461 461 ALA C C 461 179.500 179.500 176.679 2.821 19685 9646 1 18 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.584 1.915 19685 9647 1 18 . 1 1 461 461 ALA CB C 461 17.500 17.500 18.531 -1.031 19685 9648 1 18 . 1 1 461 461 ALA H H 461 7.880 7.880 7.849 0.031 19685 9649 1 18 . 1 1 462 462 ALA N N 462 121.400 121.400 119.825 1.575 19685 9650 1 18 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.793 -1.393 19685 9651 1 18 . 1 1 462 462 ALA C C 462 179.400 179.400 178.530 0.870 19685 9652 1 18 . 1 1 462 462 ALA CA C 462 54.100 54.100 53.585 0.515 19685 9653 1 18 . 1 1 462 462 ALA CB C 462 18.700 18.700 19.939 -1.239 19685 9654 1 18 . 1 1 462 462 ALA H H 462 7.860 7.860 7.406 0.454 19685 9655 1 18 . 1 1 463 463 ILE N N 463 118.600 118.600 117.016 1.584 19685 9656 1 18 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.898 -0.658 19685 9657 1 18 . 1 1 463 463 ILE C C 463 177.500 177.500 176.174 1.326 19685 9658 1 18 . 1 1 463 463 ILE CA C 463 66.000 66.000 63.400 2.600 19685 9659 1 18 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.110 0.190 19685 9660 1 18 . 1 1 463 463 ILE H H 463 8.090 8.090 7.808 0.282 19685 9661 1 18 . 1 1 464 464 GLN N N 464 117.000 117.000 115.590 1.410 19685 9662 1 18 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.518 -0.648 19685 9663 1 18 . 1 1 464 464 GLN C C 464 177.700 177.700 174.811 2.889 19685 9664 1 18 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.809 2.391 19685 9665 1 18 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.689 -1.789 19685 9666 1 18 . 1 1 464 464 GLN H H 464 7.780 7.780 7.874 -0.094 19685 9667 1 18 . 1 1 465 465 ALA N N 465 117.200 117.200 121.074 -3.874 19685 9668 1 18 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.496 -0.266 19685 9669 1 18 . 1 1 465 465 ALA C C 465 179.200 179.200 176.710 2.490 19685 9670 1 18 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.877 0.923 19685 9671 1 18 . 1 1 465 465 ALA CB C 465 21.100 21.100 21.030 0.070 19685 9672 1 18 . 1 1 465 465 ALA H H 465 7.540 7.540 7.628 -0.088 19685 9673 1 18 . 1 1 466 466 MET N N 466 110.800 110.800 117.652 -6.852 19685 9674 1 18 . 1 1 466 466 MET HA H 466 4.820 4.820 4.779 0.041 19685 9675 1 18 . 1 1 466 466 MET C C 466 177.600 177.600 175.958 1.642 19685 9676 1 18 . 1 1 466 466 MET CA C 466 53.300 53.300 55.897 -2.597 19685 9677 1 18 . 1 1 466 466 MET CB C 466 31.600 31.600 34.495 -2.895 19685 9678 1 18 . 1 1 466 466 MET H H 466 8.230 8.230 8.101 0.129 19685 9679 1 18 . 1 1 467 467 ASN N N 467 119.100 119.100 119.621 -0.521 19685 9680 1 18 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.766 -0.276 19685 9681 1 18 . 1 1 467 467 ASN C C 467 176.300 176.300 175.126 1.174 19685 9682 1 18 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.010 2.191 19685 9683 1 18 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.513 -0.313 19685 9684 1 18 . 1 1 467 467 ASN H H 467 8.560 8.560 8.122 0.438 19685 9685 1 18 . 1 1 468 468 GLY N N 468 117.900 117.900 108.296 9.604 19685 9686 1 18 . 1 1 468 468 GLY C C 468 172.800 172.800 173.010 -0.210 19685 9687 1 18 . 1 1 468 468 GLY CA C 468 45.300 45.300 44.969 0.331 19685 9688 1 18 . 1 1 468 468 GLY H H 468 8.930 8.930 8.005 0.925 19685 9689 1 18 . 1 1 469 469 PHE N N 469 123.300 123.300 121.433 1.867 19685 9690 1 18 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.769 -0.579 19685 9691 1 18 . 1 1 469 469 PHE C C 469 174.400 174.400 173.603 0.797 19685 9692 1 18 . 1 1 469 469 PHE CA C 469 58.700 58.700 55.618 3.082 19685 9693 1 18 . 1 1 469 469 PHE CB C 469 40.600 40.600 42.163 -1.563 19685 9694 1 18 . 1 1 469 469 PHE H H 469 7.950 7.950 7.447 0.503 19685 9695 1 18 . 1 1 470 470 GLN N N 470 129.200 129.200 126.108 3.092 19685 9696 1 18 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.232 0.358 19685 9697 1 18 . 1 1 470 470 GLN C C 470 174.100 174.100 174.035 0.065 19685 9698 1 18 . 1 1 470 470 GLN CA C 470 55.500 55.500 54.763 0.737 19685 9699 1 18 . 1 1 470 470 GLN CB C 470 28.800 28.800 29.469 -0.669 19685 9700 1 18 . 1 1 470 470 GLN H H 470 8.330 8.330 8.143 0.187 19685 9701 1 18 . 1 1 471 471 ILE N N 471 126.300 126.300 125.177 1.123 19685 9702 1 18 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.334 -0.164 19685 9703 1 18 . 1 1 471 471 ILE C C 471 175.400 175.400 174.779 0.621 19685 9704 1 18 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.630 -1.030 19685 9705 1 18 . 1 1 471 471 ILE CB C 471 39.100 39.100 40.688 -1.588 19685 9706 1 18 . 1 1 471 471 ILE H H 471 8.440 8.440 8.269 0.171 19685 9707 1 18 . 1 1 472 472 GLY N N 472 117.500 117.500 115.248 2.252 19685 9708 1 18 . 1 1 472 472 GLY C C 472 174.700 174.700 174.667 0.033 19685 9709 1 18 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.638 0.862 19685 9710 1 18 . 1 1 472 472 GLY H H 472 8.980 8.980 8.423 0.557 19685 9711 1 18 . 1 1 473 473 MET N N 473 124.100 124.100 120.233 3.867 19685 9712 1 18 . 1 1 473 473 MET HA H 473 4.380 4.380 4.608 -0.228 19685 9713 1 18 . 1 1 473 473 MET C C 473 175.700 175.700 175.372 0.328 19685 9714 1 18 . 1 1 473 473 MET CA C 473 55.000 55.000 56.070 -1.070 19685 9715 1 18 . 1 1 473 473 MET CB C 473 32.900 32.900 32.726 0.174 19685 9716 1 18 . 1 1 473 473 MET H H 473 9.070 9.070 8.541 0.529 19685 9717 1 18 . 1 1 474 474 LYS N N 474 118.700 118.700 118.241 0.459 19685 9718 1 18 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.536 -0.056 19685 9719 1 18 . 1 1 474 474 LYS C C 474 174.300 174.300 174.317 -0.017 19685 9720 1 18 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.928 -0.328 19685 9721 1 18 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.088 0.012 19685 9722 1 18 . 1 1 474 474 LYS H H 474 7.770 7.770 7.360 0.410 19685 9723 1 18 . 1 1 475 475 ARG N N 475 119.600 119.600 119.259 0.341 19685 9724 1 18 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.695 0.105 19685 9725 1 18 . 1 1 475 475 ARG C C 475 175.700 175.700 174.313 1.387 19685 9726 1 18 . 1 1 475 475 ARG CA C 475 54.000 54.000 54.400 -0.400 19685 9727 1 18 . 1 1 475 475 ARG CB C 475 31.300 31.300 32.453 -1.153 19685 9728 1 18 . 1 1 475 475 ARG H H 475 8.350 8.350 8.153 0.197 19685 9729 1 18 . 1 1 476 476 LEU N N 476 123.500 123.500 121.529 1.971 19685 9730 1 18 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.480 -0.050 19685 9731 1 18 . 1 1 476 476 LEU C C 476 177.600 177.600 175.815 1.785 19685 9732 1 18 . 1 1 476 476 LEU CA C 476 55.500 55.500 53.601 1.899 19685 9733 1 18 . 1 1 476 476 LEU CB C 476 42.800 42.800 43.395 -0.595 19685 9734 1 18 . 1 1 476 476 LEU H H 476 9.130 9.130 8.794 0.336 19685 9735 1 18 . 1 1 477 477 LYS N N 477 123.200 123.200 120.120 3.080 19685 9736 1 18 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.556 0.604 19685 9737 1 18 . 1 1 477 477 LYS C C 477 174.100 174.100 174.241 -0.141 19685 9738 1 18 . 1 1 477 477 LYS CA C 477 54.500 54.500 55.496 -0.996 19685 9739 1 18 . 1 1 477 477 LYS CB C 477 34.900 34.900 35.385 -0.485 19685 9740 1 18 . 1 1 477 477 LYS H H 477 8.090 8.090 8.310 -0.220 19685 9741 1 18 . 1 1 478 478 VAL N N 478 127.100 127.100 121.459 5.641 19685 9742 1 18 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.368 0.532 19685 9743 1 18 . 1 1 478 478 VAL C C 478 173.700 173.700 174.152 -0.452 19685 9744 1 18 . 1 1 478 478 VAL CA C 478 61.000 61.000 60.401 0.599 19685 9745 1 18 . 1 1 478 478 VAL CB C 478 33.700 33.700 35.007 -1.307 19685 9746 1 18 . 1 1 478 478 VAL H H 478 8.820 8.820 8.428 0.392 19685 9747 1 18 . 1 1 479 479 GLN N N 479 123.600 123.600 121.573 2.027 19685 9748 1 18 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.773 0.037 19685 9749 1 18 . 1 1 479 479 GLN C C 479 173.600 173.600 173.914 -0.314 19685 9750 1 18 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.636 -1.436 19685 9751 1 18 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.123 1.377 19685 9752 1 18 . 1 1 479 479 GLN H H 479 9.130 9.130 8.422 0.708 19685 9753 1 18 . 1 1 480 480 LEU N N 480 123.200 123.200 122.245 0.955 19685 9754 1 18 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.469 -0.029 19685 9755 1 18 . 1 1 480 480 LEU C C 480 177.100 177.100 177.091 0.009 19685 9756 1 18 . 1 1 480 480 LEU CA C 480 54.600 54.600 54.497 0.103 19685 9757 1 18 . 1 1 480 480 LEU CB C 480 42.400 42.400 42.817 -0.417 19685 9758 1 18 . 1 1 480 480 LEU H H 480 8.840 8.840 8.373 0.467 19685 9759 1 18 . 1 1 481 481 LYS N N 481 124.500 124.500 126.038 -1.538 19685 9760 1 18 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.393 -0.083 19685 9761 1 18 . 1 1 481 481 LYS C C 481 175.200 175.200 175.398 -0.198 19685 9762 1 18 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.794 -1.094 19685 9763 1 18 . 1 1 481 481 LYS CB C 481 33.100 33.100 30.936 2.164 19685 9764 1 18 . 1 1 481 481 LYS H H 481 8.400 8.400 9.112 -0.712 19685 9765 1 18 . 1 1 482 482 ARG N N 482 126.600 126.600 117.111 9.489 19685 9766 1 18 . 1 1 482 482 ARG HA H 482 4.350 4.350 4.435 -0.085 19685 9767 1 18 . 1 1 482 482 ARG C C 482 175.800 175.800 175.882 -0.082 19685 9768 1 18 . 1 1 482 482 ARG CA C 482 55.600 55.600 56.047 -0.447 19685 9769 1 18 . 1 1 482 482 ARG CB C 482 31.100 31.100 30.594 0.506 19685 9770 1 18 . 1 1 482 482 ARG H H 482 8.770 8.770 8.107 0.663 19685 9771 1 18 . 1 1 483 483 SER N N 483 118.100 118.100 113.186 4.914 19685 9772 1 18 . 1 1 483 483 SER HA H 483 4.400 4.400 4.067 0.333 19685 9773 1 18 . 1 1 483 483 SER C C 483 174.200 174.200 173.343 0.857 19685 9774 1 18 . 1 1 483 483 SER CA C 483 58.000 58.000 57.389 0.611 19685 9775 1 18 . 1 1 483 483 SER CB C 483 63.500 63.500 62.630 0.869 19685 9776 1 18 . 1 1 483 483 SER H H 483 8.610 8.610 7.261 1.349 19685 9777 1 18 . 1 1 484 484 LYS N N 484 123.000 123.000 121.972 1.028 19685 9778 1 18 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.330 -0.120 19685 9779 1 18 . 1 1 484 484 LYS C C 484 175.900 175.900 175.906 -0.006 19685 9780 1 18 . 1 1 484 484 LYS CA C 484 56.300 56.300 56.596 -0.296 19685 9781 1 18 . 1 1 484 484 LYS CB C 484 32.500 32.500 32.855 -0.355 19685 9782 1 18 . 1 1 484 484 LYS H H 484 8.560 8.560 7.845 0.715 19685 9783 1 18 . 1 1 485 485 ASN N N 485 119.600 119.600 122.275 -2.675 19685 9784 1 18 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.663 -0.063 19685 9785 1 18 . 1 1 485 485 ASN C C 485 174.400 174.400 174.281 0.119 19685 9786 1 18 . 1 1 485 485 ASN CA C 485 52.900 52.900 52.866 0.034 19685 9787 1 18 . 1 1 485 485 ASN CB C 485 38.400 38.400 39.553 -1.153 19685 9788 1 18 . 1 1 485 485 ASN H H 485 8.560 8.560 8.379 0.181 19685 9789 1 18 . 1 1 486 486 ASP N N 486 121.100 121.100 119.366 1.734 19685 9790 1 18 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.605 -0.085 19685 9791 1 18 . 1 1 486 486 ASP C C 486 175.700 175.700 174.911 0.789 19685 9792 1 18 . 1 1 486 486 ASP CA C 486 54.000 54.000 53.907 0.093 19685 9793 1 18 . 1 1 486 486 ASP CB C 486 40.800 40.800 42.292 -1.492 19685 9794 1 18 . 1 1 486 486 ASP H H 486 8.250 8.250 7.885 0.365 19685 9795 1 18 . 1 1 487 487 SER N N 487 115.400 115.400 116.549 -1.149 19685 9796 1 18 . 1 1 487 487 SER HA H 487 4.310 4.310 4.219 0.091 19685 9797 1 18 . 1 1 487 487 SER C C 487 172.800 172.800 173.344 -0.544 19685 9798 1 18 . 1 1 487 487 SER CA C 487 57.700 57.700 59.256 -1.556 19685 9799 1 18 . 1 1 487 487 SER CB C 487 63.600 63.600 62.800 0.800 19685 9800 1 18 . 1 1 487 487 SER H H 487 8.090 8.090 8.375 -0.285 19685 9801 1 18 . 1 1 488 488 LYS N N 488 122.300 122.300 117.156 5.144 19685 9802 1 18 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.080 -0.030 19685 9803 1 18 . 1 1 488 488 LYS C C 488 174.500 174.500 174.515 -0.015 19685 9804 1 18 . 1 1 488 488 LYS CA C 488 54.000 54.000 56.444 -2.443 19685 9805 1 18 . 1 1 488 488 LYS CB C 488 32.400 32.400 31.566 0.834 19685 9806 1 18 . 1 1 488 488 LYS H H 488 8.090 8.090 7.825 0.265 19685 9807 1 18 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.275 0.005 19685 9808 1 18 . 1 1 489 489 PRO C C 489 175.000 175.000 175.911 -0.911 19685 9809 1 18 . 1 1 489 489 PRO CA C 489 63.200 63.200 62.861 0.339 19685 9810 1 18 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.298 -1.198 19685 9811 1 19 . 1 1 395 395 SER N N 395 115.500 115.500 115.916 -0.416 19685 9812 1 19 . 1 1 395 395 SER HA H 395 4.300 4.300 5.251 -0.951 19685 9813 1 19 . 1 1 395 395 SER C C 395 173.900 173.900 173.349 0.551 19685 9814 1 19 . 1 1 395 395 SER CA C 395 57.900 57.900 57.452 0.448 19685 9815 1 19 . 1 1 395 395 SER CB C 395 63.400 63.400 65.021 -1.621 19685 9816 1 19 . 1 1 395 395 SER H H 395 8.200 8.200 9.192 -0.992 19685 9817 1 19 . 1 1 396 396 HIS N N 396 123.500 123.500 117.993 5.507 19685 9818 1 19 . 1 1 396 396 HIS HA H 396 4.560 4.560 5.008 -0.448 19685 9819 1 19 . 1 1 396 396 HIS C C 396 174.100 174.100 173.353 0.747 19685 9820 1 19 . 1 1 396 396 HIS CA C 396 53.700 53.700 55.964 -2.264 19685 9821 1 19 . 1 1 396 396 HIS CB C 396 32.200 32.200 30.525 1.675 19685 9822 1 19 . 1 1 396 396 HIS H H 396 8.120 8.120 8.262 -0.142 19685 9823 1 19 . 1 1 397 397 MET N N 397 121.200 121.200 120.040 1.160 19685 9824 1 19 . 1 1 397 397 MET HA H 397 4.320 4.320 4.645 -0.325 19685 9825 1 19 . 1 1 397 397 MET C C 397 175.400 175.400 174.266 1.134 19685 9826 1 19 . 1 1 397 397 MET CA C 397 55.000 55.000 54.959 0.041 19685 9827 1 19 . 1 1 397 397 MET CB C 397 32.500 32.500 34.693 -2.193 19685 9828 1 19 . 1 1 397 397 MET H H 397 8.300 8.300 8.424 -0.124 19685 9829 1 19 . 1 1 398 398 GLN N N 398 122.100 122.100 121.190 0.910 19685 9830 1 19 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.511 -0.321 19685 9831 1 19 . 1 1 398 398 GLN C C 398 174.800 174.800 174.427 0.373 19685 9832 1 19 . 1 1 398 398 GLN CA C 398 55.200 55.200 55.730 -0.530 19685 9833 1 19 . 1 1 398 398 GLN CB C 398 28.900 28.900 31.312 -2.412 19685 9834 1 19 . 1 1 398 398 GLN H H 398 8.540 8.540 8.480 0.060 19685 9835 1 19 . 1 1 399 399 LYS N N 399 123.000 123.000 121.742 1.258 19685 9836 1 19 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.702 -0.482 19685 9837 1 19 . 1 1 399 399 LYS C C 399 174.800 174.800 176.325 -1.525 19685 9838 1 19 . 1 1 399 399 LYS CA C 399 55.600 55.600 56.074 -0.474 19685 9839 1 19 . 1 1 399 399 LYS CB C 399 33.000 33.000 34.586 -1.586 19685 9840 1 19 . 1 1 399 399 LYS H H 399 8.180 8.180 8.764 -0.584 19685 9841 1 19 . 1 1 400 400 GLU N N 400 122.000 122.000 116.997 5.003 19685 9842 1 19 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.252 0.178 19685 9843 1 19 . 1 1 400 400 GLU C C 400 176.400 176.400 175.291 1.109 19685 9844 1 19 . 1 1 400 400 GLU CA C 400 55.400 55.400 57.518 -2.118 19685 9845 1 19 . 1 1 400 400 GLU CB C 400 31.400 31.400 28.771 2.629 19685 9846 1 19 . 1 1 400 400 GLU H H 400 8.350 8.350 8.054 0.296 19685 9847 1 19 . 1 1 401 401 GLY N N 401 109.500 109.500 105.176 4.324 19685 9848 1 19 . 1 1 401 401 GLY C C 401 171.500 171.500 172.343 -0.843 19685 9849 1 19 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.441 -0.741 19685 9850 1 19 . 1 1 401 401 GLY H H 401 9.050 9.050 7.978 1.072 19685 9851 1 19 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.497 -0.077 19685 9852 1 19 . 1 1 402 402 PRO C C 402 173.900 173.900 175.962 -2.062 19685 9853 1 19 . 1 1 402 402 PRO CA C 402 61.900 61.900 63.994 -2.094 19685 9854 1 19 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.783 -0.583 19685 9855 1 19 . 1 1 403 403 GLU N N 403 119.600 119.600 117.307 2.293 19685 9856 1 19 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.406 -0.446 19685 9857 1 19 . 1 1 403 403 GLU C C 403 177.300 177.300 176.908 0.392 19685 9858 1 19 . 1 1 403 403 GLU CA C 403 58.100 58.100 56.508 1.592 19685 9859 1 19 . 1 1 403 403 GLU CB C 403 29.000 29.000 31.696 -2.696 19685 9860 1 19 . 1 1 403 403 GLU H H 403 8.420 8.420 7.849 0.571 19685 9861 1 19 . 1 1 404 404 GLY N N 404 112.800 112.800 114.773 -1.973 19685 9862 1 19 . 1 1 404 404 GLY C C 404 173.300 173.300 174.326 -1.026 19685 9863 1 19 . 1 1 404 404 GLY CA C 404 44.900 44.900 46.436 -1.536 19685 9864 1 19 . 1 1 404 404 GLY H H 404 8.500 8.500 8.731 -0.231 19685 9865 1 19 . 1 1 405 405 ALA N N 405 120.000 120.000 125.202 -5.202 19685 9866 1 19 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.305 0.245 19685 9867 1 19 . 1 1 405 405 ALA C C 405 174.100 174.100 175.313 -1.213 19685 9868 1 19 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.892 -1.393 19685 9869 1 19 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.843 2.957 19685 9870 1 19 . 1 1 405 405 ALA H H 405 8.360 8.360 7.869 0.491 19685 9871 1 19 . 1 1 406 406 ASN N N 406 115.500 115.500 116.533 -1.033 19685 9872 1 19 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.329 -0.139 19685 9873 1 19 . 1 1 406 406 ASN C C 406 172.900 172.900 174.582 -1.682 19685 9874 1 19 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.498 1.102 19685 9875 1 19 . 1 1 406 406 ASN CB C 406 40.900 40.900 38.720 2.180 19685 9876 1 19 . 1 1 406 406 ASN H H 406 7.690 7.690 7.986 -0.296 19685 9877 1 19 . 1 1 407 407 LEU N N 407 123.400 123.400 120.310 3.090 19685 9878 1 19 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.005 0.955 19685 9879 1 19 . 1 1 407 407 LEU C C 407 174.900 174.900 176.695 -1.795 19685 9880 1 19 . 1 1 407 407 LEU CA C 407 53.100 53.100 56.519 -3.418 19685 9881 1 19 . 1 1 407 407 LEU CB C 407 45.400 45.400 41.644 3.756 19685 9882 1 19 . 1 1 407 407 LEU H H 407 9.290 9.290 7.639 1.651 19685 9883 1 19 . 1 1 408 408 PHE N N 408 118.700 118.700 121.511 -2.811 19685 9884 1 19 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.905 0.395 19685 9885 1 19 . 1 1 408 408 PHE C C 408 174.200 174.200 175.958 -1.758 19685 9886 1 19 . 1 1 408 408 PHE CA C 408 56.300 56.300 57.011 -0.711 19685 9887 1 19 . 1 1 408 408 PHE CB C 408 42.700 42.700 38.161 4.539 19685 9888 1 19 . 1 1 408 408 PHE H H 408 9.150 9.150 8.106 1.044 19685 9889 1 19 . 1 1 409 409 ILE N N 409 120.800 120.800 121.885 -1.085 19685 9890 1 19 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.549 0.421 19685 9891 1 19 . 1 1 409 409 ILE C C 409 173.900 173.900 175.659 -1.759 19685 9892 1 19 . 1 1 409 409 ILE CA C 409 59.000 59.000 61.639 -2.639 19685 9893 1 19 . 1 1 409 409 ILE CB C 409 40.400 40.400 38.441 1.958 19685 9894 1 19 . 1 1 409 409 ILE H H 409 8.380 8.380 7.596 0.784 19685 9895 1 19 . 1 1 410 410 TYR N N 410 123.200 123.200 123.050 0.150 19685 9896 1 19 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.857 0.083 19685 9897 1 19 . 1 1 410 410 TYR C C 410 174.300 174.300 174.914 -0.614 19685 9898 1 19 . 1 1 410 410 TYR CA C 410 56.200 56.200 57.563 -1.363 19685 9899 1 19 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.023 1.777 19685 9900 1 19 . 1 1 410 410 TYR H H 410 9.440 9.440 8.113 1.327 19685 9901 1 19 . 1 1 411 411 HIS N N 411 112.100 112.100 120.149 -8.049 19685 9902 1 19 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.233 0.217 19685 9903 1 19 . 1 1 411 411 HIS C C 411 173.300 173.300 175.561 -2.261 19685 9904 1 19 . 1 1 411 411 HIS CA C 411 55.900 55.900 55.663 0.237 19685 9905 1 19 . 1 1 411 411 HIS CB C 411 26.200 26.200 28.654 -2.454 19685 9906 1 19 . 1 1 411 411 HIS H H 411 8.580 8.580 7.988 0.592 19685 9907 1 19 . 1 1 412 412 LEU N N 412 115.100 115.100 121.082 -5.982 19685 9908 1 19 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.104 -0.144 19685 9909 1 19 . 1 1 412 412 LEU C C 412 175.100 175.100 174.965 0.135 19685 9910 1 19 . 1 1 412 412 LEU CA C 412 52.400 52.400 54.474 -2.074 19685 9911 1 19 . 1 1 412 412 LEU CB C 412 42.000 42.000 42.545 -0.545 19685 9912 1 19 . 1 1 412 412 LEU H H 412 7.560 7.560 7.972 -0.412 19685 9913 1 19 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.250 0.020 19685 9914 1 19 . 1 1 413 413 PRO C C 413 177.600 177.600 177.259 0.341 19685 9915 1 19 . 1 1 413 413 PRO CA C 413 62.300 62.300 63.417 -1.117 19685 9916 1 19 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.060 0.140 19685 9917 1 19 . 1 1 414 414 GLN N N 414 125.500 125.500 120.023 5.477 19685 9918 1 19 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.127 -0.047 19685 9919 1 19 . 1 1 414 414 GLN C C 414 175.400 175.400 175.893 -0.493 19685 9920 1 19 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.553 -0.553 19685 9921 1 19 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.437 0.063 19685 9922 1 19 . 1 1 414 414 GLN H H 414 9.170 9.170 8.588 0.582 19685 9923 1 19 . 1 1 415 415 GLU N N 415 115.300 115.300 118.118 -2.818 19685 9924 1 19 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.529 -0.269 19685 9925 1 19 . 1 1 415 415 GLU C C 415 176.700 176.700 175.183 1.517 19685 9926 1 19 . 1 1 415 415 GLU CA C 415 58.700 58.700 55.751 2.949 19685 9927 1 19 . 1 1 415 415 GLU CB C 415 28.300 28.300 30.785 -2.485 19685 9928 1 19 . 1 1 415 415 GLU H H 415 9.390 9.390 8.151 1.239 19685 9929 1 19 . 1 1 416 416 PHE N N 416 121.700 121.700 118.030 3.670 19685 9930 1 19 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.411 -0.801 19685 9931 1 19 . 1 1 416 416 PHE C C 416 176.400 176.400 176.257 0.143 19685 9932 1 19 . 1 1 416 416 PHE CA C 416 57.400 57.400 55.253 2.147 19685 9933 1 19 . 1 1 416 416 PHE CB C 416 38.700 38.700 41.969 -3.269 19685 9934 1 19 . 1 1 416 416 PHE H H 416 7.610 7.610 7.605 0.005 19685 9935 1 19 . 1 1 417 417 GLY N N 417 113.000 113.000 107.328 5.672 19685 9936 1 19 . 1 1 417 417 GLY C C 417 174.300 174.300 172.640 1.660 19685 9937 1 19 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.282 -3.382 19685 9938 1 19 . 1 1 417 417 GLY H H 417 9.740 9.740 9.323 0.417 19685 9939 1 19 . 1 1 418 418 ASP N N 418 121.500 121.500 117.293 4.207 19685 9940 1 19 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.670 -0.730 19685 9941 1 19 . 1 1 418 418 ASP C C 418 177.900 177.900 176.636 1.264 19685 9942 1 19 . 1 1 418 418 ASP CA C 418 57.600 57.600 54.916 2.684 19685 9943 1 19 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.049 -1.349 19685 9944 1 19 . 1 1 418 418 ASP H H 418 8.680 8.680 8.185 0.495 19685 9945 1 19 . 1 1 419 419 GLN N N 419 116.400 116.400 120.782 -4.382 19685 9946 1 19 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.197 -0.287 19685 9947 1 19 . 1 1 419 419 GLN C C 419 177.600 177.600 175.767 1.833 19685 9948 1 19 . 1 1 419 419 GLN CA C 419 58.000 58.000 58.351 -0.351 19685 9949 1 19 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.550 -1.150 19685 9950 1 19 . 1 1 419 419 GLN H H 419 8.780 8.780 8.606 0.174 19685 9951 1 19 . 1 1 420 420 ASP N N 420 117.500 117.500 116.237 1.263 19685 9952 1 19 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.568 -0.558 19685 9953 1 19 . 1 1 420 420 ASP C C 420 178.000 178.000 177.600 0.400 19685 9954 1 19 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.752 2.948 19685 9955 1 19 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.274 -0.474 19685 9956 1 19 . 1 1 420 420 ASP H H 420 7.210 7.210 8.337 -1.127 19685 9957 1 19 . 1 1 421 421 ILE N N 421 117.000 117.000 120.903 -3.903 19685 9958 1 19 . 1 1 421 421 ILE HA H 421 4.080 4.080 3.944 0.136 19685 9959 1 19 . 1 1 421 421 ILE C C 421 176.500 176.500 175.865 0.635 19685 9960 1 19 . 1 1 421 421 ILE CA C 421 64.000 64.000 63.538 0.462 19685 9961 1 19 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.024 -0.724 19685 9962 1 19 . 1 1 421 421 ILE H H 421 7.610 7.610 7.745 -0.135 19685 9963 1 19 . 1 1 422 422 LEU N N 422 123.200 123.200 117.108 6.092 19685 9964 1 19 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.150 -0.390 19685 9965 1 19 . 1 1 422 422 LEU C C 422 177.800 177.800 176.703 1.097 19685 9966 1 19 . 1 1 422 422 LEU CA C 422 58.600 58.600 55.720 2.880 19685 9967 1 19 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.664 -0.465 19685 9968 1 19 . 1 1 422 422 LEU H H 422 7.870 7.870 7.677 0.193 19685 9969 1 19 . 1 1 423 423 GLN N N 423 115.600 115.600 116.326 -0.726 19685 9970 1 19 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.398 -0.518 19685 9971 1 19 . 1 1 423 423 GLN C C 423 177.800 177.800 175.438 2.362 19685 9972 1 19 . 1 1 423 423 GLN CA C 423 58.600 58.600 55.932 2.668 19685 9973 1 19 . 1 1 423 423 GLN CB C 423 27.900 27.900 30.064 -2.164 19685 9974 1 19 . 1 1 423 423 GLN H H 423 7.860 7.860 7.703 0.157 19685 9975 1 19 . 1 1 424 424 MET N N 424 115.500 115.500 118.039 -2.539 19685 9976 1 19 . 1 1 424 424 MET HA H 424 3.910 3.910 4.514 -0.604 19685 9977 1 19 . 1 1 424 424 MET C C 424 175.500 175.500 175.931 -0.431 19685 9978 1 19 . 1 1 424 424 MET CA C 424 57.800 57.800 56.378 1.422 19685 9979 1 19 . 1 1 424 424 MET CB C 424 34.300 34.300 34.504 -0.204 19685 9980 1 19 . 1 1 424 424 MET H H 424 7.560 7.560 7.863 -0.303 19685 9981 1 19 . 1 1 425 425 PHE N N 425 112.300 112.300 117.750 -5.450 19685 9982 1 19 . 1 1 425 425 PHE HA H 425 4.700 4.700 4.945 -0.245 19685 9983 1 19 . 1 1 425 425 PHE C C 425 177.300 177.300 178.194 -0.894 19685 9984 1 19 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.904 0.996 19685 9985 1 19 . 1 1 425 425 PHE CB C 425 38.500 38.500 39.820 -1.320 19685 9986 1 19 . 1 1 425 425 PHE H H 425 7.680 7.680 7.938 -0.258 19685 9987 1 19 . 1 1 426 426 MET N N 426 127.400 127.400 120.233 7.167 19685 9988 1 19 . 1 1 426 426 MET HA H 426 4.630 4.630 4.120 0.510 19685 9989 1 19 . 1 1 426 426 MET C C 426 173.800 173.800 175.218 -1.418 19685 9990 1 19 . 1 1 426 426 MET CA C 426 59.100 59.100 60.286 -1.186 19685 9991 1 19 . 1 1 426 426 MET CB C 426 31.800 31.800 29.739 2.061 19685 9992 1 19 . 1 1 426 426 MET H H 426 8.540 8.540 8.492 0.048 19685 9993 1 19 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.243 -0.233 19685 9994 1 19 . 1 1 427 427 PRO C C 427 176.800 176.800 177.004 -0.204 19685 9995 1 19 . 1 1 427 427 PRO CA C 427 65.200 65.200 64.188 1.012 19685 9996 1 19 . 1 1 427 427 PRO CB C 427 30.600 30.600 30.811 -0.210 19685 9997 1 19 . 1 1 428 428 PHE N N 428 110.000 110.000 118.149 -8.149 19685 9998 1 19 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.614 -0.344 19685 9999 1 19 . 1 1 428 428 PHE C C 428 174.600 174.600 176.516 -1.916 19685 10000 1 19 . 1 1 428 428 PHE CA C 428 57.700 57.700 59.750 -2.050 19685 10001 1 19 . 1 1 428 428 PHE CB C 428 38.000 38.000 40.117 -2.117 19685 10002 1 19 . 1 1 428 428 PHE H H 428 6.560 6.560 7.331 -0.771 19685 10003 1 19 . 1 1 429 429 GLY N N 429 105.500 105.500 103.372 2.128 19685 10004 1 19 . 1 1 429 429 GLY C C 429 170.100 170.100 172.679 -2.579 19685 10005 1 19 . 1 1 429 429 GLY CA C 429 44.400 44.400 44.785 -0.385 19685 10006 1 19 . 1 1 429 429 GLY H H 429 7.650 7.650 7.641 0.009 19685 10007 1 19 . 1 1 430 430 ASN N N 430 117.400 117.400 116.814 0.586 19685 10008 1 19 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.327 0.303 19685 10009 1 19 . 1 1 430 430 ASN C C 430 173.200 173.200 175.001 -1.801 19685 10010 1 19 . 1 1 430 430 ASN CA C 430 52.600 52.600 54.381 -1.781 19685 10011 1 19 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.089 -1.889 19685 10012 1 19 . 1 1 430 430 ASN H H 430 9.020 9.020 7.692 1.328 19685 10013 1 19 . 1 1 431 431 VAL N N 431 128.000 128.000 119.574 8.426 19685 10014 1 19 . 1 1 431 431 VAL HA H 431 3.750 3.750 3.980 -0.230 19685 10015 1 19 . 1 1 431 431 VAL C C 431 176.400 176.400 177.459 -1.059 19685 10016 1 19 . 1 1 431 431 VAL CA C 431 61.800 61.800 63.656 -1.856 19685 10017 1 19 . 1 1 431 431 VAL CB C 431 31.900 31.900 32.371 -0.471 19685 10018 1 19 . 1 1 431 431 VAL H H 431 8.480 8.480 8.612 -0.132 19685 10019 1 19 . 1 1 432 432 ILE N N 432 128.000 128.000 117.647 10.353 19685 10020 1 19 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.587 0.333 19685 10021 1 19 . 1 1 432 432 ILE C C 432 176.100 176.100 175.793 0.307 19685 10022 1 19 . 1 1 432 432 ILE CA C 432 62.500 62.500 63.867 -1.367 19685 10023 1 19 . 1 1 432 432 ILE CB C 432 37.400 37.400 36.777 0.623 19685 10024 1 19 . 1 1 432 432 ILE H H 432 8.840 8.840 8.968 -0.128 19685 10025 1 19 . 1 1 433 433 SER N N 433 113.600 113.600 113.913 -0.313 19685 10026 1 19 . 1 1 433 433 SER HA H 433 4.440 4.440 4.590 -0.150 19685 10027 1 19 . 1 1 433 433 SER C C 433 171.000 171.000 171.990 -0.990 19685 10028 1 19 . 1 1 433 433 SER CA C 433 57.300 57.300 58.250 -0.950 19685 10029 1 19 . 1 1 433 433 SER CB C 433 65.200 65.200 66.017 -0.817 19685 10030 1 19 . 1 1 433 433 SER H H 433 7.280 7.280 7.946 -0.666 19685 10031 1 19 . 1 1 434 434 ALA N N 434 125.700 125.700 125.284 0.416 19685 10032 1 19 . 1 1 434 434 ALA HA H 434 4.910 4.910 4.383 0.527 19685 10033 1 19 . 1 1 434 434 ALA C C 434 174.600 174.600 175.312 -0.712 19685 10034 1 19 . 1 1 434 434 ALA CA C 434 51.000 51.000 50.875 0.125 19685 10035 1 19 . 1 1 434 434 ALA CB C 434 21.200 21.200 22.246 -1.046 19685 10036 1 19 . 1 1 434 434 ALA H H 434 8.270 8.270 8.363 -0.093 19685 10037 1 19 . 1 1 435 435 LYS N N 435 120.900 120.900 121.757 -0.857 19685 10038 1 19 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.314 0.156 19685 10039 1 19 . 1 1 435 435 LYS C C 435 173.800 173.800 174.409 -0.609 19685 10040 1 19 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.105 -1.405 19685 10041 1 19 . 1 1 435 435 LYS CB C 435 36.400 36.400 34.361 2.039 19685 10042 1 19 . 1 1 435 435 LYS H H 435 8.490 8.490 7.501 0.989 19685 10043 1 19 . 1 1 436 436 VAL N N 436 122.200 122.200 120.416 1.784 19685 10044 1 19 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.290 -0.370 19685 10045 1 19 . 1 1 436 436 VAL C C 436 175.100 175.100 173.866 1.234 19685 10046 1 19 . 1 1 436 436 VAL CA C 436 63.600 63.600 62.001 1.599 19685 10047 1 19 . 1 1 436 436 VAL CB C 436 33.500 33.500 31.878 1.622 19685 10048 1 19 . 1 1 436 436 VAL H H 436 8.390 8.390 8.259 0.131 19685 10049 1 19 . 1 1 437 437 PHE N N 437 125.900 125.900 115.296 10.604 19685 10050 1 19 . 1 1 437 437 PHE HA H 437 4.400 4.400 5.038 -0.638 19685 10051 1 19 . 1 1 437 437 PHE C C 437 173.600 173.600 173.716 -0.116 19685 10052 1 19 . 1 1 437 437 PHE CA C 437 57.700 57.700 56.386 1.314 19685 10053 1 19 . 1 1 437 437 PHE CB C 437 39.000 39.000 41.285 -2.285 19685 10054 1 19 . 1 1 437 437 PHE H H 437 8.250 8.250 7.090 1.160 19685 10055 1 19 . 1 1 438 438 ILE N N 438 121.900 121.900 117.499 4.401 19685 10056 1 19 . 1 1 438 438 ILE HA H 438 4.460 4.460 3.805 0.655 19685 10057 1 19 . 1 1 438 438 ILE C C 438 175.700 175.700 174.081 1.619 19685 10058 1 19 . 1 1 438 438 ILE CA C 438 58.300 58.300 62.760 -4.460 19685 10059 1 19 . 1 1 438 438 ILE CB C 438 39.700 39.700 35.827 3.873 19685 10060 1 19 . 1 1 438 438 ILE H H 438 8.520 8.520 8.676 -0.156 19685 10061 1 19 . 1 1 439 439 ASP N N 439 126.500 126.500 119.136 7.364 19685 10062 1 19 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.897 -0.317 19685 10063 1 19 . 1 1 439 439 ASP C C 439 176.300 176.300 175.558 0.742 19685 10064 1 19 . 1 1 439 439 ASP CA C 439 53.600 53.600 53.061 0.539 19685 10065 1 19 . 1 1 439 439 ASP CB C 439 42.300 42.300 43.644 -1.343 19685 10066 1 19 . 1 1 439 439 ASP H H 439 8.730 8.730 7.955 0.775 19685 10067 1 19 . 1 1 440 440 LYS N N 440 127.300 127.300 118.645 8.655 19685 10068 1 19 . 1 1 440 440 LYS HA H 440 4.070 4.070 3.965 0.105 19685 10069 1 19 . 1 1 440 440 LYS C C 440 176.900 176.900 176.751 0.149 19685 10070 1 19 . 1 1 440 440 LYS CA C 440 57.800 57.800 57.575 0.225 19685 10071 1 19 . 1 1 440 440 LYS CB C 440 32.100 32.100 30.172 1.928 19685 10072 1 19 . 1 1 440 440 LYS H H 440 8.930 8.930 8.741 0.189 19685 10073 1 19 . 1 1 441 441 GLN N N 441 117.400 117.400 113.154 4.246 19685 10074 1 19 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.008 0.222 19685 10075 1 19 . 1 1 441 441 GLN C C 441 177.200 177.200 175.547 1.653 19685 10076 1 19 . 1 1 441 441 GLN CA C 441 57.600 57.600 57.557 0.043 19685 10077 1 19 . 1 1 441 441 GLN CB C 441 28.800 28.800 26.952 1.848 19685 10078 1 19 . 1 1 441 441 GLN H H 441 8.650 8.650 8.711 -0.061 19685 10079 1 19 . 1 1 442 442 THR N N 442 107.300 107.300 114.774 -7.474 19685 10080 1 19 . 1 1 442 442 THR HA H 442 4.290 4.290 4.356 -0.066 19685 10081 1 19 . 1 1 442 442 THR C C 442 175.100 175.100 175.022 0.078 19685 10082 1 19 . 1 1 442 442 THR CA C 442 61.200 61.200 64.999 -3.799 19685 10083 1 19 . 1 1 442 442 THR CB C 442 70.300 70.300 69.487 0.813 19685 10084 1 19 . 1 1 442 442 THR H H 442 7.830 7.830 8.159 -0.329 19685 10085 1 19 . 1 1 443 443 ASN N N 443 117.300 117.300 117.650 -0.350 19685 10086 1 19 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.840 -0.540 19685 10087 1 19 . 1 1 443 443 ASN C C 443 173.400 173.400 173.762 -0.362 19685 10088 1 19 . 1 1 443 443 ASN CA C 443 54.300 54.300 52.406 1.894 19685 10089 1 19 . 1 1 443 443 ASN CB C 443 37.600 37.600 38.707 -1.107 19685 10090 1 19 . 1 1 443 443 ASN H H 443 8.470 8.470 8.148 0.322 19685 10091 1 19 . 1 1 444 444 LEU N N 444 118.000 118.000 118.381 -0.381 19685 10092 1 19 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.811 -0.251 19685 10093 1 19 . 1 1 444 444 LEU C C 444 176.700 176.700 176.784 -0.084 19685 10094 1 19 . 1 1 444 444 LEU CA C 444 53.300 53.300 54.758 -1.458 19685 10095 1 19 . 1 1 444 444 LEU CB C 444 43.500 43.500 41.817 1.683 19685 10096 1 19 . 1 1 444 444 LEU H H 444 7.660 7.660 7.658 0.002 19685 10097 1 19 . 1 1 445 445 SER N N 445 115.500 115.500 117.258 -1.758 19685 10098 1 19 . 1 1 445 445 SER HA H 445 4.460 4.460 4.526 -0.066 19685 10099 1 19 . 1 1 445 445 SER C C 445 176.500 176.500 174.114 2.386 19685 10100 1 19 . 1 1 445 445 SER CA C 445 57.900 57.900 57.516 0.384 19685 10101 1 19 . 1 1 445 445 SER CB C 445 63.500 63.500 64.895 -1.395 19685 10102 1 19 . 1 1 445 445 SER H H 445 8.840 8.840 8.029 0.811 19685 10103 1 19 . 1 1 446 446 LYS N N 446 125.200 125.200 125.279 -0.079 19685 10104 1 19 . 1 1 446 446 LYS HA H 446 4.500 4.500 3.960 0.540 19685 10105 1 19 . 1 1 446 446 LYS C C 446 176.100 176.100 174.472 1.628 19685 10106 1 19 . 1 1 446 446 LYS CA C 446 56.300 56.300 57.544 -1.244 19685 10107 1 19 . 1 1 446 446 LYS CB C 446 32.200 32.200 32.227 -0.027 19685 10108 1 19 . 1 1 446 446 LYS H H 446 9.230 9.230 8.768 0.462 19685 10109 1 19 . 1 1 447 447 CYS N N 447 113.000 113.000 118.549 -5.549 19685 10110 1 19 . 1 1 447 447 CYS C C 447 172.500 172.500 173.221 -0.721 19685 10111 1 19 . 1 1 447 447 CYS CA C 447 60.400 60.400 57.476 2.924 19685 10112 1 19 . 1 1 447 447 CYS CB C 447 24.900 24.900 29.712 -4.811 19685 10113 1 19 . 1 1 447 447 CYS H H 447 10.020 10.020 8.026 1.994 19685 10114 1 19 . 1 1 448 448 PHE N N 448 115.200 115.200 117.924 -2.724 19685 10115 1 19 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.182 1.158 19685 10116 1 19 . 1 1 448 448 PHE C C 448 172.400 172.400 175.249 -2.849 19685 10117 1 19 . 1 1 448 448 PHE CA C 448 54.700 54.700 58.270 -3.570 19685 10118 1 19 . 1 1 448 448 PHE CB C 448 42.000 42.000 38.408 3.592 19685 10119 1 19 . 1 1 448 448 PHE H H 448 7.810 7.810 8.329 -0.519 19685 10120 1 19 . 1 1 449 449 GLY N N 449 107.700 107.700 106.554 1.146 19685 10121 1 19 . 1 1 449 449 GLY C C 449 170.100 170.100 172.662 -2.562 19685 10122 1 19 . 1 1 449 449 GLY CA C 449 45.200 45.200 44.899 0.301 19685 10123 1 19 . 1 1 449 449 GLY H H 449 9.310 9.310 8.639 0.671 19685 10124 1 19 . 1 1 450 450 PHE N N 450 119.900 119.900 113.610 6.290 19685 10125 1 19 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.114 0.316 19685 10126 1 19 . 1 1 450 450 PHE C C 450 172.800 172.800 172.946 -0.146 19685 10127 1 19 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.791 -1.791 19685 10128 1 19 . 1 1 450 450 PHE CB C 450 43.600 43.600 40.684 2.916 19685 10129 1 19 . 1 1 450 450 PHE H H 450 8.760 8.760 7.847 0.913 19685 10130 1 19 . 1 1 451 451 VAL N N 451 123.800 123.800 116.821 6.979 19685 10131 1 19 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.254 0.036 19685 10132 1 19 . 1 1 451 451 VAL C C 451 172.400 172.400 175.438 -3.038 19685 10133 1 19 . 1 1 451 451 VAL CA C 451 59.800 59.800 61.519 -1.719 19685 10134 1 19 . 1 1 451 451 VAL CB C 451 36.100 36.100 36.462 -0.362 19685 10135 1 19 . 1 1 451 451 VAL H H 451 7.930 7.930 8.292 -0.362 19685 10136 1 19 . 1 1 452 452 SER N N 452 119.600 119.600 119.906 -0.306 19685 10137 1 19 . 1 1 452 452 SER HA H 452 5.120 5.120 5.146 -0.026 19685 10138 1 19 . 1 1 452 452 SER C C 452 173.200 173.200 174.231 -1.031 19685 10139 1 19 . 1 1 452 452 SER CA C 452 55.700 55.700 57.085 -1.385 19685 10140 1 19 . 1 1 452 452 SER CB C 452 66.100 66.100 62.660 3.440 19685 10141 1 19 . 1 1 452 452 SER H H 452 8.540 8.540 8.503 0.037 19685 10142 1 19 . 1 1 453 453 TYR N N 453 121.400 121.400 123.559 -2.159 19685 10143 1 19 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.489 0.891 19685 10144 1 19 . 1 1 453 453 TYR C C 453 173.600 173.600 177.085 -3.485 19685 10145 1 19 . 1 1 453 453 TYR CA C 453 56.500 56.500 60.018 -3.518 19685 10146 1 19 . 1 1 453 453 TYR CB C 453 42.200 42.200 38.839 3.361 19685 10147 1 19 . 1 1 453 453 TYR H H 453 8.380 8.380 7.682 0.698 19685 10148 1 19 . 1 1 454 454 ASP N N 454 113.300 113.300 121.600 -8.300 19685 10149 1 19 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.336 0.154 19685 10150 1 19 . 1 1 454 454 ASP C C 454 176.100 176.100 175.763 0.337 19685 10151 1 19 . 1 1 454 454 ASP CA C 454 52.800 52.800 56.479 -3.679 19685 10152 1 19 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.653 -1.253 19685 10153 1 19 . 1 1 454 454 ASP H H 454 7.860 7.860 8.525 -0.665 19685 10154 1 19 . 1 1 455 455 ASN N N 455 113.800 113.800 111.474 2.326 19685 10155 1 19 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.035 0.015 19685 10156 1 19 . 1 1 455 455 ASN C C 455 173.100 173.100 173.750 -0.650 19685 10157 1 19 . 1 1 455 455 ASN CA C 455 50.700 50.700 52.011 -1.311 19685 10158 1 19 . 1 1 455 455 ASN CB C 455 41.100 41.100 39.839 1.262 19685 10159 1 19 . 1 1 455 455 ASN H H 455 7.200 7.200 7.985 -0.785 19685 10160 1 19 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.507 -0.337 19685 10161 1 19 . 1 1 456 456 PRO C C 456 177.300 177.300 177.006 0.294 19685 10162 1 19 . 1 1 456 456 PRO CA C 456 64.200 64.200 65.115 -0.915 19685 10163 1 19 . 1 1 456 456 PRO CB C 456 32.300 32.300 31.971 0.329 19685 10164 1 19 . 1 1 457 457 VAL N N 457 120.900 120.900 109.763 11.137 19685 10165 1 19 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.371 -0.751 19685 10166 1 19 . 1 1 457 457 VAL C C 457 179.000 179.000 176.220 2.780 19685 10167 1 19 . 1 1 457 457 VAL CA C 457 65.900 65.900 62.864 3.036 19685 10168 1 19 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.825 -1.025 19685 10169 1 19 . 1 1 457 457 VAL H H 457 8.120 8.120 7.843 0.277 19685 10170 1 19 . 1 1 458 458 SER N N 458 117.800 117.800 116.647 1.153 19685 10171 1 19 . 1 1 458 458 SER HA H 458 3.940 3.940 4.651 -0.711 19685 10172 1 19 . 1 1 458 458 SER C C 458 173.600 173.600 175.580 -1.980 19685 10173 1 19 . 1 1 458 458 SER CA C 458 61.100 61.100 60.067 1.033 19685 10174 1 19 . 1 1 458 458 SER CB C 458 62.400 62.400 64.585 -2.185 19685 10175 1 19 . 1 1 458 458 SER H H 458 7.830 7.830 7.951 -0.121 19685 10176 1 19 . 1 1 459 459 ALA N N 459 120.000 120.000 124.670 -4.670 19685 10177 1 19 . 1 1 459 459 ALA HA H 459 3.750 3.750 3.811 -0.061 19685 10178 1 19 . 1 1 459 459 ALA C C 459 178.100 178.100 178.093 0.007 19685 10179 1 19 . 1 1 459 459 ALA CA C 459 54.500 54.500 53.845 0.655 19685 10180 1 19 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.273 -0.372 19685 10181 1 19 . 1 1 459 459 ALA H H 459 6.370 6.370 7.684 -1.314 19685 10182 1 19 . 1 1 460 460 GLN N N 460 116.100 116.100 117.006 -0.906 19685 10183 1 19 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.066 -0.236 19685 10184 1 19 . 1 1 460 460 GLN C C 460 178.000 178.000 176.769 1.231 19685 10185 1 19 . 1 1 460 460 GLN CA C 460 58.500 58.500 58.022 0.478 19685 10186 1 19 . 1 1 460 460 GLN CB C 460 27.400 27.400 27.867 -0.467 19685 10187 1 19 . 1 1 460 460 GLN H H 460 7.710 7.710 8.650 -0.940 19685 10188 1 19 . 1 1 461 461 ALA N N 461 122.800 122.800 118.335 4.465 19685 10189 1 19 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.299 -0.339 19685 10190 1 19 . 1 1 461 461 ALA C C 461 179.500 179.500 177.225 2.275 19685 10191 1 19 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.607 1.893 19685 10192 1 19 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.130 -1.630 19685 10193 1 19 . 1 1 461 461 ALA H H 461 7.880 7.880 7.409 0.471 19685 10194 1 19 . 1 1 462 462 ALA N N 462 121.400 121.400 119.455 1.945 19685 10195 1 19 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.838 -1.438 19685 10196 1 19 . 1 1 462 462 ALA C C 462 179.400 179.400 177.955 1.445 19685 10197 1 19 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.610 1.490 19685 10198 1 19 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.665 -1.965 19685 10199 1 19 . 1 1 462 462 ALA H H 462 7.860 7.860 7.619 0.241 19685 10200 1 19 . 1 1 463 463 ILE N N 463 118.600 118.600 118.232 0.368 19685 10201 1 19 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.872 -0.632 19685 10202 1 19 . 1 1 463 463 ILE C C 463 177.500 177.500 176.166 1.334 19685 10203 1 19 . 1 1 463 463 ILE CA C 463 66.000 66.000 62.024 3.976 19685 10204 1 19 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.035 0.265 19685 10205 1 19 . 1 1 463 463 ILE H H 463 8.090 8.090 8.107 -0.017 19685 10206 1 19 . 1 1 464 464 GLN N N 464 117.000 117.000 116.827 0.173 19685 10207 1 19 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.428 -0.558 19685 10208 1 19 . 1 1 464 464 GLN C C 464 177.700 177.700 175.221 2.479 19685 10209 1 19 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.955 2.245 19685 10210 1 19 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.643 -1.743 19685 10211 1 19 . 1 1 464 464 GLN H H 464 7.780 7.780 7.680 0.100 19685 10212 1 19 . 1 1 465 465 ALA N N 465 117.200 117.200 119.349 -2.149 19685 10213 1 19 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.460 -0.230 19685 10214 1 19 . 1 1 465 465 ALA C C 465 179.200 179.200 176.340 2.860 19685 10215 1 19 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.570 1.230 19685 10216 1 19 . 1 1 465 465 ALA CB C 465 21.100 21.100 19.454 1.645 19685 10217 1 19 . 1 1 465 465 ALA H H 465 7.540 7.540 7.900 -0.360 19685 10218 1 19 . 1 1 466 466 MET N N 466 110.800 110.800 117.570 -6.770 19685 10219 1 19 . 1 1 466 466 MET HA H 466 4.820 4.820 4.762 0.058 19685 10220 1 19 . 1 1 466 466 MET C C 466 177.600 177.600 177.044 0.556 19685 10221 1 19 . 1 1 466 466 MET CA C 466 53.300 53.300 56.334 -3.034 19685 10222 1 19 . 1 1 466 466 MET CB C 466 31.600 31.600 34.694 -3.094 19685 10223 1 19 . 1 1 466 466 MET H H 466 8.230 8.230 7.800 0.430 19685 10224 1 19 . 1 1 467 467 ASN N N 467 119.100 119.100 120.136 -1.036 19685 10225 1 19 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.574 -0.084 19685 10226 1 19 . 1 1 467 467 ASN C C 467 176.300 176.300 175.817 0.483 19685 10227 1 19 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.127 2.073 19685 10228 1 19 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.854 -0.654 19685 10229 1 19 . 1 1 467 467 ASN H H 467 8.560 8.560 7.825 0.735 19685 10230 1 19 . 1 1 468 468 GLY N N 468 117.900 117.900 106.435 11.465 19685 10231 1 19 . 1 1 468 468 GLY C C 468 172.800 172.800 173.512 -0.712 19685 10232 1 19 . 1 1 468 468 GLY CA C 468 45.300 45.300 44.697 0.603 19685 10233 1 19 . 1 1 468 468 GLY H H 468 8.930 8.930 8.173 0.757 19685 10234 1 19 . 1 1 469 469 PHE N N 469 123.300 123.300 120.769 2.531 19685 10235 1 19 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.747 -0.557 19685 10236 1 19 . 1 1 469 469 PHE C C 469 174.400 174.400 173.693 0.707 19685 10237 1 19 . 1 1 469 469 PHE CA C 469 58.700 58.700 56.998 1.702 19685 10238 1 19 . 1 1 469 469 PHE CB C 469 40.600 40.600 41.939 -1.339 19685 10239 1 19 . 1 1 469 469 PHE H H 469 7.950 7.950 7.499 0.451 19685 10240 1 19 . 1 1 470 470 GLN N N 470 129.200 129.200 124.778 4.422 19685 10241 1 19 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.253 0.337 19685 10242 1 19 . 1 1 470 470 GLN C C 470 174.100 174.100 173.841 0.259 19685 10243 1 19 . 1 1 470 470 GLN CA C 470 55.500 55.500 55.119 0.381 19685 10244 1 19 . 1 1 470 470 GLN CB C 470 28.800 28.800 29.765 -0.965 19685 10245 1 19 . 1 1 470 470 GLN H H 470 8.330 8.330 7.985 0.345 19685 10246 1 19 . 1 1 471 471 ILE N N 471 126.300 126.300 122.446 3.854 19685 10247 1 19 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.101 0.069 19685 10248 1 19 . 1 1 471 471 ILE C C 471 175.400 175.400 175.669 -0.269 19685 10249 1 19 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.079 -0.479 19685 10250 1 19 . 1 1 471 471 ILE CB C 471 39.100 39.100 41.212 -2.112 19685 10251 1 19 . 1 1 471 471 ILE H H 471 8.440 8.440 8.133 0.307 19685 10252 1 19 . 1 1 472 472 GLY N N 472 117.500 117.500 114.808 2.692 19685 10253 1 19 . 1 1 472 472 GLY C C 472 174.700 174.700 174.871 -0.171 19685 10254 1 19 . 1 1 472 472 GLY CA C 472 46.500 46.500 46.072 0.428 19685 10255 1 19 . 1 1 472 472 GLY H H 472 8.980 8.980 8.732 0.248 19685 10256 1 19 . 1 1 473 473 MET N N 473 124.100 124.100 111.088 13.012 19685 10257 1 19 . 1 1 473 473 MET HA H 473 4.380 4.380 4.022 0.358 19685 10258 1 19 . 1 1 473 473 MET C C 473 175.700 175.700 175.377 0.323 19685 10259 1 19 . 1 1 473 473 MET CA C 473 55.000 55.000 56.870 -1.870 19685 10260 1 19 . 1 1 473 473 MET CB C 473 32.900 32.900 30.836 2.064 19685 10261 1 19 . 1 1 473 473 MET H H 473 9.070 9.070 7.978 1.092 19685 10262 1 19 . 1 1 474 474 LYS N N 474 118.700 118.700 119.178 -0.478 19685 10263 1 19 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.283 0.197 19685 10264 1 19 . 1 1 474 474 LYS C C 474 174.300 174.300 176.362 -2.062 19685 10265 1 19 . 1 1 474 474 LYS CA C 474 54.600 54.600 55.450 -0.851 19685 10266 1 19 . 1 1 474 474 LYS CB C 474 35.100 35.100 32.508 2.592 19685 10267 1 19 . 1 1 474 474 LYS H H 474 7.770 7.770 8.229 -0.459 19685 10268 1 19 . 1 1 475 475 ARG N N 475 119.600 119.600 116.071 3.529 19685 10269 1 19 . 1 1 475 475 ARG HA H 475 4.800 4.800 3.834 0.966 19685 10270 1 19 . 1 1 475 475 ARG C C 475 175.700 175.700 175.493 0.207 19685 10271 1 19 . 1 1 475 475 ARG CA C 475 54.000 54.000 56.919 -2.919 19685 10272 1 19 . 1 1 475 475 ARG CB C 475 31.300 31.300 28.146 3.154 19685 10273 1 19 . 1 1 475 475 ARG H H 475 8.350 8.350 8.015 0.335 19685 10274 1 19 . 1 1 476 476 LEU N N 476 123.500 123.500 118.664 4.836 19685 10275 1 19 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.053 0.377 19685 10276 1 19 . 1 1 476 476 LEU C C 476 177.600 177.600 175.330 2.270 19685 10277 1 19 . 1 1 476 476 LEU CA C 476 55.500 55.500 56.079 -0.579 19685 10278 1 19 . 1 1 476 476 LEU CB C 476 42.800 42.800 41.543 1.257 19685 10279 1 19 . 1 1 476 476 LEU H H 476 9.130 9.130 8.172 0.958 19685 10280 1 19 . 1 1 477 477 LYS N N 477 123.200 123.200 119.114 4.086 19685 10281 1 19 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.324 0.836 19685 10282 1 19 . 1 1 477 477 LYS C C 477 174.100 174.100 173.881 0.219 19685 10283 1 19 . 1 1 477 477 LYS CA C 477 54.500 54.500 55.046 -0.546 19685 10284 1 19 . 1 1 477 477 LYS CB C 477 34.900 34.900 34.217 0.683 19685 10285 1 19 . 1 1 477 477 LYS H H 477 8.090 8.090 8.116 -0.026 19685 10286 1 19 . 1 1 478 478 VAL N N 478 127.100 127.100 123.959 3.141 19685 10287 1 19 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.606 0.294 19685 10288 1 19 . 1 1 478 478 VAL C C 478 173.700 173.700 173.261 0.439 19685 10289 1 19 . 1 1 478 478 VAL CA C 478 61.000 61.000 61.268 -0.268 19685 10290 1 19 . 1 1 478 478 VAL CB C 478 33.700 33.700 34.062 -0.362 19685 10291 1 19 . 1 1 478 478 VAL H H 478 8.820 8.820 8.102 0.718 19685 10292 1 19 . 1 1 479 479 GLN N N 479 123.600 123.600 123.009 0.591 19685 10293 1 19 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.637 0.173 19685 10294 1 19 . 1 1 479 479 GLN C C 479 173.600 173.600 173.628 -0.028 19685 10295 1 19 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.556 -1.356 19685 10296 1 19 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.759 0.741 19685 10297 1 19 . 1 1 479 479 GLN H H 479 9.130 9.130 8.489 0.641 19685 10298 1 19 . 1 1 480 480 LEU N N 480 123.200 123.200 120.904 2.296 19685 10299 1 19 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.627 -0.187 19685 10300 1 19 . 1 1 480 480 LEU C C 480 177.100 177.100 176.018 1.082 19685 10301 1 19 . 1 1 480 480 LEU CA C 480 54.600 54.600 53.940 0.660 19685 10302 1 19 . 1 1 480 480 LEU CB C 480 42.400 42.400 44.201 -1.801 19685 10303 1 19 . 1 1 480 480 LEU H H 480 8.840 8.840 8.266 0.574 19685 10304 1 19 . 1 1 481 481 LYS N N 481 124.500 124.500 123.829 0.671 19685 10305 1 19 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.183 0.127 19685 10306 1 19 . 1 1 481 481 LYS C C 481 175.200 175.200 175.837 -0.637 19685 10307 1 19 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.673 -0.973 19685 10308 1 19 . 1 1 481 481 LYS CB C 481 33.100 33.100 31.024 2.076 19685 10309 1 19 . 1 1 481 481 LYS H H 481 8.400 8.400 8.944 -0.544 19685 10310 1 19 . 1 1 482 482 ARG N N 482 126.600 126.600 118.038 8.562 19685 10311 1 19 . 1 1 482 482 ARG HA H 482 4.350 4.350 4.457 -0.107 19685 10312 1 19 . 1 1 482 482 ARG C C 482 175.800 175.800 174.419 1.381 19685 10313 1 19 . 1 1 482 482 ARG CA C 482 55.600 55.600 55.589 0.011 19685 10314 1 19 . 1 1 482 482 ARG CB C 482 31.100 31.100 30.916 0.184 19685 10315 1 19 . 1 1 482 482 ARG H H 482 8.770 8.770 8.365 0.405 19685 10316 1 19 . 1 1 483 483 SER N N 483 118.100 118.100 115.623 2.477 19685 10317 1 19 . 1 1 483 483 SER HA H 483 4.400 4.400 4.615 -0.215 19685 10318 1 19 . 1 1 483 483 SER C C 483 174.200 174.200 172.322 1.878 19685 10319 1 19 . 1 1 483 483 SER CA C 483 58.000 58.000 57.776 0.224 19685 10320 1 19 . 1 1 483 483 SER CB C 483 63.500 63.500 65.532 -2.032 19685 10321 1 19 . 1 1 483 483 SER H H 483 8.610 8.610 7.723 0.887 19685 10322 1 19 . 1 1 484 484 LYS N N 484 123.000 123.000 120.717 2.283 19685 10323 1 19 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.646 -0.436 19685 10324 1 19 . 1 1 484 484 LYS C C 484 175.900 175.900 174.950 0.950 19685 10325 1 19 . 1 1 484 484 LYS CA C 484 56.300 56.300 55.642 0.658 19685 10326 1 19 . 1 1 484 484 LYS CB C 484 32.500 32.500 34.618 -2.118 19685 10327 1 19 . 1 1 484 484 LYS H H 484 8.560 8.560 8.427 0.133 19685 10328 1 19 . 1 1 485 485 ASN N N 485 119.600 119.600 121.499 -1.899 19685 10329 1 19 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.891 -0.291 19685 10330 1 19 . 1 1 485 485 ASN C C 485 174.400 174.400 174.144 0.256 19685 10331 1 19 . 1 1 485 485 ASN CA C 485 52.900 52.900 52.724 0.176 19685 10332 1 19 . 1 1 485 485 ASN CB C 485 38.400 38.400 39.774 -1.374 19685 10333 1 19 . 1 1 485 485 ASN H H 485 8.560 8.560 8.577 -0.017 19685 10334 1 19 . 1 1 486 486 ASP N N 486 121.100 121.100 119.021 2.079 19685 10335 1 19 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.703 -0.183 19685 10336 1 19 . 1 1 486 486 ASP C C 486 175.700 175.700 174.938 0.762 19685 10337 1 19 . 1 1 486 486 ASP CA C 486 54.000 54.000 52.979 1.021 19685 10338 1 19 . 1 1 486 486 ASP CB C 486 40.800 40.800 43.015 -2.215 19685 10339 1 19 . 1 1 486 486 ASP H H 486 8.250 8.250 8.037 0.213 19685 10340 1 19 . 1 1 487 487 SER N N 487 115.400 115.400 117.848 -2.448 19685 10341 1 19 . 1 1 487 487 SER HA H 487 4.310 4.310 4.550 -0.240 19685 10342 1 19 . 1 1 487 487 SER C C 487 172.800 172.800 174.047 -1.247 19685 10343 1 19 . 1 1 487 487 SER CA C 487 57.700 57.700 58.405 -0.705 19685 10344 1 19 . 1 1 487 487 SER CB C 487 63.600 63.600 63.603 -0.003 19685 10345 1 19 . 1 1 487 487 SER H H 487 8.090 8.090 8.500 -0.410 19685 10346 1 19 . 1 1 488 488 LYS N N 488 122.300 122.300 121.920 0.380 19685 10347 1 19 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.068 -0.018 19685 10348 1 19 . 1 1 488 488 LYS C C 488 174.500 174.500 174.711 -0.211 19685 10349 1 19 . 1 1 488 488 LYS CA C 488 54.000 54.000 56.457 -2.457 19685 10350 1 19 . 1 1 488 488 LYS CB C 488 32.400 32.400 29.866 2.534 19685 10351 1 19 . 1 1 488 488 LYS H H 488 8.090 8.090 8.115 -0.025 19685 10352 1 19 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.344 -0.064 19685 10353 1 19 . 1 1 489 489 PRO C C 489 175.000 175.000 176.357 -1.357 19685 10354 1 19 . 1 1 489 489 PRO CA C 489 63.200 63.200 63.215 -0.015 19685 10355 1 19 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.553 -1.454 19685 10356 1 20 . 1 1 395 395 SER N N 395 115.500 115.500 115.074 0.426 19685 10357 1 20 . 1 1 395 395 SER HA H 395 4.300 4.300 4.207 0.093 19685 10358 1 20 . 1 1 395 395 SER C C 395 173.900 173.900 173.723 0.177 19685 10359 1 20 . 1 1 395 395 SER CA C 395 57.900 57.900 59.721 -1.821 19685 10360 1 20 . 1 1 395 395 SER CB C 395 63.400 63.400 62.035 1.365 19685 10361 1 20 . 1 1 395 395 SER H H 395 8.200 8.200 8.963 -0.763 19685 10362 1 20 . 1 1 396 396 HIS N N 396 123.500 123.500 115.619 7.881 19685 10363 1 20 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.760 -0.200 19685 10364 1 20 . 1 1 396 396 HIS C C 396 174.100 174.100 173.334 0.766 19685 10365 1 20 . 1 1 396 396 HIS CA C 396 53.700 53.700 55.161 -1.461 19685 10366 1 20 . 1 1 396 396 HIS CB C 396 32.200 32.200 30.800 1.400 19685 10367 1 20 . 1 1 396 396 HIS H H 396 8.120 8.120 7.359 0.761 19685 10368 1 20 . 1 1 397 397 MET N N 397 121.200 121.200 119.945 1.255 19685 10369 1 20 . 1 1 397 397 MET HA H 397 4.320 4.320 4.713 -0.393 19685 10370 1 20 . 1 1 397 397 MET C C 397 175.400 175.400 175.100 0.300 19685 10371 1 20 . 1 1 397 397 MET CA C 397 55.000 55.000 54.663 0.338 19685 10372 1 20 . 1 1 397 397 MET CB C 397 32.500 32.500 35.245 -2.745 19685 10373 1 20 . 1 1 397 397 MET H H 397 8.300 8.300 8.313 -0.013 19685 10374 1 20 . 1 1 398 398 GLN N N 398 122.100 122.100 117.386 4.714 19685 10375 1 20 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.052 0.138 19685 10376 1 20 . 1 1 398 398 GLN C C 398 174.800 174.800 174.817 -0.017 19685 10377 1 20 . 1 1 398 398 GLN CA C 398 55.200 55.200 57.531 -2.331 19685 10378 1 20 . 1 1 398 398 GLN CB C 398 28.900 28.900 27.966 0.933 19685 10379 1 20 . 1 1 398 398 GLN H H 398 8.540 8.540 8.789 -0.249 19685 10380 1 20 . 1 1 399 399 LYS N N 399 123.000 123.000 116.742 6.258 19685 10381 1 20 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.524 -0.304 19685 10382 1 20 . 1 1 399 399 LYS C C 399 174.800 174.800 175.102 -0.302 19685 10383 1 20 . 1 1 399 399 LYS CA C 399 55.600 55.600 55.129 0.471 19685 10384 1 20 . 1 1 399 399 LYS CB C 399 33.000 33.000 35.574 -2.574 19685 10385 1 20 . 1 1 399 399 LYS H H 399 8.180 8.180 7.515 0.665 19685 10386 1 20 . 1 1 400 400 GLU N N 400 122.000 122.000 117.818 4.182 19685 10387 1 20 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.059 0.371 19685 10388 1 20 . 1 1 400 400 GLU C C 400 176.400 176.400 175.183 1.217 19685 10389 1 20 . 1 1 400 400 GLU CA C 400 55.400 55.400 57.522 -2.122 19685 10390 1 20 . 1 1 400 400 GLU CB C 400 31.400 31.400 28.770 2.630 19685 10391 1 20 . 1 1 400 400 GLU H H 400 8.350 8.350 8.857 -0.507 19685 10392 1 20 . 1 1 401 401 GLY N N 401 109.500 109.500 105.543 3.957 19685 10393 1 20 . 1 1 401 401 GLY C C 401 171.500 171.500 172.912 -1.412 19685 10394 1 20 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.533 -0.833 19685 10395 1 20 . 1 1 401 401 GLY H H 401 9.050 9.050 8.032 1.018 19685 10396 1 20 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.530 -0.110 19685 10397 1 20 . 1 1 402 402 PRO C C 402 173.900 173.900 176.417 -2.517 19685 10398 1 20 . 1 1 402 402 PRO CA C 402 61.900 61.900 64.369 -2.469 19685 10399 1 20 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.616 -0.416 19685 10400 1 20 . 1 1 403 403 GLU N N 403 119.600 119.600 118.091 1.509 19685 10401 1 20 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.468 -0.508 19685 10402 1 20 . 1 1 403 403 GLU C C 403 177.300 177.300 175.882 1.418 19685 10403 1 20 . 1 1 403 403 GLU CA C 403 58.100 58.100 57.018 1.082 19685 10404 1 20 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.458 -1.458 19685 10405 1 20 . 1 1 403 403 GLU H H 403 8.420 8.420 8.342 0.078 19685 10406 1 20 . 1 1 404 404 GLY N N 404 112.800 112.800 107.318 5.482 19685 10407 1 20 . 1 1 404 404 GLY C C 404 173.300 173.300 174.051 -0.751 19685 10408 1 20 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.466 -0.566 19685 10409 1 20 . 1 1 404 404 GLY H H 404 8.500 8.500 8.433 0.067 19685 10410 1 20 . 1 1 405 405 ALA N N 405 120.000 120.000 124.177 -4.177 19685 10411 1 20 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.335 0.215 19685 10412 1 20 . 1 1 405 405 ALA C C 405 174.100 174.100 175.691 -1.591 19685 10413 1 20 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.628 -1.128 19685 10414 1 20 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.049 3.751 19685 10415 1 20 . 1 1 405 405 ALA H H 405 8.360 8.360 8.349 0.011 19685 10416 1 20 . 1 1 406 406 ASN N N 406 115.500 115.500 117.733 -2.233 19685 10417 1 20 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.043 0.147 19685 10418 1 20 . 1 1 406 406 ASN C C 406 172.900 172.900 174.440 -1.540 19685 10419 1 20 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.520 1.080 19685 10420 1 20 . 1 1 406 406 ASN CB C 406 40.900 40.900 38.739 2.161 19685 10421 1 20 . 1 1 406 406 ASN H H 406 7.690 7.690 7.911 -0.221 19685 10422 1 20 . 1 1 407 407 LEU N N 407 123.400 123.400 120.560 2.840 19685 10423 1 20 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.463 0.497 19685 10424 1 20 . 1 1 407 407 LEU C C 407 174.900 174.900 176.319 -1.419 19685 10425 1 20 . 1 1 407 407 LEU CA C 407 53.100 53.100 54.868 -1.768 19685 10426 1 20 . 1 1 407 407 LEU CB C 407 45.400 45.400 42.428 2.972 19685 10427 1 20 . 1 1 407 407 LEU H H 407 9.290 9.290 7.414 1.876 19685 10428 1 20 . 1 1 408 408 PHE N N 408 118.700 118.700 120.648 -1.948 19685 10429 1 20 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.876 0.424 19685 10430 1 20 . 1 1 408 408 PHE C C 408 174.200 174.200 175.468 -1.268 19685 10431 1 20 . 1 1 408 408 PHE CA C 408 56.300 56.300 57.425 -1.125 19685 10432 1 20 . 1 1 408 408 PHE CB C 408 42.700 42.700 38.612 4.088 19685 10433 1 20 . 1 1 408 408 PHE H H 408 9.150 9.150 8.719 0.431 19685 10434 1 20 . 1 1 409 409 ILE N N 409 120.800 120.800 123.893 -3.093 19685 10435 1 20 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.552 0.418 19685 10436 1 20 . 1 1 409 409 ILE C C 409 173.900 173.900 173.954 -0.054 19685 10437 1 20 . 1 1 409 409 ILE CA C 409 59.000 59.000 61.063 -2.063 19685 10438 1 20 . 1 1 409 409 ILE CB C 409 40.400 40.400 39.021 1.379 19685 10439 1 20 . 1 1 409 409 ILE H H 409 8.380 8.380 8.867 -0.487 19685 10440 1 20 . 1 1 410 410 TYR N N 410 123.200 123.200 121.455 1.745 19685 10441 1 20 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.608 0.332 19685 10442 1 20 . 1 1 410 410 TYR C C 410 174.300 174.300 175.676 -1.376 19685 10443 1 20 . 1 1 410 410 TYR CA C 410 56.200 56.200 57.678 -1.478 19685 10444 1 20 . 1 1 410 410 TYR CB C 410 40.800 40.800 38.974 1.827 19685 10445 1 20 . 1 1 410 410 TYR H H 410 9.440 9.440 8.501 0.939 19685 10446 1 20 . 1 1 411 411 HIS N N 411 112.100 112.100 121.525 -9.425 19685 10447 1 20 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.261 0.189 19685 10448 1 20 . 1 1 411 411 HIS C C 411 173.300 173.300 174.589 -1.289 19685 10449 1 20 . 1 1 411 411 HIS CA C 411 55.900 55.900 56.171 -0.271 19685 10450 1 20 . 1 1 411 411 HIS CB C 411 26.200 26.200 27.284 -1.083 19685 10451 1 20 . 1 1 411 411 HIS H H 411 8.580 8.580 8.094 0.486 19685 10452 1 20 . 1 1 412 412 LEU N N 412 115.100 115.100 124.111 -9.011 19685 10453 1 20 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.194 -0.234 19685 10454 1 20 . 1 1 412 412 LEU C C 412 175.100 175.100 175.267 -0.167 19685 10455 1 20 . 1 1 412 412 LEU CA C 412 52.400 52.400 54.097 -1.697 19685 10456 1 20 . 1 1 412 412 LEU CB C 412 42.000 42.000 42.576 -0.576 19685 10457 1 20 . 1 1 412 412 LEU H H 412 7.560 7.560 7.273 0.287 19685 10458 1 20 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.196 0.074 19685 10459 1 20 . 1 1 413 413 PRO C C 413 177.600 177.600 176.791 0.809 19685 10460 1 20 . 1 1 413 413 PRO CA C 413 62.300 62.300 63.279 -0.980 19685 10461 1 20 . 1 1 413 413 PRO CB C 413 32.200 32.200 31.788 0.412 19685 10462 1 20 . 1 1 414 414 GLN N N 414 125.500 125.500 117.480 8.020 19685 10463 1 20 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.382 -0.302 19685 10464 1 20 . 1 1 414 414 GLN C C 414 175.400 175.400 176.321 -0.921 19685 10465 1 20 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.407 -0.407 19685 10466 1 20 . 1 1 414 414 GLN CB C 414 28.500 28.500 28.967 -0.467 19685 10467 1 20 . 1 1 414 414 GLN H H 414 9.170 9.170 8.814 0.356 19685 10468 1 20 . 1 1 415 415 GLU N N 415 115.300 115.300 118.223 -2.923 19685 10469 1 20 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.592 -0.332 19685 10470 1 20 . 1 1 415 415 GLU C C 415 176.700 176.700 175.693 1.007 19685 10471 1 20 . 1 1 415 415 GLU CA C 415 58.700 58.700 56.198 2.502 19685 10472 1 20 . 1 1 415 415 GLU CB C 415 28.300 28.300 30.554 -2.254 19685 10473 1 20 . 1 1 415 415 GLU H H 415 9.390 9.390 8.611 0.779 19685 10474 1 20 . 1 1 416 416 PHE N N 416 121.700 121.700 118.567 3.133 19685 10475 1 20 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.039 -0.429 19685 10476 1 20 . 1 1 416 416 PHE C C 416 176.400 176.400 176.418 -0.018 19685 10477 1 20 . 1 1 416 416 PHE CA C 416 57.400 57.400 56.386 1.014 19685 10478 1 20 . 1 1 416 416 PHE CB C 416 38.700 38.700 42.054 -3.354 19685 10479 1 20 . 1 1 416 416 PHE H H 416 7.610 7.610 7.618 -0.008 19685 10480 1 20 . 1 1 417 417 GLY N N 417 113.000 113.000 106.175 6.825 19685 10481 1 20 . 1 1 417 417 GLY C C 417 174.300 174.300 173.093 1.207 19685 10482 1 20 . 1 1 417 417 GLY CA C 417 42.900 42.900 45.339 -2.439 19685 10483 1 20 . 1 1 417 417 GLY H H 417 9.740 9.740 7.886 1.854 19685 10484 1 20 . 1 1 418 418 ASP N N 418 121.500 121.500 118.352 3.148 19685 10485 1 20 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.484 -0.544 19685 10486 1 20 . 1 1 418 418 ASP C C 418 177.900 177.900 176.584 1.316 19685 10487 1 20 . 1 1 418 418 ASP CA C 418 57.600 57.600 55.428 2.172 19685 10488 1 20 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.044 -1.344 19685 10489 1 20 . 1 1 418 418 ASP H H 418 8.680 8.680 8.468 0.212 19685 10490 1 20 . 1 1 419 419 GLN N N 419 116.400 116.400 118.702 -2.302 19685 10491 1 20 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.267 -0.357 19685 10492 1 20 . 1 1 419 419 GLN C C 419 177.600 177.600 176.021 1.579 19685 10493 1 20 . 1 1 419 419 GLN CA C 419 58.000 58.000 57.467 0.533 19685 10494 1 20 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.855 -1.455 19685 10495 1 20 . 1 1 419 419 GLN H H 419 8.780 8.780 8.141 0.639 19685 10496 1 20 . 1 1 420 420 ASP N N 420 117.500 117.500 117.742 -0.242 19685 10497 1 20 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.576 -0.566 19685 10498 1 20 . 1 1 420 420 ASP C C 420 178.000 178.000 176.333 1.667 19685 10499 1 20 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.501 3.199 19685 10500 1 20 . 1 1 420 420 ASP CB C 420 39.800 39.800 41.028 -1.228 19685 10501 1 20 . 1 1 420 420 ASP H H 420 7.210 7.210 7.907 -0.697 19685 10502 1 20 . 1 1 421 421 ILE N N 421 117.000 117.000 120.402 -3.402 19685 10503 1 20 . 1 1 421 421 ILE HA H 421 4.080 4.080 3.950 0.130 19685 10504 1 20 . 1 1 421 421 ILE C C 421 176.500 176.500 176.795 -0.295 19685 10505 1 20 . 1 1 421 421 ILE CA C 421 64.000 64.000 64.212 -0.212 19685 10506 1 20 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.224 -0.924 19685 10507 1 20 . 1 1 421 421 ILE H H 421 7.610 7.610 7.861 -0.251 19685 10508 1 20 . 1 1 422 422 LEU N N 422 123.200 123.200 119.443 3.757 19685 10509 1 20 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.034 -0.274 19685 10510 1 20 . 1 1 422 422 LEU C C 422 177.800 177.800 178.140 -0.340 19685 10511 1 20 . 1 1 422 422 LEU CA C 422 58.600 58.600 57.669 0.931 19685 10512 1 20 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.701 -0.501 19685 10513 1 20 . 1 1 422 422 LEU H H 422 7.870 7.870 7.823 0.047 19685 10514 1 20 . 1 1 423 423 GLN N N 423 115.600 115.600 116.798 -1.198 19685 10515 1 20 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.105 -0.225 19685 10516 1 20 . 1 1 423 423 GLN C C 423 177.800 177.800 176.235 1.565 19685 10517 1 20 . 1 1 423 423 GLN CA C 423 58.600 58.600 58.142 0.458 19685 10518 1 20 . 1 1 423 423 GLN CB C 423 27.900 27.900 28.082 -0.182 19685 10519 1 20 . 1 1 423 423 GLN H H 423 7.860 7.860 8.184 -0.324 19685 10520 1 20 . 1 1 424 424 MET N N 424 115.500 115.500 115.180 0.320 19685 10521 1 20 . 1 1 424 424 MET HA H 424 3.910 3.910 4.686 -0.776 19685 10522 1 20 . 1 1 424 424 MET C C 424 175.500 175.500 176.496 -0.996 19685 10523 1 20 . 1 1 424 424 MET CA C 424 57.800 57.800 55.146 2.654 19685 10524 1 20 . 1 1 424 424 MET CB C 424 34.300 34.300 34.496 -0.196 19685 10525 1 20 . 1 1 424 424 MET H H 424 7.560 7.560 7.574 -0.014 19685 10526 1 20 . 1 1 425 425 PHE N N 425 112.300 112.300 117.020 -4.720 19685 10527 1 20 . 1 1 425 425 PHE HA H 425 4.700 4.700 4.982 -0.282 19685 10528 1 20 . 1 1 425 425 PHE C C 425 177.300 177.300 177.856 -0.556 19685 10529 1 20 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.359 1.541 19685 10530 1 20 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.074 -1.573 19685 10531 1 20 . 1 1 425 425 PHE H H 425 7.680 7.680 7.954 -0.274 19685 10532 1 20 . 1 1 426 426 MET N N 426 127.400 127.400 120.535 6.865 19685 10533 1 20 . 1 1 426 426 MET HA H 426 4.630 4.630 4.194 0.436 19685 10534 1 20 . 1 1 426 426 MET C C 426 173.800 173.800 175.210 -1.410 19685 10535 1 20 . 1 1 426 426 MET CA C 426 59.100 59.100 60.188 -1.088 19685 10536 1 20 . 1 1 426 426 MET CB C 426 31.800 31.800 29.737 2.063 19685 10537 1 20 . 1 1 426 426 MET H H 426 8.540 8.540 7.983 0.557 19685 10538 1 20 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.221 -0.211 19685 10539 1 20 . 1 1 427 427 PRO C C 427 176.800 176.800 176.631 0.169 19685 10540 1 20 . 1 1 427 427 PRO CA C 427 65.200 65.200 64.409 0.791 19685 10541 1 20 . 1 1 427 427 PRO CB C 427 30.600 30.600 30.488 0.112 19685 10542 1 20 . 1 1 428 428 PHE N N 428 110.000 110.000 117.512 -7.512 19685 10543 1 20 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.667 -0.397 19685 10544 1 20 . 1 1 428 428 PHE C C 428 174.600 174.600 176.311 -1.711 19685 10545 1 20 . 1 1 428 428 PHE CA C 428 57.700 57.700 58.672 -0.972 19685 10546 1 20 . 1 1 428 428 PHE CB C 428 38.000 38.000 41.045 -3.045 19685 10547 1 20 . 1 1 428 428 PHE H H 428 6.560 6.560 7.583 -1.023 19685 10548 1 20 . 1 1 429 429 GLY N N 429 105.500 105.500 106.590 -1.090 19685 10549 1 20 . 1 1 429 429 GLY C C 429 170.100 170.100 172.797 -2.697 19685 10550 1 20 . 1 1 429 429 GLY CA C 429 44.400 44.400 45.416 -1.016 19685 10551 1 20 . 1 1 429 429 GLY H H 429 7.650 7.650 7.576 0.074 19685 10552 1 20 . 1 1 430 430 ASN N N 430 117.400 117.400 116.929 0.471 19685 10553 1 20 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.221 0.409 19685 10554 1 20 . 1 1 430 430 ASN C C 430 173.200 173.200 174.234 -1.034 19685 10555 1 20 . 1 1 430 430 ASN CA C 430 52.600 52.600 54.467 -1.867 19685 10556 1 20 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.275 -2.075 19685 10557 1 20 . 1 1 430 430 ASN H H 430 9.020 9.020 7.969 1.051 19685 10558 1 20 . 1 1 431 431 VAL N N 431 128.000 128.000 120.027 7.973 19685 10559 1 20 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.300 -0.550 19685 10560 1 20 . 1 1 431 431 VAL C C 431 176.400 176.400 176.834 -0.434 19685 10561 1 20 . 1 1 431 431 VAL CA C 431 61.800 61.800 61.597 0.203 19685 10562 1 20 . 1 1 431 431 VAL CB C 431 31.900 31.900 32.904 -1.004 19685 10563 1 20 . 1 1 431 431 VAL H H 431 8.480 8.480 8.613 -0.133 19685 10564 1 20 . 1 1 432 432 ILE N N 432 128.000 128.000 119.617 8.383 19685 10565 1 20 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.615 0.305 19685 10566 1 20 . 1 1 432 432 ILE C C 432 176.100 176.100 176.182 -0.082 19685 10567 1 20 . 1 1 432 432 ILE CA C 432 62.500 62.500 64.369 -1.869 19685 10568 1 20 . 1 1 432 432 ILE CB C 432 37.400 37.400 36.598 0.802 19685 10569 1 20 . 1 1 432 432 ILE H H 432 8.840 8.840 8.715 0.125 19685 10570 1 20 . 1 1 433 433 SER N N 433 113.600 113.600 114.619 -1.019 19685 10571 1 20 . 1 1 433 433 SER HA H 433 4.440 4.440 4.706 -0.266 19685 10572 1 20 . 1 1 433 433 SER C C 433 171.000 171.000 172.155 -1.155 19685 10573 1 20 . 1 1 433 433 SER CA C 433 57.300 57.300 57.582 -0.282 19685 10574 1 20 . 1 1 433 433 SER CB C 433 65.200 65.200 66.490 -1.290 19685 10575 1 20 . 1 1 433 433 SER H H 433 7.280 7.280 8.054 -0.774 19685 10576 1 20 . 1 1 434 434 ALA N N 434 125.700 125.700 124.693 1.007 19685 10577 1 20 . 1 1 434 434 ALA HA H 434 4.910 4.910 4.515 0.395 19685 10578 1 20 . 1 1 434 434 ALA C C 434 174.600 174.600 176.225 -1.625 19685 10579 1 20 . 1 1 434 434 ALA CA C 434 51.000 51.000 51.427 -0.427 19685 10580 1 20 . 1 1 434 434 ALA CB C 434 21.200 21.200 21.272 -0.072 19685 10581 1 20 . 1 1 434 434 ALA H H 434 8.270 8.270 8.374 -0.104 19685 10582 1 20 . 1 1 435 435 LYS N N 435 120.900 120.900 120.601 0.299 19685 10583 1 20 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.661 -0.191 19685 10584 1 20 . 1 1 435 435 LYS C C 435 173.800 173.800 176.855 -3.055 19685 10585 1 20 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.587 -1.887 19685 10586 1 20 . 1 1 435 435 LYS CB C 435 36.400 36.400 34.972 1.428 19685 10587 1 20 . 1 1 435 435 LYS H H 435 8.490 8.490 7.992 0.498 19685 10588 1 20 . 1 1 436 436 VAL N N 436 122.200 122.200 118.025 4.175 19685 10589 1 20 . 1 1 436 436 VAL HA H 436 3.920 3.920 3.660 0.260 19685 10590 1 20 . 1 1 436 436 VAL C C 436 175.100 175.100 175.341 -0.241 19685 10591 1 20 . 1 1 436 436 VAL CA C 436 63.600 63.600 66.127 -2.527 19685 10592 1 20 . 1 1 436 436 VAL CB C 436 33.500 33.500 31.100 2.400 19685 10593 1 20 . 1 1 436 436 VAL H H 436 8.390 8.390 7.649 0.741 19685 10594 1 20 . 1 1 437 437 PHE N N 437 125.900 125.900 116.720 9.180 19685 10595 1 20 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.880 -0.480 19685 10596 1 20 . 1 1 437 437 PHE C C 437 173.600 173.600 174.086 -0.486 19685 10597 1 20 . 1 1 437 437 PHE CA C 437 57.700 57.700 55.952 1.748 19685 10598 1 20 . 1 1 437 437 PHE CB C 437 39.000 39.000 40.085 -1.085 19685 10599 1 20 . 1 1 437 437 PHE H H 437 8.250 8.250 8.256 -0.006 19685 10600 1 20 . 1 1 438 438 ILE N N 438 121.900 121.900 113.111 8.789 19685 10601 1 20 . 1 1 438 438 ILE HA H 438 4.460 4.460 3.572 0.888 19685 10602 1 20 . 1 1 438 438 ILE C C 438 175.700 175.700 174.835 0.865 19685 10603 1 20 . 1 1 438 438 ILE CA C 438 58.300 58.300 62.470 -4.170 19685 10604 1 20 . 1 1 438 438 ILE CB C 438 39.700 39.700 37.266 2.434 19685 10605 1 20 . 1 1 438 438 ILE H H 438 8.520 8.520 8.088 0.432 19685 10606 1 20 . 1 1 439 439 ASP N N 439 126.500 126.500 122.307 4.193 19685 10607 1 20 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.549 0.031 19685 10608 1 20 . 1 1 439 439 ASP C C 439 176.300 176.300 176.032 0.268 19685 10609 1 20 . 1 1 439 439 ASP CA C 439 53.600 53.600 53.688 -0.088 19685 10610 1 20 . 1 1 439 439 ASP CB C 439 42.300 42.300 40.915 1.385 19685 10611 1 20 . 1 1 439 439 ASP H H 439 8.730 8.730 8.529 0.201 19685 10612 1 20 . 1 1 440 440 LYS N N 440 127.300 127.300 117.312 9.988 19685 10613 1 20 . 1 1 440 440 LYS HA H 440 4.070 4.070 3.938 0.132 19685 10614 1 20 . 1 1 440 440 LYS C C 440 176.900 176.900 176.176 0.724 19685 10615 1 20 . 1 1 440 440 LYS CA C 440 57.800 57.800 57.797 0.003 19685 10616 1 20 . 1 1 440 440 LYS CB C 440 32.100 32.100 31.138 0.962 19685 10617 1 20 . 1 1 440 440 LYS H H 440 8.930 8.930 8.360 0.570 19685 10618 1 20 . 1 1 441 441 GLN N N 441 117.400 117.400 115.921 1.479 19685 10619 1 20 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.417 -0.187 19685 10620 1 20 . 1 1 441 441 GLN C C 441 177.200 177.200 175.357 1.843 19685 10621 1 20 . 1 1 441 441 GLN CA C 441 57.600 57.600 56.596 1.004 19685 10622 1 20 . 1 1 441 441 GLN CB C 441 28.800 28.800 29.881 -1.081 19685 10623 1 20 . 1 1 441 441 GLN H H 441 8.650 8.650 7.995 0.655 19685 10624 1 20 . 1 1 442 442 THR N N 442 107.300 107.300 110.373 -3.073 19685 10625 1 20 . 1 1 442 442 THR HA H 442 4.290 4.290 4.379 -0.089 19685 10626 1 20 . 1 1 442 442 THR C C 442 175.100 175.100 174.626 0.474 19685 10627 1 20 . 1 1 442 442 THR CA C 442 61.200 61.200 61.454 -0.254 19685 10628 1 20 . 1 1 442 442 THR CB C 442 70.300 70.300 69.147 1.153 19685 10629 1 20 . 1 1 442 442 THR H H 442 7.830 7.830 7.752 0.078 19685 10630 1 20 . 1 1 443 443 ASN N N 443 117.300 117.300 119.126 -1.826 19685 10631 1 20 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.313 -0.013 19685 10632 1 20 . 1 1 443 443 ASN C C 443 173.400 173.400 174.773 -1.373 19685 10633 1 20 . 1 1 443 443 ASN CA C 443 54.300 54.300 53.440 0.860 19685 10634 1 20 . 1 1 443 443 ASN CB C 443 37.600 37.600 37.204 0.396 19685 10635 1 20 . 1 1 443 443 ASN H H 443 8.470 8.470 8.253 0.217 19685 10636 1 20 . 1 1 444 444 LEU N N 444 118.000 118.000 115.117 2.883 19685 10637 1 20 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.313 0.247 19685 10638 1 20 . 1 1 444 444 LEU C C 444 176.700 176.700 176.988 -0.288 19685 10639 1 20 . 1 1 444 444 LEU CA C 444 53.300 53.300 55.456 -2.156 19685 10640 1 20 . 1 1 444 444 LEU CB C 444 43.500 43.500 42.400 1.101 19685 10641 1 20 . 1 1 444 444 LEU H H 444 7.660 7.660 7.318 0.342 19685 10642 1 20 . 1 1 445 445 SER N N 445 115.500 115.500 116.531 -1.031 19685 10643 1 20 . 1 1 445 445 SER HA H 445 4.460 4.460 4.438 0.022 19685 10644 1 20 . 1 1 445 445 SER C C 445 176.500 176.500 174.019 2.481 19685 10645 1 20 . 1 1 445 445 SER CA C 445 57.900 57.900 58.131 -0.231 19685 10646 1 20 . 1 1 445 445 SER CB C 445 63.500 63.500 63.352 0.148 19685 10647 1 20 . 1 1 445 445 SER H H 445 8.840 8.840 8.204 0.636 19685 10648 1 20 . 1 1 446 446 LYS N N 446 125.200 125.200 125.401 -0.201 19685 10649 1 20 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.508 -0.008 19685 10650 1 20 . 1 1 446 446 LYS C C 446 176.100 176.100 174.573 1.527 19685 10651 1 20 . 1 1 446 446 LYS CA C 446 56.300 56.300 55.466 0.834 19685 10652 1 20 . 1 1 446 446 LYS CB C 446 32.200 32.200 35.751 -3.551 19685 10653 1 20 . 1 1 446 446 LYS H H 446 9.230 9.230 8.253 0.977 19685 10654 1 20 . 1 1 447 447 CYS N N 447 113.000 113.000 122.913 -9.913 19685 10655 1 20 . 1 1 447 447 CYS C C 447 172.500 172.500 173.987 -1.487 19685 10656 1 20 . 1 1 447 447 CYS CA C 447 60.400 60.400 58.553 1.847 19685 10657 1 20 . 1 1 447 447 CYS CB C 447 24.900 24.900 28.376 -3.476 19685 10658 1 20 . 1 1 447 447 CYS H H 447 10.020 10.020 8.327 1.693 19685 10659 1 20 . 1 1 448 448 PHE N N 448 115.200 115.200 120.601 -5.401 19685 10660 1 20 . 1 1 448 448 PHE HA H 448 5.340 5.340 3.499 1.841 19685 10661 1 20 . 1 1 448 448 PHE C C 448 172.400 172.400 173.753 -1.353 19685 10662 1 20 . 1 1 448 448 PHE CA C 448 54.700 54.700 57.916 -3.216 19685 10663 1 20 . 1 1 448 448 PHE CB C 448 42.000 42.000 37.761 4.239 19685 10664 1 20 . 1 1 448 448 PHE H H 448 7.810 7.810 7.727 0.083 19685 10665 1 20 . 1 1 449 449 GLY N N 449 107.700 107.700 105.880 1.820 19685 10666 1 20 . 1 1 449 449 GLY C C 449 170.100 170.100 172.572 -2.472 19685 10667 1 20 . 1 1 449 449 GLY CA C 449 45.200 45.200 43.595 1.605 19685 10668 1 20 . 1 1 449 449 GLY H H 449 9.310 9.310 7.718 1.592 19685 10669 1 20 . 1 1 450 450 PHE N N 450 119.900 119.900 115.147 4.753 19685 10670 1 20 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.294 0.136 19685 10671 1 20 . 1 1 450 450 PHE C C 450 172.800 172.800 172.960 -0.160 19685 10672 1 20 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.399 -1.399 19685 10673 1 20 . 1 1 450 450 PHE CB C 450 43.600 43.600 41.487 2.113 19685 10674 1 20 . 1 1 450 450 PHE H H 450 8.760 8.760 8.518 0.242 19685 10675 1 20 . 1 1 451 451 VAL N N 451 123.800 123.800 117.884 5.916 19685 10676 1 20 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.129 0.161 19685 10677 1 20 . 1 1 451 451 VAL C C 451 172.400 172.400 175.240 -2.840 19685 10678 1 20 . 1 1 451 451 VAL CA C 451 59.800 59.800 60.501 -0.701 19685 10679 1 20 . 1 1 451 451 VAL CB C 451 36.100 36.100 35.050 1.050 19685 10680 1 20 . 1 1 451 451 VAL H H 451 7.930 7.930 8.295 -0.365 19685 10681 1 20 . 1 1 452 452 SER N N 452 119.600 119.600 124.267 -4.667 19685 10682 1 20 . 1 1 452 452 SER HA H 452 5.120 5.120 4.943 0.177 19685 10683 1 20 . 1 1 452 452 SER C C 452 173.200 173.200 173.741 -0.541 19685 10684 1 20 . 1 1 452 452 SER CA C 452 55.700 55.700 57.916 -2.216 19685 10685 1 20 . 1 1 452 452 SER CB C 452 66.100 66.100 61.754 4.346 19685 10686 1 20 . 1 1 452 452 SER H H 452 8.540 8.540 8.636 -0.096 19685 10687 1 20 . 1 1 453 453 TYR N N 453 121.400 121.400 123.115 -1.715 19685 10688 1 20 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.211 1.169 19685 10689 1 20 . 1 1 453 453 TYR C C 453 173.600 173.600 176.890 -3.290 19685 10690 1 20 . 1 1 453 453 TYR CA C 453 56.500 56.500 60.465 -3.965 19685 10691 1 20 . 1 1 453 453 TYR CB C 453 42.200 42.200 39.508 2.692 19685 10692 1 20 . 1 1 453 453 TYR H H 453 8.380 8.380 7.691 0.689 19685 10693 1 20 . 1 1 454 454 ASP N N 454 113.300 113.300 124.729 -11.429 19685 10694 1 20 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.339 0.151 19685 10695 1 20 . 1 1 454 454 ASP C C 454 176.100 176.100 175.591 0.509 19685 10696 1 20 . 1 1 454 454 ASP CA C 454 52.800 52.800 56.866 -4.066 19685 10697 1 20 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.773 -1.373 19685 10698 1 20 . 1 1 454 454 ASP H H 454 7.860 7.860 8.256 -0.396 19685 10699 1 20 . 1 1 455 455 ASN N N 455 113.800 113.800 111.974 1.826 19685 10700 1 20 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.037 0.013 19685 10701 1 20 . 1 1 455 455 ASN C C 455 173.100 173.100 173.477 -0.377 19685 10702 1 20 . 1 1 455 455 ASN CA C 455 50.700 50.700 52.306 -1.605 19685 10703 1 20 . 1 1 455 455 ASN CB C 455 41.100 41.100 39.873 1.227 19685 10704 1 20 . 1 1 455 455 ASN H H 455 7.200 7.200 8.390 -1.190 19685 10705 1 20 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.396 -0.226 19685 10706 1 20 . 1 1 456 456 PRO C C 456 177.300 177.300 176.749 0.551 19685 10707 1 20 . 1 1 456 456 PRO CA C 456 64.200 64.200 65.097 -0.897 19685 10708 1 20 . 1 1 456 456 PRO CB C 456 32.300 32.300 32.169 0.131 19685 10709 1 20 . 1 1 457 457 VAL N N 457 120.900 120.900 115.932 4.968 19685 10710 1 20 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.142 -0.522 19685 10711 1 20 . 1 1 457 457 VAL C C 457 179.000 179.000 175.602 3.398 19685 10712 1 20 . 1 1 457 457 VAL CA C 457 65.900 65.900 62.773 3.127 19685 10713 1 20 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.779 -0.979 19685 10714 1 20 . 1 1 457 457 VAL H H 457 8.120 8.120 8.043 0.077 19685 10715 1 20 . 1 1 458 458 SER N N 458 117.800 117.800 116.638 1.162 19685 10716 1 20 . 1 1 458 458 SER HA H 458 3.940 3.940 4.613 -0.673 19685 10717 1 20 . 1 1 458 458 SER C C 458 173.600 173.600 175.308 -1.708 19685 10718 1 20 . 1 1 458 458 SER CA C 458 61.100 61.100 60.009 1.091 19685 10719 1 20 . 1 1 458 458 SER CB C 458 62.400 62.400 65.131 -2.731 19685 10720 1 20 . 1 1 458 458 SER H H 458 7.830 7.830 7.891 -0.061 19685 10721 1 20 . 1 1 459 459 ALA N N 459 120.000 120.000 124.640 -4.640 19685 10722 1 20 . 1 1 459 459 ALA HA H 459 3.750 3.750 2.874 0.876 19685 10723 1 20 . 1 1 459 459 ALA C C 459 178.100 178.100 177.794 0.306 19685 10724 1 20 . 1 1 459 459 ALA CA C 459 54.500 54.500 53.639 0.861 19685 10725 1 20 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.017 -0.117 19685 10726 1 20 . 1 1 459 459 ALA H H 459 6.370 6.370 8.217 -1.847 19685 10727 1 20 . 1 1 460 460 GLN N N 460 116.100 116.100 118.083 -1.983 19685 10728 1 20 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.047 -0.217 19685 10729 1 20 . 1 1 460 460 GLN C C 460 178.000 178.000 176.534 1.466 19685 10730 1 20 . 1 1 460 460 GLN CA C 460 58.500 58.500 57.746 0.754 19685 10731 1 20 . 1 1 460 460 GLN CB C 460 27.400 27.400 27.774 -0.374 19685 10732 1 20 . 1 1 460 460 GLN H H 460 7.710 7.710 8.270 -0.560 19685 10733 1 20 . 1 1 461 461 ALA N N 461 122.800 122.800 120.122 2.678 19685 10734 1 20 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.281 -0.321 19685 10735 1 20 . 1 1 461 461 ALA C C 461 179.500 179.500 177.397 2.103 19685 10736 1 20 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.391 2.109 19685 10737 1 20 . 1 1 461 461 ALA CB C 461 17.500 17.500 18.944 -1.444 19685 10738 1 20 . 1 1 461 461 ALA H H 461 7.880 7.880 7.563 0.317 19685 10739 1 20 . 1 1 462 462 ALA N N 462 121.400 121.400 119.570 1.830 19685 10740 1 20 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.704 -1.304 19685 10741 1 20 . 1 1 462 462 ALA C C 462 179.400 179.400 178.028 1.372 19685 10742 1 20 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.613 1.487 19685 10743 1 20 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.208 -1.508 19685 10744 1 20 . 1 1 462 462 ALA H H 462 7.860 7.860 7.378 0.482 19685 10745 1 20 . 1 1 463 463 ILE N N 463 118.600 118.600 118.155 0.445 19685 10746 1 20 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.883 -0.643 19685 10747 1 20 . 1 1 463 463 ILE C C 463 177.500 177.500 176.124 1.376 19685 10748 1 20 . 1 1 463 463 ILE CA C 463 66.000 66.000 63.163 2.837 19685 10749 1 20 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.043 0.257 19685 10750 1 20 . 1 1 463 463 ILE H H 463 8.090 8.090 7.871 0.219 19685 10751 1 20 . 1 1 464 464 GLN N N 464 117.000 117.000 115.891 1.109 19685 10752 1 20 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.368 -0.498 19685 10753 1 20 . 1 1 464 464 GLN C C 464 177.700 177.700 174.899 2.801 19685 10754 1 20 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.673 2.527 19685 10755 1 20 . 1 1 464 464 GLN CB C 464 27.900 27.900 28.628 -0.729 19685 10756 1 20 . 1 1 464 464 GLN H H 464 7.780 7.780 7.944 -0.164 19685 10757 1 20 . 1 1 465 465 ALA N N 465 117.200 117.200 120.714 -3.514 19685 10758 1 20 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.205 0.025 19685 10759 1 20 . 1 1 465 465 ALA C C 465 179.200 179.200 176.732 2.468 19685 10760 1 20 . 1 1 465 465 ALA CA C 465 53.800 53.800 53.129 0.671 19685 10761 1 20 . 1 1 465 465 ALA CB C 465 21.100 21.100 20.154 0.946 19685 10762 1 20 . 1 1 465 465 ALA H H 465 7.540 7.540 7.490 0.050 19685 10763 1 20 . 1 1 466 466 MET N N 466 110.800 110.800 116.574 -5.774 19685 10764 1 20 . 1 1 466 466 MET HA H 466 4.820 4.820 4.665 0.155 19685 10765 1 20 . 1 1 466 466 MET C C 466 177.600 177.600 175.720 1.880 19685 10766 1 20 . 1 1 466 466 MET CA C 466 53.300 53.300 55.013 -1.713 19685 10767 1 20 . 1 1 466 466 MET CB C 466 31.600 31.600 34.883 -3.283 19685 10768 1 20 . 1 1 466 466 MET H H 466 8.230 8.230 7.860 0.370 19685 10769 1 20 . 1 1 467 467 ASN N N 467 119.100 119.100 118.445 0.655 19685 10770 1 20 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.622 -0.132 19685 10771 1 20 . 1 1 467 467 ASN C C 467 176.300 176.300 176.968 -0.668 19685 10772 1 20 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.514 1.685 19685 10773 1 20 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.663 -0.463 19685 10774 1 20 . 1 1 467 467 ASN H H 467 8.560 8.560 7.425 1.135 19685 10775 1 20 . 1 1 468 468 GLY N N 468 117.900 117.900 113.555 4.345 19685 10776 1 20 . 1 1 468 468 GLY C C 468 172.800 172.800 173.460 -0.660 19685 10777 1 20 . 1 1 468 468 GLY CA C 468 45.300 45.300 45.675 -0.375 19685 10778 1 20 . 1 1 468 468 GLY H H 468 8.930 8.930 8.567 0.363 19685 10779 1 20 . 1 1 469 469 PHE N N 469 123.300 123.300 120.902 2.398 19685 10780 1 20 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.746 -0.556 19685 10781 1 20 . 1 1 469 469 PHE C C 469 174.400 174.400 173.550 0.850 19685 10782 1 20 . 1 1 469 469 PHE CA C 469 58.700 58.700 55.952 2.748 19685 10783 1 20 . 1 1 469 469 PHE CB C 469 40.600 40.600 41.732 -1.132 19685 10784 1 20 . 1 1 469 469 PHE H H 469 7.950 7.950 7.586 0.364 19685 10785 1 20 . 1 1 470 470 GLN N N 470 129.200 129.200 126.486 2.714 19685 10786 1 20 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.334 0.256 19685 10787 1 20 . 1 1 470 470 GLN C C 470 174.100 174.100 174.709 -0.609 19685 10788 1 20 . 1 1 470 470 GLN CA C 470 55.500 55.500 55.030 0.470 19685 10789 1 20 . 1 1 470 470 GLN CB C 470 28.800 28.800 29.508 -0.708 19685 10790 1 20 . 1 1 470 470 GLN H H 470 8.330 8.330 8.125 0.205 19685 10791 1 20 . 1 1 471 471 ILE N N 471 126.300 126.300 124.916 1.384 19685 10792 1 20 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.177 -0.007 19685 10793 1 20 . 1 1 471 471 ILE C C 471 175.400 175.400 174.019 1.381 19685 10794 1 20 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.307 -0.707 19685 10795 1 20 . 1 1 471 471 ILE CB C 471 39.100 39.100 38.315 0.785 19685 10796 1 20 . 1 1 471 471 ILE H H 471 8.440 8.440 8.688 -0.248 19685 10797 1 20 . 1 1 472 472 GLY N N 472 117.500 117.500 110.450 7.050 19685 10798 1 20 . 1 1 472 472 GLY C C 472 174.700 174.700 175.386 -0.686 19685 10799 1 20 . 1 1 472 472 GLY CA C 472 46.500 46.500 44.550 1.950 19685 10800 1 20 . 1 1 472 472 GLY H H 472 8.980 8.980 8.391 0.589 19685 10801 1 20 . 1 1 473 473 MET N N 473 124.100 124.100 115.672 8.428 19685 10802 1 20 . 1 1 473 473 MET HA H 473 4.380 4.380 4.038 0.342 19685 10803 1 20 . 1 1 473 473 MET C C 473 175.700 175.700 174.773 0.927 19685 10804 1 20 . 1 1 473 473 MET CA C 473 55.000 55.000 57.246 -2.246 19685 10805 1 20 . 1 1 473 473 MET CB C 473 32.900 32.900 31.052 1.848 19685 10806 1 20 . 1 1 473 473 MET H H 473 9.070 9.070 8.721 0.349 19685 10807 1 20 . 1 1 474 474 LYS N N 474 118.700 118.700 114.823 3.877 19685 10808 1 20 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.548 -0.068 19685 10809 1 20 . 1 1 474 474 LYS C C 474 174.300 174.300 173.931 0.369 19685 10810 1 20 . 1 1 474 474 LYS CA C 474 54.600 54.600 55.059 -0.459 19685 10811 1 20 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.073 0.027 19685 10812 1 20 . 1 1 474 474 LYS H H 474 7.770 7.770 7.555 0.215 19685 10813 1 20 . 1 1 475 475 ARG N N 475 119.600 119.600 118.740 0.860 19685 10814 1 20 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.882 -0.082 19685 10815 1 20 . 1 1 475 475 ARG C C 475 175.700 175.700 174.212 1.488 19685 10816 1 20 . 1 1 475 475 ARG CA C 475 54.000 54.000 54.463 -0.463 19685 10817 1 20 . 1 1 475 475 ARG CB C 475 31.300 31.300 32.647 -1.347 19685 10818 1 20 . 1 1 475 475 ARG H H 475 8.350 8.350 8.123 0.227 19685 10819 1 20 . 1 1 476 476 LEU N N 476 123.500 123.500 120.556 2.944 19685 10820 1 20 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.518 -0.088 19685 10821 1 20 . 1 1 476 476 LEU C C 476 177.600 177.600 176.480 1.120 19685 10822 1 20 . 1 1 476 476 LEU CA C 476 55.500 55.500 54.294 1.206 19685 10823 1 20 . 1 1 476 476 LEU CB C 476 42.800 42.800 42.927 -0.127 19685 10824 1 20 . 1 1 476 476 LEU H H 476 9.130 9.130 8.047 1.083 19685 10825 1 20 . 1 1 477 477 LYS N N 477 123.200 123.200 119.725 3.475 19685 10826 1 20 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.582 0.578 19685 10827 1 20 . 1 1 477 477 LYS C C 477 174.100 174.100 175.513 -1.413 19685 10828 1 20 . 1 1 477 477 LYS CA C 477 54.500 54.500 54.808 -0.308 19685 10829 1 20 . 1 1 477 477 LYS CB C 477 34.900 34.900 32.340 2.560 19685 10830 1 20 . 1 1 477 477 LYS H H 477 8.090 8.090 8.462 -0.372 19685 10831 1 20 . 1 1 478 478 VAL N N 478 127.100 127.100 120.820 6.280 19685 10832 1 20 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.306 0.594 19685 10833 1 20 . 1 1 478 478 VAL C C 478 173.700 173.700 175.128 -1.428 19685 10834 1 20 . 1 1 478 478 VAL CA C 478 61.000 61.000 63.276 -2.276 19685 10835 1 20 . 1 1 478 478 VAL CB C 478 33.700 33.700 32.484 1.216 19685 10836 1 20 . 1 1 478 478 VAL H H 478 8.820 8.820 7.904 0.916 19685 10837 1 20 . 1 1 479 479 GLN N N 479 123.600 123.600 125.357 -1.757 19685 10838 1 20 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.457 0.353 19685 10839 1 20 . 1 1 479 479 GLN C C 479 173.600 173.600 173.857 -0.257 19685 10840 1 20 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.514 -1.314 19685 10841 1 20 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.693 0.807 19685 10842 1 20 . 1 1 479 479 GLN H H 479 9.130 9.130 8.352 0.778 19685 10843 1 20 . 1 1 480 480 LEU N N 480 123.200 123.200 123.675 -0.475 19685 10844 1 20 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.373 0.067 19685 10845 1 20 . 1 1 480 480 LEU C C 480 177.100 177.100 177.038 0.062 19685 10846 1 20 . 1 1 480 480 LEU CA C 480 54.600 54.600 55.602 -1.002 19685 10847 1 20 . 1 1 480 480 LEU CB C 480 42.400 42.400 41.883 0.518 19685 10848 1 20 . 1 1 480 480 LEU H H 480 8.840 8.840 8.550 0.290 19685 10849 1 20 . 1 1 481 481 LYS N N 481 124.500 124.500 124.725 -0.225 19685 10850 1 20 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.081 0.229 19685 10851 1 20 . 1 1 481 481 LYS C C 481 175.200 175.200 177.121 -1.921 19685 10852 1 20 . 1 1 481 481 LYS CA C 481 56.700 56.700 58.686 -1.986 19685 10853 1 20 . 1 1 481 481 LYS CB C 481 33.100 33.100 31.565 1.535 19685 10854 1 20 . 1 1 481 481 LYS H H 481 8.400 8.400 8.795 -0.395 19685 10855 1 20 . 1 1 482 482 ARG N N 482 126.600 126.600 117.655 8.945 19685 10856 1 20 . 1 1 482 482 ARG HA H 482 4.350 4.350 3.979 0.371 19685 10857 1 20 . 1 1 482 482 ARG C C 482 175.800 175.800 175.304 0.496 19685 10858 1 20 . 1 1 482 482 ARG CA C 482 55.600 55.600 57.946 -2.346 19685 10859 1 20 . 1 1 482 482 ARG CB C 482 31.100 31.100 27.480 3.620 19685 10860 1 20 . 1 1 482 482 ARG H H 482 8.770 8.770 8.697 0.073 19685 10861 1 20 . 1 1 483 483 SER N N 483 118.100 118.100 112.250 5.850 19685 10862 1 20 . 1 1 483 483 SER HA H 483 4.400 4.400 4.248 0.152 19685 10863 1 20 . 1 1 483 483 SER C C 483 174.200 174.200 173.885 0.315 19685 10864 1 20 . 1 1 483 483 SER CA C 483 58.000 58.000 57.444 0.556 19685 10865 1 20 . 1 1 483 483 SER CB C 483 63.500 63.500 63.771 -0.271 19685 10866 1 20 . 1 1 483 483 SER H H 483 8.610 8.610 7.236 1.374 19685 10867 1 20 . 1 1 484 484 LYS N N 484 123.000 123.000 121.148 1.852 19685 10868 1 20 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.346 -0.136 19685 10869 1 20 . 1 1 484 484 LYS C C 484 175.900 175.900 174.463 1.437 19685 10870 1 20 . 1 1 484 484 LYS CA C 484 56.300 56.300 57.885 -1.585 19685 10871 1 20 . 1 1 484 484 LYS CB C 484 32.500 32.500 32.126 0.374 19685 10872 1 20 . 1 1 484 484 LYS H H 484 8.560 8.560 8.184 0.376 19685 10873 1 20 . 1 1 485 485 ASN N N 485 119.600 119.600 117.553 2.047 19685 10874 1 20 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.947 -0.347 19685 10875 1 20 . 1 1 485 485 ASN C C 485 174.400 174.400 173.661 0.739 19685 10876 1 20 . 1 1 485 485 ASN CA C 485 52.900 52.900 53.075 -0.175 19685 10877 1 20 . 1 1 485 485 ASN CB C 485 38.400 38.400 39.529 -1.129 19685 10878 1 20 . 1 1 485 485 ASN H H 485 8.560 8.560 8.117 0.443 19685 10879 1 20 . 1 1 486 486 ASP N N 486 121.100 121.100 123.618 -2.518 19685 10880 1 20 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.821 -0.301 19685 10881 1 20 . 1 1 486 486 ASP C C 486 175.700 175.700 175.311 0.389 19685 10882 1 20 . 1 1 486 486 ASP CA C 486 54.000 54.000 53.701 0.299 19685 10883 1 20 . 1 1 486 486 ASP CB C 486 40.800 40.800 43.745 -2.945 19685 10884 1 20 . 1 1 486 486 ASP H H 486 8.250 8.250 8.276 -0.026 19685 10885 1 20 . 1 1 487 487 SER N N 487 115.400 115.400 117.106 -1.706 19685 10886 1 20 . 1 1 487 487 SER HA H 487 4.310 4.310 4.608 -0.298 19685 10887 1 20 . 1 1 487 487 SER C C 487 172.800 172.800 174.108 -1.308 19685 10888 1 20 . 1 1 487 487 SER CA C 487 57.700 57.700 58.186 -0.486 19685 10889 1 20 . 1 1 487 487 SER CB C 487 63.600 63.600 63.963 -0.363 19685 10890 1 20 . 1 1 487 487 SER H H 487 8.090 8.090 8.473 -0.383 19685 10891 1 20 . 1 1 488 488 LYS N N 488 122.300 122.300 121.339 0.961 19685 10892 1 20 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.693 -0.643 19685 10893 1 20 . 1 1 488 488 LYS C C 488 174.500 174.500 174.296 0.204 19685 10894 1 20 . 1 1 488 488 LYS CA C 488 54.000 54.000 54.144 -0.144 19685 10895 1 20 . 1 1 488 488 LYS CB C 488 32.400 32.400 32.279 0.121 19685 10896 1 20 . 1 1 488 488 LYS H H 488 8.090 8.090 8.156 -0.066 19685 10897 1 20 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.394 -0.114 19685 10898 1 20 . 1 1 489 489 PRO C C 489 175.000 175.000 174.959 0.041 19685 10899 1 20 . 1 1 489 489 PRO CA C 489 63.200 63.200 63.176 0.024 19685 10900 1 20 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.014 -0.914 19685 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 90 4.672 -1.088 4.569 19685 2 1 1 "Average Difference" HA 101 0.400 0.054 0.399 19685 3 1 1 "Average Difference" C 95 1.495 0.060 1.501 19685 4 1 1 "Average Difference" CA 95 1.575 0.171 1.574 19685 5 1 1 "Average Difference" CB 88 1.718 0.216 1.714 19685 6 1 1 "Average Difference" HN 90 0.672 -0.214 0.640 19685 7 1 2 "Average Difference" N 90 4.615 -1.259 4.465 19685 8 1 2 "Average Difference" HA 101 0.431 0.042 0.431 19685 9 1 2 "Average Difference" C 95 1.476 0.060 1.482 19685 10 1 2 "Average Difference" CA 95 1.714 0.160 1.715 19685 11 1 2 "Average Difference" CB 88 1.907 0.107 1.915 19685 12 1 2 "Average Difference" HN 90 0.703 -0.234 0.667 19685 13 1 3 "Average Difference" N 90 4.681 -1.356 4.505 19685 14 1 3 "Average Difference" HA 101 0.412 0.062 0.409 19685 15 1 3 "Average Difference" C 95 1.392 0.028 1.399 19685 16 1 3 "Average Difference" CA 95 1.742 0.164 1.743 19685 17 1 3 "Average Difference" CB 88 1.810 0.084 1.818 19685 18 1 3 "Average Difference" HN 90 0.647 -0.215 0.613 19685 19 1 4 "Average Difference" N 90 4.364 -0.890 4.297 19685 20 1 4 "Average Difference" HA 101 0.432 0.057 0.430 19685 21 1 4 "Average Difference" C 95 1.435 0.101 1.439 19685 22 1 4 "Average Difference" CA 95 1.610 0.220 1.603 19685 23 1 4 "Average Difference" CB 88 1.787 0.036 1.796 19685 24 1 4 "Average Difference" HN 90 0.666 -0.219 0.632 19685 25 1 5 "Average Difference" N 90 4.923 -1.508 4.713 19685 26 1 5 "Average Difference" HA 101 0.422 0.015 0.424 19685 27 1 5 "Average Difference" C 95 1.378 0.164 1.376 19685 28 1 5 "Average Difference" CA 95 1.673 0.285 1.657 19685 29 1 5 "Average Difference" CB 88 1.874 0.008 1.884 19685 30 1 5 "Average Difference" HN 90 0.655 -0.245 0.611 19685 31 1 6 "Average Difference" N 90 4.729 -1.426 4.535 19685 32 1 6 "Average Difference" HA 101 0.487 0.036 0.488 19685 33 1 6 "Average Difference" C 95 1.488 0.160 1.487 19685 34 1 6 "Average Difference" CA 95 1.724 0.301 1.706 19685 35 1 6 "Average Difference" CB 88 1.946 -0.043 1.956 19685 36 1 6 "Average Difference" HN 90 0.722 -0.242 0.684 19685 37 1 7 "Average Difference" N 90 4.488 -1.250 4.335 19685 38 1 7 "Average Difference" HA 101 0.384 0.069 0.380 19685 39 1 7 "Average Difference" C 95 1.377 0.134 1.378 19685 40 1 7 "Average Difference" CA 95 1.481 0.149 1.481 19685 41 1 7 "Average Difference" CB 88 1.902 0.199 1.903 19685 42 1 7 "Average Difference" HN 90 0.714 -0.225 0.682 19685 43 1 8 "Average Difference" N 90 4.872 -1.403 4.692 19685 44 1 8 "Average Difference" HA 101 0.414 0.105 0.402 19685 45 1 8 "Average Difference" C 95 1.472 0.010 1.479 19685 46 1 8 "Average Difference" CA 95 1.738 0.089 1.745 19685 47 1 8 "Average Difference" CB 88 1.683 0.113 1.688 19685 48 1 8 "Average Difference" HN 90 0.716 -0.234 0.681 19685 49 1 9 "Average Difference" N 90 4.459 -1.454 4.239 19685 50 1 9 "Average Difference" HA 101 0.389 0.060 0.386 19685 51 1 9 "Average Difference" C 95 1.353 0.118 1.355 19685 52 1 9 "Average Difference" CA 95 1.595 0.166 1.595 19685 53 1 9 "Average Difference" CB 88 1.699 0.107 1.705 19685 54 1 9 "Average Difference" HN 90 0.626 -0.217 0.590 19685 55 1 10 "Average Difference" N 90 4.838 -1.455 4.640 19685 56 1 10 "Average Difference" HA 101 0.437 0.059 0.435 19685 57 1 10 "Average Difference" C 95 1.330 0.133 1.331 19685 58 1 10 "Average Difference" CA 95 1.633 0.230 1.625 19685 59 1 10 "Average Difference" CB 88 1.752 0.029 1.762 19685 60 1 10 "Average Difference" HN 90 0.613 -0.201 0.582 19685 61 1 11 "Average Difference" N 90 4.862 -1.327 4.704 19685 62 1 11 "Average Difference" HA 101 0.456 0.066 0.453 19685 63 1 11 "Average Difference" C 95 1.439 -0.025 1.446 19685 64 1 11 "Average Difference" CA 95 1.679 0.247 1.669 19685 65 1 11 "Average Difference" CB 88 1.838 0.096 1.846 19685 66 1 11 "Average Difference" HN 90 0.632 -0.189 0.606 19685 67 1 12 "Average Difference" N 90 4.516 -1.102 4.404 19685 68 1 12 "Average Difference" HA 101 0.486 0.077 0.482 19685 69 1 12 "Average Difference" C 95 1.488 0.060 1.495 19685 70 1 12 "Average Difference" CA 95 1.560 0.137 1.562 19685 71 1 12 "Average Difference" CB 88 1.957 0.026 1.968 19685 72 1 12 "Average Difference" HN 90 0.698 -0.225 0.665 19685 73 1 13 "Average Difference" N 90 4.945 -1.446 4.756 19685 74 1 13 "Average Difference" HA 101 0.416 0.063 0.414 19685 75 1 13 "Average Difference" C 95 1.384 0.202 1.376 19685 76 1 13 "Average Difference" CA 95 1.607 0.254 1.595 19685 77 1 13 "Average Difference" CB 88 1.645 -0.025 1.654 19685 78 1 13 "Average Difference" HN 90 0.633 -0.245 0.587 19685 79 1 14 "Average Difference" N 90 4.604 -1.023 4.515 19685 80 1 14 "Average Difference" HA 101 0.406 0.097 0.397 19685 81 1 14 "Average Difference" C 95 1.368 0.026 1.375 19685 82 1 14 "Average Difference" CA 95 1.543 0.076 1.550 19685 83 1 14 "Average Difference" CB 88 1.892 0.253 1.886 19685 84 1 14 "Average Difference" HN 90 0.652 -0.221 0.617 19685 85 1 15 "Average Difference" N 90 5.097 -1.695 4.834 19685 86 1 15 "Average Difference" HA 101 0.436 0.052 0.435 19685 87 1 15 "Average Difference" C 95 1.470 0.201 1.464 19685 88 1 15 "Average Difference" CA 95 1.710 0.371 1.678 19685 89 1 15 "Average Difference" CB 88 1.846 -0.022 1.856 19685 90 1 15 "Average Difference" HN 90 0.728 -0.255 0.686 19685 91 1 16 "Average Difference" N 90 4.596 -1.511 4.365 19685 92 1 16 "Average Difference" HA 101 0.482 0.056 0.481 19685 93 1 16 "Average Difference" C 95 1.370 0.031 1.377 19685 94 1 16 "Average Difference" CA 95 1.664 0.255 1.653 19685 95 1 16 "Average Difference" CB 88 2.011 0.248 2.007 19685 96 1 16 "Average Difference" HN 90 0.704 -0.231 0.669 19685 97 1 17 "Average Difference" N 90 4.631 -1.343 4.457 19685 98 1 17 "Average Difference" HA 101 0.416 0.081 0.410 19685 99 1 17 "Average Difference" C 95 1.361 0.114 1.363 19685 100 1 17 "Average Difference" CA 95 1.630 0.204 1.626 19685 101 1 17 "Average Difference" CB 88 1.821 0.093 1.829 19685 102 1 17 "Average Difference" HN 90 0.604 -0.237 0.558 19685 103 1 18 "Average Difference" N 90 4.613 -1.454 4.402 19685 104 1 18 "Average Difference" HA 101 0.420 0.076 0.416 19685 105 1 18 "Average Difference" C 95 1.369 0.051 1.375 19685 106 1 18 "Average Difference" CA 95 1.700 0.203 1.697 19685 107 1 18 "Average Difference" CB 88 1.740 0.165 1.742 19685 108 1 18 "Average Difference" HN 90 0.586 -0.220 0.547 19685 109 1 19 "Average Difference" N 90 4.755 -1.333 4.590 19685 110 1 19 "Average Difference" HA 101 0.458 0.068 0.455 19685 111 1 19 "Average Difference" C 95 1.388 0.011 1.395 19685 112 1 19 "Average Difference" CA 95 1.816 0.271 1.805 19685 113 1 19 "Average Difference" CB 88 1.970 0.062 1.980 19685 114 1 19 "Average Difference" HN 90 0.650 -0.206 0.620 19685 115 1 20 "Average Difference" N 90 4.697 -1.173 4.574 19685 116 1 20 "Average Difference" HA 101 0.455 0.017 0.457 19685 117 1 20 "Average Difference" C 95 1.364 0.065 1.369 19685 118 1 20 "Average Difference" CA 95 1.679 0.299 1.661 19685 119 1 20 "Average Difference" CB 88 1.828 -0.077 1.837 19685 120 1 20 "Average Difference" HN 90 0.662 -0.225 0.626 19685 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 19685 _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 1 395 395 SER N N 395 115.500 115.500 115.156 0.344 19685 2 1 . 1 1 395 395 SER HA H 395 4.300 4.300 4.611 -0.311 19685 3 1 . 1 1 395 395 SER C C 395 173.900 173.900 173.584 0.316 19685 4 1 . 1 1 395 395 SER CA C 395 57.900 57.900 57.920 -0.020 19685 5 1 . 1 1 395 395 SER CB C 395 63.400 63.400 64.172 -0.772 19685 6 1 . 1 1 395 395 SER H H 395 8.200 8.200 8.463 -0.263 19685 7 1 . 1 1 396 396 HIS N N 396 123.500 123.500 118.983 4.517 19685 8 1 . 1 1 396 396 HIS HA H 396 4.560 4.560 4.744 -0.184 19685 9 1 . 1 1 396 396 HIS C C 396 174.100 174.100 174.239 -0.139 19685 10 1 . 1 1 396 396 HIS CA C 396 53.700 53.700 56.008 -2.308 19685 11 1 . 1 1 396 396 HIS CB C 396 32.200 32.200 30.657 1.543 19685 12 1 . 1 1 396 396 HIS H H 396 8.120 8.120 8.343 -0.223 19685 13 1 . 1 1 397 397 MET N N 397 121.200 121.200 119.214 1.986 19685 14 1 . 1 1 397 397 MET HA H 397 4.320 4.320 4.547 -0.227 19685 15 1 . 1 1 397 397 MET C C 397 175.400 175.400 175.212 0.188 19685 16 1 . 1 1 397 397 MET CA C 397 55.000 55.000 55.413 -0.413 19685 17 1 . 1 1 397 397 MET CB C 397 32.500 32.500 33.977 -1.477 19685 18 1 . 1 1 397 397 MET H H 397 8.300 8.300 8.051 0.249 19685 19 1 . 1 1 398 398 GLN N N 398 122.100 122.100 118.882 3.218 19685 20 1 . 1 1 398 398 GLN HA H 398 4.190 4.190 4.282 -0.092 19685 21 1 . 1 1 398 398 GLN C C 398 174.800 174.800 175.203 -0.403 19685 22 1 . 1 1 398 398 GLN CA C 398 55.200 55.200 56.500 -1.300 19685 23 1 . 1 1 398 398 GLN CB C 398 28.900 28.900 29.104 -0.204 19685 24 1 . 1 1 398 398 GLN H H 398 8.540 8.540 8.476 0.064 19685 25 1 . 1 1 399 399 LYS N N 399 123.000 123.000 119.078 3.922 19685 26 1 . 1 1 399 399 LYS HA H 399 4.220 4.220 4.448 -0.228 19685 27 1 . 1 1 399 399 LYS C C 399 174.800 174.800 176.026 -1.226 19685 28 1 . 1 1 399 399 LYS CA C 399 55.600 55.600 56.168 -0.568 19685 29 1 . 1 1 399 399 LYS CB C 399 33.000 33.000 33.588 -0.588 19685 30 1 . 1 1 399 399 LYS H H 399 8.180 8.180 8.305 -0.125 19685 31 1 . 1 1 400 400 GLU N N 400 122.000 122.000 117.742 4.258 19685 32 1 . 1 1 400 400 GLU HA H 400 4.430 4.430 4.458 -0.028 19685 33 1 . 1 1 400 400 GLU C C 400 176.400 176.400 175.840 0.560 19685 34 1 . 1 1 400 400 GLU CA C 400 55.400 55.400 56.067 -0.667 19685 35 1 . 1 1 400 400 GLU CB C 400 31.400 31.400 30.195 1.205 19685 36 1 . 1 1 400 400 GLU H H 400 8.350 8.350 8.225 0.125 19685 37 1 . 1 1 401 401 GLY N N 401 109.500 109.500 107.747 1.753 19685 38 1 . 1 1 401 401 GLY C C 401 171.500 171.500 173.041 -1.541 19685 39 1 . 1 1 401 401 GLY CA C 401 43.700 43.700 44.296 -0.596 19685 40 1 . 1 1 401 401 GLY H H 401 9.050 9.050 7.961 1.089 19685 41 1 . 1 1 402 402 PRO HA H 402 4.420 4.420 4.478 -0.058 19685 42 1 . 1 1 402 402 PRO C C 402 173.900 173.900 176.421 -2.521 19685 43 1 . 1 1 402 402 PRO CA C 402 61.900 61.900 63.980 -2.080 19685 44 1 . 1 1 402 402 PRO CB C 402 32.200 32.200 32.576 -0.376 19685 45 1 . 1 1 403 403 GLU N N 403 119.600 119.600 117.740 1.860 19685 46 1 . 1 1 403 403 GLU HA H 403 3.960 3.960 4.360 -0.400 19685 47 1 . 1 1 403 403 GLU C C 403 177.300 177.300 176.053 1.247 19685 48 1 . 1 1 403 403 GLU CA C 403 58.100 58.100 56.928 1.172 19685 49 1 . 1 1 403 403 GLU CB C 403 29.000 29.000 30.523 -1.523 19685 50 1 . 1 1 403 403 GLU H H 403 8.420 8.420 8.123 0.297 19685 51 1 . 1 1 404 404 GLY N N 404 112.800 112.800 108.003 4.797 19685 52 1 . 1 1 404 404 GLY C C 404 173.300 173.300 173.951 -0.651 19685 53 1 . 1 1 404 404 GLY CA C 404 44.900 44.900 45.634 -0.734 19685 54 1 . 1 1 404 404 GLY H H 404 8.500 8.500 8.392 0.108 19685 55 1 . 1 1 405 405 ALA N N 405 120.000 120.000 124.108 -4.108 19685 56 1 . 1 1 405 405 ALA HA H 405 4.550 4.550 4.293 0.257 19685 57 1 . 1 1 405 405 ALA C C 405 174.100 174.100 175.686 -1.586 19685 58 1 . 1 1 405 405 ALA CA C 405 50.500 50.500 51.850 -1.350 19685 59 1 . 1 1 405 405 ALA CB C 405 20.800 20.800 17.311 3.489 19685 60 1 . 1 1 405 405 ALA H H 405 8.360 8.360 8.200 0.160 19685 61 1 . 1 1 406 406 ASN N N 406 115.500 115.500 117.547 -2.047 19685 62 1 . 1 1 406 406 ASN HA H 406 5.190 5.190 5.149 0.041 19685 63 1 . 1 1 406 406 ASN C C 406 172.900 172.900 174.555 -1.655 19685 64 1 . 1 1 406 406 ASN CA C 406 52.600 52.600 51.765 0.835 19685 65 1 . 1 1 406 406 ASN CB C 406 40.900 40.900 39.153 1.747 19685 66 1 . 1 1 406 406 ASN H H 406 7.690 7.690 8.040 -0.350 19685 67 1 . 1 1 407 407 LEU N N 407 123.400 123.400 121.322 2.078 19685 68 1 . 1 1 407 407 LEU HA H 407 4.960 4.960 4.310 0.650 19685 69 1 . 1 1 407 407 LEU C C 407 174.900 174.900 176.640 -1.740 19685 70 1 . 1 1 407 407 LEU CA C 407 53.100 53.100 55.738 -2.638 19685 71 1 . 1 1 407 407 LEU CB C 407 45.400 45.400 41.824 3.576 19685 72 1 . 1 1 407 407 LEU H H 407 9.290 9.290 7.714 1.576 19685 73 1 . 1 1 408 408 PHE N N 408 118.700 118.700 121.614 -2.914 19685 74 1 . 1 1 408 408 PHE HA H 408 5.300 5.300 4.782 0.518 19685 75 1 . 1 1 408 408 PHE C C 408 174.200 174.200 175.340 -1.140 19685 76 1 . 1 1 408 408 PHE CA C 408 56.300 56.300 57.360 -1.060 19685 77 1 . 1 1 408 408 PHE CB C 408 42.700 42.700 38.134 4.566 19685 78 1 . 1 1 408 408 PHE H H 408 9.150 9.150 8.183 0.967 19685 79 1 . 1 1 409 409 ILE N N 409 120.800 120.800 122.082 -1.282 19685 80 1 . 1 1 409 409 ILE HA H 409 4.970 4.970 4.353 0.617 19685 81 1 . 1 1 409 409 ILE C C 409 173.900 173.900 174.979 -1.079 19685 82 1 . 1 1 409 409 ILE CA C 409 59.000 59.000 61.454 -2.454 19685 83 1 . 1 1 409 409 ILE CB C 409 40.400 40.400 38.609 1.791 19685 84 1 . 1 1 409 409 ILE H H 409 8.380 8.380 8.098 0.282 19685 85 1 . 1 1 410 410 TYR N N 410 123.200 123.200 123.233 -0.033 19685 86 1 . 1 1 410 410 TYR HA H 410 4.940 4.940 4.826 0.114 19685 87 1 . 1 1 410 410 TYR C C 410 174.300 174.300 174.963 -0.663 19685 88 1 . 1 1 410 410 TYR CA C 410 56.200 56.200 57.415 -1.215 19685 89 1 . 1 1 410 410 TYR CB C 410 40.800 40.800 39.178 1.622 19685 90 1 . 1 1 410 410 TYR H H 410 9.440 9.440 8.521 0.919 19685 91 1 . 1 1 411 411 HIS N N 411 112.100 112.100 119.822 -7.722 19685 92 1 . 1 1 411 411 HIS HA H 411 4.450 4.450 4.409 0.041 19685 93 1 . 1 1 411 411 HIS C C 411 173.300 173.300 175.035 -1.736 19685 94 1 . 1 1 411 411 HIS CA C 411 55.900 55.900 56.077 -0.177 19685 95 1 . 1 1 411 411 HIS CB C 411 26.200 26.200 28.604 -2.404 19685 96 1 . 1 1 411 411 HIS H H 411 8.580 8.580 8.233 0.347 19685 97 1 . 1 1 412 412 LEU N N 412 115.100 115.100 120.073 -4.973 19685 98 1 . 1 1 412 412 LEU HA H 412 3.960 3.960 4.345 -0.385 19685 99 1 . 1 1 412 412 LEU C C 412 175.100 175.100 175.266 -0.166 19685 100 1 . 1 1 412 412 LEU CA C 412 52.400 52.400 54.049 -1.649 19685 101 1 . 1 1 412 412 LEU CB C 412 42.000 42.000 41.887 0.113 19685 102 1 . 1 1 412 412 LEU H H 412 7.560 7.560 7.703 -0.143 19685 103 1 . 1 1 413 413 PRO HA H 413 4.270 4.270 4.398 -0.128 19685 104 1 . 1 1 413 413 PRO C C 413 177.600 177.600 176.957 0.643 19685 105 1 . 1 1 413 413 PRO CA C 413 62.300 62.300 63.060 -0.760 19685 106 1 . 1 1 413 413 PRO CB C 413 32.200 32.200 32.225 -0.025 19685 107 1 . 1 1 414 414 GLN N N 414 125.500 125.500 118.175 7.325 19685 108 1 . 1 1 414 414 GLN HA H 414 4.080 4.080 4.282 -0.202 19685 109 1 . 1 1 414 414 GLN C C 414 175.400 175.400 175.786 -0.386 19685 110 1 . 1 1 414 414 GLN CA C 414 57.000 57.000 57.062 -0.062 19685 111 1 . 1 1 414 414 GLN CB C 414 28.500 28.500 29.127 -0.627 19685 112 1 . 1 1 414 414 GLN H H 414 9.170 9.170 8.515 0.655 19685 113 1 . 1 1 415 415 GLU N N 415 115.300 115.300 118.369 -3.069 19685 114 1 . 1 1 415 415 GLU HA H 415 4.260 4.260 4.416 -0.156 19685 115 1 . 1 1 415 415 GLU C C 415 176.700 176.700 175.209 1.491 19685 116 1 . 1 1 415 415 GLU CA C 415 58.700 58.700 56.256 2.444 19685 117 1 . 1 1 415 415 GLU CB C 415 28.300 28.300 30.223 -1.923 19685 118 1 . 1 1 415 415 GLU H H 415 9.390 9.390 8.488 0.902 19685 119 1 . 1 1 416 416 PHE N N 416 121.700 121.700 117.184 4.516 19685 120 1 . 1 1 416 416 PHE HA H 416 4.610 4.610 5.084 -0.474 19685 121 1 . 1 1 416 416 PHE C C 416 176.400 176.400 175.648 0.752 19685 122 1 . 1 1 416 416 PHE CA C 416 57.400 57.400 56.510 0.890 19685 123 1 . 1 1 416 416 PHE CB C 416 38.700 38.700 41.921 -3.221 19685 124 1 . 1 1 416 416 PHE H H 416 7.610 7.610 7.555 0.055 19685 125 1 . 1 1 417 417 GLY N N 417 113.000 113.000 107.476 5.524 19685 126 1 . 1 1 417 417 GLY C C 417 174.300 174.300 173.038 1.262 19685 127 1 . 1 1 417 417 GLY CA C 417 42.900 42.900 46.185 -3.285 19685 128 1 . 1 1 417 417 GLY H H 417 9.740 9.740 9.179 0.561 19685 129 1 . 1 1 418 418 ASP N N 418 121.500 121.500 117.614 3.886 19685 130 1 . 1 1 418 418 ASP HA H 418 3.940 3.940 4.652 -0.712 19685 131 1 . 1 1 418 418 ASP C C 418 177.900 177.900 176.562 1.337 19685 132 1 . 1 1 418 418 ASP CA C 418 57.600 57.600 54.860 2.740 19685 133 1 . 1 1 418 418 ASP CB C 418 39.700 39.700 41.425 -1.725 19685 134 1 . 1 1 418 418 ASP H H 418 8.680 8.680 8.257 0.423 19685 135 1 . 1 1 419 419 GLN N N 419 116.400 116.400 119.514 -3.114 19685 136 1 . 1 1 419 419 GLN HA H 419 3.910 3.910 4.276 -0.366 19685 137 1 . 1 1 419 419 GLN C C 419 177.600 177.600 175.624 1.976 19685 138 1 . 1 1 419 419 GLN CA C 419 58.000 58.000 57.745 0.255 19685 139 1 . 1 1 419 419 GLN CB C 419 27.400 27.400 28.717 -1.317 19685 140 1 . 1 1 419 419 GLN H H 419 8.780 8.780 8.394 0.386 19685 141 1 . 1 1 420 420 ASP N N 420 117.500 117.500 116.654 0.846 19685 142 1 . 1 1 420 420 ASP HA H 420 4.010 4.010 4.637 -0.628 19685 143 1 . 1 1 420 420 ASP C C 420 178.000 178.000 177.315 0.685 19685 144 1 . 1 1 420 420 ASP CA C 420 56.700 56.700 53.939 2.761 19685 145 1 . 1 1 420 420 ASP CB C 420 39.800 39.800 40.637 -0.837 19685 146 1 . 1 1 420 420 ASP H H 420 7.210 7.210 8.237 -1.027 19685 147 1 . 1 1 421 421 ILE N N 421 117.000 117.000 121.123 -4.123 19685 148 1 . 1 1 421 421 ILE HA H 421 4.080 4.080 4.016 0.064 19685 149 1 . 1 1 421 421 ILE C C 421 176.500 176.500 176.552 -0.052 19685 150 1 . 1 1 421 421 ILE CA C 421 64.000 64.000 63.773 0.227 19685 151 1 . 1 1 421 421 ILE CB C 421 37.300 37.300 38.113 -0.813 19685 152 1 . 1 1 421 421 ILE H H 421 7.610 7.610 7.876 -0.266 19685 153 1 . 1 1 422 422 LEU N N 422 123.200 123.200 118.568 4.632 19685 154 1 . 1 1 422 422 LEU HA H 422 3.760 3.760 4.146 -0.386 19685 155 1 . 1 1 422 422 LEU C C 422 177.800 177.800 177.185 0.615 19685 156 1 . 1 1 422 422 LEU CA C 422 58.600 58.600 56.706 1.894 19685 157 1 . 1 1 422 422 LEU CB C 422 41.200 41.200 41.590 -0.390 19685 158 1 . 1 1 422 422 LEU H H 422 7.870 7.870 7.925 -0.055 19685 159 1 . 1 1 423 423 GLN N N 423 115.600 115.600 116.918 -1.318 19685 160 1 . 1 1 423 423 GLN HA H 423 3.880 3.880 4.345 -0.465 19685 161 1 . 1 1 423 423 GLN C C 423 177.800 177.800 175.871 1.929 19685 162 1 . 1 1 423 423 GLN CA C 423 58.600 58.600 56.470 2.130 19685 163 1 . 1 1 423 423 GLN CB C 423 27.900 27.900 29.719 -1.819 19685 164 1 . 1 1 423 423 GLN H H 423 7.860 7.860 7.882 -0.022 19685 165 1 . 1 1 424 424 MET N N 424 115.500 115.500 117.576 -2.075 19685 166 1 . 1 1 424 424 MET HA H 424 3.910 3.910 4.500 -0.590 19685 167 1 . 1 1 424 424 MET C C 424 175.500 175.500 175.491 0.009 19685 168 1 . 1 1 424 424 MET CA C 424 57.800 57.800 55.720 2.080 19685 169 1 . 1 1 424 424 MET CB C 424 34.300 34.300 34.500 -0.200 19685 170 1 . 1 1 424 424 MET H H 424 7.560 7.560 7.864 -0.304 19685 171 1 . 1 1 425 425 PHE N N 425 112.300 112.300 117.097 -4.797 19685 172 1 . 1 1 425 425 PHE HA H 425 4.700 4.700 4.936 -0.236 19685 173 1 . 1 1 425 425 PHE C C 425 177.300 177.300 177.185 0.115 19685 174 1 . 1 1 425 425 PHE CA C 425 59.900 59.900 58.483 1.417 19685 175 1 . 1 1 425 425 PHE CB C 425 38.500 38.500 40.466 -1.966 19685 176 1 . 1 1 425 425 PHE H H 425 7.680 7.680 7.990 -0.310 19685 177 1 . 1 1 426 426 MET N N 426 127.400 127.400 119.501 7.899 19685 178 1 . 1 1 426 426 MET HA H 426 4.630 4.630 4.325 0.305 19685 179 1 . 1 1 426 426 MET C C 426 173.800 173.800 175.247 -1.447 19685 180 1 . 1 1 426 426 MET CA C 426 59.100 59.100 59.236 -0.136 19685 181 1 . 1 1 426 426 MET CB C 426 31.800 31.800 30.128 1.672 19685 182 1 . 1 1 426 426 MET H H 426 8.540 8.540 8.350 0.190 19685 183 1 . 1 1 427 427 PRO HA H 427 4.010 4.010 4.236 -0.226 19685 184 1 . 1 1 427 427 PRO C C 427 176.800 176.800 176.635 0.165 19685 185 1 . 1 1 427 427 PRO CA C 427 65.200 65.200 64.109 1.091 19685 186 1 . 1 1 427 427 PRO CB C 427 30.600 30.600 30.996 -0.396 19685 187 1 . 1 1 428 428 PHE N N 428 110.000 110.000 118.085 -8.085 19685 188 1 . 1 1 428 428 PHE HA H 428 4.270 4.270 4.606 -0.336 19685 189 1 . 1 1 428 428 PHE C C 428 174.600 174.600 176.118 -1.518 19685 190 1 . 1 1 428 428 PHE CA C 428 57.700 57.700 59.200 -1.500 19685 191 1 . 1 1 428 428 PHE CB C 428 38.000 38.000 40.243 -2.243 19685 192 1 . 1 1 428 428 PHE H H 428 6.560 6.560 7.492 -0.932 19685 193 1 . 1 1 429 429 GLY N N 429 105.500 105.500 104.069 1.431 19685 194 1 . 1 1 429 429 GLY C C 429 170.100 170.100 172.390 -2.290 19685 195 1 . 1 1 429 429 GLY CA C 429 44.400 44.400 44.275 0.125 19685 196 1 . 1 1 429 429 GLY H H 429 7.650 7.650 7.427 0.223 19685 197 1 . 1 1 430 430 ASN N N 430 117.400 117.400 117.187 0.213 19685 198 1 . 1 1 430 430 ASN HA H 430 4.630 4.630 4.416 0.214 19685 199 1 . 1 1 430 430 ASN C C 430 173.200 173.200 175.064 -1.864 19685 200 1 . 1 1 430 430 ASN CA C 430 52.600 52.600 53.827 -1.227 19685 201 1 . 1 1 430 430 ASN CB C 430 37.200 37.200 39.111 -1.911 19685 202 1 . 1 1 430 430 ASN H H 430 9.020 9.020 7.966 1.054 19685 203 1 . 1 1 431 431 VAL N N 431 128.000 128.000 119.070 8.930 19685 204 1 . 1 1 431 431 VAL HA H 431 3.750 3.750 4.251 -0.501 19685 205 1 . 1 1 431 431 VAL C C 431 176.400 176.400 176.586 -0.186 19685 206 1 . 1 1 431 431 VAL CA C 431 61.800 61.800 62.665 -0.865 19685 207 1 . 1 1 431 431 VAL CB C 431 31.900 31.900 32.788 -0.888 19685 208 1 . 1 1 431 431 VAL H H 431 8.480 8.480 8.424 0.056 19685 209 1 . 1 1 432 432 ILE N N 432 128.000 128.000 117.577 10.423 19685 210 1 . 1 1 432 432 ILE HA H 432 3.920 3.920 3.840 0.080 19685 211 1 . 1 1 432 432 ILE C C 432 176.100 176.100 175.733 0.367 19685 212 1 . 1 1 432 432 ILE CA C 432 62.500 62.500 63.223 -0.723 19685 213 1 . 1 1 432 432 ILE CB C 432 37.400 37.400 37.442 -0.042 19685 214 1 . 1 1 432 432 ILE H H 432 8.840 8.840 8.358 0.482 19685 215 1 . 1 1 433 433 SER N N 433 113.600 113.600 114.352 -0.752 19685 216 1 . 1 1 433 433 SER HA H 433 4.440 4.440 4.578 -0.138 19685 217 1 . 1 1 433 433 SER C C 433 171.000 171.000 172.523 -1.523 19685 218 1 . 1 1 433 433 SER CA C 433 57.300 57.300 57.941 -0.640 19685 219 1 . 1 1 433 433 SER CB C 433 65.200 65.200 65.710 -0.510 19685 220 1 . 1 1 433 433 SER H H 433 7.280 7.280 7.910 -0.630 19685 221 1 . 1 1 434 434 ALA N N 434 125.700 125.700 125.077 0.622 19685 222 1 . 1 1 434 434 ALA HA H 434 4.910 4.910 4.625 0.285 19685 223 1 . 1 1 434 434 ALA C C 434 174.600 174.600 175.944 -1.344 19685 224 1 . 1 1 434 434 ALA CA C 434 51.000 51.000 51.462 -0.462 19685 225 1 . 1 1 434 434 ALA CB C 434 21.200 21.200 20.839 0.361 19685 226 1 . 1 1 434 434 ALA H H 434 8.270 8.270 8.194 0.076 19685 227 1 . 1 1 435 435 LYS N N 435 120.900 120.900 120.312 0.588 19685 228 1 . 1 1 435 435 LYS HA H 435 4.470 4.470 4.429 0.041 19685 229 1 . 1 1 435 435 LYS C C 435 173.800 173.800 175.114 -1.314 19685 230 1 . 1 1 435 435 LYS CA C 435 53.700 53.700 55.497 -1.797 19685 231 1 . 1 1 435 435 LYS CB C 435 36.400 36.400 34.790 1.610 19685 232 1 . 1 1 435 435 LYS H H 435 8.490 8.490 7.680 0.810 19685 233 1 . 1 1 436 436 VAL N N 436 122.200 122.200 119.474 2.726 19685 234 1 . 1 1 436 436 VAL HA H 436 3.920 3.920 4.153 -0.233 19685 235 1 . 1 1 436 436 VAL C C 436 175.100 175.100 174.598 0.502 19685 236 1 . 1 1 436 436 VAL CA C 436 63.600 63.600 62.331 1.269 19685 237 1 . 1 1 436 436 VAL CB C 436 33.500 33.500 32.216 1.284 19685 238 1 . 1 1 436 436 VAL H H 436 8.390 8.390 8.322 0.068 19685 239 1 . 1 1 437 437 PHE N N 437 125.900 125.900 118.788 7.112 19685 240 1 . 1 1 437 437 PHE HA H 437 4.400 4.400 4.536 -0.136 19685 241 1 . 1 1 437 437 PHE C C 437 173.600 173.600 174.702 -1.102 19685 242 1 . 1 1 437 437 PHE CA C 437 57.700 57.700 57.386 0.313 19685 243 1 . 1 1 437 437 PHE CB C 437 39.000 39.000 39.783 -0.783 19685 244 1 . 1 1 437 437 PHE H H 437 8.250 8.250 7.862 0.389 19685 245 1 . 1 1 438 438 ILE N N 438 121.900 121.900 118.358 3.542 19685 246 1 . 1 1 438 438 ILE HA H 438 4.460 4.460 4.042 0.418 19685 247 1 . 1 1 438 438 ILE C C 438 175.700 175.700 174.926 0.774 19685 248 1 . 1 1 438 438 ILE CA C 438 58.300 58.300 61.283 -2.983 19685 249 1 . 1 1 438 438 ILE CB C 438 39.700 39.700 38.633 1.067 19685 250 1 . 1 1 438 438 ILE H H 438 8.520 8.520 7.870 0.650 19685 251 1 . 1 1 439 439 ASP N N 439 126.500 126.500 120.727 5.773 19685 252 1 . 1 1 439 439 ASP HA H 439 4.580 4.580 4.481 0.099 19685 253 1 . 1 1 439 439 ASP C C 439 176.300 176.300 176.159 0.141 19685 254 1 . 1 1 439 439 ASP CA C 439 53.600 53.600 54.607 -1.007 19685 255 1 . 1 1 439 439 ASP CB C 439 42.300 42.300 40.782 1.518 19685 256 1 . 1 1 439 439 ASP H H 439 8.730 8.730 8.361 0.369 19685 257 1 . 1 1 440 440 LYS N N 440 127.300 127.300 117.110 10.190 19685 258 1 . 1 1 440 440 LYS HA H 440 4.070 4.070 4.002 0.068 19685 259 1 . 1 1 440 440 LYS C C 440 176.900 176.900 176.378 0.522 19685 260 1 . 1 1 440 440 LYS CA C 440 57.800 57.800 58.247 -0.447 19685 261 1 . 1 1 440 440 LYS CB C 440 32.100 32.100 31.439 0.661 19685 262 1 . 1 1 440 440 LYS H H 440 8.930 8.930 8.476 0.454 19685 263 1 . 1 1 441 441 GLN N N 441 117.400 117.400 114.810 2.590 19685 264 1 . 1 1 441 441 GLN HA H 441 4.230 4.230 4.456 -0.226 19685 265 1 . 1 1 441 441 GLN C C 441 177.200 177.200 175.861 1.339 19685 266 1 . 1 1 441 441 GLN CA C 441 57.600 57.600 56.130 1.470 19685 267 1 . 1 1 441 441 GLN CB C 441 28.800 28.800 30.086 -1.286 19685 268 1 . 1 1 441 441 GLN H H 441 8.650 8.650 8.093 0.556 19685 269 1 . 1 1 442 442 THR N N 442 107.300 107.300 114.014 -6.714 19685 270 1 . 1 1 442 442 THR HA H 442 4.290 4.290 4.325 -0.035 19685 271 1 . 1 1 442 442 THR C C 442 175.100 175.100 174.528 0.572 19685 272 1 . 1 1 442 442 THR CA C 442 61.200 61.200 62.828 -1.628 19685 273 1 . 1 1 442 442 THR CB C 442 70.300 70.300 69.266 1.034 19685 274 1 . 1 1 442 442 THR H H 442 7.830 7.830 7.884 -0.054 19685 275 1 . 1 1 443 443 ASN N N 443 117.300 117.300 117.938 -0.638 19685 276 1 . 1 1 443 443 ASN HA H 443 4.300 4.300 4.479 -0.179 19685 277 1 . 1 1 443 443 ASN C C 443 173.400 173.400 174.572 -1.172 19685 278 1 . 1 1 443 443 ASN CA C 443 54.300 54.300 53.562 0.738 19685 279 1 . 1 1 443 443 ASN CB C 443 37.600 37.600 37.727 -0.127 19685 280 1 . 1 1 443 443 ASN H H 443 8.470 8.470 8.074 0.396 19685 281 1 . 1 1 444 444 LEU N N 444 118.000 118.000 116.719 1.281 19685 282 1 . 1 1 444 444 LEU HA H 444 4.560 4.560 4.441 0.119 19685 283 1 . 1 1 444 444 LEU C C 444 176.700 176.700 176.956 -0.256 19685 284 1 . 1 1 444 444 LEU CA C 444 53.300 53.300 55.153 -1.853 19685 285 1 . 1 1 444 444 LEU CB C 444 43.500 43.500 42.319 1.181 19685 286 1 . 1 1 444 444 LEU H H 444 7.660 7.660 7.561 0.099 19685 287 1 . 1 1 445 445 SER N N 445 115.500 115.500 114.029 1.471 19685 288 1 . 1 1 445 445 SER HA H 445 4.460 4.460 4.257 0.203 19685 289 1 . 1 1 445 445 SER C C 445 176.500 176.500 173.963 2.537 19685 290 1 . 1 1 445 445 SER CA C 445 57.900 57.900 58.599 -0.699 19685 291 1 . 1 1 445 445 SER CB C 445 63.500 63.500 63.670 -0.170 19685 292 1 . 1 1 445 445 SER H H 445 8.840 8.840 8.257 0.583 19685 293 1 . 1 1 446 446 LYS N N 446 125.200 125.200 120.813 4.387 19685 294 1 . 1 1 446 446 LYS HA H 446 4.500 4.500 4.201 0.299 19685 295 1 . 1 1 446 446 LYS C C 446 176.100 176.100 175.411 0.689 19685 296 1 . 1 1 446 446 LYS CA C 446 56.300 56.300 56.490 -0.190 19685 297 1 . 1 1 446 446 LYS CB C 446 32.200 32.200 33.524 -1.324 19685 298 1 . 1 1 446 446 LYS H H 446 9.230 9.230 8.147 1.083 19685 299 1 . 1 1 447 447 CYS N N 447 113.000 113.000 117.532 -4.532 19685 300 1 . 1 1 447 447 CYS C C 447 172.500 172.500 173.339 -0.839 19685 301 1 . 1 1 447 447 CYS CA C 447 60.400 60.400 58.329 2.071 19685 302 1 . 1 1 447 447 CYS CB C 447 24.900 24.900 28.579 -3.679 19685 303 1 . 1 1 447 447 CYS H H 447 10.020 10.020 7.782 2.238 19685 304 1 . 1 1 448 448 PHE N N 448 115.200 115.200 117.227 -2.027 19685 305 1 . 1 1 448 448 PHE HA H 448 5.340 5.340 4.513 0.827 19685 306 1 . 1 1 448 448 PHE C C 448 172.400 172.400 174.382 -1.982 19685 307 1 . 1 1 448 448 PHE CA C 448 54.700 54.700 56.697 -1.997 19685 308 1 . 1 1 448 448 PHE CB C 448 42.000 42.000 39.775 2.225 19685 309 1 . 1 1 448 448 PHE H H 448 7.810 7.810 7.604 0.206 19685 310 1 . 1 1 449 449 GLY N N 449 107.700 107.700 106.706 0.994 19685 311 1 . 1 1 449 449 GLY C C 449 170.100 170.100 172.515 -2.415 19685 312 1 . 1 1 449 449 GLY CA C 449 45.200 45.200 44.246 0.954 19685 313 1 . 1 1 449 449 GLY H H 449 9.310 9.310 8.496 0.814 19685 314 1 . 1 1 450 450 PHE N N 450 119.900 119.900 114.216 5.684 19685 315 1 . 1 1 450 450 PHE HA H 450 5.430 5.430 5.173 0.257 19685 316 1 . 1 1 450 450 PHE C C 450 172.800 172.800 172.978 -0.178 19685 317 1 . 1 1 450 450 PHE CA C 450 55.000 55.000 56.660 -1.660 19685 318 1 . 1 1 450 450 PHE CB C 450 43.600 43.600 40.895 2.705 19685 319 1 . 1 1 450 450 PHE H H 450 8.760 8.760 8.241 0.519 19685 320 1 . 1 1 451 451 VAL N N 451 123.800 123.800 118.274 5.526 19685 321 1 . 1 1 451 451 VAL HA H 451 4.290 4.290 4.416 -0.126 19685 322 1 . 1 1 451 451 VAL C C 451 172.400 172.400 175.648 -3.248 19685 323 1 . 1 1 451 451 VAL CA C 451 59.800 59.800 61.068 -1.268 19685 324 1 . 1 1 451 451 VAL CB C 451 36.100 36.100 35.569 0.531 19685 325 1 . 1 1 451 451 VAL H H 451 7.930 7.930 8.281 -0.351 19685 326 1 . 1 1 452 452 SER N N 452 119.600 119.600 122.122 -2.522 19685 327 1 . 1 1 452 452 SER HA H 452 5.120 5.120 4.945 0.175 19685 328 1 . 1 1 452 452 SER C C 452 173.200 173.200 174.078 -0.878 19685 329 1 . 1 1 452 452 SER CA C 452 55.700 55.700 57.490 -1.790 19685 330 1 . 1 1 452 452 SER CB C 452 66.100 66.100 62.474 3.626 19685 331 1 . 1 1 452 452 SER H H 452 8.540 8.540 8.608 -0.068 19685 332 1 . 1 1 453 453 TYR N N 453 121.400 121.400 123.926 -2.526 19685 333 1 . 1 1 453 453 TYR HA H 453 5.380 5.380 4.525 0.855 19685 334 1 . 1 1 453 453 TYR C C 453 173.600 173.600 176.911 -3.311 19685 335 1 . 1 1 453 453 TYR CA C 453 56.500 56.500 58.979 -2.479 19685 336 1 . 1 1 453 453 TYR CB C 453 42.200 42.200 38.801 3.399 19685 337 1 . 1 1 453 453 TYR H H 453 8.380 8.380 7.840 0.540 19685 338 1 . 1 1 454 454 ASP N N 454 113.300 113.300 122.802 -9.502 19685 339 1 . 1 1 454 454 ASP HA H 454 4.490 4.490 4.403 0.087 19685 340 1 . 1 1 454 454 ASP C C 454 176.100 176.100 175.459 0.641 19685 341 1 . 1 1 454 454 ASP CA C 454 52.800 52.800 56.197 -3.397 19685 342 1 . 1 1 454 454 ASP CB C 454 40.400 40.400 41.563 -1.164 19685 343 1 . 1 1 454 454 ASP H H 454 7.860 7.860 8.539 -0.679 19685 344 1 . 1 1 455 455 ASN N N 455 113.800 113.800 112.827 0.973 19685 345 1 . 1 1 455 455 ASN HA H 455 5.050 5.050 5.076 -0.026 19685 346 1 . 1 1 455 455 ASN C C 455 173.100 173.100 173.605 -0.505 19685 347 1 . 1 1 455 455 ASN CA C 455 50.700 50.700 51.743 -1.043 19685 348 1 . 1 1 455 455 ASN CB C 455 41.100 41.100 40.251 0.849 19685 349 1 . 1 1 455 455 ASN H H 455 7.200 7.200 7.984 -0.784 19685 350 1 . 1 1 456 456 PRO HA H 456 4.170 4.170 4.491 -0.321 19685 351 1 . 1 1 456 456 PRO C C 456 177.300 177.300 177.443 -0.143 19685 352 1 . 1 1 456 456 PRO CA C 456 64.200 64.200 64.945 -0.745 19685 353 1 . 1 1 456 456 PRO CB C 456 32.300 32.300 32.091 0.209 19685 354 1 . 1 1 457 457 VAL N N 457 120.900 120.900 113.995 6.905 19685 355 1 . 1 1 457 457 VAL HA H 457 3.620 3.620 4.206 -0.586 19685 356 1 . 1 1 457 457 VAL C C 457 179.000 179.000 176.468 2.532 19685 357 1 . 1 1 457 457 VAL CA C 457 65.900 65.900 63.502 2.399 19685 358 1 . 1 1 457 457 VAL CB C 457 30.800 30.800 31.511 -0.711 19685 359 1 . 1 1 457 457 VAL H H 457 8.120 8.120 7.950 0.170 19685 360 1 . 1 1 458 458 SER N N 458 117.800 117.800 116.010 1.790 19685 361 1 . 1 1 458 458 SER HA H 458 3.940 3.940 4.547 -0.607 19685 362 1 . 1 1 458 458 SER C C 458 173.600 173.600 175.395 -1.795 19685 363 1 . 1 1 458 458 SER CA C 458 61.100 61.100 60.067 1.033 19685 364 1 . 1 1 458 458 SER CB C 458 62.400 62.400 64.243 -1.843 19685 365 1 . 1 1 458 458 SER H H 458 7.830 7.830 7.706 0.124 19685 366 1 . 1 1 459 459 ALA N N 459 120.000 120.000 124.747 -4.747 19685 367 1 . 1 1 459 459 ALA HA H 459 3.750 3.750 3.982 -0.232 19685 368 1 . 1 1 459 459 ALA C C 459 178.100 178.100 178.132 -0.032 19685 369 1 . 1 1 459 459 ALA CA C 459 54.500 54.500 53.986 0.514 19685 370 1 . 1 1 459 459 ALA CB C 459 17.900 17.900 18.449 -0.549 19685 371 1 . 1 1 459 459 ALA H H 459 6.370 6.370 7.862 -1.492 19685 372 1 . 1 1 460 460 GLN N N 460 116.100 116.100 118.480 -2.380 19685 373 1 . 1 1 460 460 GLN HA H 460 3.830 3.830 4.061 -0.231 19685 374 1 . 1 1 460 460 GLN C C 460 178.000 178.000 176.628 1.372 19685 375 1 . 1 1 460 460 GLN CA C 460 58.500 58.500 58.016 0.484 19685 376 1 . 1 1 460 460 GLN CB C 460 27.400 27.400 28.279 -0.879 19685 377 1 . 1 1 460 460 GLN H H 460 7.710 7.710 8.342 -0.632 19685 378 1 . 1 1 461 461 ALA N N 461 122.800 122.800 119.132 3.668 19685 379 1 . 1 1 461 461 ALA HA H 461 3.960 3.960 4.322 -0.362 19685 380 1 . 1 1 461 461 ALA C C 461 179.500 179.500 177.150 2.350 19685 381 1 . 1 1 461 461 ALA CA C 461 54.500 54.500 52.482 2.018 19685 382 1 . 1 1 461 461 ALA CB C 461 17.500 17.500 19.048 -1.548 19685 383 1 . 1 1 461 461 ALA H H 461 7.880 7.880 7.542 0.338 19685 384 1 . 1 1 462 462 ALA N N 462 121.400 121.400 119.703 1.697 19685 385 1 . 1 1 462 462 ALA HA H 462 2.400 2.400 3.745 -1.345 19685 386 1 . 1 1 462 462 ALA C C 462 179.400 179.400 177.962 1.438 19685 387 1 . 1 1 462 462 ALA CA C 462 54.100 54.100 52.748 1.352 19685 388 1 . 1 1 462 462 ALA CB C 462 18.700 18.700 20.303 -1.602 19685 389 1 . 1 1 462 462 ALA H H 462 7.860 7.860 7.584 0.276 19685 390 1 . 1 1 463 463 ILE N N 463 118.600 118.600 118.128 0.472 19685 391 1 . 1 1 463 463 ILE HA H 463 3.240 3.240 3.899 -0.659 19685 392 1 . 1 1 463 463 ILE C C 463 177.500 177.500 176.252 1.248 19685 393 1 . 1 1 463 463 ILE CA C 463 66.000 66.000 62.724 3.276 19685 394 1 . 1 1 463 463 ILE CB C 463 38.300 38.300 38.244 0.056 19685 395 1 . 1 1 463 463 ILE H H 463 8.090 8.090 7.974 0.116 19685 396 1 . 1 1 464 464 GLN N N 464 117.000 117.000 116.521 0.479 19685 397 1 . 1 1 464 464 GLN HA H 464 3.870 3.870 4.372 -0.502 19685 398 1 . 1 1 464 464 GLN C C 464 177.700 177.700 175.227 2.473 19685 399 1 . 1 1 464 464 GLN CA C 464 58.200 58.200 55.949 2.251 19685 400 1 . 1 1 464 464 GLN CB C 464 27.900 27.900 29.350 -1.450 19685 401 1 . 1 1 464 464 GLN H H 464 7.780 7.780 7.935 -0.155 19685 402 1 . 1 1 465 465 ALA N N 465 117.200 117.200 120.481 -3.281 19685 403 1 . 1 1 465 465 ALA HA H 465 4.230 4.230 4.402 -0.172 19685 404 1 . 1 1 465 465 ALA C C 465 179.200 179.200 176.541 2.659 19685 405 1 . 1 1 465 465 ALA CA C 465 53.800 53.800 52.873 0.927 19685 406 1 . 1 1 465 465 ALA CB C 465 21.100 21.100 20.136 0.964 19685 407 1 . 1 1 465 465 ALA H H 465 7.540 7.540 7.551 -0.011 19685 408 1 . 1 1 466 466 MET N N 466 110.800 110.800 116.767 -5.966 19685 409 1 . 1 1 466 466 MET HA H 466 4.820 4.820 4.635 0.185 19685 410 1 . 1 1 466 466 MET C C 466 177.600 177.600 175.694 1.906 19685 411 1 . 1 1 466 466 MET CA C 466 53.300 53.300 55.532 -2.232 19685 412 1 . 1 1 466 466 MET CB C 466 31.600 31.600 34.989 -3.389 19685 413 1 . 1 1 466 466 MET H H 466 8.230 8.230 7.765 0.465 19685 414 1 . 1 1 467 467 ASN N N 467 119.100 119.100 119.106 -0.006 19685 415 1 . 1 1 467 467 ASN HA H 467 4.490 4.490 4.612 -0.122 19685 416 1 . 1 1 467 467 ASN C C 467 176.300 176.300 176.419 -0.119 19685 417 1 . 1 1 467 467 ASN CA C 467 56.200 56.200 54.400 1.800 19685 418 1 . 1 1 467 467 ASN CB C 467 38.200 38.200 38.518 -0.318 19685 419 1 . 1 1 467 467 ASN H H 467 8.560 8.560 7.787 0.773 19685 420 1 . 1 1 468 468 GLY N N 468 117.900 117.900 110.435 7.465 19685 421 1 . 1 1 468 468 GLY C C 468 172.800 172.800 173.791 -0.991 19685 422 1 . 1 1 468 468 GLY CA C 468 45.300 45.300 45.454 -0.154 19685 423 1 . 1 1 468 468 GLY H H 468 8.930 8.930 8.472 0.458 19685 424 1 . 1 1 469 469 PHE N N 469 123.300 123.300 120.593 2.707 19685 425 1 . 1 1 469 469 PHE HA H 469 4.190 4.190 4.671 -0.481 19685 426 1 . 1 1 469 469 PHE C C 469 174.400 174.400 174.299 0.101 19685 427 1 . 1 1 469 469 PHE CA C 469 58.700 58.700 57.000 1.700 19685 428 1 . 1 1 469 469 PHE CB C 469 40.600 40.600 40.975 -0.376 19685 429 1 . 1 1 469 469 PHE H H 469 7.950 7.950 7.611 0.339 19685 430 1 . 1 1 470 470 GLN N N 470 129.200 129.200 121.582 7.618 19685 431 1 . 1 1 470 470 GLN HA H 470 4.590 4.590 4.164 0.426 19685 432 1 . 1 1 470 470 GLN C C 470 174.100 174.100 174.120 -0.020 19685 433 1 . 1 1 470 470 GLN CA C 470 55.500 55.500 55.930 -0.430 19685 434 1 . 1 1 470 470 GLN CB C 470 28.800 28.800 29.030 -0.230 19685 435 1 . 1 1 470 470 GLN H H 470 8.330 8.330 8.099 0.231 19685 436 1 . 1 1 471 471 ILE N N 471 126.300 126.300 123.610 2.690 19685 437 1 . 1 1 471 471 ILE HA H 471 4.170 4.170 4.274 -0.104 19685 438 1 . 1 1 471 471 ILE C C 471 175.400 175.400 175.153 0.247 19685 439 1 . 1 1 471 471 ILE CA C 471 59.600 59.600 60.392 -0.792 19685 440 1 . 1 1 471 471 ILE CB C 471 39.100 39.100 40.177 -1.077 19685 441 1 . 1 1 471 471 ILE H H 471 8.440 8.440 8.408 0.032 19685 442 1 . 1 1 472 472 GLY N N 472 117.500 117.500 114.915 2.585 19685 443 1 . 1 1 472 472 GLY C C 472 174.700 174.700 174.652 0.048 19685 444 1 . 1 1 472 472 GLY CA C 472 46.500 46.500 45.627 0.873 19685 445 1 . 1 1 472 472 GLY H H 472 8.980 8.980 8.470 0.510 19685 446 1 . 1 1 473 473 MET N N 473 124.100 124.100 118.075 6.025 19685 447 1 . 1 1 473 473 MET HA H 473 4.380 4.380 4.371 0.009 19685 448 1 . 1 1 473 473 MET C C 473 175.700 175.700 175.457 0.243 19685 449 1 . 1 1 473 473 MET CA C 473 55.000 55.000 56.350 -1.351 19685 450 1 . 1 1 473 473 MET CB C 473 32.900 32.900 31.914 0.986 19685 451 1 . 1 1 473 473 MET H H 473 9.070 9.070 8.386 0.684 19685 452 1 . 1 1 474 474 LYS N N 474 118.700 118.700 117.809 0.891 19685 453 1 . 1 1 474 474 LYS HA H 474 4.480 4.480 4.604 -0.124 19685 454 1 . 1 1 474 474 LYS C C 474 174.300 174.300 174.933 -0.633 19685 455 1 . 1 1 474 474 LYS CA C 474 54.600 54.600 54.816 -0.216 19685 456 1 . 1 1 474 474 LYS CB C 474 35.100 35.100 35.089 0.011 19685 457 1 . 1 1 474 474 LYS H H 474 7.770 7.770 7.527 0.243 19685 458 1 . 1 1 475 475 ARG N N 475 119.600 119.600 118.969 0.631 19685 459 1 . 1 1 475 475 ARG HA H 475 4.800 4.800 4.486 0.314 19685 460 1 . 1 1 475 475 ARG C C 475 175.700 175.700 174.595 1.105 19685 461 1 . 1 1 475 475 ARG CA C 475 54.000 54.000 55.382 -1.383 19685 462 1 . 1 1 475 475 ARG CB C 475 31.300 31.300 31.282 0.018 19685 463 1 . 1 1 475 475 ARG H H 475 8.350 8.350 8.419 -0.069 19685 464 1 . 1 1 476 476 LEU N N 476 123.500 123.500 120.925 2.575 19685 465 1 . 1 1 476 476 LEU HA H 476 4.430 4.430 4.374 0.056 19685 466 1 . 1 1 476 476 LEU C C 476 177.600 177.600 175.722 1.878 19685 467 1 . 1 1 476 476 LEU CA C 476 55.500 55.500 54.713 0.787 19685 468 1 . 1 1 476 476 LEU CB C 476 42.800 42.800 43.120 -0.320 19685 469 1 . 1 1 476 476 LEU H H 476 9.130 9.130 8.376 0.754 19685 470 1 . 1 1 477 477 LYS N N 477 123.200 123.200 122.579 0.621 19685 471 1 . 1 1 477 477 LYS HA H 477 5.160 5.160 4.607 0.553 19685 472 1 . 1 1 477 477 LYS C C 477 174.100 174.100 174.626 -0.526 19685 473 1 . 1 1 477 477 LYS CA C 477 54.500 54.500 55.164 -0.664 19685 474 1 . 1 1 477 477 LYS CB C 477 34.900 34.900 34.327 0.573 19685 475 1 . 1 1 477 477 LYS H H 477 8.090 8.090 8.353 -0.263 19685 476 1 . 1 1 478 478 VAL N N 478 127.100 127.100 121.711 5.389 19685 477 1 . 1 1 478 478 VAL HA H 478 4.900 4.900 4.478 0.421 19685 478 1 . 1 1 478 478 VAL C C 478 173.700 173.700 174.170 -0.470 19685 479 1 . 1 1 478 478 VAL CA C 478 61.000 61.000 61.274 -0.274 19685 480 1 . 1 1 478 478 VAL CB C 478 33.700 33.700 34.072 -0.372 19685 481 1 . 1 1 478 478 VAL H H 478 8.820 8.820 8.199 0.621 19685 482 1 . 1 1 479 479 GLN N N 479 123.600 123.600 123.098 0.502 19685 483 1 . 1 1 479 479 GLN HA H 479 4.810 4.810 4.610 0.200 19685 484 1 . 1 1 479 479 GLN C C 479 173.600 173.600 173.775 -0.175 19685 485 1 . 1 1 479 479 GLN CA C 479 53.200 53.200 54.469 -1.270 19685 486 1 . 1 1 479 479 GLN CB C 479 33.500 33.500 32.239 1.261 19685 487 1 . 1 1 479 479 GLN H H 479 9.130 9.130 8.430 0.700 19685 488 1 . 1 1 480 480 LEU N N 480 123.200 123.200 120.077 3.123 19685 489 1 . 1 1 480 480 LEU HA H 480 4.440 4.440 4.620 -0.180 19685 490 1 . 1 1 480 480 LEU C C 480 177.100 177.100 176.770 0.330 19685 491 1 . 1 1 480 480 LEU CA C 480 54.600 54.600 54.351 0.249 19685 492 1 . 1 1 480 480 LEU CB C 480 42.400 42.400 43.662 -1.262 19685 493 1 . 1 1 480 480 LEU H H 480 8.840 8.840 8.268 0.572 19685 494 1 . 1 1 481 481 LYS N N 481 124.500 124.500 122.669 1.831 19685 495 1 . 1 1 481 481 LYS HA H 481 4.310 4.310 4.054 0.256 19685 496 1 . 1 1 481 481 LYS C C 481 175.200 175.200 176.384 -1.184 19685 497 1 . 1 1 481 481 LYS CA C 481 56.700 56.700 57.992 -1.292 19685 498 1 . 1 1 481 481 LYS CB C 481 33.100 33.100 31.282 1.818 19685 499 1 . 1 1 481 481 LYS H H 481 8.400 8.400 8.684 -0.284 19685 500 1 . 1 1 482 482 ARG N N 482 126.600 126.600 118.698 7.902 19685 501 1 . 1 1 482 482 ARG HA H 482 4.350 4.350 4.167 0.183 19685 502 1 . 1 1 482 482 ARG C C 482 175.800 175.800 175.391 0.409 19685 503 1 . 1 1 482 482 ARG CA C 482 55.600 55.600 56.712 -1.112 19685 504 1 . 1 1 482 482 ARG CB C 482 31.100 31.100 29.636 1.464 19685 505 1 . 1 1 482 482 ARG H H 482 8.770 8.770 8.263 0.507 19685 506 1 . 1 1 483 483 SER N N 483 118.100 118.100 114.753 3.347 19685 507 1 . 1 1 483 483 SER HA H 483 4.400 4.400 4.441 -0.041 19685 508 1 . 1 1 483 483 SER C C 483 174.200 174.200 173.577 0.623 19685 509 1 . 1 1 483 483 SER CA C 483 58.000 58.000 58.048 -0.048 19685 510 1 . 1 1 483 483 SER CB C 483 63.500 63.500 64.231 -0.731 19685 511 1 . 1 1 483 483 SER H H 483 8.610 8.610 7.923 0.687 19685 512 1 . 1 1 484 484 LYS N N 484 123.000 123.000 120.655 2.345 19685 513 1 . 1 1 484 484 LYS HA H 484 4.210 4.210 4.347 -0.137 19685 514 1 . 1 1 484 484 LYS C C 484 175.900 175.900 175.369 0.530 19685 515 1 . 1 1 484 484 LYS CA C 484 56.300 56.300 56.638 -0.338 19685 516 1 . 1 1 484 484 LYS CB C 484 32.500 32.500 32.913 -0.413 19685 517 1 . 1 1 484 484 LYS H H 484 8.560 8.560 8.331 0.229 19685 518 1 . 1 1 485 485 ASN N N 485 119.600 119.600 118.716 0.884 19685 519 1 . 1 1 485 485 ASN HA H 485 4.600 4.600 4.786 -0.186 19685 520 1 . 1 1 485 485 ASN C C 485 174.400 174.400 174.198 0.202 19685 521 1 . 1 1 485 485 ASN CA C 485 52.900 52.900 53.007 -0.107 19685 522 1 . 1 1 485 485 ASN CB C 485 38.400 38.400 39.723 -1.323 19685 523 1 . 1 1 485 485 ASN H H 485 8.560 8.560 8.132 0.428 19685 524 1 . 1 1 486 486 ASP N N 486 121.100 121.100 119.970 1.130 19685 525 1 . 1 1 486 486 ASP HA H 486 4.520 4.520 4.727 -0.207 19685 526 1 . 1 1 486 486 ASP C C 486 175.700 175.700 175.387 0.313 19685 527 1 . 1 1 486 486 ASP CA C 486 54.000 54.000 53.941 0.059 19685 528 1 . 1 1 486 486 ASP CB C 486 40.800 40.800 42.237 -1.437 19685 529 1 . 1 1 486 486 ASP H H 486 8.250 8.250 8.421 -0.171 19685 530 1 . 1 1 487 487 SER N N 487 115.400 115.400 115.703 -0.303 19685 531 1 . 1 1 487 487 SER HA H 487 4.310 4.310 4.429 -0.119 19685 532 1 . 1 1 487 487 SER C C 487 172.800 172.800 173.604 -0.804 19685 533 1 . 1 1 487 487 SER CA C 487 57.700 57.700 58.379 -0.679 19685 534 1 . 1 1 487 487 SER CB C 487 63.600 63.600 64.218 -0.618 19685 535 1 . 1 1 487 487 SER H H 487 8.090 8.090 8.282 -0.192 19685 536 1 . 1 1 488 488 LYS N N 488 122.300 122.300 120.608 1.692 19685 537 1 . 1 1 488 488 LYS HA H 488 4.050 4.050 4.438 -0.388 19685 538 1 . 1 1 488 488 LYS C C 488 174.500 174.500 174.492 0.008 19685 539 1 . 1 1 488 488 LYS CA C 488 54.000 54.000 54.773 -0.773 19685 540 1 . 1 1 488 488 LYS CB C 488 32.400 32.400 32.310 0.090 19685 541 1 . 1 1 488 488 LYS H H 488 8.090 8.090 8.256 -0.166 19685 542 1 . 1 1 489 489 PRO HA H 489 4.280 4.280 4.371 -0.091 19685 543 1 . 1 1 489 489 PRO C C 489 175.000 175.000 175.529 -0.529 19685 544 1 . 1 1 489 489 PRO CA C 489 63.200 63.200 63.016 0.184 19685 545 1 . 1 1 489 489 PRO CB C 489 31.100 31.100 32.125 -1.025 19685 stop_ save_