data_17732 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17732 _Entry.PDB_ID 2LEX 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 17732 _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 1 408 408 LEU N N 408 122.600 122.600 118.002 4.598 17732 2 1 1 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.038 0.222 17732 3 1 1 . 1 1 408 408 LEU CA C 408 55.000 55.000 55.484 -0.484 17732 4 1 1 . 1 1 408 408 LEU H H 408 8.090 8.090 7.869 0.221 17732 5 1 1 . 1 1 409 409 ASP N N 409 122.500 122.500 121.683 0.817 17732 6 1 1 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.914 -0.274 17732 7 1 1 . 1 1 409 409 ASP CA C 409 55.100 55.100 54.164 0.936 17732 8 1 1 . 1 1 409 409 ASP H H 409 8.140 8.140 8.379 -0.239 17732 9 1 1 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.671 -0.171 17732 10 1 1 . 1 1 410 410 ASP CA C 410 53.200 53.200 53.981 -0.781 17732 11 1 1 . 1 1 410 410 ASP H H 410 8.570 8.570 8.912 -0.342 17732 12 1 1 . 1 1 411 411 GLY N N 411 108.400 108.400 107.290 1.110 17732 13 1 1 . 1 1 411 411 GLY CA C 411 45.300 45.300 45.034 0.266 17732 14 1 1 . 1 1 411 411 GLY H H 411 8.520 8.520 8.271 0.249 17732 15 1 1 . 1 1 412 412 TYR N N 412 118.600 118.600 118.040 0.560 17732 16 1 1 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.732 -0.382 17732 17 1 1 . 1 1 412 412 TYR CA C 412 58.000 58.000 55.712 2.288 17732 18 1 1 . 1 1 412 412 TYR H H 412 8.160 8.160 7.539 0.621 17732 19 1 1 . 1 1 413 413 ARG N N 413 121.100 121.100 120.426 0.674 17732 20 1 1 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.769 0.011 17732 21 1 1 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.127 -0.027 17732 22 1 1 . 1 1 413 413 ARG H H 413 8.750 8.750 8.446 0.304 17732 23 1 1 . 1 1 414 414 TRP N N 414 120.600 120.600 124.468 -3.868 17732 24 1 1 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.223 0.357 17732 25 1 1 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.292 -0.192 17732 26 1 1 . 1 1 414 414 TRP H H 414 8.250 8.250 8.710 -0.460 17732 27 1 1 . 1 1 415 415 ARG N N 415 122.900 122.900 123.607 -0.707 17732 28 1 1 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.821 0.459 17732 29 1 1 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.958 -0.358 17732 30 1 1 . 1 1 415 415 ARG H H 415 9.450 9.450 8.405 1.045 17732 31 1 1 . 1 1 416 416 LYS N N 416 134.700 134.700 129.062 5.638 17732 32 1 1 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.885 0.475 17732 33 1 1 . 1 1 416 416 LYS CA C 416 57.000 57.000 56.064 0.936 17732 34 1 1 . 1 1 416 416 LYS H H 416 11.120 11.120 8.988 2.132 17732 35 1 1 . 1 1 417 417 TYR N N 417 118.600 118.600 122.438 -3.838 17732 36 1 1 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.677 0.583 17732 37 1 1 . 1 1 417 417 TYR CA C 417 56.000 56.000 56.706 -0.706 17732 38 1 1 . 1 1 417 417 TYR H H 417 8.900 8.900 7.945 0.955 17732 39 1 1 . 1 1 418 418 GLY N N 418 105.300 105.300 111.288 -5.988 17732 40 1 1 . 1 1 418 418 GLY CA C 418 45.900 45.900 45.085 0.815 17732 41 1 1 . 1 1 418 418 GLY H H 418 6.990 6.990 8.636 -1.646 17732 42 1 1 . 1 1 419 419 GLN N N 419 122.600 122.600 120.949 1.651 17732 43 1 1 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.535 0.945 17732 44 1 1 . 1 1 419 419 GLN CA C 419 56.600 56.600 56.155 0.445 17732 45 1 1 . 1 1 419 419 GLN H H 419 9.000 9.000 8.034 0.966 17732 46 1 1 . 1 1 420 420 LYS N N 420 123.000 123.000 125.959 -2.959 17732 47 1 1 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.657 0.243 17732 48 1 1 . 1 1 420 420 LYS CA C 420 52.800 52.800 55.288 -2.488 17732 49 1 1 . 1 1 420 420 LYS H H 420 9.140 9.140 8.463 0.677 17732 50 1 1 . 1 1 421 421 VAL N N 421 122.800 122.800 121.322 1.478 17732 51 1 1 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.451 -0.171 17732 52 1 1 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.965 3.135 17732 53 1 1 . 1 1 421 421 VAL H H 421 8.550 8.550 8.331 0.219 17732 54 1 1 . 1 1 422 422 VAL N N 422 128.600 128.600 123.599 5.001 17732 55 1 1 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.647 -0.077 17732 56 1 1 . 1 1 422 422 VAL CA C 422 60.200 60.200 59.323 0.877 17732 57 1 1 . 1 1 422 422 VAL H H 422 9.500 9.500 8.441 1.059 17732 58 1 1 . 1 1 423 423 LYS N N 423 123.800 123.800 125.190 -1.390 17732 59 1 1 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.213 -0.273 17732 60 1 1 . 1 1 423 423 LYS CA C 423 58.300 58.300 57.092 1.208 17732 61 1 1 . 1 1 423 423 LYS H H 423 8.880 8.880 8.598 0.282 17732 62 1 1 . 1 1 424 424 GLY N N 424 110.800 110.800 107.774 3.026 17732 63 1 1 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.244 -0.944 17732 64 1 1 . 1 1 424 424 GLY H H 424 8.600 8.600 8.739 -0.139 17732 65 1 1 . 1 1 425 425 ASN N N 425 119.800 119.800 117.646 2.154 17732 66 1 1 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.121 0.019 17732 67 1 1 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.272 -1.172 17732 68 1 1 . 1 1 425 425 ASN H H 425 7.600 7.600 7.611 -0.011 17732 69 1 1 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.145 0.155 17732 70 1 1 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.494 -1.094 17732 71 1 1 . 1 1 427 427 TYR N N 427 121.100 121.100 117.755 3.345 17732 72 1 1 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.668 0.222 17732 73 1 1 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.077 0.023 17732 74 1 1 . 1 1 427 427 TYR H H 427 8.120 8.120 8.148 -0.028 17732 75 1 1 . 1 1 428 428 PRO HA H 428 4.420 4.420 5.121 -0.701 17732 76 1 1 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.331 0.969 17732 77 1 1 . 1 1 429 429 ARG N N 429 124.900 124.900 122.582 2.318 17732 78 1 1 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.975 -0.295 17732 79 1 1 . 1 1 429 429 ARG CA C 429 55.000 55.000 54.788 0.212 17732 80 1 1 . 1 1 429 429 ARG H H 429 9.280 9.280 8.859 0.421 17732 81 1 1 . 1 1 430 430 SER N N 430 122.200 122.200 114.526 7.674 17732 82 1 1 . 1 1 430 430 SER HA H 430 4.960 4.960 4.777 0.183 17732 83 1 1 . 1 1 430 430 SER CA C 430 59.300 59.300 57.532 1.768 17732 84 1 1 . 1 1 430 430 SER H H 430 9.100 9.100 8.486 0.614 17732 85 1 1 . 1 1 431 431 TYR N N 431 122.100 122.100 122.856 -0.756 17732 86 1 1 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.953 -0.293 17732 87 1 1 . 1 1 431 431 TYR CA C 431 57.400 57.400 56.324 1.076 17732 88 1 1 . 1 1 431 431 TYR H H 431 7.590 7.590 8.241 -0.651 17732 89 1 1 . 1 1 432 432 TYR N N 432 120.300 120.300 124.964 -4.664 17732 90 1 1 . 1 1 432 432 TYR HA H 432 5.720 5.720 5.094 0.626 17732 91 1 1 . 1 1 432 432 TYR CA C 432 57.100 57.100 57.787 -0.687 17732 92 1 1 . 1 1 432 432 TYR H H 432 9.370 9.370 8.490 0.880 17732 93 1 1 . 1 1 433 433 LYS N N 433 121.500 121.500 124.582 -3.082 17732 94 1 1 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.320 0.510 17732 95 1 1 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.494 -0.294 17732 96 1 1 . 1 1 433 433 LYS H H 433 9.960 9.960 8.554 1.406 17732 97 1 1 . 1 1 434 434 CYS N N 434 128.700 128.700 126.540 2.160 17732 98 1 1 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.064 -0.864 17732 99 1 1 . 1 1 434 434 CYS CA C 434 60.300 60.300 57.656 2.644 17732 100 1 1 . 1 1 434 434 CYS H H 434 8.440 8.440 9.109 -0.669 17732 101 1 1 . 1 1 435 435 THR N N 435 118.000 118.000 121.447 -3.447 17732 102 1 1 . 1 1 435 435 THR HA H 435 4.270 4.270 4.958 -0.688 17732 103 1 1 . 1 1 435 435 THR CA C 435 62.800 62.800 60.933 1.867 17732 104 1 1 . 1 1 435 435 THR H H 435 8.200 8.200 8.017 0.183 17732 105 1 1 . 1 1 436 436 THR N N 436 127.500 127.500 112.772 14.728 17732 106 1 1 . 1 1 436 436 THR HA H 436 4.230 4.230 4.482 -0.252 17732 107 1 1 . 1 1 436 436 THR CA C 436 63.300 63.300 60.712 2.587 17732 108 1 1 . 1 1 436 436 THR H H 436 8.880 8.880 7.850 1.030 17732 109 1 1 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.130 0.140 17732 110 1 1 . 1 1 438 438 GLY N N 438 112.800 112.800 110.361 2.439 17732 111 1 1 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.523 0.877 17732 112 1 1 . 1 1 438 438 GLY H H 438 8.870 8.870 8.496 0.373 17732 113 1 1 . 1 1 439 439 CYS N N 439 123.900 123.900 119.998 3.902 17732 114 1 1 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.830 -0.230 17732 115 1 1 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.355 2.345 17732 116 1 1 . 1 1 439 439 CYS H H 439 7.870 7.870 8.343 -0.473 17732 117 1 1 . 1 1 440 440 GLY N N 440 113.300 113.300 113.362 -0.062 17732 118 1 1 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.238 0.162 17732 119 1 1 . 1 1 440 440 GLY H H 440 9.070 9.070 8.256 0.814 17732 120 1 1 . 1 1 441 441 VAL N N 441 123.400 123.400 124.073 -0.673 17732 121 1 1 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.419 -0.309 17732 122 1 1 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.662 4.838 17732 123 1 1 . 1 1 441 441 VAL H H 441 8.230 8.230 8.398 -0.168 17732 124 1 1 . 1 1 442 442 ARG N N 442 126.100 126.100 122.864 3.236 17732 125 1 1 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.111 0.539 17732 126 1 1 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.771 -0.471 17732 127 1 1 . 1 1 442 442 ARG H H 442 8.340 8.340 8.368 -0.028 17732 128 1 1 . 1 1 443 443 LYS N N 443 120.700 120.700 121.769 -1.069 17732 129 1 1 . 1 1 443 443 LYS HA H 443 5.110 5.110 4.978 0.132 17732 130 1 1 . 1 1 443 443 LYS CA C 443 54.000 54.000 55.075 -1.075 17732 131 1 1 . 1 1 443 443 LYS H H 443 9.340 9.340 8.903 0.437 17732 132 1 1 . 1 1 444 444 HIS N N 444 122.000 122.000 123.569 -1.569 17732 133 1 1 . 1 1 444 444 HIS HA H 444 5.700 5.700 5.093 0.607 17732 134 1 1 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.369 -3.369 17732 135 1 1 . 1 1 444 444 HIS H H 444 8.860 8.860 8.374 0.486 17732 136 1 1 . 1 1 445 445 VAL N N 445 121.200 121.200 123.559 -2.359 17732 137 1 1 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.098 -0.288 17732 138 1 1 . 1 1 445 445 VAL CA C 445 61.600 61.600 60.495 1.105 17732 139 1 1 . 1 1 445 445 VAL H H 445 8.560 8.560 8.696 -0.136 17732 140 1 1 . 1 1 446 446 GLU N N 446 125.100 125.100 126.332 -1.232 17732 141 1 1 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.773 0.137 17732 142 1 1 . 1 1 446 446 GLU CA C 446 54.400 54.400 53.764 0.636 17732 143 1 1 . 1 1 446 446 GLU H H 446 8.680 8.680 8.549 0.131 17732 144 1 1 . 1 1 447 447 ARG N N 447 122.400 122.400 123.649 -1.249 17732 145 1 1 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.338 0.352 17732 146 1 1 . 1 1 447 447 ARG CA C 447 55.400 55.400 55.302 0.098 17732 147 1 1 . 1 1 447 447 ARG H H 447 8.660 8.660 8.707 -0.047 17732 148 1 1 . 1 1 448 448 ALA N N 448 125.000 125.000 126.700 -1.700 17732 149 1 1 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.012 0.208 17732 150 1 1 . 1 1 448 448 ALA CA C 448 52.300 52.300 52.817 -0.517 17732 151 1 1 . 1 1 448 448 ALA H H 448 8.100 8.100 8.410 -0.310 17732 152 1 1 . 1 1 449 449 ALA N N 449 123.700 123.700 124.848 -1.148 17732 153 1 1 . 1 1 449 449 ALA HA H 449 4.220 4.220 4.160 0.060 17732 154 1 1 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.134 1.066 17732 155 1 1 . 1 1 449 449 ALA H H 449 8.550 8.550 8.821 -0.271 17732 156 1 1 . 1 1 450 450 THR N N 450 102.500 102.500 104.670 -2.170 17732 157 1 1 . 1 1 450 450 THR HA H 450 4.340 4.340 4.484 -0.144 17732 158 1 1 . 1 1 450 450 THR CA C 450 61.300 61.300 61.408 -0.108 17732 159 1 1 . 1 1 450 450 THR H H 450 7.600 7.600 7.533 0.067 17732 160 1 1 . 1 1 451 451 ASP N N 451 118.200 118.200 121.727 -3.527 17732 161 1 1 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.920 -0.010 17732 162 1 1 . 1 1 451 451 ASP CA C 451 52.000 52.000 53.616 -1.616 17732 163 1 1 . 1 1 451 451 ASP H H 451 7.060 7.060 7.793 -0.733 17732 164 1 1 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.105 0.195 17732 165 1 1 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.137 -0.137 17732 166 1 1 . 1 1 453 453 LYS N N 453 117.000 117.000 117.053 -0.053 17732 167 1 1 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.203 -0.043 17732 168 1 1 . 1 1 453 453 LYS CA C 453 56.700 56.700 57.323 -0.623 17732 169 1 1 . 1 1 453 453 LYS H H 453 7.880 7.880 8.203 -0.323 17732 170 1 1 . 1 1 454 454 ALA N N 454 124.700 124.700 121.967 2.733 17732 171 1 1 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.218 0.352 17732 172 1 1 . 1 1 454 454 ALA CA C 454 51.200 51.200 52.994 -1.794 17732 173 1 1 . 1 1 454 454 ALA H H 454 8.060 8.060 7.263 0.797 17732 174 1 1 . 1 1 455 455 VAL N N 455 119.700 119.700 114.984 4.716 17732 175 1 1 . 1 1 455 455 VAL HA H 455 4.370 4.370 3.900 0.470 17732 176 1 1 . 1 1 455 455 VAL CA C 455 61.400 61.400 62.603 -1.203 17732 177 1 1 . 1 1 455 455 VAL H H 455 8.190 8.190 7.810 0.380 17732 178 1 1 . 1 1 456 456 VAL N N 456 129.400 129.400 122.450 6.950 17732 179 1 1 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.605 -0.295 17732 180 1 1 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.320 1.580 17732 181 1 1 . 1 1 456 456 VAL H H 456 9.220 9.220 9.028 0.192 17732 182 1 1 . 1 1 457 457 THR N N 457 125.000 125.000 121.452 3.548 17732 183 1 1 . 1 1 457 457 THR HA H 457 5.160 5.160 5.201 -0.041 17732 184 1 1 . 1 1 457 457 THR CA C 457 61.100 61.100 60.888 0.212 17732 185 1 1 . 1 1 457 457 THR H H 457 8.560 8.560 8.385 0.175 17732 186 1 1 . 1 1 458 458 THR N N 458 120.600 120.600 122.972 -2.372 17732 187 1 1 . 1 1 458 458 THR HA H 458 4.550 4.550 4.670 -0.120 17732 188 1 1 . 1 1 458 458 THR CA C 458 60.600 60.600 61.414 -0.814 17732 189 1 1 . 1 1 458 458 THR H H 458 8.560 8.560 8.539 0.021 17732 190 1 1 . 1 1 459 459 TYR N N 459 122.500 122.500 126.152 -3.652 17732 191 1 1 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.778 0.162 17732 192 1 1 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.757 0.043 17732 193 1 1 . 1 1 459 459 TYR H H 459 8.870 8.870 8.962 -0.092 17732 194 1 1 . 1 1 460 460 GLU N N 460 123.200 123.200 126.280 -3.080 17732 195 1 1 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.668 -0.038 17732 196 1 1 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.380 0.220 17732 197 1 1 . 1 1 460 460 GLU H H 460 9.150 9.150 8.610 0.540 17732 198 1 1 . 1 1 461 461 GLY N N 461 112.700 112.700 113.755 -1.055 17732 199 1 1 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.927 -1.027 17732 200 1 1 . 1 1 461 461 GLY H H 461 8.330 8.330 8.243 0.087 17732 201 1 1 . 1 1 462 462 LYS N N 462 118.300 118.300 120.109 -1.809 17732 202 1 1 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.379 0.111 17732 203 1 1 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.261 -1.261 17732 204 1 1 . 1 1 462 462 LYS H H 462 8.050 8.050 8.152 -0.102 17732 205 1 1 . 1 1 463 463 HIS N N 463 123.900 123.900 119.177 4.723 17732 206 1 1 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.373 0.227 17732 207 1 1 . 1 1 463 463 HIS CA C 463 57.200 57.200 56.027 1.173 17732 208 1 1 . 1 1 463 463 HIS H H 463 8.470 8.470 8.097 0.373 17732 209 1 1 . 1 1 464 464 ASN N N 464 124.400 124.400 119.439 4.961 17732 210 1 1 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.769 0.181 17732 211 1 1 . 1 1 464 464 ASN CA C 464 51.500 51.500 52.874 -1.374 17732 212 1 1 . 1 1 464 464 ASN H H 464 8.360 8.360 8.287 0.073 17732 213 1 1 . 1 1 465 465 HIS N N 465 112.100 112.100 115.962 -3.862 17732 214 1 1 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.871 -0.001 17732 215 1 1 . 1 1 465 465 HIS CA C 465 52.900 52.900 54.940 -2.040 17732 216 1 1 . 1 1 465 465 HIS H H 465 6.830 6.830 6.991 -0.161 17732 217 1 1 . 1 1 466 466 ASP N N 466 120.300 120.300 121.268 -0.968 17732 218 1 1 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.536 0.084 17732 219 1 1 . 1 1 466 466 ASP CA C 466 54.000 54.000 56.135 -2.135 17732 220 1 1 . 1 1 466 466 ASP H H 466 8.780 8.780 8.562 0.218 17732 221 1 1 . 1 1 467 467 LEU N N 467 124.200 124.200 118.932 5.268 17732 222 1 1 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.761 -0.721 17732 223 1 1 . 1 1 467 467 LEU CA C 467 54.100 54.100 54.171 -0.071 17732 224 1 1 . 1 1 467 467 LEU H H 467 8.530 8.530 7.800 0.730 17732 225 1 1 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.610 -0.260 17732 226 1 1 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.679 0.621 17732 227 1 2 . 1 1 408 408 LEU N N 408 122.600 122.600 122.159 0.441 17732 228 1 2 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.544 -0.284 17732 229 1 2 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.427 0.573 17732 230 1 2 . 1 1 408 408 LEU H H 408 8.090 8.090 7.898 0.192 17732 231 1 2 . 1 1 409 409 ASP N N 409 122.500 122.500 119.371 3.129 17732 232 1 2 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.537 0.103 17732 233 1 2 . 1 1 409 409 ASP CA C 409 55.100 55.100 53.678 1.421 17732 234 1 2 . 1 1 409 409 ASP H H 409 8.140 8.140 7.636 0.504 17732 235 1 2 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.452 0.048 17732 236 1 2 . 1 1 410 410 ASP CA C 410 53.200 53.200 55.982 -2.782 17732 237 1 2 . 1 1 410 410 ASP H H 410 8.570 8.570 8.782 -0.212 17732 238 1 2 . 1 1 411 411 GLY N N 411 108.400 108.400 105.179 3.221 17732 239 1 2 . 1 1 411 411 GLY CA C 411 45.300 45.300 44.773 0.527 17732 240 1 2 . 1 1 411 411 GLY H H 411 8.520 8.520 8.425 0.095 17732 241 1 2 . 1 1 412 412 TYR N N 412 118.600 118.600 119.221 -0.621 17732 242 1 2 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.623 -0.273 17732 243 1 2 . 1 1 412 412 TYR CA C 412 58.000 58.000 56.799 1.201 17732 244 1 2 . 1 1 412 412 TYR H H 412 8.160 8.160 7.716 0.444 17732 245 1 2 . 1 1 413 413 ARG N N 413 121.100 121.100 120.990 0.110 17732 246 1 2 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.504 0.276 17732 247 1 2 . 1 1 413 413 ARG CA C 413 55.100 55.100 56.194 -1.094 17732 248 1 2 . 1 1 413 413 ARG H H 413 8.750 8.750 8.509 0.241 17732 249 1 2 . 1 1 414 414 TRP N N 414 120.600 120.600 123.370 -2.770 17732 250 1 2 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.212 0.368 17732 251 1 2 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.246 -0.146 17732 252 1 2 . 1 1 414 414 TRP H H 414 8.250 8.250 8.735 -0.485 17732 253 1 2 . 1 1 415 415 ARG N N 415 122.900 122.900 123.683 -0.783 17732 254 1 2 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.908 0.372 17732 255 1 2 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.610 -0.010 17732 256 1 2 . 1 1 415 415 ARG H H 415 9.450 9.450 9.235 0.215 17732 257 1 2 . 1 1 416 416 LYS N N 416 134.700 134.700 128.949 5.751 17732 258 1 2 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.678 0.682 17732 259 1 2 . 1 1 416 416 LYS CA C 416 57.000 57.000 57.135 -0.135 17732 260 1 2 . 1 1 416 416 LYS H H 416 11.120 11.120 8.849 2.271 17732 261 1 2 . 1 1 417 417 TYR N N 417 118.600 118.600 120.610 -2.010 17732 262 1 2 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.544 0.716 17732 263 1 2 . 1 1 417 417 TYR CA C 417 56.000 56.000 58.150 -2.150 17732 264 1 2 . 1 1 417 417 TYR H H 417 8.900 8.900 7.645 1.255 17732 265 1 2 . 1 1 418 418 GLY N N 418 105.300 105.300 110.630 -5.330 17732 266 1 2 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.947 0.953 17732 267 1 2 . 1 1 418 418 GLY H H 418 6.990 6.990 8.698 -1.708 17732 268 1 2 . 1 1 419 419 GLN N N 419 122.600 122.600 122.089 0.511 17732 269 1 2 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.197 1.283 17732 270 1 2 . 1 1 419 419 GLN CA C 419 56.600 56.600 55.681 0.919 17732 271 1 2 . 1 1 419 419 GLN H H 419 9.000 9.000 8.453 0.547 17732 272 1 2 . 1 1 420 420 LYS N N 420 123.000 123.000 125.038 -2.038 17732 273 1 2 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.508 0.392 17732 274 1 2 . 1 1 420 420 LYS CA C 420 52.800 52.800 55.133 -2.333 17732 275 1 2 . 1 1 420 420 LYS H H 420 9.140 9.140 8.447 0.693 17732 276 1 2 . 1 1 421 421 VAL N N 421 122.800 122.800 120.451 2.349 17732 277 1 2 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.522 -0.242 17732 278 1 2 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.390 3.710 17732 279 1 2 . 1 1 421 421 VAL H H 421 8.550 8.550 8.322 0.228 17732 280 1 2 . 1 1 422 422 VAL N N 422 128.600 128.600 121.090 7.510 17732 281 1 2 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.637 -0.067 17732 282 1 2 . 1 1 422 422 VAL CA C 422 60.200 60.200 59.670 0.530 17732 283 1 2 . 1 1 422 422 VAL H H 422 9.500 9.500 8.383 1.117 17732 284 1 2 . 1 1 423 423 LYS N N 423 123.800 123.800 126.480 -2.680 17732 285 1 2 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.246 -0.306 17732 286 1 2 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.504 1.796 17732 287 1 2 . 1 1 423 423 LYS H H 423 8.880 8.880 8.681 0.199 17732 288 1 2 . 1 1 424 424 GLY N N 424 110.800 110.800 106.351 4.449 17732 289 1 2 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.096 -0.796 17732 290 1 2 . 1 1 424 424 GLY H H 424 8.600 8.600 8.645 -0.045 17732 291 1 2 . 1 1 425 425 ASN N N 425 119.800 119.800 116.719 3.081 17732 292 1 2 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.080 0.060 17732 293 1 2 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.800 -1.700 17732 294 1 2 . 1 1 425 425 ASN H H 425 7.600 7.600 7.867 -0.267 17732 295 1 2 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.166 0.134 17732 296 1 2 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.352 -0.952 17732 297 1 2 . 1 1 427 427 TYR N N 427 121.100 121.100 119.818 1.282 17732 298 1 2 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.625 0.265 17732 299 1 2 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.482 -0.382 17732 300 1 2 . 1 1 427 427 TYR H H 427 8.120 8.120 7.828 0.292 17732 301 1 2 . 1 1 428 428 PRO HA H 428 4.420 4.420 4.827 -0.407 17732 302 1 2 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.257 1.043 17732 303 1 2 . 1 1 429 429 ARG N N 429 124.900 124.900 124.263 0.637 17732 304 1 2 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.489 0.191 17732 305 1 2 . 1 1 429 429 ARG CA C 429 55.000 55.000 56.169 -1.169 17732 306 1 2 . 1 1 429 429 ARG H H 429 9.280 9.280 8.839 0.441 17732 307 1 2 . 1 1 430 430 SER N N 430 122.200 122.200 119.315 2.885 17732 308 1 2 . 1 1 430 430 SER HA H 430 4.960 4.960 4.643 0.317 17732 309 1 2 . 1 1 430 430 SER CA C 430 59.300 59.300 57.484 1.816 17732 310 1 2 . 1 1 430 430 SER H H 430 9.100 9.100 8.269 0.831 17732 311 1 2 . 1 1 431 431 TYR N N 431 122.100 122.100 125.519 -3.419 17732 312 1 2 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.862 -0.202 17732 313 1 2 . 1 1 431 431 TYR CA C 431 57.400 57.400 57.528 -0.128 17732 314 1 2 . 1 1 431 431 TYR H H 431 7.590 7.590 7.845 -0.255 17732 315 1 2 . 1 1 432 432 TYR N N 432 120.300 120.300 124.975 -4.675 17732 316 1 2 . 1 1 432 432 TYR HA H 432 5.720 5.720 4.984 0.736 17732 317 1 2 . 1 1 432 432 TYR CA C 432 57.100 57.100 58.099 -0.999 17732 318 1 2 . 1 1 432 432 TYR H H 432 9.370 9.370 8.556 0.814 17732 319 1 2 . 1 1 433 433 LYS N N 433 121.500 121.500 123.979 -2.479 17732 320 1 2 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.580 0.250 17732 321 1 2 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.332 -0.132 17732 322 1 2 . 1 1 433 433 LYS H H 433 9.960 9.960 9.358 0.602 17732 323 1 2 . 1 1 434 434 CYS N N 434 128.700 128.700 126.673 2.027 17732 324 1 2 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.203 -1.003 17732 325 1 2 . 1 1 434 434 CYS CA C 434 60.300 60.300 57.499 2.801 17732 326 1 2 . 1 1 434 434 CYS H H 434 8.440 8.440 9.213 -0.773 17732 327 1 2 . 1 1 435 435 THR N N 435 118.000 118.000 121.326 -3.326 17732 328 1 2 . 1 1 435 435 THR HA H 435 4.270 4.270 5.116 -0.846 17732 329 1 2 . 1 1 435 435 THR CA C 435 62.800 62.800 60.576 2.224 17732 330 1 2 . 1 1 435 435 THR H H 435 8.200 8.200 8.099 0.101 17732 331 1 2 . 1 1 436 436 THR N N 436 127.500 127.500 112.904 14.596 17732 332 1 2 . 1 1 436 436 THR HA H 436 4.230 4.230 4.459 -0.229 17732 333 1 2 . 1 1 436 436 THR CA C 436 63.300 63.300 60.706 2.594 17732 334 1 2 . 1 1 436 436 THR H H 436 8.880 8.880 7.693 1.187 17732 335 1 2 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.206 0.064 17732 336 1 2 . 1 1 438 438 GLY N N 438 112.800 112.800 105.491 7.309 17732 337 1 2 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.298 1.102 17732 338 1 2 . 1 1 438 438 GLY H H 438 8.870 8.870 8.357 0.513 17732 339 1 2 . 1 1 439 439 CYS N N 439 123.900 123.900 119.934 3.966 17732 340 1 2 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.801 -0.201 17732 341 1 2 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.707 1.993 17732 342 1 2 . 1 1 439 439 CYS H H 439 7.870 7.870 7.529 0.341 17732 343 1 2 . 1 1 440 440 GLY N N 440 113.300 113.300 112.666 0.634 17732 344 1 2 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.192 0.208 17732 345 1 2 . 1 1 440 440 GLY H H 440 9.070 9.070 8.261 0.809 17732 346 1 2 . 1 1 441 441 VAL N N 441 123.400 123.400 124.394 -0.994 17732 347 1 2 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.394 -0.284 17732 348 1 2 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.726 4.774 17732 349 1 2 . 1 1 441 441 VAL H H 441 8.230 8.230 8.532 -0.302 17732 350 1 2 . 1 1 442 442 ARG N N 442 126.100 126.100 123.305 2.795 17732 351 1 2 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.477 0.173 17732 352 1 2 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.653 -0.353 17732 353 1 2 . 1 1 442 442 ARG H H 442 8.340 8.340 8.396 -0.056 17732 354 1 2 . 1 1 443 443 LYS N N 443 120.700 120.700 120.923 -0.223 17732 355 1 2 . 1 1 443 443 LYS HA H 443 5.110 5.110 4.961 0.149 17732 356 1 2 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.742 -0.742 17732 357 1 2 . 1 1 443 443 LYS H H 443 9.340 9.340 9.161 0.179 17732 358 1 2 . 1 1 444 444 HIS N N 444 122.000 122.000 121.981 0.019 17732 359 1 2 . 1 1 444 444 HIS HA H 444 5.700 5.700 4.708 0.992 17732 360 1 2 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.374 -3.374 17732 361 1 2 . 1 1 444 444 HIS H H 444 8.860 8.860 8.485 0.375 17732 362 1 2 . 1 1 445 445 VAL N N 445 121.200 121.200 122.271 -1.071 17732 363 1 2 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.123 -0.313 17732 364 1 2 . 1 1 445 445 VAL CA C 445 61.600 61.600 60.730 0.870 17732 365 1 2 . 1 1 445 445 VAL H H 445 8.560 8.560 8.013 0.547 17732 366 1 2 . 1 1 446 446 GLU N N 446 125.100 125.100 126.432 -1.332 17732 367 1 2 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.750 0.160 17732 368 1 2 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.304 0.096 17732 369 1 2 . 1 1 446 446 GLU H H 446 8.680 8.680 8.378 0.302 17732 370 1 2 . 1 1 447 447 ARG N N 447 122.400 122.400 122.799 -0.399 17732 371 1 2 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.720 -0.030 17732 372 1 2 . 1 1 447 447 ARG CA C 447 55.400 55.400 54.689 0.711 17732 373 1 2 . 1 1 447 447 ARG H H 447 8.660 8.660 8.597 0.063 17732 374 1 2 . 1 1 448 448 ALA N N 448 125.000 125.000 127.357 -2.357 17732 375 1 2 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.035 0.185 17732 376 1 2 . 1 1 448 448 ALA CA C 448 52.300 52.300 52.437 -0.137 17732 377 1 2 . 1 1 448 448 ALA H H 448 8.100 8.100 8.177 -0.077 17732 378 1 2 . 1 1 449 449 ALA N N 449 123.700 123.700 124.745 -1.045 17732 379 1 2 . 1 1 449 449 ALA HA H 449 4.220 4.220 3.965 0.255 17732 380 1 2 . 1 1 449 449 ALA CA C 449 55.200 55.200 53.944 1.256 17732 381 1 2 . 1 1 449 449 ALA H H 449 8.550 8.550 8.447 0.103 17732 382 1 2 . 1 1 450 450 THR N N 450 102.500 102.500 105.546 -3.046 17732 383 1 2 . 1 1 450 450 THR HA H 450 4.340 4.340 4.465 -0.125 17732 384 1 2 . 1 1 450 450 THR CA C 450 61.300 61.300 60.963 0.337 17732 385 1 2 . 1 1 450 450 THR H H 450 7.600 7.600 7.467 0.133 17732 386 1 2 . 1 1 451 451 ASP N N 451 118.200 118.200 121.544 -3.344 17732 387 1 2 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.742 0.168 17732 388 1 2 . 1 1 451 451 ASP CA C 451 52.000 52.000 53.535 -1.535 17732 389 1 2 . 1 1 451 451 ASP H H 451 7.060 7.060 7.778 -0.718 17732 390 1 2 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.353 -0.053 17732 391 1 2 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.462 -0.462 17732 392 1 2 . 1 1 453 453 LYS N N 453 117.000 117.000 117.831 -0.831 17732 393 1 2 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.220 -0.060 17732 394 1 2 . 1 1 453 453 LYS CA C 453 56.700 56.700 56.017 0.684 17732 395 1 2 . 1 1 453 453 LYS H H 453 7.880 7.880 8.344 -0.464 17732 396 1 2 . 1 1 454 454 ALA N N 454 124.700 124.700 123.236 1.464 17732 397 1 2 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.601 -0.031 17732 398 1 2 . 1 1 454 454 ALA CA C 454 51.200 51.200 51.057 0.143 17732 399 1 2 . 1 1 454 454 ALA H H 454 8.060 8.060 7.553 0.507 17732 400 1 2 . 1 1 455 455 VAL N N 455 119.700 119.700 123.608 -3.908 17732 401 1 2 . 1 1 455 455 VAL HA H 455 4.370 4.370 5.123 -0.753 17732 402 1 2 . 1 1 455 455 VAL CA C 455 61.400 61.400 60.072 1.328 17732 403 1 2 . 1 1 455 455 VAL H H 455 8.190 8.190 8.421 -0.231 17732 404 1 2 . 1 1 456 456 VAL N N 456 129.400 129.400 122.741 6.659 17732 405 1 2 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.549 -0.239 17732 406 1 2 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.279 1.621 17732 407 1 2 . 1 1 456 456 VAL H H 456 9.220 9.220 9.009 0.211 17732 408 1 2 . 1 1 457 457 THR N N 457 125.000 125.000 121.838 3.162 17732 409 1 2 . 1 1 457 457 THR HA H 457 5.160 5.160 5.294 -0.134 17732 410 1 2 . 1 1 457 457 THR CA C 457 61.100 61.100 60.975 0.124 17732 411 1 2 . 1 1 457 457 THR H H 457 8.560 8.560 8.271 0.289 17732 412 1 2 . 1 1 458 458 THR N N 458 120.600 120.600 122.316 -1.716 17732 413 1 2 . 1 1 458 458 THR HA H 458 4.550 4.550 4.571 -0.021 17732 414 1 2 . 1 1 458 458 THR CA C 458 60.600 60.600 61.454 -0.854 17732 415 1 2 . 1 1 458 458 THR H H 458 8.560 8.560 8.294 0.266 17732 416 1 2 . 1 1 459 459 TYR N N 459 122.500 122.500 125.426 -2.926 17732 417 1 2 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.676 0.264 17732 418 1 2 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.670 0.130 17732 419 1 2 . 1 1 459 459 TYR H H 459 8.870 8.870 8.787 0.083 17732 420 1 2 . 1 1 460 460 GLU N N 460 123.200 123.200 125.890 -2.690 17732 421 1 2 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.695 -0.065 17732 422 1 2 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.470 0.130 17732 423 1 2 . 1 1 460 460 GLU H H 460 9.150 9.150 8.362 0.788 17732 424 1 2 . 1 1 461 461 GLY N N 461 112.700 112.700 112.670 0.030 17732 425 1 2 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.857 -0.957 17732 426 1 2 . 1 1 461 461 GLY H H 461 8.330 8.330 8.443 -0.113 17732 427 1 2 . 1 1 462 462 LYS N N 462 118.300 118.300 120.422 -2.122 17732 428 1 2 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.277 0.213 17732 429 1 2 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.056 -1.056 17732 430 1 2 . 1 1 462 462 LYS H H 462 8.050 8.050 8.214 -0.164 17732 431 1 2 . 1 1 463 463 HIS N N 463 123.900 123.900 121.646 2.254 17732 432 1 2 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.589 0.011 17732 433 1 2 . 1 1 463 463 HIS CA C 463 57.200 57.200 56.014 1.185 17732 434 1 2 . 1 1 463 463 HIS H H 463 8.470 8.470 8.318 0.152 17732 435 1 2 . 1 1 464 464 ASN N N 464 124.400 124.400 122.795 1.605 17732 436 1 2 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.743 0.207 17732 437 1 2 . 1 1 464 464 ASN CA C 464 51.500 51.500 53.195 -1.695 17732 438 1 2 . 1 1 464 464 ASN H H 464 8.360 8.360 8.496 -0.136 17732 439 1 2 . 1 1 465 465 HIS N N 465 112.100 112.100 114.668 -2.568 17732 440 1 2 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.817 0.053 17732 441 1 2 . 1 1 465 465 HIS CA C 465 52.900 52.900 54.193 -1.293 17732 442 1 2 . 1 1 465 465 HIS H H 465 6.830 6.830 7.321 -0.491 17732 443 1 2 . 1 1 466 466 ASP N N 466 120.300 120.300 120.893 -0.593 17732 444 1 2 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.533 0.087 17732 445 1 2 . 1 1 466 466 ASP CA C 466 54.000 54.000 54.043 -0.043 17732 446 1 2 . 1 1 466 466 ASP H H 466 8.780 8.780 8.432 0.348 17732 447 1 2 . 1 1 467 467 LEU N N 467 124.200 124.200 122.515 1.685 17732 448 1 2 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.106 -0.066 17732 449 1 2 . 1 1 467 467 LEU CA C 467 54.100 54.100 53.152 0.948 17732 450 1 2 . 1 1 467 467 LEU H H 467 8.530 8.530 8.340 0.190 17732 451 1 2 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.347 0.003 17732 452 1 2 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.568 0.732 17732 453 1 3 . 1 1 408 408 LEU N N 408 122.600 122.600 120.831 1.769 17732 454 1 3 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.023 0.237 17732 455 1 3 . 1 1 408 408 LEU CA C 408 55.000 55.000 55.622 -0.622 17732 456 1 3 . 1 1 408 408 LEU H H 408 8.090 8.090 8.282 -0.192 17732 457 1 3 . 1 1 409 409 ASP N N 409 122.500 122.500 117.069 5.431 17732 458 1 3 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.415 0.225 17732 459 1 3 . 1 1 409 409 ASP CA C 409 55.100 55.100 55.323 -0.223 17732 460 1 3 . 1 1 409 409 ASP H H 409 8.140 8.140 8.391 -0.251 17732 461 1 3 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.556 -0.056 17732 462 1 3 . 1 1 410 410 ASP CA C 410 53.200 53.200 55.001 -1.801 17732 463 1 3 . 1 1 410 410 ASP H H 410 8.570 8.570 8.732 -0.162 17732 464 1 3 . 1 1 411 411 GLY N N 411 108.400 108.400 106.917 1.483 17732 465 1 3 . 1 1 411 411 GLY CA C 411 45.300 45.300 44.952 0.348 17732 466 1 3 . 1 1 411 411 GLY H H 411 8.520 8.520 7.912 0.608 17732 467 1 3 . 1 1 412 412 TYR N N 412 118.600 118.600 116.197 2.403 17732 468 1 3 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.465 -0.115 17732 469 1 3 . 1 1 412 412 TYR CA C 412 58.000 58.000 57.159 0.841 17732 470 1 3 . 1 1 412 412 TYR H H 412 8.160 8.160 7.879 0.281 17732 471 1 3 . 1 1 413 413 ARG N N 413 121.100 121.100 121.811 -0.711 17732 472 1 3 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.797 -0.017 17732 473 1 3 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.443 -0.343 17732 474 1 3 . 1 1 413 413 ARG H H 413 8.750 8.750 8.723 0.027 17732 475 1 3 . 1 1 414 414 TRP N N 414 120.600 120.600 123.731 -3.131 17732 476 1 3 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.045 0.535 17732 477 1 3 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.507 -0.407 17732 478 1 3 . 1 1 414 414 TRP H H 414 8.250 8.250 8.832 -0.582 17732 479 1 3 . 1 1 415 415 ARG N N 415 122.900 122.900 124.316 -1.416 17732 480 1 3 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.898 0.382 17732 481 1 3 . 1 1 415 415 ARG CA C 415 54.600 54.600 55.011 -0.412 17732 482 1 3 . 1 1 415 415 ARG H H 415 9.450 9.450 8.583 0.867 17732 483 1 3 . 1 1 416 416 LYS N N 416 134.700 134.700 127.041 7.659 17732 484 1 3 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.841 0.519 17732 485 1 3 . 1 1 416 416 LYS CA C 416 57.000 57.000 57.166 -0.166 17732 486 1 3 . 1 1 416 416 LYS H H 416 11.120 11.120 8.796 2.324 17732 487 1 3 . 1 1 417 417 TYR N N 417 118.600 118.600 115.339 3.261 17732 488 1 3 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.414 0.846 17732 489 1 3 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.418 -1.418 17732 490 1 3 . 1 1 417 417 TYR H H 417 8.900 8.900 7.684 1.216 17732 491 1 3 . 1 1 418 418 GLY N N 418 105.300 105.300 109.792 -4.492 17732 492 1 3 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.720 1.180 17732 493 1 3 . 1 1 418 418 GLY H H 418 6.990 6.990 8.462 -1.472 17732 494 1 3 . 1 1 419 419 GLN N N 419 122.600 122.600 120.129 2.471 17732 495 1 3 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.230 1.250 17732 496 1 3 . 1 1 419 419 GLN CA C 419 56.600 56.600 56.204 0.396 17732 497 1 3 . 1 1 419 419 GLN H H 419 9.000 9.000 8.073 0.927 17732 498 1 3 . 1 1 420 420 LYS N N 420 123.000 123.000 128.072 -5.072 17732 499 1 3 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.642 0.258 17732 500 1 3 . 1 1 420 420 LYS CA C 420 52.800 52.800 55.621 -2.821 17732 501 1 3 . 1 1 420 420 LYS H H 420 9.140 9.140 8.277 0.863 17732 502 1 3 . 1 1 421 421 VAL N N 421 122.800 122.800 122.879 -0.079 17732 503 1 3 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.580 -0.300 17732 504 1 3 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.923 3.177 17732 505 1 3 . 1 1 421 421 VAL H H 421 8.550 8.550 8.306 0.244 17732 506 1 3 . 1 1 422 422 VAL N N 422 128.600 128.600 123.581 5.019 17732 507 1 3 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.609 -0.039 17732 508 1 3 . 1 1 422 422 VAL CA C 422 60.200 60.200 59.946 0.254 17732 509 1 3 . 1 1 422 422 VAL H H 422 9.500 9.500 8.465 1.035 17732 510 1 3 . 1 1 423 423 LYS N N 423 123.800 123.800 126.592 -2.792 17732 511 1 3 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.260 -0.320 17732 512 1 3 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.640 1.660 17732 513 1 3 . 1 1 423 423 LYS H H 423 8.880 8.880 8.521 0.359 17732 514 1 3 . 1 1 424 424 GLY N N 424 110.800 110.800 106.750 4.050 17732 515 1 3 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.081 -0.781 17732 516 1 3 . 1 1 424 424 GLY H H 424 8.600 8.600 8.730 -0.130 17732 517 1 3 . 1 1 425 425 ASN N N 425 119.800 119.800 116.709 3.091 17732 518 1 3 . 1 1 425 425 ASN HA H 425 5.140 5.140 4.986 0.154 17732 519 1 3 . 1 1 425 425 ASN CA C 425 50.100 50.100 50.950 -0.850 17732 520 1 3 . 1 1 425 425 ASN H H 425 7.600 7.600 7.821 -0.221 17732 521 1 3 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.335 -0.035 17732 522 1 3 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.347 -0.947 17732 523 1 3 . 1 1 427 427 TYR N N 427 121.100 121.100 119.484 1.616 17732 524 1 3 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.664 0.226 17732 525 1 3 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.114 -0.014 17732 526 1 3 . 1 1 427 427 TYR H H 427 8.120 8.120 8.017 0.103 17732 527 1 3 . 1 1 428 428 PRO HA H 428 4.420 4.420 5.062 -0.642 17732 528 1 3 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.125 1.175 17732 529 1 3 . 1 1 429 429 ARG N N 429 124.900 124.900 123.425 1.475 17732 530 1 3 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.635 0.045 17732 531 1 3 . 1 1 429 429 ARG CA C 429 55.000 55.000 56.363 -1.363 17732 532 1 3 . 1 1 429 429 ARG H H 429 9.280 9.280 8.895 0.385 17732 533 1 3 . 1 1 430 430 SER N N 430 122.200 122.200 116.596 5.604 17732 534 1 3 . 1 1 430 430 SER HA H 430 4.960 4.960 4.803 0.157 17732 535 1 3 . 1 1 430 430 SER CA C 430 59.300 59.300 57.650 1.650 17732 536 1 3 . 1 1 430 430 SER H H 430 9.100 9.100 8.226 0.874 17732 537 1 3 . 1 1 431 431 TYR N N 431 122.100 122.100 123.840 -1.740 17732 538 1 3 . 1 1 431 431 TYR HA H 431 4.660 4.660 5.250 -0.590 17732 539 1 3 . 1 1 431 431 TYR CA C 431 57.400 57.400 56.121 1.279 17732 540 1 3 . 1 1 431 431 TYR H H 431 7.590 7.590 8.170 -0.580 17732 541 1 3 . 1 1 432 432 TYR N N 432 120.300 120.300 124.657 -4.357 17732 542 1 3 . 1 1 432 432 TYR HA H 432 5.720 5.720 4.799 0.921 17732 543 1 3 . 1 1 432 432 TYR CA C 432 57.100 57.100 57.905 -0.805 17732 544 1 3 . 1 1 432 432 TYR H H 432 9.370 9.370 9.091 0.279 17732 545 1 3 . 1 1 433 433 LYS N N 433 121.500 121.500 124.604 -3.104 17732 546 1 3 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.339 0.491 17732 547 1 3 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.550 -0.350 17732 548 1 3 . 1 1 433 433 LYS H H 433 9.960 9.960 8.471 1.489 17732 549 1 3 . 1 1 434 434 CYS N N 434 128.700 128.700 126.758 1.942 17732 550 1 3 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.032 -0.832 17732 551 1 3 . 1 1 434 434 CYS CA C 434 60.300 60.300 57.786 2.514 17732 552 1 3 . 1 1 434 434 CYS H H 434 8.440 8.440 9.082 -0.642 17732 553 1 3 . 1 1 435 435 THR N N 435 118.000 118.000 121.463 -3.463 17732 554 1 3 . 1 1 435 435 THR HA H 435 4.270 4.270 4.944 -0.674 17732 555 1 3 . 1 1 435 435 THR CA C 435 62.800 62.800 60.964 1.836 17732 556 1 3 . 1 1 435 435 THR H H 435 8.200 8.200 7.982 0.218 17732 557 1 3 . 1 1 436 436 THR N N 436 127.500 127.500 113.841 13.659 17732 558 1 3 . 1 1 436 436 THR HA H 436 4.230 4.230 4.578 -0.348 17732 559 1 3 . 1 1 436 436 THR CA C 436 63.300 63.300 60.190 3.110 17732 560 1 3 . 1 1 436 436 THR H H 436 8.880 8.880 7.753 1.127 17732 561 1 3 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.207 0.063 17732 562 1 3 . 1 1 438 438 GLY N N 438 112.800 112.800 105.808 6.992 17732 563 1 3 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.226 1.174 17732 564 1 3 . 1 1 438 438 GLY H H 438 8.870 8.870 8.357 0.513 17732 565 1 3 . 1 1 439 439 CYS N N 439 123.900 123.900 119.347 4.553 17732 566 1 3 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.786 -0.186 17732 567 1 3 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.802 1.898 17732 568 1 3 . 1 1 439 439 CYS H H 439 7.870 7.870 7.486 0.384 17732 569 1 3 . 1 1 440 440 GLY N N 440 113.300 113.300 113.982 -0.682 17732 570 1 3 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.449 -0.049 17732 571 1 3 . 1 1 440 440 GLY H H 440 9.070 9.070 8.324 0.746 17732 572 1 3 . 1 1 441 441 VAL N N 441 123.400 123.400 124.221 -0.821 17732 573 1 3 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.250 -0.140 17732 574 1 3 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.612 4.888 17732 575 1 3 . 1 1 441 441 VAL H H 441 8.230 8.230 8.563 -0.333 17732 576 1 3 . 1 1 442 442 ARG N N 442 126.100 126.100 123.202 2.898 17732 577 1 3 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.147 0.503 17732 578 1 3 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.632 -0.332 17732 579 1 3 . 1 1 442 442 ARG H H 442 8.340 8.340 8.605 -0.265 17732 580 1 3 . 1 1 443 443 LYS N N 443 120.700 120.700 122.303 -1.603 17732 581 1 3 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.091 0.019 17732 582 1 3 . 1 1 443 443 LYS CA C 443 54.000 54.000 55.162 -1.162 17732 583 1 3 . 1 1 443 443 LYS H H 443 9.340 9.340 9.020 0.320 17732 584 1 3 . 1 1 444 444 HIS N N 444 122.000 122.000 124.392 -2.392 17732 585 1 3 . 1 1 444 444 HIS HA H 444 5.700 5.700 5.036 0.664 17732 586 1 3 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.262 -3.262 17732 587 1 3 . 1 1 444 444 HIS H H 444 8.860 8.860 8.813 0.047 17732 588 1 3 . 1 1 445 445 VAL N N 445 121.200 121.200 124.704 -3.504 17732 589 1 3 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.175 -0.365 17732 590 1 3 . 1 1 445 445 VAL CA C 445 61.600 61.600 60.160 1.440 17732 591 1 3 . 1 1 445 445 VAL H H 445 8.560 8.560 8.718 -0.158 17732 592 1 3 . 1 1 446 446 GLU N N 446 125.100 125.100 125.572 -0.472 17732 593 1 3 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.782 0.128 17732 594 1 3 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.372 0.028 17732 595 1 3 . 1 1 446 446 GLU H H 446 8.680 8.680 8.355 0.325 17732 596 1 3 . 1 1 447 447 ARG N N 447 122.400 122.400 120.288 2.112 17732 597 1 3 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.503 0.187 17732 598 1 3 . 1 1 447 447 ARG CA C 447 55.400 55.400 54.989 0.411 17732 599 1 3 . 1 1 447 447 ARG H H 447 8.660 8.660 8.641 0.019 17732 600 1 3 . 1 1 448 448 ALA N N 448 125.000 125.000 125.113 -0.113 17732 601 1 3 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.388 -0.168 17732 602 1 3 . 1 1 448 448 ALA CA C 448 52.300 52.300 51.160 1.140 17732 603 1 3 . 1 1 448 448 ALA H H 448 8.100 8.100 7.996 0.104 17732 604 1 3 . 1 1 449 449 ALA N N 449 123.700 123.700 127.001 -3.301 17732 605 1 3 . 1 1 449 449 ALA HA H 449 4.220 4.220 3.956 0.264 17732 606 1 3 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.768 0.432 17732 607 1 3 . 1 1 449 449 ALA H H 449 8.550 8.550 8.697 -0.147 17732 608 1 3 . 1 1 450 450 THR N N 450 102.500 102.500 108.287 -5.787 17732 609 1 3 . 1 1 450 450 THR HA H 450 4.340 4.340 4.221 0.119 17732 610 1 3 . 1 1 450 450 THR CA C 450 61.300 61.300 62.739 -1.439 17732 611 1 3 . 1 1 450 450 THR H H 450 7.600 7.600 7.942 -0.342 17732 612 1 3 . 1 1 451 451 ASP N N 451 118.200 118.200 121.766 -3.566 17732 613 1 3 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.961 -0.051 17732 614 1 3 . 1 1 451 451 ASP CA C 451 52.000 52.000 51.120 0.880 17732 615 1 3 . 1 1 451 451 ASP H H 451 7.060 7.060 7.946 -0.886 17732 616 1 3 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.107 0.193 17732 617 1 3 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.467 -0.467 17732 618 1 3 . 1 1 453 453 LYS N N 453 117.000 117.000 117.223 -0.223 17732 619 1 3 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.378 -0.218 17732 620 1 3 . 1 1 453 453 LYS CA C 453 56.700 56.700 55.962 0.738 17732 621 1 3 . 1 1 453 453 LYS H H 453 7.880 7.880 7.916 -0.036 17732 622 1 3 . 1 1 454 454 ALA N N 454 124.700 124.700 123.095 1.605 17732 623 1 3 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.160 0.410 17732 624 1 3 . 1 1 454 454 ALA CA C 454 51.200 51.200 53.305 -2.105 17732 625 1 3 . 1 1 454 454 ALA H H 454 8.060 8.060 7.311 0.749 17732 626 1 3 . 1 1 455 455 VAL N N 455 119.700 119.700 116.969 2.731 17732 627 1 3 . 1 1 455 455 VAL HA H 455 4.370 4.370 3.934 0.436 17732 628 1 3 . 1 1 455 455 VAL CA C 455 61.400 61.400 62.298 -0.898 17732 629 1 3 . 1 1 455 455 VAL H H 455 8.190 8.190 7.887 0.303 17732 630 1 3 . 1 1 456 456 VAL N N 456 129.400 129.400 122.019 7.381 17732 631 1 3 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.541 -0.231 17732 632 1 3 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.488 1.412 17732 633 1 3 . 1 1 456 456 VAL H H 456 9.220 9.220 8.911 0.309 17732 634 1 3 . 1 1 457 457 THR N N 457 125.000 125.000 121.323 3.677 17732 635 1 3 . 1 1 457 457 THR HA H 457 5.160 5.160 5.117 0.043 17732 636 1 3 . 1 1 457 457 THR CA C 457 61.100 61.100 60.683 0.417 17732 637 1 3 . 1 1 457 457 THR H H 457 8.560 8.560 8.382 0.178 17732 638 1 3 . 1 1 458 458 THR N N 458 120.600 120.600 123.084 -2.484 17732 639 1 3 . 1 1 458 458 THR HA H 458 4.550 4.550 4.627 -0.077 17732 640 1 3 . 1 1 458 458 THR CA C 458 60.600 60.600 61.250 -0.650 17732 641 1 3 . 1 1 458 458 THR H H 458 8.560 8.560 8.517 0.043 17732 642 1 3 . 1 1 459 459 TYR N N 459 122.500 122.500 125.960 -3.460 17732 643 1 3 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.841 0.099 17732 644 1 3 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.598 0.202 17732 645 1 3 . 1 1 459 459 TYR H H 459 8.870 8.870 8.907 -0.037 17732 646 1 3 . 1 1 460 460 GLU N N 460 123.200 123.200 125.984 -2.784 17732 647 1 3 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.533 0.097 17732 648 1 3 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.080 0.520 17732 649 1 3 . 1 1 460 460 GLU H H 460 9.150 9.150 9.087 0.063 17732 650 1 3 . 1 1 461 461 GLY N N 461 112.700 112.700 112.832 -0.132 17732 651 1 3 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.366 -0.466 17732 652 1 3 . 1 1 461 461 GLY H H 461 8.330 8.330 7.856 0.474 17732 653 1 3 . 1 1 462 462 LYS N N 462 118.300 118.300 121.934 -3.634 17732 654 1 3 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.362 0.128 17732 655 1 3 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.400 -1.400 17732 656 1 3 . 1 1 462 462 LYS H H 462 8.050 8.050 8.194 -0.144 17732 657 1 3 . 1 1 463 463 HIS N N 463 123.900 123.900 117.699 6.201 17732 658 1 3 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.530 0.070 17732 659 1 3 . 1 1 463 463 HIS CA C 463 57.200 57.200 56.350 0.850 17732 660 1 3 . 1 1 463 463 HIS H H 463 8.470 8.470 8.354 0.116 17732 661 1 3 . 1 1 464 464 ASN N N 464 124.400 124.400 119.648 4.752 17732 662 1 3 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.840 0.110 17732 663 1 3 . 1 1 464 464 ASN CA C 464 51.500 51.500 53.416 -1.916 17732 664 1 3 . 1 1 464 464 ASN H H 464 8.360 8.360 8.734 -0.374 17732 665 1 3 . 1 1 465 465 HIS N N 465 112.100 112.100 115.904 -3.804 17732 666 1 3 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.829 0.041 17732 667 1 3 . 1 1 465 465 HIS CA C 465 52.900 52.900 54.254 -1.354 17732 668 1 3 . 1 1 465 465 HIS H H 465 6.830 6.830 7.464 -0.634 17732 669 1 3 . 1 1 466 466 ASP N N 466 120.300 120.300 121.132 -0.832 17732 670 1 3 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.528 0.092 17732 671 1 3 . 1 1 466 466 ASP CA C 466 54.000 54.000 54.461 -0.461 17732 672 1 3 . 1 1 466 466 ASP H H 466 8.780 8.780 8.639 0.141 17732 673 1 3 . 1 1 467 467 LEU N N 467 124.200 124.200 121.301 2.899 17732 674 1 3 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.289 -0.249 17732 675 1 3 . 1 1 467 467 LEU CA C 467 54.100 54.100 52.459 1.641 17732 676 1 3 . 1 1 467 467 LEU H H 467 8.530 8.530 8.386 0.144 17732 677 1 3 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.397 -0.047 17732 678 1 3 . 1 1 468 468 PRO CA C 468 63.300 63.300 63.125 0.175 17732 679 1 4 . 1 1 408 408 LEU N N 408 122.600 122.600 122.477 0.123 17732 680 1 4 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.584 -0.324 17732 681 1 4 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.513 0.487 17732 682 1 4 . 1 1 408 408 LEU H H 408 8.090 8.090 8.288 -0.198 17732 683 1 4 . 1 1 409 409 ASP N N 409 122.500 122.500 123.206 -0.706 17732 684 1 4 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.557 0.083 17732 685 1 4 . 1 1 409 409 ASP CA C 409 55.100 55.100 55.491 -0.391 17732 686 1 4 . 1 1 409 409 ASP H H 409 8.140 8.140 8.529 -0.389 17732 687 1 4 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.797 -0.297 17732 688 1 4 . 1 1 410 410 ASP CA C 410 53.200 53.200 53.707 -0.507 17732 689 1 4 . 1 1 410 410 ASP H H 410 8.570 8.570 8.753 -0.183 17732 690 1 4 . 1 1 411 411 GLY N N 411 108.400 108.400 107.282 1.118 17732 691 1 4 . 1 1 411 411 GLY CA C 411 45.300 45.300 44.886 0.414 17732 692 1 4 . 1 1 411 411 GLY H H 411 8.520 8.520 7.899 0.621 17732 693 1 4 . 1 1 412 412 TYR N N 412 118.600 118.600 116.474 2.126 17732 694 1 4 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.381 -0.031 17732 695 1 4 . 1 1 412 412 TYR CA C 412 58.000 58.000 57.203 0.797 17732 696 1 4 . 1 1 412 412 TYR H H 412 8.160 8.160 7.927 0.233 17732 697 1 4 . 1 1 413 413 ARG N N 413 121.100 121.100 123.972 -2.872 17732 698 1 4 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.502 0.278 17732 699 1 4 . 1 1 413 413 ARG CA C 413 55.100 55.100 56.263 -1.163 17732 700 1 4 . 1 1 413 413 ARG H H 413 8.750 8.750 8.572 0.178 17732 701 1 4 . 1 1 414 414 TRP N N 414 120.600 120.600 124.939 -4.339 17732 702 1 4 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.196 0.384 17732 703 1 4 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.259 -0.159 17732 704 1 4 . 1 1 414 414 TRP H H 414 8.250 8.250 8.694 -0.444 17732 705 1 4 . 1 1 415 415 ARG N N 415 122.900 122.900 124.464 -1.564 17732 706 1 4 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.750 0.530 17732 707 1 4 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.740 -0.141 17732 708 1 4 . 1 1 415 415 ARG H H 415 9.450 9.450 8.678 0.772 17732 709 1 4 . 1 1 416 416 LYS N N 416 134.700 134.700 128.866 5.834 17732 710 1 4 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.706 0.654 17732 711 1 4 . 1 1 416 416 LYS CA C 416 57.000 57.000 56.839 0.161 17732 712 1 4 . 1 1 416 416 LYS H H 416 11.120 11.120 8.726 2.394 17732 713 1 4 . 1 1 417 417 TYR N N 417 118.600 118.600 120.998 -2.398 17732 714 1 4 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.489 0.771 17732 715 1 4 . 1 1 417 417 TYR CA C 417 56.000 56.000 58.144 -2.144 17732 716 1 4 . 1 1 417 417 TYR H H 417 8.900 8.900 7.635 1.265 17732 717 1 4 . 1 1 418 418 GLY N N 418 105.300 105.300 112.862 -7.562 17732 718 1 4 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.998 0.902 17732 719 1 4 . 1 1 418 418 GLY H H 418 6.990 6.990 8.590 -1.600 17732 720 1 4 . 1 1 419 419 GLN N N 419 122.600 122.600 121.311 1.289 17732 721 1 4 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.033 1.447 17732 722 1 4 . 1 1 419 419 GLN CA C 419 56.600 56.600 56.657 -0.057 17732 723 1 4 . 1 1 419 419 GLN H H 419 9.000 9.000 8.429 0.571 17732 724 1 4 . 1 1 420 420 LYS N N 420 123.000 123.000 124.024 -1.024 17732 725 1 4 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.656 0.244 17732 726 1 4 . 1 1 420 420 LYS CA C 420 52.800 52.800 54.874 -2.074 17732 727 1 4 . 1 1 420 420 LYS H H 420 9.140 9.140 8.207 0.933 17732 728 1 4 . 1 1 421 421 VAL N N 421 122.800 122.800 122.319 0.481 17732 729 1 4 . 1 1 421 421 VAL HA H 421 4.280 4.280 5.106 -0.826 17732 730 1 4 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.432 3.668 17732 731 1 4 . 1 1 421 421 VAL H H 421 8.550 8.550 8.367 0.183 17732 732 1 4 . 1 1 422 422 VAL N N 422 128.600 128.600 121.278 7.322 17732 733 1 4 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.574 -0.004 17732 734 1 4 . 1 1 422 422 VAL CA C 422 60.200 60.200 59.757 0.443 17732 735 1 4 . 1 1 422 422 VAL H H 422 9.500 9.500 8.439 1.061 17732 736 1 4 . 1 1 423 423 LYS N N 423 123.800 123.800 124.666 -0.866 17732 737 1 4 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.165 -0.225 17732 738 1 4 . 1 1 423 423 LYS CA C 423 58.300 58.300 57.240 1.060 17732 739 1 4 . 1 1 423 423 LYS H H 423 8.880 8.880 8.516 0.364 17732 740 1 4 . 1 1 424 424 GLY N N 424 110.800 110.800 107.225 3.575 17732 741 1 4 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.173 -0.873 17732 742 1 4 . 1 1 424 424 GLY H H 424 8.600 8.600 8.699 -0.099 17732 743 1 4 . 1 1 425 425 ASN N N 425 119.800 119.800 116.965 2.835 17732 744 1 4 . 1 1 425 425 ASN HA H 425 5.140 5.140 4.664 0.476 17732 745 1 4 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.117 -1.017 17732 746 1 4 . 1 1 425 425 ASN H H 425 7.600 7.600 7.607 -0.007 17732 747 1 4 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.490 -0.190 17732 748 1 4 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.002 -0.602 17732 749 1 4 . 1 1 427 427 TYR N N 427 121.100 121.100 119.963 1.137 17732 750 1 4 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.828 0.062 17732 751 1 4 . 1 1 427 427 TYR CA C 427 55.100 55.100 53.548 1.552 17732 752 1 4 . 1 1 427 427 TYR H H 427 8.120 8.120 8.761 -0.641 17732 753 1 4 . 1 1 428 428 PRO HA H 428 4.420 4.420 5.126 -0.706 17732 754 1 4 . 1 1 428 428 PRO CA C 428 63.300 63.300 61.981 1.319 17732 755 1 4 . 1 1 429 429 ARG N N 429 124.900 124.900 123.416 1.484 17732 756 1 4 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.572 0.108 17732 757 1 4 . 1 1 429 429 ARG CA C 429 55.000 55.000 55.436 -0.436 17732 758 1 4 . 1 1 429 429 ARG H H 429 9.280 9.280 9.089 0.191 17732 759 1 4 . 1 1 430 430 SER N N 430 122.200 122.200 115.469 6.731 17732 760 1 4 . 1 1 430 430 SER HA H 430 4.960 4.960 4.708 0.252 17732 761 1 4 . 1 1 430 430 SER CA C 430 59.300 59.300 57.392 1.908 17732 762 1 4 . 1 1 430 430 SER H H 430 9.100 9.100 8.024 1.076 17732 763 1 4 . 1 1 431 431 TYR N N 431 122.100 122.100 123.774 -1.674 17732 764 1 4 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.744 -0.084 17732 765 1 4 . 1 1 431 431 TYR CA C 431 57.400 57.400 56.190 1.210 17732 766 1 4 . 1 1 431 431 TYR H H 431 7.590 7.590 8.098 -0.508 17732 767 1 4 . 1 1 432 432 TYR N N 432 120.300 120.300 124.769 -4.469 17732 768 1 4 . 1 1 432 432 TYR HA H 432 5.720 5.720 4.867 0.853 17732 769 1 4 . 1 1 432 432 TYR CA C 432 57.100 57.100 57.886 -0.787 17732 770 1 4 . 1 1 432 432 TYR H H 432 9.370 9.370 8.765 0.605 17732 771 1 4 . 1 1 433 433 LYS N N 433 121.500 121.500 124.337 -2.837 17732 772 1 4 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.326 0.504 17732 773 1 4 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.442 -0.242 17732 774 1 4 . 1 1 433 433 LYS H H 433 9.960 9.960 8.559 1.401 17732 775 1 4 . 1 1 434 434 CYS N N 434 128.700 128.700 127.156 1.544 17732 776 1 4 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.042 -0.842 17732 777 1 4 . 1 1 434 434 CYS CA C 434 60.300 60.300 58.023 2.277 17732 778 1 4 . 1 1 434 434 CYS H H 434 8.440 8.440 9.281 -0.841 17732 779 1 4 . 1 1 435 435 THR N N 435 118.000 118.000 123.472 -5.472 17732 780 1 4 . 1 1 435 435 THR HA H 435 4.270 4.270 5.040 -0.770 17732 781 1 4 . 1 1 435 435 THR CA C 435 62.800 62.800 61.475 1.325 17732 782 1 4 . 1 1 435 435 THR H H 435 8.200 8.200 8.125 0.075 17732 783 1 4 . 1 1 436 436 THR N N 436 127.500 127.500 113.591 13.909 17732 784 1 4 . 1 1 436 436 THR HA H 436 4.230 4.230 4.555 -0.325 17732 785 1 4 . 1 1 436 436 THR CA C 436 63.300 63.300 60.414 2.886 17732 786 1 4 . 1 1 436 436 THR H H 436 8.880 8.880 7.807 1.073 17732 787 1 4 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.224 0.045 17732 788 1 4 . 1 1 438 438 GLY N N 438 112.800 112.800 110.157 2.643 17732 789 1 4 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.560 0.840 17732 790 1 4 . 1 1 438 438 GLY H H 438 8.870 8.870 8.623 0.247 17732 791 1 4 . 1 1 439 439 CYS N N 439 123.900 123.900 120.092 3.808 17732 792 1 4 . 1 1 439 439 CYS HA H 439 4.600 4.600 5.498 -0.898 17732 793 1 4 . 1 1 439 439 CYS CA C 439 60.700 60.700 57.572 3.128 17732 794 1 4 . 1 1 439 439 CYS H H 439 7.870 7.870 8.129 -0.259 17732 795 1 4 . 1 1 440 440 GLY N N 440 113.300 113.300 115.292 -1.992 17732 796 1 4 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.699 -0.299 17732 797 1 4 . 1 1 440 440 GLY H H 440 9.070 9.070 8.517 0.553 17732 798 1 4 . 1 1 441 441 VAL N N 441 123.400 123.400 124.489 -1.089 17732 799 1 4 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.319 -0.209 17732 800 1 4 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.515 4.985 17732 801 1 4 . 1 1 441 441 VAL H H 441 8.230 8.230 8.834 -0.604 17732 802 1 4 . 1 1 442 442 ARG N N 442 126.100 126.100 123.578 2.522 17732 803 1 4 . 1 1 442 442 ARG HA H 442 5.650 5.650 4.961 0.689 17732 804 1 4 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.800 -0.500 17732 805 1 4 . 1 1 442 442 ARG H H 442 8.340 8.340 8.728 -0.388 17732 806 1 4 . 1 1 443 443 LYS N N 443 120.700 120.700 121.979 -1.279 17732 807 1 4 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.253 -0.143 17732 808 1 4 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.782 -0.782 17732 809 1 4 . 1 1 443 443 LYS H H 443 9.340 9.340 8.897 0.443 17732 810 1 4 . 1 1 444 444 HIS N N 444 122.000 122.000 122.813 -0.813 17732 811 1 4 . 1 1 444 444 HIS HA H 444 5.700 5.700 4.884 0.816 17732 812 1 4 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.869 -3.869 17732 813 1 4 . 1 1 444 444 HIS H H 444 8.860 8.860 8.640 0.220 17732 814 1 4 . 1 1 445 445 VAL N N 445 121.200 121.200 122.022 -0.822 17732 815 1 4 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.126 -0.316 17732 816 1 4 . 1 1 445 445 VAL CA C 445 61.600 61.600 60.359 1.241 17732 817 1 4 . 1 1 445 445 VAL H H 445 8.560 8.560 8.148 0.412 17732 818 1 4 . 1 1 446 446 GLU N N 446 125.100 125.100 126.034 -0.934 17732 819 1 4 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.808 0.102 17732 820 1 4 . 1 1 446 446 GLU CA C 446 54.400 54.400 53.974 0.426 17732 821 1 4 . 1 1 446 446 GLU H H 446 8.680 8.680 8.264 0.416 17732 822 1 4 . 1 1 447 447 ARG N N 447 122.400 122.400 123.060 -0.660 17732 823 1 4 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.927 -0.237 17732 824 1 4 . 1 1 447 447 ARG CA C 447 55.400 55.400 54.810 0.590 17732 825 1 4 . 1 1 447 447 ARG H H 447 8.660 8.660 8.731 -0.071 17732 826 1 4 . 1 1 448 448 ALA N N 448 125.000 125.000 128.475 -3.475 17732 827 1 4 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.266 -0.046 17732 828 1 4 . 1 1 448 448 ALA CA C 448 52.300 52.300 52.718 -0.418 17732 829 1 4 . 1 1 448 448 ALA H H 448 8.100 8.100 8.411 -0.311 17732 830 1 4 . 1 1 449 449 ALA N N 449 123.700 123.700 127.637 -3.937 17732 831 1 4 . 1 1 449 449 ALA HA H 449 4.220 4.220 3.788 0.432 17732 832 1 4 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.444 0.756 17732 833 1 4 . 1 1 449 449 ALA H H 449 8.550 8.550 8.642 -0.092 17732 834 1 4 . 1 1 450 450 THR N N 450 102.500 102.500 106.462 -3.962 17732 835 1 4 . 1 1 450 450 THR HA H 450 4.340 4.340 4.371 -0.031 17732 836 1 4 . 1 1 450 450 THR CA C 450 61.300 61.300 61.740 -0.440 17732 837 1 4 . 1 1 450 450 THR H H 450 7.600 7.600 7.773 -0.173 17732 838 1 4 . 1 1 451 451 ASP N N 451 118.200 118.200 121.980 -3.780 17732 839 1 4 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.931 -0.021 17732 840 1 4 . 1 1 451 451 ASP CA C 451 52.000 52.000 53.424 -1.424 17732 841 1 4 . 1 1 451 451 ASP H H 451 7.060 7.060 8.402 -1.342 17732 842 1 4 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.313 -0.013 17732 843 1 4 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.790 -0.790 17732 844 1 4 . 1 1 453 453 LYS N N 453 117.000 117.000 115.289 1.711 17732 845 1 4 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.329 -0.169 17732 846 1 4 . 1 1 453 453 LYS CA C 453 56.700 56.700 56.004 0.696 17732 847 1 4 . 1 1 453 453 LYS H H 453 7.880 7.880 8.400 -0.520 17732 848 1 4 . 1 1 454 454 ALA N N 454 124.700 124.700 123.541 1.159 17732 849 1 4 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.617 -0.047 17732 850 1 4 . 1 1 454 454 ALA CA C 454 51.200 51.200 51.246 -0.046 17732 851 1 4 . 1 1 454 454 ALA H H 454 8.060 8.060 7.771 0.289 17732 852 1 4 . 1 1 455 455 VAL N N 455 119.700 119.700 122.777 -3.077 17732 853 1 4 . 1 1 455 455 VAL HA H 455 4.370 4.370 5.085 -0.715 17732 854 1 4 . 1 1 455 455 VAL CA C 455 61.400 61.400 60.608 0.792 17732 855 1 4 . 1 1 455 455 VAL H H 455 8.190 8.190 8.363 -0.173 17732 856 1 4 . 1 1 456 456 VAL N N 456 129.400 129.400 122.195 7.205 17732 857 1 4 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.605 -0.295 17732 858 1 4 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.056 1.844 17732 859 1 4 . 1 1 456 456 VAL H H 456 9.220 9.220 9.161 0.059 17732 860 1 4 . 1 1 457 457 THR N N 457 125.000 125.000 121.026 3.974 17732 861 1 4 . 1 1 457 457 THR HA H 457 5.160 5.160 5.193 -0.033 17732 862 1 4 . 1 1 457 457 THR CA C 457 61.100 61.100 61.106 -0.006 17732 863 1 4 . 1 1 457 457 THR H H 457 8.560 8.560 8.264 0.296 17732 864 1 4 . 1 1 458 458 THR N N 458 120.600 120.600 122.883 -2.283 17732 865 1 4 . 1 1 458 458 THR HA H 458 4.550 4.550 4.648 -0.098 17732 866 1 4 . 1 1 458 458 THR CA C 458 60.600 60.600 61.472 -0.872 17732 867 1 4 . 1 1 458 458 THR H H 458 8.560 8.560 8.622 -0.062 17732 868 1 4 . 1 1 459 459 TYR N N 459 122.500 122.500 126.147 -3.647 17732 869 1 4 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.875 0.065 17732 870 1 4 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.555 0.245 17732 871 1 4 . 1 1 459 459 TYR H H 459 8.870 8.870 8.956 -0.086 17732 872 1 4 . 1 1 460 460 GLU N N 460 123.200 123.200 125.443 -2.243 17732 873 1 4 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.730 -0.100 17732 874 1 4 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.471 0.129 17732 875 1 4 . 1 1 460 460 GLU H H 460 9.150 9.150 9.068 0.082 17732 876 1 4 . 1 1 461 461 GLY N N 461 112.700 112.700 112.602 0.098 17732 877 1 4 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.342 -0.442 17732 878 1 4 . 1 1 461 461 GLY H H 461 8.330 8.330 8.266 0.064 17732 879 1 4 . 1 1 462 462 LYS N N 462 118.300 118.300 121.298 -2.998 17732 880 1 4 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.394 0.096 17732 881 1 4 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.322 -1.322 17732 882 1 4 . 1 1 462 462 LYS H H 462 8.050 8.050 8.305 -0.255 17732 883 1 4 . 1 1 463 463 HIS N N 463 123.900 123.900 119.011 4.889 17732 884 1 4 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.628 -0.028 17732 885 1 4 . 1 1 463 463 HIS CA C 463 57.200 57.200 56.214 0.986 17732 886 1 4 . 1 1 463 463 HIS H H 463 8.470 8.470 8.497 -0.027 17732 887 1 4 . 1 1 464 464 ASN N N 464 124.400 124.400 120.718 3.682 17732 888 1 4 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.663 0.287 17732 889 1 4 . 1 1 464 464 ASN CA C 464 51.500 51.500 54.074 -2.574 17732 890 1 4 . 1 1 464 464 ASN H H 464 8.360 8.360 8.878 -0.518 17732 891 1 4 . 1 1 465 465 HIS N N 465 112.100 112.100 113.849 -1.749 17732 892 1 4 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.814 0.056 17732 893 1 4 . 1 1 465 465 HIS CA C 465 52.900 52.900 54.283 -1.383 17732 894 1 4 . 1 1 465 465 HIS H H 465 6.830 6.830 7.463 -0.633 17732 895 1 4 . 1 1 466 466 ASP N N 466 120.300 120.300 122.261 -1.961 17732 896 1 4 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.283 0.337 17732 897 1 4 . 1 1 466 466 ASP CA C 466 54.000 54.000 55.955 -1.955 17732 898 1 4 . 1 1 466 466 ASP H H 466 8.780 8.780 8.678 0.102 17732 899 1 4 . 1 1 467 467 LEU N N 467 124.200 124.200 117.563 6.637 17732 900 1 4 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.370 -0.330 17732 901 1 4 . 1 1 467 467 LEU CA C 467 54.100 54.100 52.629 1.471 17732 902 1 4 . 1 1 467 467 LEU H H 467 8.530 8.530 7.879 0.651 17732 903 1 4 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.332 0.018 17732 904 1 4 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.774 0.526 17732 905 1 5 . 1 1 408 408 LEU N N 408 122.600 122.600 124.642 -2.042 17732 906 1 5 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.489 -0.229 17732 907 1 5 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.729 0.271 17732 908 1 5 . 1 1 408 408 LEU H H 408 8.090 8.090 8.503 -0.413 17732 909 1 5 . 1 1 409 409 ASP N N 409 122.500 122.500 120.008 2.492 17732 910 1 5 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.871 -0.231 17732 911 1 5 . 1 1 409 409 ASP CA C 409 55.100 55.100 54.857 0.243 17732 912 1 5 . 1 1 409 409 ASP H H 409 8.140 8.140 8.535 -0.395 17732 913 1 5 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.733 -0.233 17732 914 1 5 . 1 1 410 410 ASP CA C 410 53.200 53.200 54.449 -1.249 17732 915 1 5 . 1 1 410 410 ASP H H 410 8.570 8.570 8.318 0.252 17732 916 1 5 . 1 1 411 411 GLY N N 411 108.400 108.400 109.265 -0.865 17732 917 1 5 . 1 1 411 411 GLY CA C 411 45.300 45.300 46.250 -0.950 17732 918 1 5 . 1 1 411 411 GLY H H 411 8.520 8.520 8.240 0.280 17732 919 1 5 . 1 1 412 412 TYR N N 412 118.600 118.600 117.836 0.764 17732 920 1 5 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.660 -0.310 17732 921 1 5 . 1 1 412 412 TYR CA C 412 58.000 58.000 56.689 1.311 17732 922 1 5 . 1 1 412 412 TYR H H 412 8.160 8.160 8.125 0.035 17732 923 1 5 . 1 1 413 413 ARG N N 413 121.100 121.100 121.290 -0.190 17732 924 1 5 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.726 0.054 17732 925 1 5 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.147 -0.047 17732 926 1 5 . 1 1 413 413 ARG H H 413 8.750 8.750 8.700 0.050 17732 927 1 5 . 1 1 414 414 TRP N N 414 120.600 120.600 124.151 -3.551 17732 928 1 5 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.444 0.136 17732 929 1 5 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.060 0.040 17732 930 1 5 . 1 1 414 414 TRP H H 414 8.250 8.250 8.600 -0.350 17732 931 1 5 . 1 1 415 415 ARG N N 415 122.900 122.900 124.287 -1.387 17732 932 1 5 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.879 0.401 17732 933 1 5 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.254 0.346 17732 934 1 5 . 1 1 415 415 ARG H H 415 9.450 9.450 9.095 0.355 17732 935 1 5 . 1 1 416 416 LYS N N 416 134.700 134.700 128.449 6.251 17732 936 1 5 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.769 0.591 17732 937 1 5 . 1 1 416 416 LYS CA C 416 57.000 57.000 56.931 0.069 17732 938 1 5 . 1 1 416 416 LYS H H 416 11.120 11.120 8.882 2.238 17732 939 1 5 . 1 1 417 417 TYR N N 417 118.600 118.600 119.620 -1.020 17732 940 1 5 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.465 0.795 17732 941 1 5 . 1 1 417 417 TYR CA C 417 56.000 56.000 58.112 -2.112 17732 942 1 5 . 1 1 417 417 TYR H H 417 8.900 8.900 7.648 1.252 17732 943 1 5 . 1 1 418 418 GLY N N 418 105.300 105.300 111.885 -6.585 17732 944 1 5 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.989 0.911 17732 945 1 5 . 1 1 418 418 GLY H H 418 6.990 6.990 8.650 -1.660 17732 946 1 5 . 1 1 419 419 GLN N N 419 122.600 122.600 121.138 1.462 17732 947 1 5 . 1 1 419 419 GLN HA H 419 5.480 5.480 3.998 1.482 17732 948 1 5 . 1 1 419 419 GLN CA C 419 56.600 56.600 56.394 0.206 17732 949 1 5 . 1 1 419 419 GLN H H 419 9.000 9.000 8.260 0.740 17732 950 1 5 . 1 1 420 420 LYS N N 420 123.000 123.000 125.241 -2.241 17732 951 1 5 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.633 0.267 17732 952 1 5 . 1 1 420 420 LYS CA C 420 52.800 52.800 54.776 -1.976 17732 953 1 5 . 1 1 420 420 LYS H H 420 9.140 9.140 8.247 0.893 17732 954 1 5 . 1 1 421 421 VAL N N 421 122.800 122.800 122.444 0.356 17732 955 1 5 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.349 -0.069 17732 956 1 5 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.904 3.196 17732 957 1 5 . 1 1 421 421 VAL H H 421 8.550 8.550 8.266 0.284 17732 958 1 5 . 1 1 422 422 VAL N N 422 128.600 128.600 121.711 6.889 17732 959 1 5 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.618 -0.048 17732 960 1 5 . 1 1 422 422 VAL CA C 422 60.200 60.200 60.074 0.126 17732 961 1 5 . 1 1 422 422 VAL H H 422 9.500 9.500 8.088 1.412 17732 962 1 5 . 1 1 423 423 LYS N N 423 123.800 123.800 126.311 -2.511 17732 963 1 5 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.262 -0.322 17732 964 1 5 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.695 1.605 17732 965 1 5 . 1 1 423 423 LYS H H 423 8.880 8.880 8.603 0.277 17732 966 1 5 . 1 1 424 424 GLY N N 424 110.800 110.800 106.874 3.926 17732 967 1 5 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.066 -0.766 17732 968 1 5 . 1 1 424 424 GLY H H 424 8.600 8.600 8.630 -0.030 17732 969 1 5 . 1 1 425 425 ASN N N 425 119.800 119.800 116.933 2.867 17732 970 1 5 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.093 0.047 17732 971 1 5 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.800 -1.700 17732 972 1 5 . 1 1 425 425 ASN H H 425 7.600 7.600 7.855 -0.255 17732 973 1 5 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.243 0.057 17732 974 1 5 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.177 -0.777 17732 975 1 5 . 1 1 427 427 TYR N N 427 121.100 121.100 119.699 1.401 17732 976 1 5 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.613 0.277 17732 977 1 5 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.541 -0.442 17732 978 1 5 . 1 1 427 427 TYR H H 427 8.120 8.120 7.981 0.139 17732 979 1 5 . 1 1 428 428 PRO HA H 428 4.420 4.420 5.109 -0.689 17732 980 1 5 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.375 0.925 17732 981 1 5 . 1 1 429 429 ARG N N 429 124.900 124.900 121.715 3.185 17732 982 1 5 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.686 -0.006 17732 983 1 5 . 1 1 429 429 ARG CA C 429 55.000 55.000 54.463 0.537 17732 984 1 5 . 1 1 429 429 ARG H H 429 9.280 9.280 8.871 0.409 17732 985 1 5 . 1 1 430 430 SER N N 430 122.200 122.200 114.277 7.923 17732 986 1 5 . 1 1 430 430 SER HA H 430 4.960 4.960 4.700 0.260 17732 987 1 5 . 1 1 430 430 SER CA C 430 59.300 59.300 57.828 1.472 17732 988 1 5 . 1 1 430 430 SER H H 430 9.100 9.100 8.487 0.613 17732 989 1 5 . 1 1 431 431 TYR N N 431 122.100 122.100 122.315 -0.215 17732 990 1 5 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.997 -0.337 17732 991 1 5 . 1 1 431 431 TYR CA C 431 57.400 57.400 56.611 0.789 17732 992 1 5 . 1 1 431 431 TYR H H 431 7.590 7.590 8.071 -0.481 17732 993 1 5 . 1 1 432 432 TYR N N 432 120.300 120.300 125.018 -4.718 17732 994 1 5 . 1 1 432 432 TYR HA H 432 5.720 5.720 4.962 0.758 17732 995 1 5 . 1 1 432 432 TYR CA C 432 57.100 57.100 57.973 -0.873 17732 996 1 5 . 1 1 432 432 TYR H H 432 9.370 9.370 8.392 0.978 17732 997 1 5 . 1 1 433 433 LYS N N 433 121.500 121.500 124.053 -2.553 17732 998 1 5 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.441 0.389 17732 999 1 5 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.528 -0.328 17732 1000 1 5 . 1 1 433 433 LYS H H 433 9.960 9.960 8.611 1.349 17732 1001 1 5 . 1 1 434 434 CYS N N 434 128.700 128.700 126.322 2.378 17732 1002 1 5 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.308 -1.108 17732 1003 1 5 . 1 1 434 434 CYS CA C 434 60.300 60.300 56.878 3.422 17732 1004 1 5 . 1 1 434 434 CYS H H 434 8.440 8.440 9.240 -0.800 17732 1005 1 5 . 1 1 435 435 THR N N 435 118.000 118.000 122.239 -4.239 17732 1006 1 5 . 1 1 435 435 THR HA H 435 4.270 4.270 5.122 -0.852 17732 1007 1 5 . 1 1 435 435 THR CA C 435 62.800 62.800 60.458 2.342 17732 1008 1 5 . 1 1 435 435 THR H H 435 8.200 8.200 8.703 -0.503 17732 1009 1 5 . 1 1 436 436 THR N N 436 127.500 127.500 114.638 12.862 17732 1010 1 5 . 1 1 436 436 THR HA H 436 4.230 4.230 4.353 -0.123 17732 1011 1 5 . 1 1 436 436 THR CA C 436 63.300 63.300 60.937 2.363 17732 1012 1 5 . 1 1 436 436 THR H H 436 8.880 8.880 7.766 1.114 17732 1013 1 5 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.094 0.176 17732 1014 1 5 . 1 1 438 438 GLY N N 438 112.800 112.800 110.481 2.319 17732 1015 1 5 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.567 0.833 17732 1016 1 5 . 1 1 438 438 GLY H H 438 8.870 8.870 8.422 0.448 17732 1017 1 5 . 1 1 439 439 CYS N N 439 123.900 123.900 119.821 4.079 17732 1018 1 5 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.771 -0.171 17732 1019 1 5 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.056 2.644 17732 1020 1 5 . 1 1 439 439 CYS H H 439 7.870 7.870 8.366 -0.496 17732 1021 1 5 . 1 1 440 440 GLY N N 440 113.300 113.300 113.359 -0.059 17732 1022 1 5 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.395 0.005 17732 1023 1 5 . 1 1 440 440 GLY H H 440 9.070 9.070 8.575 0.495 17732 1024 1 5 . 1 1 441 441 VAL N N 441 123.400 123.400 123.604 -0.204 17732 1025 1 5 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.453 -0.343 17732 1026 1 5 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.251 5.250 17732 1027 1 5 . 1 1 441 441 VAL H H 441 8.230 8.230 8.744 -0.514 17732 1028 1 5 . 1 1 442 442 ARG N N 442 126.100 126.100 122.297 3.803 17732 1029 1 5 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.484 0.166 17732 1030 1 5 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.558 -0.258 17732 1031 1 5 . 1 1 442 442 ARG H H 442 8.340 8.340 9.403 -1.063 17732 1032 1 5 . 1 1 443 443 LYS N N 443 120.700 120.700 121.005 -0.305 17732 1033 1 5 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.382 -0.272 17732 1034 1 5 . 1 1 443 443 LYS CA C 443 54.000 54.000 55.044 -1.044 17732 1035 1 5 . 1 1 443 443 LYS H H 443 9.340 9.340 9.062 0.278 17732 1036 1 5 . 1 1 444 444 HIS N N 444 122.000 122.000 121.054 0.946 17732 1037 1 5 . 1 1 444 444 HIS HA H 444 5.700 5.700 4.849 0.851 17732 1038 1 5 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.676 -3.676 17732 1039 1 5 . 1 1 444 444 HIS H H 444 8.860 8.860 8.225 0.635 17732 1040 1 5 . 1 1 445 445 VAL N N 445 121.200 121.200 124.728 -3.528 17732 1041 1 5 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.008 -0.198 17732 1042 1 5 . 1 1 445 445 VAL CA C 445 61.600 61.600 61.270 0.330 17732 1043 1 5 . 1 1 445 445 VAL H H 445 8.560 8.560 7.697 0.863 17732 1044 1 5 . 1 1 446 446 GLU N N 446 125.100 125.100 123.895 1.205 17732 1045 1 5 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.722 0.188 17732 1046 1 5 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.887 -0.487 17732 1047 1 5 . 1 1 446 446 GLU H H 446 8.680 8.680 7.999 0.681 17732 1048 1 5 . 1 1 447 447 ARG N N 447 122.400 122.400 123.378 -0.978 17732 1049 1 5 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.034 0.656 17732 1050 1 5 . 1 1 447 447 ARG CA C 447 55.400 55.400 56.606 -1.206 17732 1051 1 5 . 1 1 447 447 ARG H H 447 8.660 8.660 8.835 -0.175 17732 1052 1 5 . 1 1 448 448 ALA N N 448 125.000 125.000 122.541 2.459 17732 1053 1 5 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.459 -0.239 17732 1054 1 5 . 1 1 448 448 ALA CA C 448 52.300 52.300 50.242 2.058 17732 1055 1 5 . 1 1 448 448 ALA H H 448 8.100 8.100 8.069 0.031 17732 1056 1 5 . 1 1 449 449 ALA N N 449 123.700 123.700 127.781 -4.081 17732 1057 1 5 . 1 1 449 449 ALA HA H 449 4.220 4.220 3.814 0.406 17732 1058 1 5 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.814 0.386 17732 1059 1 5 . 1 1 449 449 ALA H H 449 8.550 8.550 8.926 -0.376 17732 1060 1 5 . 1 1 450 450 THR N N 450 102.500 102.500 107.230 -4.730 17732 1061 1 5 . 1 1 450 450 THR HA H 450 4.340 4.340 4.329 0.011 17732 1062 1 5 . 1 1 450 450 THR CA C 450 61.300 61.300 61.868 -0.568 17732 1063 1 5 . 1 1 450 450 THR H H 450 7.600 7.600 7.734 -0.134 17732 1064 1 5 . 1 1 451 451 ASP N N 451 118.200 118.200 120.724 -2.524 17732 1065 1 5 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.870 0.040 17732 1066 1 5 . 1 1 451 451 ASP CA C 451 52.000 52.000 53.559 -1.559 17732 1067 1 5 . 1 1 451 451 ASP H H 451 7.060 7.060 7.937 -0.877 17732 1068 1 5 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.005 0.295 17732 1069 1 5 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.210 -0.210 17732 1070 1 5 . 1 1 453 453 LYS N N 453 117.000 117.000 115.038 1.962 17732 1071 1 5 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.343 -0.183 17732 1072 1 5 . 1 1 453 453 LYS CA C 453 56.700 56.700 56.139 0.562 17732 1073 1 5 . 1 1 453 453 LYS H H 453 7.880 7.880 7.942 -0.062 17732 1074 1 5 . 1 1 454 454 ALA N N 454 124.700 124.700 123.171 1.529 17732 1075 1 5 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.185 0.385 17732 1076 1 5 . 1 1 454 454 ALA CA C 454 51.200 51.200 53.275 -2.075 17732 1077 1 5 . 1 1 454 454 ALA H H 454 8.060 8.060 7.726 0.334 17732 1078 1 5 . 1 1 455 455 VAL N N 455 119.700 119.700 116.287 3.413 17732 1079 1 5 . 1 1 455 455 VAL HA H 455 4.370 4.370 3.824 0.546 17732 1080 1 5 . 1 1 455 455 VAL CA C 455 61.400 61.400 62.847 -1.447 17732 1081 1 5 . 1 1 455 455 VAL H H 455 8.190 8.190 7.835 0.355 17732 1082 1 5 . 1 1 456 456 VAL N N 456 129.400 129.400 121.254 8.146 17732 1083 1 5 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.525 -0.215 17732 1084 1 5 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.866 1.034 17732 1085 1 5 . 1 1 456 456 VAL H H 456 9.220 9.220 8.126 1.094 17732 1086 1 5 . 1 1 457 457 THR N N 457 125.000 125.000 121.177 3.823 17732 1087 1 5 . 1 1 457 457 THR HA H 457 5.160 5.160 5.441 -0.281 17732 1088 1 5 . 1 1 457 457 THR CA C 457 61.100 61.100 60.615 0.485 17732 1089 1 5 . 1 1 457 457 THR H H 457 8.560 8.560 8.280 0.280 17732 1090 1 5 . 1 1 458 458 THR N N 458 120.600 120.600 122.233 -1.633 17732 1091 1 5 . 1 1 458 458 THR HA H 458 4.550 4.550 4.578 -0.028 17732 1092 1 5 . 1 1 458 458 THR CA C 458 60.600 60.600 61.339 -0.739 17732 1093 1 5 . 1 1 458 458 THR H H 458 8.560 8.560 8.398 0.162 17732 1094 1 5 . 1 1 459 459 TYR N N 459 122.500 122.500 125.467 -2.967 17732 1095 1 5 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.812 0.128 17732 1096 1 5 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.887 -0.087 17732 1097 1 5 . 1 1 459 459 TYR H H 459 8.870 8.870 8.826 0.044 17732 1098 1 5 . 1 1 460 460 GLU N N 460 123.200 123.200 125.696 -2.496 17732 1099 1 5 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.744 -0.114 17732 1100 1 5 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.595 0.005 17732 1101 1 5 . 1 1 460 460 GLU H H 460 9.150 9.150 9.243 -0.093 17732 1102 1 5 . 1 1 461 461 GLY N N 461 112.700 112.700 112.540 0.160 17732 1103 1 5 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.619 -0.719 17732 1104 1 5 . 1 1 461 461 GLY H H 461 8.330 8.330 8.414 -0.084 17732 1105 1 5 . 1 1 462 462 LYS N N 462 118.300 118.300 121.756 -3.456 17732 1106 1 5 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.320 0.170 17732 1107 1 5 . 1 1 462 462 LYS CA C 462 54.000 54.000 54.968 -0.968 17732 1108 1 5 . 1 1 462 462 LYS H H 462 8.050 8.050 8.211 -0.161 17732 1109 1 5 . 1 1 463 463 HIS N N 463 123.900 123.900 121.536 2.364 17732 1110 1 5 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.510 0.090 17732 1111 1 5 . 1 1 463 463 HIS CA C 463 57.200 57.200 55.983 1.217 17732 1112 1 5 . 1 1 463 463 HIS H H 463 8.470 8.470 8.331 0.139 17732 1113 1 5 . 1 1 464 464 ASN N N 464 124.400 124.400 121.686 2.714 17732 1114 1 5 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.741 0.209 17732 1115 1 5 . 1 1 464 464 ASN CA C 464 51.500 51.500 52.516 -1.016 17732 1116 1 5 . 1 1 464 464 ASN H H 464 8.360 8.360 8.691 -0.331 17732 1117 1 5 . 1 1 465 465 HIS N N 465 112.100 112.100 113.094 -0.994 17732 1118 1 5 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.719 0.151 17732 1119 1 5 . 1 1 465 465 HIS CA C 465 52.900 52.900 54.435 -1.535 17732 1120 1 5 . 1 1 465 465 HIS H H 465 6.830 6.830 7.523 -0.693 17732 1121 1 5 . 1 1 466 466 ASP N N 466 120.300 120.300 120.445 -0.145 17732 1122 1 5 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.221 0.399 17732 1123 1 5 . 1 1 466 466 ASP CA C 466 54.000 54.000 56.332 -2.332 17732 1124 1 5 . 1 1 466 466 ASP H H 466 8.780 8.780 8.373 0.407 17732 1125 1 5 . 1 1 467 467 LEU N N 467 124.200 124.200 119.205 4.995 17732 1126 1 5 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.648 -0.608 17732 1127 1 5 . 1 1 467 467 LEU CA C 467 54.100 54.100 53.518 0.582 17732 1128 1 5 . 1 1 467 467 LEU H H 467 8.530 8.530 7.902 0.628 17732 1129 1 5 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.523 -0.173 17732 1130 1 5 . 1 1 468 468 PRO CA C 468 63.300 63.300 63.368 -0.069 17732 1131 1 6 . 1 1 408 408 LEU N N 408 122.600 122.600 119.688 2.912 17732 1132 1 6 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.649 -0.389 17732 1133 1 6 . 1 1 408 408 LEU CA C 408 55.000 55.000 56.573 -1.573 17732 1134 1 6 . 1 1 408 408 LEU H H 408 8.090 8.090 8.921 -0.831 17732 1135 1 6 . 1 1 409 409 ASP N N 409 122.500 122.500 118.444 4.056 17732 1136 1 6 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.913 -0.273 17732 1137 1 6 . 1 1 409 409 ASP CA C 409 55.100 55.100 54.737 0.363 17732 1138 1 6 . 1 1 409 409 ASP H H 409 8.140 8.140 8.166 -0.026 17732 1139 1 6 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.585 -0.085 17732 1140 1 6 . 1 1 410 410 ASP CA C 410 53.200 53.200 54.892 -1.692 17732 1141 1 6 . 1 1 410 410 ASP H H 410 8.570 8.570 8.707 -0.137 17732 1142 1 6 . 1 1 411 411 GLY N N 411 108.400 108.400 106.451 1.949 17732 1143 1 6 . 1 1 411 411 GLY CA C 411 45.300 45.300 44.989 0.311 17732 1144 1 6 . 1 1 411 411 GLY H H 411 8.520 8.520 7.912 0.608 17732 1145 1 6 . 1 1 412 412 TYR N N 412 118.600 118.600 116.291 2.309 17732 1146 1 6 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.444 -0.094 17732 1147 1 6 . 1 1 412 412 TYR CA C 412 58.000 58.000 57.093 0.907 17732 1148 1 6 . 1 1 412 412 TYR H H 412 8.160 8.160 7.819 0.341 17732 1149 1 6 . 1 1 413 413 ARG N N 413 121.100 121.100 120.984 0.116 17732 1150 1 6 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.752 0.028 17732 1151 1 6 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.144 -0.044 17732 1152 1 6 . 1 1 413 413 ARG H H 413 8.750 8.750 8.700 0.050 17732 1153 1 6 . 1 1 414 414 TRP N N 414 120.600 120.600 124.101 -3.501 17732 1154 1 6 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.149 0.431 17732 1155 1 6 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.310 -0.210 17732 1156 1 6 . 1 1 414 414 TRP H H 414 8.250 8.250 8.761 -0.511 17732 1157 1 6 . 1 1 415 415 ARG N N 415 122.900 122.900 124.451 -1.551 17732 1158 1 6 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.843 0.437 17732 1159 1 6 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.723 -0.123 17732 1160 1 6 . 1 1 415 415 ARG H H 415 9.450 9.450 8.479 0.971 17732 1161 1 6 . 1 1 416 416 LYS N N 416 134.700 134.700 128.586 6.114 17732 1162 1 6 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.487 0.873 17732 1163 1 6 . 1 1 416 416 LYS CA C 416 57.000 57.000 56.749 0.251 17732 1164 1 6 . 1 1 416 416 LYS H H 416 11.120 11.120 8.619 2.501 17732 1165 1 6 . 1 1 417 417 TYR N N 417 118.600 118.600 121.780 -3.180 17732 1166 1 6 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.499 0.761 17732 1167 1 6 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.564 -1.564 17732 1168 1 6 . 1 1 417 417 TYR H H 417 8.900 8.900 7.652 1.248 17732 1169 1 6 . 1 1 418 418 GLY N N 418 105.300 105.300 111.566 -6.266 17732 1170 1 6 . 1 1 418 418 GLY CA C 418 45.900 45.900 45.070 0.830 17732 1171 1 6 . 1 1 418 418 GLY H H 418 6.990 6.990 8.648 -1.658 17732 1172 1 6 . 1 1 419 419 GLN N N 419 122.600 122.600 121.203 1.397 17732 1173 1 6 . 1 1 419 419 GLN HA H 419 5.480 5.480 3.964 1.516 17732 1174 1 6 . 1 1 419 419 GLN CA C 419 56.600 56.600 56.749 -0.149 17732 1175 1 6 . 1 1 419 419 GLN H H 419 9.000 9.000 8.133 0.867 17732 1176 1 6 . 1 1 420 420 LYS N N 420 123.000 123.000 125.005 -2.005 17732 1177 1 6 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.618 0.282 17732 1178 1 6 . 1 1 420 420 LYS CA C 420 52.800 52.800 55.087 -2.287 17732 1179 1 6 . 1 1 420 420 LYS H H 420 9.140 9.140 8.385 0.755 17732 1180 1 6 . 1 1 421 421 VAL N N 421 122.800 122.800 122.492 0.308 17732 1181 1 6 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.394 -0.114 17732 1182 1 6 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.966 3.134 17732 1183 1 6 . 1 1 421 421 VAL H H 421 8.550 8.550 8.320 0.230 17732 1184 1 6 . 1 1 422 422 VAL N N 422 128.600 128.600 123.217 5.383 17732 1185 1 6 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.619 -0.049 17732 1186 1 6 . 1 1 422 422 VAL CA C 422 60.200 60.200 59.403 0.797 17732 1187 1 6 . 1 1 422 422 VAL H H 422 9.500 9.500 8.156 1.344 17732 1188 1 6 . 1 1 423 423 LYS N N 423 123.800 123.800 126.464 -2.664 17732 1189 1 6 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.238 -0.298 17732 1190 1 6 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.710 1.590 17732 1191 1 6 . 1 1 423 423 LYS H H 423 8.880 8.880 8.515 0.365 17732 1192 1 6 . 1 1 424 424 GLY N N 424 110.800 110.800 106.418 4.382 17732 1193 1 6 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.056 -0.756 17732 1194 1 6 . 1 1 424 424 GLY H H 424 8.600 8.600 8.639 -0.039 17732 1195 1 6 . 1 1 425 425 ASN N N 425 119.800 119.800 116.652 3.148 17732 1196 1 6 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.064 0.076 17732 1197 1 6 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.784 -1.684 17732 1198 1 6 . 1 1 425 425 ASN H H 425 7.600 7.600 7.823 -0.223 17732 1199 1 6 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.288 0.012 17732 1200 1 6 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.214 -0.814 17732 1201 1 6 . 1 1 427 427 TYR N N 427 121.100 121.100 120.350 0.750 17732 1202 1 6 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.651 0.239 17732 1203 1 6 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.523 -0.423 17732 1204 1 6 . 1 1 427 427 TYR H H 427 8.120 8.120 8.029 0.091 17732 1205 1 6 . 1 1 428 428 PRO HA H 428 4.420 4.420 4.762 -0.342 17732 1206 1 6 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.491 0.809 17732 1207 1 6 . 1 1 429 429 ARG N N 429 124.900 124.900 125.065 -0.165 17732 1208 1 6 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.618 0.062 17732 1209 1 6 . 1 1 429 429 ARG CA C 429 55.000 55.000 55.379 -0.379 17732 1210 1 6 . 1 1 429 429 ARG H H 429 9.280 9.280 9.068 0.212 17732 1211 1 6 . 1 1 430 430 SER N N 430 122.200 122.200 117.755 4.445 17732 1212 1 6 . 1 1 430 430 SER HA H 430 4.960 4.960 4.720 0.240 17732 1213 1 6 . 1 1 430 430 SER CA C 430 59.300 59.300 57.675 1.625 17732 1214 1 6 . 1 1 430 430 SER H H 430 9.100 9.100 8.717 0.383 17732 1215 1 6 . 1 1 431 431 TYR N N 431 122.100 122.100 123.858 -1.758 17732 1216 1 6 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.869 -0.209 17732 1217 1 6 . 1 1 431 431 TYR CA C 431 57.400 57.400 56.995 0.406 17732 1218 1 6 . 1 1 431 431 TYR H H 431 7.590 7.590 8.107 -0.517 17732 1219 1 6 . 1 1 432 432 TYR N N 432 120.300 120.300 125.147 -4.847 17732 1220 1 6 . 1 1 432 432 TYR HA H 432 5.720 5.720 4.964 0.756 17732 1221 1 6 . 1 1 432 432 TYR CA C 432 57.100 57.100 57.824 -0.724 17732 1222 1 6 . 1 1 432 432 TYR H H 432 9.370 9.370 8.827 0.543 17732 1223 1 6 . 1 1 433 433 LYS N N 433 121.500 121.500 124.527 -3.027 17732 1224 1 6 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.353 0.477 17732 1225 1 6 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.587 -0.387 17732 1226 1 6 . 1 1 433 433 LYS H H 433 9.960 9.960 8.647 1.313 17732 1227 1 6 . 1 1 434 434 CYS N N 434 128.700 128.700 126.751 1.949 17732 1228 1 6 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.048 -0.848 17732 1229 1 6 . 1 1 434 434 CYS CA C 434 60.300 60.300 57.768 2.532 17732 1230 1 6 . 1 1 434 434 CYS H H 434 8.440 8.440 9.169 -0.729 17732 1231 1 6 . 1 1 435 435 THR N N 435 118.000 118.000 121.641 -3.641 17732 1232 1 6 . 1 1 435 435 THR HA H 435 4.270 4.270 5.078 -0.808 17732 1233 1 6 . 1 1 435 435 THR CA C 435 62.800 62.800 60.937 1.863 17732 1234 1 6 . 1 1 435 435 THR H H 435 8.200 8.200 8.017 0.183 17732 1235 1 6 . 1 1 436 436 THR N N 436 127.500 127.500 112.276 15.224 17732 1236 1 6 . 1 1 436 436 THR HA H 436 4.230 4.230 4.441 -0.211 17732 1237 1 6 . 1 1 436 436 THR CA C 436 63.300 63.300 60.257 3.043 17732 1238 1 6 . 1 1 436 436 THR H H 436 8.880 8.880 7.807 1.073 17732 1239 1 6 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.154 0.116 17732 1240 1 6 . 1 1 438 438 GLY N N 438 112.800 112.800 110.070 2.730 17732 1241 1 6 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.544 0.856 17732 1242 1 6 . 1 1 438 438 GLY H H 438 8.870 8.870 8.586 0.284 17732 1243 1 6 . 1 1 439 439 CYS N N 439 123.900 123.900 119.967 3.933 17732 1244 1 6 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.783 -0.183 17732 1245 1 6 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.039 2.661 17732 1246 1 6 . 1 1 439 439 CYS H H 439 7.870 7.870 8.250 -0.380 17732 1247 1 6 . 1 1 440 440 GLY N N 440 113.300 113.300 113.078 0.222 17732 1248 1 6 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.429 -0.029 17732 1249 1 6 . 1 1 440 440 GLY H H 440 9.070 9.070 8.571 0.499 17732 1250 1 6 . 1 1 441 441 VAL N N 441 123.400 123.400 123.440 -0.040 17732 1251 1 6 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.296 -0.186 17732 1252 1 6 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.382 5.118 17732 1253 1 6 . 1 1 441 441 VAL H H 441 8.230 8.230 8.623 -0.393 17732 1254 1 6 . 1 1 442 442 ARG N N 442 126.100 126.100 122.739 3.361 17732 1255 1 6 . 1 1 442 442 ARG HA H 442 5.650 5.650 4.922 0.728 17732 1256 1 6 . 1 1 442 442 ARG CA C 442 54.300 54.300 55.045 -0.746 17732 1257 1 6 . 1 1 442 442 ARG H H 442 8.340 8.340 8.576 -0.236 17732 1258 1 6 . 1 1 443 443 LYS N N 443 120.700 120.700 122.073 -1.373 17732 1259 1 6 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.180 -0.070 17732 1260 1 6 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.741 -0.741 17732 1261 1 6 . 1 1 443 443 LYS H H 443 9.340 9.340 8.961 0.379 17732 1262 1 6 . 1 1 444 444 HIS N N 444 122.000 122.000 122.802 -0.802 17732 1263 1 6 . 1 1 444 444 HIS HA H 444 5.700 5.700 4.971 0.729 17732 1264 1 6 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.920 -3.920 17732 1265 1 6 . 1 1 444 444 HIS H H 444 8.860 8.860 8.440 0.420 17732 1266 1 6 . 1 1 445 445 VAL N N 445 121.200 121.200 121.798 -0.598 17732 1267 1 6 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.153 -0.343 17732 1268 1 6 . 1 1 445 445 VAL CA C 445 61.600 61.600 60.095 1.505 17732 1269 1 6 . 1 1 445 445 VAL H H 445 8.560 8.560 8.542 0.018 17732 1270 1 6 . 1 1 446 446 GLU N N 446 125.100 125.100 126.185 -1.085 17732 1271 1 6 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.800 0.110 17732 1272 1 6 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.111 0.290 17732 1273 1 6 . 1 1 446 446 GLU H H 446 8.680 8.680 8.107 0.573 17732 1274 1 6 . 1 1 447 447 ARG N N 447 122.400 122.400 123.074 -0.674 17732 1275 1 6 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.884 -0.194 17732 1276 1 6 . 1 1 447 447 ARG CA C 447 55.400 55.400 54.744 0.656 17732 1277 1 6 . 1 1 447 447 ARG H H 447 8.660 8.660 8.643 0.017 17732 1278 1 6 . 1 1 448 448 ALA N N 448 125.000 125.000 128.199 -3.199 17732 1279 1 6 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.029 0.191 17732 1280 1 6 . 1 1 448 448 ALA CA C 448 52.300 52.300 52.645 -0.345 17732 1281 1 6 . 1 1 448 448 ALA H H 448 8.100 8.100 8.095 0.005 17732 1282 1 6 . 1 1 449 449 ALA N N 449 123.700 123.700 125.253 -1.553 17732 1283 1 6 . 1 1 449 449 ALA HA H 449 4.220 4.220 3.405 0.815 17732 1284 1 6 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.844 0.356 17732 1285 1 6 . 1 1 449 449 ALA H H 449 8.550 8.550 8.365 0.185 17732 1286 1 6 . 1 1 450 450 THR N N 450 102.500 102.500 108.638 -6.138 17732 1287 1 6 . 1 1 450 450 THR HA H 450 4.340 4.340 4.221 0.119 17732 1288 1 6 . 1 1 450 450 THR CA C 450 61.300 61.300 62.221 -0.921 17732 1289 1 6 . 1 1 450 450 THR H H 450 7.600 7.600 7.748 -0.148 17732 1290 1 6 . 1 1 451 451 ASP N N 451 118.200 118.200 121.151 -2.951 17732 1291 1 6 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.975 -0.065 17732 1292 1 6 . 1 1 451 451 ASP CA C 451 52.000 52.000 51.252 0.749 17732 1293 1 6 . 1 1 451 451 ASP H H 451 7.060 7.060 7.164 -0.104 17732 1294 1 6 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.497 -0.197 17732 1295 1 6 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.357 -0.357 17732 1296 1 6 . 1 1 453 453 LYS N N 453 117.000 117.000 115.937 1.063 17732 1297 1 6 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.367 -0.207 17732 1298 1 6 . 1 1 453 453 LYS CA C 453 56.700 56.700 55.351 1.349 17732 1299 1 6 . 1 1 453 453 LYS H H 453 7.880 7.880 8.206 -0.326 17732 1300 1 6 . 1 1 454 454 ALA N N 454 124.700 124.700 123.784 0.916 17732 1301 1 6 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.489 0.081 17732 1302 1 6 . 1 1 454 454 ALA CA C 454 51.200 51.200 51.423 -0.223 17732 1303 1 6 . 1 1 454 454 ALA H H 454 8.060 8.060 7.336 0.724 17732 1304 1 6 . 1 1 455 455 VAL N N 455 119.700 119.700 122.495 -2.795 17732 1305 1 6 . 1 1 455 455 VAL HA H 455 4.370 4.370 5.183 -0.813 17732 1306 1 6 . 1 1 455 455 VAL CA C 455 61.400 61.400 60.404 0.996 17732 1307 1 6 . 1 1 455 455 VAL H H 455 8.190 8.190 8.255 -0.066 17732 1308 1 6 . 1 1 456 456 VAL N N 456 129.400 129.400 122.063 7.337 17732 1309 1 6 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.564 -0.254 17732 1310 1 6 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.165 1.735 17732 1311 1 6 . 1 1 456 456 VAL H H 456 9.220 9.220 9.014 0.206 17732 1312 1 6 . 1 1 457 457 THR N N 457 125.000 125.000 121.071 3.929 17732 1313 1 6 . 1 1 457 457 THR HA H 457 5.160 5.160 5.306 -0.146 17732 1314 1 6 . 1 1 457 457 THR CA C 457 61.100 61.100 60.371 0.729 17732 1315 1 6 . 1 1 457 457 THR H H 457 8.560 8.560 8.210 0.350 17732 1316 1 6 . 1 1 458 458 THR N N 458 120.600 120.600 122.285 -1.685 17732 1317 1 6 . 1 1 458 458 THR HA H 458 4.550 4.550 4.607 -0.057 17732 1318 1 6 . 1 1 458 458 THR CA C 458 60.600 60.600 61.315 -0.715 17732 1319 1 6 . 1 1 458 458 THR H H 458 8.560 8.560 8.265 0.295 17732 1320 1 6 . 1 1 459 459 TYR N N 459 122.500 122.500 125.639 -3.139 17732 1321 1 6 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.816 0.124 17732 1322 1 6 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.698 0.102 17732 1323 1 6 . 1 1 459 459 TYR H H 459 8.870 8.870 8.858 0.012 17732 1324 1 6 . 1 1 460 460 GLU N N 460 123.200 123.200 125.811 -2.611 17732 1325 1 6 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.769 -0.139 17732 1326 1 6 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.544 0.056 17732 1327 1 6 . 1 1 460 460 GLU H H 460 9.150 9.150 8.742 0.408 17732 1328 1 6 . 1 1 461 461 GLY N N 461 112.700 112.700 111.828 0.872 17732 1329 1 6 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.737 -0.837 17732 1330 1 6 . 1 1 461 461 GLY H H 461 8.330 8.330 8.522 -0.192 17732 1331 1 6 . 1 1 462 462 LYS N N 462 118.300 118.300 121.403 -3.103 17732 1332 1 6 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.543 -0.053 17732 1333 1 6 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.433 -1.433 17732 1334 1 6 . 1 1 462 462 LYS H H 462 8.050 8.050 8.383 -0.333 17732 1335 1 6 . 1 1 463 463 HIS N N 463 123.900 123.900 121.688 2.212 17732 1336 1 6 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.611 -0.011 17732 1337 1 6 . 1 1 463 463 HIS CA C 463 57.200 57.200 56.453 0.747 17732 1338 1 6 . 1 1 463 463 HIS H H 463 8.470 8.470 8.435 0.035 17732 1339 1 6 . 1 1 464 464 ASN N N 464 124.400 124.400 117.339 7.061 17732 1340 1 6 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.943 0.007 17732 1341 1 6 . 1 1 464 464 ASN CA C 464 51.500 51.500 53.277 -1.777 17732 1342 1 6 . 1 1 464 464 ASN H H 464 8.360 8.360 8.891 -0.531 17732 1343 1 6 . 1 1 465 465 HIS N N 465 112.100 112.100 116.714 -4.614 17732 1344 1 6 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.898 -0.028 17732 1345 1 6 . 1 1 465 465 HIS CA C 465 52.900 52.900 54.835 -1.935 17732 1346 1 6 . 1 1 465 465 HIS H H 465 6.830 6.830 7.622 -0.792 17732 1347 1 6 . 1 1 466 466 ASP N N 466 120.300 120.300 121.673 -1.373 17732 1348 1 6 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.383 0.237 17732 1349 1 6 . 1 1 466 466 ASP CA C 466 54.000 54.000 56.628 -2.628 17732 1350 1 6 . 1 1 466 466 ASP H H 466 8.780 8.780 8.656 0.124 17732 1351 1 6 . 1 1 467 467 LEU N N 467 124.200 124.200 116.729 7.471 17732 1352 1 6 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.349 -0.309 17732 1353 1 6 . 1 1 467 467 LEU CA C 467 54.100 54.100 53.418 0.682 17732 1354 1 6 . 1 1 467 467 LEU H H 467 8.530 8.530 7.816 0.714 17732 1355 1 6 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.570 -0.220 17732 1356 1 6 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.898 0.402 17732 1357 1 7 . 1 1 408 408 LEU N N 408 122.600 122.600 120.140 2.460 17732 1358 1 7 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.334 -0.074 17732 1359 1 7 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.724 0.276 17732 1360 1 7 . 1 1 408 408 LEU H H 408 8.090 8.090 7.992 0.098 17732 1361 1 7 . 1 1 409 409 ASP N N 409 122.500 122.500 120.052 2.448 17732 1362 1 7 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.562 0.078 17732 1363 1 7 . 1 1 409 409 ASP CA C 409 55.100 55.100 55.663 -0.562 17732 1364 1 7 . 1 1 409 409 ASP H H 409 8.140 8.140 8.508 -0.368 17732 1365 1 7 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.764 -0.264 17732 1366 1 7 . 1 1 410 410 ASP CA C 410 53.200 53.200 53.739 -0.539 17732 1367 1 7 . 1 1 410 410 ASP H H 410 8.570 8.570 8.577 -0.007 17732 1368 1 7 . 1 1 411 411 GLY N N 411 108.400 108.400 107.151 1.249 17732 1369 1 7 . 1 1 411 411 GLY CA C 411 45.300 45.300 44.731 0.569 17732 1370 1 7 . 1 1 411 411 GLY H H 411 8.520 8.520 7.922 0.598 17732 1371 1 7 . 1 1 412 412 TYR N N 412 118.600 118.600 117.450 1.150 17732 1372 1 7 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.444 -0.094 17732 1373 1 7 . 1 1 412 412 TYR CA C 412 58.000 58.000 57.869 0.131 17732 1374 1 7 . 1 1 412 412 TYR H H 412 8.160 8.160 7.898 0.262 17732 1375 1 7 . 1 1 413 413 ARG N N 413 121.100 121.100 116.497 4.603 17732 1376 1 7 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.314 0.466 17732 1377 1 7 . 1 1 413 413 ARG CA C 413 55.100 55.100 56.572 -1.472 17732 1378 1 7 . 1 1 413 413 ARG H H 413 8.750 8.750 8.397 0.353 17732 1379 1 7 . 1 1 414 414 TRP N N 414 120.600 120.600 123.633 -3.033 17732 1380 1 7 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.541 0.039 17732 1381 1 7 . 1 1 414 414 TRP CA C 414 56.100 56.100 55.791 0.309 17732 1382 1 7 . 1 1 414 414 TRP H H 414 8.250 8.250 8.890 -0.640 17732 1383 1 7 . 1 1 415 415 ARG N N 415 122.900 122.900 123.511 -0.611 17732 1384 1 7 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.885 0.395 17732 1385 1 7 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.471 0.129 17732 1386 1 7 . 1 1 415 415 ARG H H 415 9.450 9.450 9.242 0.208 17732 1387 1 7 . 1 1 416 416 LYS N N 416 134.700 134.700 129.715 4.985 17732 1388 1 7 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.541 0.819 17732 1389 1 7 . 1 1 416 416 LYS CA C 416 57.000 57.000 57.150 -0.150 17732 1390 1 7 . 1 1 416 416 LYS H H 416 11.120 11.120 9.089 2.031 17732 1391 1 7 . 1 1 417 417 TYR N N 417 118.600 118.600 124.244 -5.644 17732 1392 1 7 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.670 0.590 17732 1393 1 7 . 1 1 417 417 TYR CA C 417 56.000 56.000 56.487 -0.487 17732 1394 1 7 . 1 1 417 417 TYR H H 417 8.900 8.900 8.658 0.242 17732 1395 1 7 . 1 1 418 418 GLY N N 418 105.300 105.300 111.939 -6.639 17732 1396 1 7 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.761 1.139 17732 1397 1 7 . 1 1 418 418 GLY H H 418 6.990 6.990 8.415 -1.425 17732 1398 1 7 . 1 1 419 419 GLN N N 419 122.600 122.600 120.227 2.373 17732 1399 1 7 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.749 0.731 17732 1400 1 7 . 1 1 419 419 GLN CA C 419 56.600 56.600 55.887 0.713 17732 1401 1 7 . 1 1 419 419 GLN H H 419 9.000 9.000 8.377 0.623 17732 1402 1 7 . 1 1 420 420 LYS N N 420 123.000 123.000 126.433 -3.433 17732 1403 1 7 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.766 0.134 17732 1404 1 7 . 1 1 420 420 LYS CA C 420 52.800 52.800 54.758 -1.958 17732 1405 1 7 . 1 1 420 420 LYS H H 420 9.140 9.140 8.135 1.005 17732 1406 1 7 . 1 1 421 421 VAL N N 421 122.800 122.800 121.021 1.779 17732 1407 1 7 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.326 -0.046 17732 1408 1 7 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.824 3.276 17732 1409 1 7 . 1 1 421 421 VAL H H 421 8.550 8.550 8.436 0.114 17732 1410 1 7 . 1 1 422 422 VAL N N 422 128.600 128.600 122.827 5.773 17732 1411 1 7 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.574 -0.004 17732 1412 1 7 . 1 1 422 422 VAL CA C 422 60.200 60.200 59.680 0.520 17732 1413 1 7 . 1 1 422 422 VAL H H 422 9.500 9.500 8.075 1.425 17732 1414 1 7 . 1 1 423 423 LYS N N 423 123.800 123.800 125.527 -1.727 17732 1415 1 7 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.206 -0.266 17732 1416 1 7 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.915 1.385 17732 1417 1 7 . 1 1 423 423 LYS H H 423 8.880 8.880 8.707 0.173 17732 1418 1 7 . 1 1 424 424 GLY N N 424 110.800 110.800 106.597 4.203 17732 1419 1 7 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.291 -0.992 17732 1420 1 7 . 1 1 424 424 GLY H H 424 8.600 8.600 8.706 -0.106 17732 1421 1 7 . 1 1 425 425 ASN N N 425 119.800 119.800 116.314 3.486 17732 1422 1 7 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.058 0.082 17732 1423 1 7 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.518 -1.418 17732 1424 1 7 . 1 1 425 425 ASN H H 425 7.600 7.600 7.718 -0.118 17732 1425 1 7 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.268 0.032 17732 1426 1 7 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.528 -1.128 17732 1427 1 7 . 1 1 427 427 TYR N N 427 121.100 121.100 118.992 2.108 17732 1428 1 7 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.642 0.248 17732 1429 1 7 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.047 0.053 17732 1430 1 7 . 1 1 427 427 TYR H H 427 8.120 8.120 7.944 0.176 17732 1431 1 7 . 1 1 428 428 PRO HA H 428 4.420 4.420 4.977 -0.557 17732 1432 1 7 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.411 0.889 17732 1433 1 7 . 1 1 429 429 ARG N N 429 124.900 124.900 123.943 0.957 17732 1434 1 7 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.343 0.337 17732 1435 1 7 . 1 1 429 429 ARG CA C 429 55.000 55.000 56.080 -1.079 17732 1436 1 7 . 1 1 429 429 ARG H H 429 9.280 9.280 9.063 0.217 17732 1437 1 7 . 1 1 430 430 SER N N 430 122.200 122.200 114.740 7.460 17732 1438 1 7 . 1 1 430 430 SER HA H 430 4.960 4.960 4.635 0.325 17732 1439 1 7 . 1 1 430 430 SER CA C 430 59.300 59.300 57.430 1.870 17732 1440 1 7 . 1 1 430 430 SER H H 430 9.100 9.100 8.466 0.634 17732 1441 1 7 . 1 1 431 431 TYR N N 431 122.100 122.100 122.442 -0.342 17732 1442 1 7 . 1 1 431 431 TYR HA H 431 4.660 4.660 5.002 -0.342 17732 1443 1 7 . 1 1 431 431 TYR CA C 431 57.400 57.400 55.952 1.448 17732 1444 1 7 . 1 1 431 431 TYR H H 431 7.590 7.590 8.166 -0.576 17732 1445 1 7 . 1 1 432 432 TYR N N 432 120.300 120.300 125.063 -4.763 17732 1446 1 7 . 1 1 432 432 TYR HA H 432 5.720 5.720 5.013 0.707 17732 1447 1 7 . 1 1 432 432 TYR CA C 432 57.100 57.100 58.035 -0.935 17732 1448 1 7 . 1 1 432 432 TYR H H 432 9.370 9.370 8.373 0.997 17732 1449 1 7 . 1 1 433 433 LYS N N 433 121.500 121.500 123.880 -2.380 17732 1450 1 7 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.448 0.382 17732 1451 1 7 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.632 -0.432 17732 1452 1 7 . 1 1 433 433 LYS H H 433 9.960 9.960 8.558 1.402 17732 1453 1 7 . 1 1 434 434 CYS N N 434 128.700 128.700 125.657 3.043 17732 1454 1 7 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.366 -1.166 17732 1455 1 7 . 1 1 434 434 CYS CA C 434 60.300 60.300 56.589 3.711 17732 1456 1 7 . 1 1 434 434 CYS H H 434 8.440 8.440 9.197 -0.757 17732 1457 1 7 . 1 1 435 435 THR N N 435 118.000 118.000 119.957 -1.957 17732 1458 1 7 . 1 1 435 435 THR HA H 435 4.270 4.270 5.112 -0.842 17732 1459 1 7 . 1 1 435 435 THR CA C 435 62.800 62.800 61.073 1.727 17732 1460 1 7 . 1 1 435 435 THR H H 435 8.200 8.200 8.217 -0.017 17732 1461 1 7 . 1 1 436 436 THR N N 436 127.500 127.500 115.143 12.357 17732 1462 1 7 . 1 1 436 436 THR HA H 436 4.230 4.230 4.423 -0.193 17732 1463 1 7 . 1 1 436 436 THR CA C 436 63.300 63.300 61.413 1.887 17732 1464 1 7 . 1 1 436 436 THR H H 436 8.880 8.880 7.933 0.947 17732 1465 1 7 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.208 0.062 17732 1466 1 7 . 1 1 438 438 GLY N N 438 112.800 112.800 102.902 9.898 17732 1467 1 7 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.198 1.202 17732 1468 1 7 . 1 1 438 438 GLY H H 438 8.870 8.870 8.218 0.652 17732 1469 1 7 . 1 1 439 439 CYS N N 439 123.900 123.900 119.555 4.345 17732 1470 1 7 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.787 -0.188 17732 1471 1 7 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.588 2.112 17732 1472 1 7 . 1 1 439 439 CYS H H 439 7.870 7.870 8.271 -0.401 17732 1473 1 7 . 1 1 440 440 GLY N N 440 113.300 113.300 112.018 1.282 17732 1474 1 7 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.216 0.184 17732 1475 1 7 . 1 1 440 440 GLY H H 440 9.070 9.070 8.207 0.863 17732 1476 1 7 . 1 1 441 441 VAL N N 441 123.400 123.400 124.011 -0.611 17732 1477 1 7 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.454 -0.344 17732 1478 1 7 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.541 4.959 17732 1479 1 7 . 1 1 441 441 VAL H H 441 8.230 8.230 8.889 -0.659 17732 1480 1 7 . 1 1 442 442 ARG N N 442 126.100 126.100 122.319 3.781 17732 1481 1 7 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.485 0.165 17732 1482 1 7 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.594 -0.294 17732 1483 1 7 . 1 1 442 442 ARG H H 442 8.340 8.340 8.396 -0.056 17732 1484 1 7 . 1 1 443 443 LYS N N 443 120.700 120.700 117.887 2.813 17732 1485 1 7 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.113 -0.003 17732 1486 1 7 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.967 -0.967 17732 1487 1 7 . 1 1 443 443 LYS H H 443 9.340 9.340 8.728 0.612 17732 1488 1 7 . 1 1 444 444 HIS N N 444 122.000 122.000 117.487 4.513 17732 1489 1 7 . 1 1 444 444 HIS HA H 444 5.700 5.700 5.001 0.699 17732 1490 1 7 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.158 -3.158 17732 1491 1 7 . 1 1 444 444 HIS H H 444 8.860 8.860 8.251 0.609 17732 1492 1 7 . 1 1 445 445 VAL N N 445 121.200 121.200 121.950 -0.750 17732 1493 1 7 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.263 -0.453 17732 1494 1 7 . 1 1 445 445 VAL CA C 445 61.600 61.600 60.269 1.331 17732 1495 1 7 . 1 1 445 445 VAL H H 445 8.560 8.560 8.816 -0.256 17732 1496 1 7 . 1 1 446 446 GLU N N 446 125.100 125.100 125.108 -0.008 17732 1497 1 7 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.757 0.153 17732 1498 1 7 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.586 -0.186 17732 1499 1 7 . 1 1 446 446 GLU H H 446 8.680 8.680 8.061 0.619 17732 1500 1 7 . 1 1 447 447 ARG N N 447 122.400 122.400 123.624 -1.224 17732 1501 1 7 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.112 0.578 17732 1502 1 7 . 1 1 447 447 ARG CA C 447 55.400 55.400 56.889 -1.490 17732 1503 1 7 . 1 1 447 447 ARG H H 447 8.660 8.660 8.826 -0.166 17732 1504 1 7 . 1 1 448 448 ALA N N 448 125.000 125.000 123.468 1.532 17732 1505 1 7 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.231 -0.011 17732 1506 1 7 . 1 1 448 448 ALA CA C 448 52.300 52.300 51.095 1.205 17732 1507 1 7 . 1 1 448 448 ALA H H 448 8.100 8.100 7.660 0.440 17732 1508 1 7 . 1 1 449 449 ALA N N 449 123.700 123.700 125.456 -1.756 17732 1509 1 7 . 1 1 449 449 ALA HA H 449 4.220 4.220 3.847 0.373 17732 1510 1 7 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.593 0.607 17732 1511 1 7 . 1 1 449 449 ALA H H 449 8.550 8.550 8.602 -0.052 17732 1512 1 7 . 1 1 450 450 THR N N 450 102.500 102.500 106.351 -3.851 17732 1513 1 7 . 1 1 450 450 THR HA H 450 4.340 4.340 4.305 0.035 17732 1514 1 7 . 1 1 450 450 THR CA C 450 61.300 61.300 63.293 -1.993 17732 1515 1 7 . 1 1 450 450 THR H H 450 7.600 7.600 7.786 -0.186 17732 1516 1 7 . 1 1 451 451 ASP N N 451 118.200 118.200 121.677 -3.477 17732 1517 1 7 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.976 -0.066 17732 1518 1 7 . 1 1 451 451 ASP CA C 451 52.000 52.000 51.821 0.179 17732 1519 1 7 . 1 1 451 451 ASP H H 451 7.060 7.060 7.982 -0.922 17732 1520 1 7 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.169 0.131 17732 1521 1 7 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.324 -0.324 17732 1522 1 7 . 1 1 453 453 LYS N N 453 117.000 117.000 116.912 0.088 17732 1523 1 7 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.220 -0.060 17732 1524 1 7 . 1 1 453 453 LYS CA C 453 56.700 56.700 57.151 -0.451 17732 1525 1 7 . 1 1 453 453 LYS H H 453 7.880 7.880 8.364 -0.484 17732 1526 1 7 . 1 1 454 454 ALA N N 454 124.700 124.700 121.967 2.733 17732 1527 1 7 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.517 0.053 17732 1528 1 7 . 1 1 454 454 ALA CA C 454 51.200 51.200 51.301 -0.101 17732 1529 1 7 . 1 1 454 454 ALA H H 454 8.060 8.060 7.407 0.653 17732 1530 1 7 . 1 1 455 455 VAL N N 455 119.700 119.700 121.287 -1.587 17732 1531 1 7 . 1 1 455 455 VAL HA H 455 4.370 4.370 4.261 0.109 17732 1532 1 7 . 1 1 455 455 VAL CA C 455 61.400 61.400 60.803 0.597 17732 1533 1 7 . 1 1 455 455 VAL H H 455 8.190 8.190 8.297 -0.107 17732 1534 1 7 . 1 1 456 456 VAL N N 456 129.400 129.400 122.642 6.758 17732 1535 1 7 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.603 -0.293 17732 1536 1 7 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.335 1.565 17732 1537 1 7 . 1 1 456 456 VAL H H 456 9.220 9.220 8.117 1.103 17732 1538 1 7 . 1 1 457 457 THR N N 457 125.000 125.000 122.102 2.898 17732 1539 1 7 . 1 1 457 457 THR HA H 457 5.160 5.160 5.454 -0.294 17732 1540 1 7 . 1 1 457 457 THR CA C 457 61.100 61.100 60.706 0.394 17732 1541 1 7 . 1 1 457 457 THR H H 457 8.560 8.560 8.321 0.239 17732 1542 1 7 . 1 1 458 458 THR N N 458 120.600 120.600 122.773 -2.173 17732 1543 1 7 . 1 1 458 458 THR HA H 458 4.550 4.550 4.521 0.029 17732 1544 1 7 . 1 1 458 458 THR CA C 458 60.600 60.600 61.252 -0.652 17732 1545 1 7 . 1 1 458 458 THR H H 458 8.560 8.560 8.521 0.039 17732 1546 1 7 . 1 1 459 459 TYR N N 459 122.500 122.500 125.856 -3.356 17732 1547 1 7 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.684 0.256 17732 1548 1 7 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.854 -0.054 17732 1549 1 7 . 1 1 459 459 TYR H H 459 8.870 8.870 8.871 -0.001 17732 1550 1 7 . 1 1 460 460 GLU N N 460 123.200 123.200 125.423 -2.223 17732 1551 1 7 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.653 -0.023 17732 1552 1 7 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.494 0.106 17732 1553 1 7 . 1 1 460 460 GLU H H 460 9.150 9.150 8.825 0.325 17732 1554 1 7 . 1 1 461 461 GLY N N 461 112.700 112.700 111.879 0.821 17732 1555 1 7 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.305 -0.405 17732 1556 1 7 . 1 1 461 461 GLY H H 461 8.330 8.330 8.203 0.127 17732 1557 1 7 . 1 1 462 462 LYS N N 462 118.300 118.300 122.060 -3.760 17732 1558 1 7 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.298 0.192 17732 1559 1 7 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.376 -1.376 17732 1560 1 7 . 1 1 462 462 LYS H H 462 8.050 8.050 8.242 -0.192 17732 1561 1 7 . 1 1 463 463 HIS N N 463 123.900 123.900 118.210 5.690 17732 1562 1 7 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.468 0.132 17732 1563 1 7 . 1 1 463 463 HIS CA C 463 57.200 57.200 56.001 1.199 17732 1564 1 7 . 1 1 463 463 HIS H H 463 8.470 8.470 8.359 0.111 17732 1565 1 7 . 1 1 464 464 ASN N N 464 124.400 124.400 121.172 3.228 17732 1566 1 7 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.639 0.311 17732 1567 1 7 . 1 1 464 464 ASN CA C 464 51.500 51.500 53.896 -2.396 17732 1568 1 7 . 1 1 464 464 ASN H H 464 8.360 8.360 8.629 -0.269 17732 1569 1 7 . 1 1 465 465 HIS N N 465 112.100 112.100 114.994 -2.894 17732 1570 1 7 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.834 0.036 17732 1571 1 7 . 1 1 465 465 HIS CA C 465 52.900 52.900 54.600 -1.700 17732 1572 1 7 . 1 1 465 465 HIS H H 465 6.830 6.830 7.272 -0.442 17732 1573 1 7 . 1 1 466 466 ASP N N 466 120.300 120.300 120.933 -0.633 17732 1574 1 7 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.474 0.146 17732 1575 1 7 . 1 1 466 466 ASP CA C 466 54.000 54.000 56.647 -2.647 17732 1576 1 7 . 1 1 466 466 ASP H H 466 8.780 8.780 8.753 0.027 17732 1577 1 7 . 1 1 467 467 LEU N N 467 124.200 124.200 119.879 4.321 17732 1578 1 7 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.710 -0.670 17732 1579 1 7 . 1 1 467 467 LEU CA C 467 54.100 54.100 54.412 -0.312 17732 1580 1 7 . 1 1 467 467 LEU H H 467 8.530 8.530 7.926 0.604 17732 1581 1 7 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.668 -0.318 17732 1582 1 7 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.423 0.877 17732 1583 1 8 . 1 1 408 408 LEU N N 408 122.600 122.600 121.203 1.397 17732 1584 1 8 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.050 0.210 17732 1585 1 8 . 1 1 408 408 LEU CA C 408 55.000 55.000 55.621 -0.621 17732 1586 1 8 . 1 1 408 408 LEU H H 408 8.090 8.090 8.379 -0.289 17732 1587 1 8 . 1 1 409 409 ASP N N 409 122.500 122.500 119.052 3.448 17732 1588 1 8 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.948 -0.308 17732 1589 1 8 . 1 1 409 409 ASP CA C 409 55.100 55.100 53.847 1.253 17732 1590 1 8 . 1 1 409 409 ASP H H 409 8.140 8.140 8.344 -0.204 17732 1591 1 8 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.463 0.037 17732 1592 1 8 . 1 1 410 410 ASP CA C 410 53.200 53.200 54.305 -1.105 17732 1593 1 8 . 1 1 410 410 ASP H H 410 8.570 8.570 8.454 0.116 17732 1594 1 8 . 1 1 411 411 GLY N N 411 108.400 108.400 104.267 4.133 17732 1595 1 8 . 1 1 411 411 GLY CA C 411 45.300 45.300 44.563 0.737 17732 1596 1 8 . 1 1 411 411 GLY H H 411 8.520 8.520 8.057 0.463 17732 1597 1 8 . 1 1 412 412 TYR N N 412 118.600 118.600 119.463 -0.863 17732 1598 1 8 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.640 -0.290 17732 1599 1 8 . 1 1 412 412 TYR CA C 412 58.000 58.000 56.252 1.748 17732 1600 1 8 . 1 1 412 412 TYR H H 412 8.160 8.160 8.319 -0.159 17732 1601 1 8 . 1 1 413 413 ARG N N 413 121.100 121.100 120.375 0.725 17732 1602 1 8 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.663 0.117 17732 1603 1 8 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.297 -0.197 17732 1604 1 8 . 1 1 413 413 ARG H H 413 8.750 8.750 8.530 0.221 17732 1605 1 8 . 1 1 414 414 TRP N N 414 120.600 120.600 124.714 -4.114 17732 1606 1 8 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.211 0.369 17732 1607 1 8 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.337 -0.237 17732 1608 1 8 . 1 1 414 414 TRP H H 414 8.250 8.250 8.781 -0.531 17732 1609 1 8 . 1 1 415 415 ARG N N 415 122.900 122.900 124.030 -1.130 17732 1610 1 8 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.837 0.443 17732 1611 1 8 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.645 -0.045 17732 1612 1 8 . 1 1 415 415 ARG H H 415 9.450 9.450 8.481 0.969 17732 1613 1 8 . 1 1 416 416 LYS N N 416 134.700 134.700 127.626 7.074 17732 1614 1 8 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.730 0.630 17732 1615 1 8 . 1 1 416 416 LYS CA C 416 57.000 57.000 57.328 -0.328 17732 1616 1 8 . 1 1 416 416 LYS H H 416 11.120 11.120 8.696 2.424 17732 1617 1 8 . 1 1 417 417 TYR N N 417 118.600 118.600 119.429 -0.829 17732 1618 1 8 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.375 0.885 17732 1619 1 8 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.826 -1.826 17732 1620 1 8 . 1 1 417 417 TYR H H 417 8.900 8.900 7.921 0.979 17732 1621 1 8 . 1 1 418 418 GLY N N 418 105.300 105.300 110.043 -4.743 17732 1622 1 8 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.819 1.081 17732 1623 1 8 . 1 1 418 418 GLY H H 418 6.990 6.990 8.507 -1.517 17732 1624 1 8 . 1 1 419 419 GLN N N 419 122.600 122.600 120.546 2.054 17732 1625 1 8 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.518 0.962 17732 1626 1 8 . 1 1 419 419 GLN CA C 419 56.600 56.600 55.299 1.301 17732 1627 1 8 . 1 1 419 419 GLN H H 419 9.000 9.000 8.305 0.695 17732 1628 1 8 . 1 1 420 420 LYS N N 420 123.000 123.000 127.536 -4.536 17732 1629 1 8 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.596 0.304 17732 1630 1 8 . 1 1 420 420 LYS CA C 420 52.800 52.800 54.983 -2.183 17732 1631 1 8 . 1 1 420 420 LYS H H 420 9.140 9.140 8.232 0.908 17732 1632 1 8 . 1 1 421 421 VAL N N 421 122.800 122.800 122.880 -0.080 17732 1633 1 8 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.483 -0.203 17732 1634 1 8 . 1 1 421 421 VAL CA C 421 63.100 63.100 60.198 2.902 17732 1635 1 8 . 1 1 421 421 VAL H H 421 8.550 8.550 8.268 0.282 17732 1636 1 8 . 1 1 422 422 VAL N N 422 128.600 128.600 123.924 4.676 17732 1637 1 8 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.610 -0.040 17732 1638 1 8 . 1 1 422 422 VAL CA C 422 60.200 60.200 59.855 0.345 17732 1639 1 8 . 1 1 422 422 VAL H H 422 9.500 9.500 8.534 0.966 17732 1640 1 8 . 1 1 423 423 LYS N N 423 123.800 123.800 125.753 -1.953 17732 1641 1 8 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.254 -0.314 17732 1642 1 8 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.959 1.341 17732 1643 1 8 . 1 1 423 423 LYS H H 423 8.880 8.880 8.586 0.294 17732 1644 1 8 . 1 1 424 424 GLY N N 424 110.800 110.800 106.176 4.624 17732 1645 1 8 . 1 1 424 424 GLY CA C 424 45.300 45.300 45.963 -0.663 17732 1646 1 8 . 1 1 424 424 GLY H H 424 8.600 8.600 8.607 -0.007 17732 1647 1 8 . 1 1 425 425 ASN N N 425 119.800 119.800 116.902 2.898 17732 1648 1 8 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.106 0.034 17732 1649 1 8 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.793 -1.693 17732 1650 1 8 . 1 1 425 425 ASN H H 425 7.600 7.600 7.863 -0.263 17732 1651 1 8 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.174 0.126 17732 1652 1 8 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.340 -0.940 17732 1653 1 8 . 1 1 427 427 TYR N N 427 121.100 121.100 119.500 1.600 17732 1654 1 8 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.635 0.255 17732 1655 1 8 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.465 -0.365 17732 1656 1 8 . 1 1 427 427 TYR H H 427 8.120 8.120 8.028 0.092 17732 1657 1 8 . 1 1 428 428 PRO HA H 428 4.420 4.420 4.979 -0.559 17732 1658 1 8 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.308 0.992 17732 1659 1 8 . 1 1 429 429 ARG N N 429 124.900 124.900 124.024 0.876 17732 1660 1 8 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.252 0.428 17732 1661 1 8 . 1 1 429 429 ARG CA C 429 55.000 55.000 56.627 -1.627 17732 1662 1 8 . 1 1 429 429 ARG H H 429 9.280 9.280 8.899 0.381 17732 1663 1 8 . 1 1 430 430 SER N N 430 122.200 122.200 119.111 3.089 17732 1664 1 8 . 1 1 430 430 SER HA H 430 4.960 4.960 4.778 0.182 17732 1665 1 8 . 1 1 430 430 SER CA C 430 59.300 59.300 57.501 1.799 17732 1666 1 8 . 1 1 430 430 SER H H 430 9.100 9.100 8.397 0.703 17732 1667 1 8 . 1 1 431 431 TYR N N 431 122.100 122.100 124.179 -2.079 17732 1668 1 8 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.793 -0.133 17732 1669 1 8 . 1 1 431 431 TYR CA C 431 57.400 57.400 58.225 -0.825 17732 1670 1 8 . 1 1 431 431 TYR H H 431 7.590 7.590 7.966 -0.376 17732 1671 1 8 . 1 1 432 432 TYR N N 432 120.300 120.300 115.321 4.979 17732 1672 1 8 . 1 1 432 432 TYR HA H 432 5.720 5.720 5.206 0.514 17732 1673 1 8 . 1 1 432 432 TYR CA C 432 57.100 57.100 58.050 -0.950 17732 1674 1 8 . 1 1 432 432 TYR H H 432 9.370 9.370 8.590 0.780 17732 1675 1 8 . 1 1 433 433 LYS N N 433 121.500 121.500 123.686 -2.186 17732 1676 1 8 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.483 0.347 17732 1677 1 8 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.741 -0.541 17732 1678 1 8 . 1 1 433 433 LYS H H 433 9.960 9.960 8.599 1.361 17732 1679 1 8 . 1 1 434 434 CYS N N 434 128.700 128.700 126.228 2.472 17732 1680 1 8 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.275 -1.075 17732 1681 1 8 . 1 1 434 434 CYS CA C 434 60.300 60.300 56.911 3.389 17732 1682 1 8 . 1 1 434 434 CYS H H 434 8.440 8.440 9.273 -0.833 17732 1683 1 8 . 1 1 435 435 THR N N 435 118.000 118.000 121.217 -3.217 17732 1684 1 8 . 1 1 435 435 THR HA H 435 4.270 4.270 4.781 -0.511 17732 1685 1 8 . 1 1 435 435 THR CA C 435 62.800 62.800 61.133 1.667 17732 1686 1 8 . 1 1 435 435 THR H H 435 8.200 8.200 7.987 0.213 17732 1687 1 8 . 1 1 436 436 THR N N 436 127.500 127.500 112.442 15.058 17732 1688 1 8 . 1 1 436 436 THR HA H 436 4.230 4.230 4.380 -0.150 17732 1689 1 8 . 1 1 436 436 THR CA C 436 63.300 63.300 60.424 2.876 17732 1690 1 8 . 1 1 436 436 THR H H 436 8.880 8.880 7.788 1.092 17732 1691 1 8 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.144 0.126 17732 1692 1 8 . 1 1 438 438 GLY N N 438 112.800 112.800 109.026 3.774 17732 1693 1 8 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.622 0.778 17732 1694 1 8 . 1 1 438 438 GLY H H 438 8.870 8.870 8.305 0.565 17732 1695 1 8 . 1 1 439 439 CYS N N 439 123.900 123.900 119.374 4.526 17732 1696 1 8 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.865 -0.265 17732 1697 1 8 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.218 2.482 17732 1698 1 8 . 1 1 439 439 CYS H H 439 7.870 7.870 8.409 -0.539 17732 1699 1 8 . 1 1 440 440 GLY N N 440 113.300 113.300 113.990 -0.690 17732 1700 1 8 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.460 -0.060 17732 1701 1 8 . 1 1 440 440 GLY H H 440 9.070 9.070 8.346 0.724 17732 1702 1 8 . 1 1 441 441 VAL N N 441 123.400 123.400 123.925 -0.525 17732 1703 1 8 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.420 -0.310 17732 1704 1 8 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.593 4.907 17732 1705 1 8 . 1 1 441 441 VAL H H 441 8.230 8.230 8.152 0.078 17732 1706 1 8 . 1 1 442 442 ARG N N 442 126.100 126.100 122.278 3.822 17732 1707 1 8 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.642 0.008 17732 1708 1 8 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.017 0.282 17732 1709 1 8 . 1 1 442 442 ARG H H 442 8.340 8.340 8.389 -0.049 17732 1710 1 8 . 1 1 443 443 LYS N N 443 120.700 120.700 121.844 -1.144 17732 1711 1 8 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.038 0.072 17732 1712 1 8 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.385 -0.385 17732 1713 1 8 . 1 1 443 443 LYS H H 443 9.340 9.340 9.246 0.094 17732 1714 1 8 . 1 1 444 444 HIS N N 444 122.000 122.000 121.184 0.816 17732 1715 1 8 . 1 1 444 444 HIS HA H 444 5.700 5.700 4.699 1.001 17732 1716 1 8 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.843 -3.843 17732 1717 1 8 . 1 1 444 444 HIS H H 444 8.860 8.860 8.685 0.175 17732 1718 1 8 . 1 1 445 445 VAL N N 445 121.200 121.200 123.665 -2.465 17732 1719 1 8 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.215 -0.405 17732 1720 1 8 . 1 1 445 445 VAL CA C 445 61.600 61.600 60.156 1.444 17732 1721 1 8 . 1 1 445 445 VAL H H 445 8.560 8.560 8.164 0.396 17732 1722 1 8 . 1 1 446 446 GLU N N 446 125.100 125.100 126.336 -1.236 17732 1723 1 8 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.725 0.185 17732 1724 1 8 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.229 0.171 17732 1725 1 8 . 1 1 446 446 GLU H H 446 8.680 8.680 8.244 0.436 17732 1726 1 8 . 1 1 447 447 ARG N N 447 122.400 122.400 121.890 0.510 17732 1727 1 8 . 1 1 447 447 ARG HA H 447 4.690 4.690 5.151 -0.461 17732 1728 1 8 . 1 1 447 447 ARG CA C 447 55.400 55.400 55.280 0.120 17732 1729 1 8 . 1 1 447 447 ARG H H 447 8.660 8.660 8.509 0.151 17732 1730 1 8 . 1 1 448 448 ALA N N 448 125.000 125.000 122.356 2.644 17732 1731 1 8 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.394 -0.174 17732 1732 1 8 . 1 1 448 448 ALA CA C 448 52.300 52.300 50.407 1.893 17732 1733 1 8 . 1 1 448 448 ALA H H 448 8.100 8.100 8.413 -0.313 17732 1734 1 8 . 1 1 449 449 ALA N N 449 123.700 123.700 125.956 -2.256 17732 1735 1 8 . 1 1 449 449 ALA HA H 449 4.220 4.220 3.997 0.223 17732 1736 1 8 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.213 0.987 17732 1737 1 8 . 1 1 449 449 ALA H H 449 8.550 8.550 8.705 -0.155 17732 1738 1 8 . 1 1 450 450 THR N N 450 102.500 102.500 106.400 -3.900 17732 1739 1 8 . 1 1 450 450 THR HA H 450 4.340 4.340 4.412 -0.072 17732 1740 1 8 . 1 1 450 450 THR CA C 450 61.300 61.300 61.197 0.103 17732 1741 1 8 . 1 1 450 450 THR H H 450 7.600 7.600 7.503 0.097 17732 1742 1 8 . 1 1 451 451 ASP N N 451 118.200 118.200 120.991 -2.791 17732 1743 1 8 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.864 0.046 17732 1744 1 8 . 1 1 451 451 ASP CA C 451 52.000 52.000 53.690 -1.690 17732 1745 1 8 . 1 1 451 451 ASP H H 451 7.060 7.060 7.763 -0.703 17732 1746 1 8 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.342 -0.042 17732 1747 1 8 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.289 -0.289 17732 1748 1 8 . 1 1 453 453 LYS N N 453 117.000 117.000 114.276 2.724 17732 1749 1 8 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.538 -0.378 17732 1750 1 8 . 1 1 453 453 LYS CA C 453 56.700 56.700 54.861 1.839 17732 1751 1 8 . 1 1 453 453 LYS H H 453 7.880 7.880 7.991 -0.111 17732 1752 1 8 . 1 1 454 454 ALA N N 454 124.700 124.700 124.967 -0.267 17732 1753 1 8 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.610 -0.040 17732 1754 1 8 . 1 1 454 454 ALA CA C 454 51.200 51.200 51.346 -0.146 17732 1755 1 8 . 1 1 454 454 ALA H H 454 8.060 8.060 7.838 0.222 17732 1756 1 8 . 1 1 455 455 VAL N N 455 119.700 119.700 124.446 -4.746 17732 1757 1 8 . 1 1 455 455 VAL HA H 455 4.370 4.370 5.039 -0.669 17732 1758 1 8 . 1 1 455 455 VAL CA C 455 61.400 61.400 60.798 0.602 17732 1759 1 8 . 1 1 455 455 VAL H H 455 8.190 8.190 8.264 -0.074 17732 1760 1 8 . 1 1 456 456 VAL N N 456 129.400 129.400 122.355 7.045 17732 1761 1 8 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.590 -0.280 17732 1762 1 8 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.252 1.648 17732 1763 1 8 . 1 1 456 456 VAL H H 456 9.220 9.220 9.098 0.122 17732 1764 1 8 . 1 1 457 457 THR N N 457 125.000 125.000 120.444 4.556 17732 1765 1 8 . 1 1 457 457 THR HA H 457 5.160 5.160 5.460 -0.300 17732 1766 1 8 . 1 1 457 457 THR CA C 457 61.100 61.100 60.777 0.323 17732 1767 1 8 . 1 1 457 457 THR H H 457 8.560 8.560 8.271 0.289 17732 1768 1 8 . 1 1 458 458 THR N N 458 120.600 120.600 121.721 -1.121 17732 1769 1 8 . 1 1 458 458 THR HA H 458 4.550 4.550 4.604 -0.054 17732 1770 1 8 . 1 1 458 458 THR CA C 458 60.600 60.600 61.655 -1.055 17732 1771 1 8 . 1 1 458 458 THR H H 458 8.560 8.560 8.724 -0.164 17732 1772 1 8 . 1 1 459 459 TYR N N 459 122.500 122.500 124.401 -1.901 17732 1773 1 8 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.856 0.084 17732 1774 1 8 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.464 0.336 17732 1775 1 8 . 1 1 459 459 TYR H H 459 8.870 8.870 8.738 0.132 17732 1776 1 8 . 1 1 460 460 GLU N N 460 123.200 123.200 124.770 -1.570 17732 1777 1 8 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.725 -0.095 17732 1778 1 8 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.577 0.023 17732 1779 1 8 . 1 1 460 460 GLU H H 460 9.150 9.150 8.566 0.584 17732 1780 1 8 . 1 1 461 461 GLY N N 461 112.700 112.700 111.509 1.191 17732 1781 1 8 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.519 -0.619 17732 1782 1 8 . 1 1 461 461 GLY H H 461 8.330 8.330 8.233 0.097 17732 1783 1 8 . 1 1 462 462 LYS N N 462 118.300 118.300 119.730 -1.430 17732 1784 1 8 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.407 0.083 17732 1785 1 8 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.193 -1.193 17732 1786 1 8 . 1 1 462 462 LYS H H 462 8.050 8.050 8.191 -0.141 17732 1787 1 8 . 1 1 463 463 HIS N N 463 123.900 123.900 118.557 5.343 17732 1788 1 8 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.565 0.035 17732 1789 1 8 . 1 1 463 463 HIS CA C 463 57.200 57.200 56.020 1.179 17732 1790 1 8 . 1 1 463 463 HIS H H 463 8.470 8.470 8.338 0.132 17732 1791 1 8 . 1 1 464 464 ASN N N 464 124.400 124.400 124.203 0.197 17732 1792 1 8 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.795 0.155 17732 1793 1 8 . 1 1 464 464 ASN CA C 464 51.500 51.500 52.359 -0.859 17732 1794 1 8 . 1 1 464 464 ASN H H 464 8.360 8.360 8.879 -0.519 17732 1795 1 8 . 1 1 465 465 HIS N N 465 112.100 112.100 116.870 -4.770 17732 1796 1 8 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.695 0.175 17732 1797 1 8 . 1 1 465 465 HIS CA C 465 52.900 52.900 55.503 -2.603 17732 1798 1 8 . 1 1 465 465 HIS H H 465 6.830 6.830 7.238 -0.408 17732 1799 1 8 . 1 1 466 466 ASP N N 466 120.300 120.300 120.556 -0.256 17732 1800 1 8 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.561 0.059 17732 1801 1 8 . 1 1 466 466 ASP CA C 466 54.000 54.000 55.851 -1.851 17732 1802 1 8 . 1 1 466 466 ASP H H 466 8.780 8.780 8.432 0.348 17732 1803 1 8 . 1 1 467 467 LEU N N 467 124.200 124.200 119.379 4.821 17732 1804 1 8 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.832 -0.792 17732 1805 1 8 . 1 1 467 467 LEU CA C 467 54.100 54.100 54.269 -0.169 17732 1806 1 8 . 1 1 467 467 LEU H H 467 8.530 8.530 7.963 0.567 17732 1807 1 8 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.611 -0.261 17732 1808 1 8 . 1 1 468 468 PRO CA C 468 63.300 63.300 63.004 0.296 17732 1809 1 9 . 1 1 408 408 LEU N N 408 122.600 122.600 117.922 4.678 17732 1810 1 9 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.744 -0.484 17732 1811 1 9 . 1 1 408 408 LEU CA C 408 55.000 55.000 55.153 -0.153 17732 1812 1 9 . 1 1 408 408 LEU H H 408 8.090 8.090 8.407 -0.317 17732 1813 1 9 . 1 1 409 409 ASP N N 409 122.500 122.500 117.054 5.446 17732 1814 1 9 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.792 -0.152 17732 1815 1 9 . 1 1 409 409 ASP CA C 409 55.100 55.100 53.994 1.106 17732 1816 1 9 . 1 1 409 409 ASP H H 409 8.140 8.140 7.908 0.232 17732 1817 1 9 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.566 -0.066 17732 1818 1 9 . 1 1 410 410 ASP CA C 410 53.200 53.200 55.032 -1.832 17732 1819 1 9 . 1 1 410 410 ASP H H 410 8.570 8.570 8.876 -0.306 17732 1820 1 9 . 1 1 411 411 GLY N N 411 108.400 108.400 106.887 1.513 17732 1821 1 9 . 1 1 411 411 GLY CA C 411 45.300 45.300 45.030 0.270 17732 1822 1 9 . 1 1 411 411 GLY H H 411 8.520 8.520 7.929 0.591 17732 1823 1 9 . 1 1 412 412 TYR N N 412 118.600 118.600 116.580 2.020 17732 1824 1 9 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.479 -0.129 17732 1825 1 9 . 1 1 412 412 TYR CA C 412 58.000 58.000 56.980 1.020 17732 1826 1 9 . 1 1 412 412 TYR H H 412 8.160 8.160 7.944 0.216 17732 1827 1 9 . 1 1 413 413 ARG N N 413 121.100 121.100 121.737 -0.637 17732 1828 1 9 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.654 0.126 17732 1829 1 9 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.391 -0.291 17732 1830 1 9 . 1 1 413 413 ARG H H 413 8.750 8.750 8.524 0.226 17732 1831 1 9 . 1 1 414 414 TRP N N 414 120.600 120.600 125.581 -4.981 17732 1832 1 9 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.170 0.410 17732 1833 1 9 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.384 -0.284 17732 1834 1 9 . 1 1 414 414 TRP H H 414 8.250 8.250 8.821 -0.571 17732 1835 1 9 . 1 1 415 415 ARG N N 415 122.900 122.900 124.574 -1.674 17732 1836 1 9 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.852 0.428 17732 1837 1 9 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.693 -0.093 17732 1838 1 9 . 1 1 415 415 ARG H H 415 9.450 9.450 8.847 0.603 17732 1839 1 9 . 1 1 416 416 LYS N N 416 134.700 134.700 128.207 6.493 17732 1840 1 9 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.616 0.744 17732 1841 1 9 . 1 1 416 416 LYS CA C 416 57.000 57.000 57.227 -0.227 17732 1842 1 9 . 1 1 416 416 LYS H H 416 11.120 11.120 8.835 2.285 17732 1843 1 9 . 1 1 417 417 TYR N N 417 118.600 118.600 123.322 -4.722 17732 1844 1 9 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.436 0.824 17732 1845 1 9 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.858 -1.858 17732 1846 1 9 . 1 1 417 417 TYR H H 417 8.900 8.900 7.861 1.039 17732 1847 1 9 . 1 1 418 418 GLY N N 418 105.300 105.300 110.363 -5.063 17732 1848 1 9 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.758 1.142 17732 1849 1 9 . 1 1 418 418 GLY H H 418 6.990 6.990 8.549 -1.559 17732 1850 1 9 . 1 1 419 419 GLN N N 419 122.600 122.600 120.558 2.042 17732 1851 1 9 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.428 1.052 17732 1852 1 9 . 1 1 419 419 GLN CA C 419 56.600 56.600 55.732 0.868 17732 1853 1 9 . 1 1 419 419 GLN H H 419 9.000 9.000 8.361 0.639 17732 1854 1 9 . 1 1 420 420 LYS N N 420 123.000 123.000 125.935 -2.935 17732 1855 1 9 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.603 0.297 17732 1856 1 9 . 1 1 420 420 LYS CA C 420 52.800 52.800 55.195 -2.395 17732 1857 1 9 . 1 1 420 420 LYS H H 420 9.140 9.140 8.273 0.867 17732 1858 1 9 . 1 1 421 421 VAL N N 421 122.800 122.800 121.014 1.786 17732 1859 1 9 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.295 -0.015 17732 1860 1 9 . 1 1 421 421 VAL CA C 421 63.100 63.100 60.013 3.087 17732 1861 1 9 . 1 1 421 421 VAL H H 421 8.550 8.550 8.257 0.293 17732 1862 1 9 . 1 1 422 422 VAL N N 422 128.600 128.600 124.211 4.389 17732 1863 1 9 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.608 -0.038 17732 1864 1 9 . 1 1 422 422 VAL CA C 422 60.200 60.200 59.918 0.282 17732 1865 1 9 . 1 1 422 422 VAL H H 422 9.500 9.500 8.396 1.104 17732 1866 1 9 . 1 1 423 423 LYS N N 423 123.800 123.800 126.253 -2.453 17732 1867 1 9 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.285 -0.345 17732 1868 1 9 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.472 1.828 17732 1869 1 9 . 1 1 423 423 LYS H H 423 8.880 8.880 8.536 0.344 17732 1870 1 9 . 1 1 424 424 GLY N N 424 110.800 110.800 106.560 4.240 17732 1871 1 9 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.135 -0.834 17732 1872 1 9 . 1 1 424 424 GLY H H 424 8.600 8.600 8.666 -0.066 17732 1873 1 9 . 1 1 425 425 ASN N N 425 119.800 119.800 116.697 3.103 17732 1874 1 9 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.099 0.041 17732 1875 1 9 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.930 -1.830 17732 1876 1 9 . 1 1 425 425 ASN H H 425 7.600 7.600 7.807 -0.207 17732 1877 1 9 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.121 0.179 17732 1878 1 9 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.618 -1.218 17732 1879 1 9 . 1 1 427 427 TYR N N 427 121.100 121.100 117.489 3.611 17732 1880 1 9 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.649 0.241 17732 1881 1 9 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.056 0.044 17732 1882 1 9 . 1 1 427 427 TYR H H 427 8.120 8.120 7.927 0.193 17732 1883 1 9 . 1 1 428 428 PRO HA H 428 4.420 4.420 4.687 -0.267 17732 1884 1 9 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.464 0.836 17732 1885 1 9 . 1 1 429 429 ARG N N 429 124.900 124.900 124.605 0.295 17732 1886 1 9 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.324 0.356 17732 1887 1 9 . 1 1 429 429 ARG CA C 429 55.000 55.000 55.972 -0.972 17732 1888 1 9 . 1 1 429 429 ARG H H 429 9.280 9.280 8.756 0.524 17732 1889 1 9 . 1 1 430 430 SER N N 430 122.200 122.200 117.890 4.310 17732 1890 1 9 . 1 1 430 430 SER HA H 430 4.960 4.960 4.764 0.196 17732 1891 1 9 . 1 1 430 430 SER CA C 430 59.300 59.300 57.033 2.267 17732 1892 1 9 . 1 1 430 430 SER H H 430 9.100 9.100 8.101 0.999 17732 1893 1 9 . 1 1 431 431 TYR N N 431 122.100 122.100 123.941 -1.841 17732 1894 1 9 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.726 -0.066 17732 1895 1 9 . 1 1 431 431 TYR CA C 431 57.400 57.400 57.297 0.103 17732 1896 1 9 . 1 1 431 431 TYR H H 431 7.590 7.590 8.097 -0.507 17732 1897 1 9 . 1 1 432 432 TYR N N 432 120.300 120.300 125.353 -5.053 17732 1898 1 9 . 1 1 432 432 TYR HA H 432 5.720 5.720 4.993 0.727 17732 1899 1 9 . 1 1 432 432 TYR CA C 432 57.100 57.100 57.907 -0.808 17732 1900 1 9 . 1 1 432 432 TYR H H 432 9.370 9.370 8.295 1.075 17732 1901 1 9 . 1 1 433 433 LYS N N 433 121.500 121.500 123.963 -2.463 17732 1902 1 9 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.371 0.459 17732 1903 1 9 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.657 -0.458 17732 1904 1 9 . 1 1 433 433 LYS H H 433 9.960 9.960 8.627 1.333 17732 1905 1 9 . 1 1 434 434 CYS N N 434 128.700 128.700 126.251 2.449 17732 1906 1 9 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.143 -0.943 17732 1907 1 9 . 1 1 434 434 CYS CA C 434 60.300 60.300 58.184 2.116 17732 1908 1 9 . 1 1 434 434 CYS H H 434 8.440 8.440 9.160 -0.720 17732 1909 1 9 . 1 1 435 435 THR N N 435 118.000 118.000 123.278 -5.278 17732 1910 1 9 . 1 1 435 435 THR HA H 435 4.270 4.270 5.005 -0.735 17732 1911 1 9 . 1 1 435 435 THR CA C 435 62.800 62.800 60.448 2.352 17732 1912 1 9 . 1 1 435 435 THR H H 435 8.200 8.200 8.074 0.126 17732 1913 1 9 . 1 1 436 436 THR N N 436 127.500 127.500 118.752 8.748 17732 1914 1 9 . 1 1 436 436 THR HA H 436 4.230 4.230 4.306 -0.076 17732 1915 1 9 . 1 1 436 436 THR CA C 436 63.300 63.300 61.180 2.120 17732 1916 1 9 . 1 1 436 436 THR H H 436 8.880 8.880 7.894 0.986 17732 1917 1 9 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.200 0.070 17732 1918 1 9 . 1 1 438 438 GLY N N 438 112.800 112.800 111.106 1.694 17732 1919 1 9 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.586 0.814 17732 1920 1 9 . 1 1 438 438 GLY H H 438 8.870 8.870 8.483 0.387 17732 1921 1 9 . 1 1 439 439 CYS N N 439 123.900 123.900 119.966 3.934 17732 1922 1 9 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.738 -0.138 17732 1923 1 9 . 1 1 439 439 CYS CA C 439 60.700 60.700 57.779 2.921 17732 1924 1 9 . 1 1 439 439 CYS H H 439 7.870 7.870 8.317 -0.447 17732 1925 1 9 . 1 1 440 440 GLY N N 440 113.300 113.300 113.965 -0.665 17732 1926 1 9 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.421 -0.021 17732 1927 1 9 . 1 1 440 440 GLY H H 440 9.070 9.070 8.482 0.588 17732 1928 1 9 . 1 1 441 441 VAL N N 441 123.400 123.400 122.897 0.503 17732 1929 1 9 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.328 -0.218 17732 1930 1 9 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.075 5.425 17732 1931 1 9 . 1 1 441 441 VAL H H 441 8.230 8.230 8.493 -0.263 17732 1932 1 9 . 1 1 442 442 ARG N N 442 126.100 126.100 121.754 4.346 17732 1933 1 9 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.230 0.420 17732 1934 1 9 . 1 1 442 442 ARG CA C 442 54.300 54.300 55.134 -0.834 17732 1935 1 9 . 1 1 442 442 ARG H H 442 8.340 8.340 8.848 -0.508 17732 1936 1 9 . 1 1 443 443 LYS N N 443 120.700 120.700 119.167 1.533 17732 1937 1 9 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.146 -0.036 17732 1938 1 9 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.879 -0.879 17732 1939 1 9 . 1 1 443 443 LYS H H 443 9.340 9.340 8.860 0.480 17732 1940 1 9 . 1 1 444 444 HIS N N 444 122.000 122.000 116.616 5.384 17732 1941 1 9 . 1 1 444 444 HIS HA H 444 5.700 5.700 5.082 0.618 17732 1942 1 9 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.001 -3.001 17732 1943 1 9 . 1 1 444 444 HIS H H 444 8.860 8.860 7.582 1.278 17732 1944 1 9 . 1 1 445 445 VAL N N 445 121.200 121.200 123.602 -2.402 17732 1945 1 9 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.074 -0.264 17732 1946 1 9 . 1 1 445 445 VAL CA C 445 61.600 61.600 60.898 0.702 17732 1947 1 9 . 1 1 445 445 VAL H H 445 8.560 8.560 8.269 0.291 17732 1948 1 9 . 1 1 446 446 GLU N N 446 125.100 125.100 126.039 -0.939 17732 1949 1 9 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.751 0.159 17732 1950 1 9 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.055 0.345 17732 1951 1 9 . 1 1 446 446 GLU H H 446 8.680 8.680 8.803 -0.123 17732 1952 1 9 . 1 1 447 447 ARG N N 447 122.400 122.400 121.248 1.152 17732 1953 1 9 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.966 -0.276 17732 1954 1 9 . 1 1 447 447 ARG CA C 447 55.400 55.400 54.678 0.722 17732 1955 1 9 . 1 1 447 447 ARG H H 447 8.660 8.660 8.623 0.037 17732 1956 1 9 . 1 1 448 448 ALA N N 448 125.000 125.000 126.171 -1.171 17732 1957 1 9 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.306 -0.086 17732 1958 1 9 . 1 1 448 448 ALA CA C 448 52.300 52.300 51.637 0.663 17732 1959 1 9 . 1 1 448 448 ALA H H 448 8.100 8.100 8.538 -0.438 17732 1960 1 9 . 1 1 449 449 ALA N N 449 123.700 123.700 125.447 -1.747 17732 1961 1 9 . 1 1 449 449 ALA HA H 449 4.220 4.220 4.214 0.006 17732 1962 1 9 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.536 0.664 17732 1963 1 9 . 1 1 449 449 ALA H H 449 8.550 8.550 8.771 -0.221 17732 1964 1 9 . 1 1 450 450 THR N N 450 102.500 102.500 105.299 -2.799 17732 1965 1 9 . 1 1 450 450 THR HA H 450 4.340 4.340 4.547 -0.207 17732 1966 1 9 . 1 1 450 450 THR CA C 450 61.300 61.300 61.398 -0.098 17732 1967 1 9 . 1 1 450 450 THR H H 450 7.600 7.600 7.746 -0.146 17732 1968 1 9 . 1 1 451 451 ASP N N 451 118.200 118.200 121.625 -3.425 17732 1969 1 9 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.786 0.124 17732 1970 1 9 . 1 1 451 451 ASP CA C 451 52.000 52.000 53.641 -1.641 17732 1971 1 9 . 1 1 451 451 ASP H H 451 7.060 7.060 7.874 -0.814 17732 1972 1 9 . 1 1 452 452 PRO HA H 452 4.300 4.300 3.899 0.401 17732 1973 1 9 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.652 -0.652 17732 1974 1 9 . 1 1 453 453 LYS N N 453 117.000 117.000 115.355 1.645 17732 1975 1 9 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.274 -0.114 17732 1976 1 9 . 1 1 453 453 LYS CA C 453 56.700 56.700 55.468 1.232 17732 1977 1 9 . 1 1 453 453 LYS H H 453 7.880 7.880 8.182 -0.302 17732 1978 1 9 . 1 1 454 454 ALA N N 454 124.700 124.700 124.241 0.459 17732 1979 1 9 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.453 0.117 17732 1980 1 9 . 1 1 454 454 ALA CA C 454 51.200 51.200 51.531 -0.331 17732 1981 1 9 . 1 1 454 454 ALA H H 454 8.060 8.060 7.987 0.073 17732 1982 1 9 . 1 1 455 455 VAL N N 455 119.700 119.700 124.949 -5.249 17732 1983 1 9 . 1 1 455 455 VAL HA H 455 4.370 4.370 5.131 -0.761 17732 1984 1 9 . 1 1 455 455 VAL CA C 455 61.400 61.400 60.824 0.576 17732 1985 1 9 . 1 1 455 455 VAL H H 455 8.190 8.190 8.359 -0.169 17732 1986 1 9 . 1 1 456 456 VAL N N 456 129.400 129.400 123.819 5.581 17732 1987 1 9 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.521 -0.211 17732 1988 1 9 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.720 1.180 17732 1989 1 9 . 1 1 456 456 VAL H H 456 9.220 9.220 9.131 0.089 17732 1990 1 9 . 1 1 457 457 THR N N 457 125.000 125.000 121.707 3.293 17732 1991 1 9 . 1 1 457 457 THR HA H 457 5.160 5.160 5.084 0.076 17732 1992 1 9 . 1 1 457 457 THR CA C 457 61.100 61.100 60.941 0.158 17732 1993 1 9 . 1 1 457 457 THR H H 457 8.560 8.560 8.270 0.290 17732 1994 1 9 . 1 1 458 458 THR N N 458 120.600 120.600 122.540 -1.940 17732 1995 1 9 . 1 1 458 458 THR HA H 458 4.550 4.550 4.447 0.103 17732 1996 1 9 . 1 1 458 458 THR CA C 458 60.600 60.600 61.261 -0.661 17732 1997 1 9 . 1 1 458 458 THR H H 458 8.560 8.560 8.029 0.531 17732 1998 1 9 . 1 1 459 459 TYR N N 459 122.500 122.500 126.042 -3.542 17732 1999 1 9 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.731 0.209 17732 2000 1 9 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.768 0.032 17732 2001 1 9 . 1 1 459 459 TYR H H 459 8.870 8.870 8.733 0.137 17732 2002 1 9 . 1 1 460 460 GLU N N 460 123.200 123.200 125.282 -2.082 17732 2003 1 9 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.780 -0.150 17732 2004 1 9 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.962 -0.363 17732 2005 1 9 . 1 1 460 460 GLU H H 460 9.150 9.150 8.796 0.354 17732 2006 1 9 . 1 1 461 461 GLY N N 461 112.700 112.700 111.051 1.649 17732 2007 1 9 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.728 -0.828 17732 2008 1 9 . 1 1 461 461 GLY H H 461 8.330 8.330 8.330 -0.000 17732 2009 1 9 . 1 1 462 462 LYS N N 462 118.300 118.300 121.765 -3.465 17732 2010 1 9 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.551 -0.061 17732 2011 1 9 . 1 1 462 462 LYS CA C 462 54.000 54.000 54.305 -0.305 17732 2012 1 9 . 1 1 462 462 LYS H H 462 8.050 8.050 8.292 -0.242 17732 2013 1 9 . 1 1 463 463 HIS N N 463 123.900 123.900 121.766 2.134 17732 2014 1 9 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.612 -0.012 17732 2015 1 9 . 1 1 463 463 HIS CA C 463 57.200 57.200 56.438 0.762 17732 2016 1 9 . 1 1 463 463 HIS H H 463 8.470 8.470 8.507 -0.037 17732 2017 1 9 . 1 1 464 464 ASN N N 464 124.400 124.400 116.366 8.034 17732 2018 1 9 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.917 0.033 17732 2019 1 9 . 1 1 464 464 ASN CA C 464 51.500 51.500 53.023 -1.523 17732 2020 1 9 . 1 1 464 464 ASN H H 464 8.360 8.360 8.842 -0.482 17732 2021 1 9 . 1 1 465 465 HIS N N 465 112.100 112.100 116.378 -4.278 17732 2022 1 9 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.706 0.164 17732 2023 1 9 . 1 1 465 465 HIS CA C 465 52.900 52.900 56.060 -3.160 17732 2024 1 9 . 1 1 465 465 HIS H H 465 6.830 6.830 7.722 -0.892 17732 2025 1 9 . 1 1 466 466 ASP N N 466 120.300 120.300 118.257 2.043 17732 2026 1 9 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.535 0.085 17732 2027 1 9 . 1 1 466 466 ASP CA C 466 54.000 54.000 54.304 -0.304 17732 2028 1 9 . 1 1 466 466 ASP H H 466 8.780 8.780 8.129 0.651 17732 2029 1 9 . 1 1 467 467 LEU N N 467 124.200 124.200 121.911 2.289 17732 2030 1 9 . 1 1 467 467 LEU HA H 467 4.040 4.040 5.108 -1.068 17732 2031 1 9 . 1 1 467 467 LEU CA C 467 54.100 54.100 54.034 0.066 17732 2032 1 9 . 1 1 467 467 LEU H H 467 8.530 8.530 8.100 0.430 17732 2033 1 9 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.747 -0.397 17732 2034 1 9 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.337 0.964 17732 2035 1 10 . 1 1 408 408 LEU N N 408 122.600 122.600 126.127 -3.527 17732 2036 1 10 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.621 -0.361 17732 2037 1 10 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.838 0.162 17732 2038 1 10 . 1 1 408 408 LEU H H 408 8.090 8.090 8.341 -0.251 17732 2039 1 10 . 1 1 409 409 ASP N N 409 122.500 122.500 122.564 -0.064 17732 2040 1 10 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.460 0.180 17732 2041 1 10 . 1 1 409 409 ASP CA C 409 55.100 55.100 55.638 -0.538 17732 2042 1 10 . 1 1 409 409 ASP H H 409 8.140 8.140 8.549 -0.409 17732 2043 1 10 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.632 -0.132 17732 2044 1 10 . 1 1 410 410 ASP CA C 410 53.200 53.200 53.994 -0.794 17732 2045 1 10 . 1 1 410 410 ASP H H 410 8.570 8.570 8.441 0.129 17732 2046 1 10 . 1 1 411 411 GLY N N 411 108.400 108.400 107.135 1.265 17732 2047 1 10 . 1 1 411 411 GLY CA C 411 45.300 45.300 44.666 0.634 17732 2048 1 10 . 1 1 411 411 GLY H H 411 8.520 8.520 8.012 0.508 17732 2049 1 10 . 1 1 412 412 TYR N N 412 118.600 118.600 116.939 1.661 17732 2050 1 10 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.416 -0.066 17732 2051 1 10 . 1 1 412 412 TYR CA C 412 58.000 58.000 57.889 0.111 17732 2052 1 10 . 1 1 412 412 TYR H H 412 8.160 8.160 7.992 0.168 17732 2053 1 10 . 1 1 413 413 ARG N N 413 121.100 121.100 121.985 -0.885 17732 2054 1 10 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.668 0.112 17732 2055 1 10 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.488 -0.388 17732 2056 1 10 . 1 1 413 413 ARG H H 413 8.750 8.750 8.601 0.149 17732 2057 1 10 . 1 1 414 414 TRP N N 414 120.600 120.600 125.286 -4.686 17732 2058 1 10 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.072 0.508 17732 2059 1 10 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.288 -0.188 17732 2060 1 10 . 1 1 414 414 TRP H H 414 8.250 8.250 8.703 -0.453 17732 2061 1 10 . 1 1 415 415 ARG N N 415 122.900 122.900 124.041 -1.141 17732 2062 1 10 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.868 0.412 17732 2063 1 10 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.673 -0.073 17732 2064 1 10 . 1 1 415 415 ARG H H 415 9.450 9.450 8.469 0.981 17732 2065 1 10 . 1 1 416 416 LYS N N 416 134.700 134.700 127.627 7.073 17732 2066 1 10 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.559 0.801 17732 2067 1 10 . 1 1 416 416 LYS CA C 416 57.000 57.000 57.469 -0.469 17732 2068 1 10 . 1 1 416 416 LYS H H 416 11.120 11.120 8.930 2.190 17732 2069 1 10 . 1 1 417 417 TYR N N 417 118.600 118.600 119.629 -1.029 17732 2070 1 10 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.420 0.840 17732 2071 1 10 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.405 -1.405 17732 2072 1 10 . 1 1 417 417 TYR H H 417 8.900 8.900 7.684 1.216 17732 2073 1 10 . 1 1 418 418 GLY N N 418 105.300 105.300 111.380 -6.080 17732 2074 1 10 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.667 1.233 17732 2075 1 10 . 1 1 418 418 GLY H H 418 6.990 6.990 8.578 -1.588 17732 2076 1 10 . 1 1 419 419 GLN N N 419 122.600 122.600 120.731 1.869 17732 2077 1 10 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.186 1.294 17732 2078 1 10 . 1 1 419 419 GLN CA C 419 56.600 56.600 55.803 0.797 17732 2079 1 10 . 1 1 419 419 GLN H H 419 9.000 9.000 8.360 0.640 17732 2080 1 10 . 1 1 420 420 LYS N N 420 123.000 123.000 126.271 -3.271 17732 2081 1 10 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.519 0.381 17732 2082 1 10 . 1 1 420 420 LYS CA C 420 52.800 52.800 54.911 -2.111 17732 2083 1 10 . 1 1 420 420 LYS H H 420 9.140 9.140 8.116 1.024 17732 2084 1 10 . 1 1 421 421 VAL N N 421 122.800 122.800 121.937 0.863 17732 2085 1 10 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.666 -0.386 17732 2086 1 10 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.580 3.520 17732 2087 1 10 . 1 1 421 421 VAL H H 421 8.550 8.550 8.338 0.213 17732 2088 1 10 . 1 1 422 422 VAL N N 422 128.600 128.600 121.600 7.000 17732 2089 1 10 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.633 -0.063 17732 2090 1 10 . 1 1 422 422 VAL CA C 422 60.200 60.200 60.109 0.091 17732 2091 1 10 . 1 1 422 422 VAL H H 422 9.500 9.500 8.643 0.857 17732 2092 1 10 . 1 1 423 423 LYS N N 423 123.800 123.800 125.378 -1.578 17732 2093 1 10 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.329 -0.389 17732 2094 1 10 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.078 2.222 17732 2095 1 10 . 1 1 423 423 LYS H H 423 8.880 8.880 8.487 0.393 17732 2096 1 10 . 1 1 424 424 GLY N N 424 110.800 110.800 108.014 2.786 17732 2097 1 10 . 1 1 424 424 GLY CA C 424 45.300 45.300 45.903 -0.603 17732 2098 1 10 . 1 1 424 424 GLY H H 424 8.600 8.600 8.630 -0.030 17732 2099 1 10 . 1 1 425 425 ASN N N 425 119.800 119.800 117.267 2.533 17732 2100 1 10 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.095 0.045 17732 2101 1 10 . 1 1 425 425 ASN CA C 425 50.100 50.100 52.027 -1.927 17732 2102 1 10 . 1 1 425 425 ASN H H 425 7.600 7.600 7.829 -0.229 17732 2103 1 10 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.266 0.034 17732 2104 1 10 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.526 -1.127 17732 2105 1 10 . 1 1 427 427 TYR N N 427 121.100 121.100 118.546 2.554 17732 2106 1 10 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.671 0.219 17732 2107 1 10 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.128 -0.028 17732 2108 1 10 . 1 1 427 427 TYR H H 427 8.120 8.120 7.927 0.193 17732 2109 1 10 . 1 1 428 428 PRO HA H 428 4.420 4.420 4.985 -0.565 17732 2110 1 10 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.371 0.929 17732 2111 1 10 . 1 1 429 429 ARG N N 429 124.900 124.900 125.146 -0.246 17732 2112 1 10 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.385 0.295 17732 2113 1 10 . 1 1 429 429 ARG CA C 429 55.000 55.000 56.130 -1.130 17732 2114 1 10 . 1 1 429 429 ARG H H 429 9.280 9.280 8.963 0.317 17732 2115 1 10 . 1 1 430 430 SER N N 430 122.200 122.200 117.694 4.506 17732 2116 1 10 . 1 1 430 430 SER HA H 430 4.960 4.960 4.739 0.221 17732 2117 1 10 . 1 1 430 430 SER CA C 430 59.300 59.300 57.691 1.609 17732 2118 1 10 . 1 1 430 430 SER H H 430 9.100 9.100 8.068 1.032 17732 2119 1 10 . 1 1 431 431 TYR N N 431 122.100 122.100 124.862 -2.762 17732 2120 1 10 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.953 -0.293 17732 2121 1 10 . 1 1 431 431 TYR CA C 431 57.400 57.400 56.503 0.897 17732 2122 1 10 . 1 1 431 431 TYR H H 431 7.590 7.590 8.154 -0.564 17732 2123 1 10 . 1 1 432 432 TYR N N 432 120.300 120.300 124.200 -3.900 17732 2124 1 10 . 1 1 432 432 TYR HA H 432 5.720 5.720 4.976 0.744 17732 2125 1 10 . 1 1 432 432 TYR CA C 432 57.100 57.100 57.989 -0.889 17732 2126 1 10 . 1 1 432 432 TYR H H 432 9.370 9.370 9.312 0.058 17732 2127 1 10 . 1 1 433 433 LYS N N 433 121.500 121.500 125.914 -4.414 17732 2128 1 10 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.375 0.455 17732 2129 1 10 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.995 -0.795 17732 2130 1 10 . 1 1 433 433 LYS H H 433 9.960 9.960 8.594 1.366 17732 2131 1 10 . 1 1 434 434 CYS N N 434 128.700 128.700 128.424 0.276 17732 2132 1 10 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.049 -0.849 17732 2133 1 10 . 1 1 434 434 CYS CA C 434 60.300 60.300 57.635 2.665 17732 2134 1 10 . 1 1 434 434 CYS H H 434 8.440 8.440 9.346 -0.906 17732 2135 1 10 . 1 1 435 435 THR N N 435 118.000 118.000 122.266 -4.266 17732 2136 1 10 . 1 1 435 435 THR HA H 435 4.270 4.270 4.930 -0.660 17732 2137 1 10 . 1 1 435 435 THR CA C 435 62.800 62.800 60.618 2.182 17732 2138 1 10 . 1 1 435 435 THR H H 435 8.200 8.200 8.137 0.063 17732 2139 1 10 . 1 1 436 436 THR N N 436 127.500 127.500 114.061 13.439 17732 2140 1 10 . 1 1 436 436 THR HA H 436 4.230 4.230 4.404 -0.174 17732 2141 1 10 . 1 1 436 436 THR CA C 436 63.300 63.300 60.757 2.543 17732 2142 1 10 . 1 1 436 436 THR H H 436 8.880 8.880 7.898 0.982 17732 2143 1 10 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.197 0.073 17732 2144 1 10 . 1 1 438 438 GLY N N 438 112.800 112.800 108.765 4.035 17732 2145 1 10 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.623 0.777 17732 2146 1 10 . 1 1 438 438 GLY H H 438 8.870 8.870 8.343 0.527 17732 2147 1 10 . 1 1 439 439 CYS N N 439 123.900 123.900 119.300 4.600 17732 2148 1 10 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.833 -0.233 17732 2149 1 10 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.221 2.479 17732 2150 1 10 . 1 1 439 439 CYS H H 439 7.870 7.870 8.417 -0.547 17732 2151 1 10 . 1 1 440 440 GLY N N 440 113.300 113.300 112.418 0.882 17732 2152 1 10 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.476 -0.076 17732 2153 1 10 . 1 1 440 440 GLY H H 440 9.070 9.070 8.510 0.560 17732 2154 1 10 . 1 1 441 441 VAL N N 441 123.400 123.400 124.064 -0.664 17732 2155 1 10 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.338 -0.228 17732 2156 1 10 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.696 4.804 17732 2157 1 10 . 1 1 441 441 VAL H H 441 8.230 8.230 8.526 -0.296 17732 2158 1 10 . 1 1 442 442 ARG N N 442 126.100 126.100 123.257 2.843 17732 2159 1 10 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.329 0.321 17732 2160 1 10 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.419 -0.119 17732 2161 1 10 . 1 1 442 442 ARG H H 442 8.340 8.340 8.832 -0.492 17732 2162 1 10 . 1 1 443 443 LYS N N 443 120.700 120.700 123.712 -3.012 17732 2163 1 10 . 1 1 443 443 LYS HA H 443 5.110 5.110 4.749 0.361 17732 2164 1 10 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.836 -0.836 17732 2165 1 10 . 1 1 443 443 LYS H H 443 9.340 9.340 9.230 0.110 17732 2166 1 10 . 1 1 444 444 HIS N N 444 122.000 122.000 123.751 -1.751 17732 2167 1 10 . 1 1 444 444 HIS HA H 444 5.700 5.700 5.313 0.387 17732 2168 1 10 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.130 -3.130 17732 2169 1 10 . 1 1 444 444 HIS H H 444 8.860 8.860 8.812 0.048 17732 2170 1 10 . 1 1 445 445 VAL N N 445 121.200 121.200 122.287 -1.087 17732 2171 1 10 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.009 -0.199 17732 2172 1 10 . 1 1 445 445 VAL CA C 445 61.600 61.600 61.521 0.079 17732 2173 1 10 . 1 1 445 445 VAL H H 445 8.560 8.560 8.138 0.422 17732 2174 1 10 . 1 1 446 446 GLU N N 446 125.100 125.100 125.583 -0.483 17732 2175 1 10 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.819 0.091 17732 2176 1 10 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.423 -0.023 17732 2177 1 10 . 1 1 446 446 GLU H H 446 8.680 8.680 8.579 0.101 17732 2178 1 10 . 1 1 447 447 ARG N N 447 122.400 122.400 120.520 1.880 17732 2179 1 10 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.346 0.344 17732 2180 1 10 . 1 1 447 447 ARG CA C 447 55.400 55.400 55.113 0.287 17732 2181 1 10 . 1 1 447 447 ARG H H 447 8.660 8.660 8.538 0.122 17732 2182 1 10 . 1 1 448 448 ALA N N 448 125.000 125.000 122.096 2.904 17732 2183 1 10 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.424 -0.204 17732 2184 1 10 . 1 1 448 448 ALA CA C 448 52.300 52.300 50.743 1.557 17732 2185 1 10 . 1 1 448 448 ALA H H 448 8.100 8.100 7.859 0.241 17732 2186 1 10 . 1 1 449 449 ALA N N 449 123.700 123.700 126.521 -2.821 17732 2187 1 10 . 1 1 449 449 ALA HA H 449 4.220 4.220 4.055 0.165 17732 2188 1 10 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.886 0.314 17732 2189 1 10 . 1 1 449 449 ALA H H 449 8.550 8.550 8.591 -0.041 17732 2190 1 10 . 1 1 450 450 THR N N 450 102.500 102.500 108.811 -6.311 17732 2191 1 10 . 1 1 450 450 THR HA H 450 4.340 4.340 4.253 0.087 17732 2192 1 10 . 1 1 450 450 THR CA C 450 61.300 61.300 62.941 -1.641 17732 2193 1 10 . 1 1 450 450 THR H H 450 7.600 7.600 8.171 -0.571 17732 2194 1 10 . 1 1 451 451 ASP N N 451 118.200 118.200 122.945 -4.745 17732 2195 1 10 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.899 0.011 17732 2196 1 10 . 1 1 451 451 ASP CA C 451 52.000 52.000 51.409 0.591 17732 2197 1 10 . 1 1 451 451 ASP H H 451 7.060 7.060 8.044 -0.984 17732 2198 1 10 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.142 0.158 17732 2199 1 10 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.067 -0.067 17732 2200 1 10 . 1 1 453 453 LYS N N 453 117.000 117.000 116.140 0.860 17732 2201 1 10 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.353 -0.193 17732 2202 1 10 . 1 1 453 453 LYS CA C 453 56.700 56.700 56.136 0.563 17732 2203 1 10 . 1 1 453 453 LYS H H 453 7.880 7.880 8.290 -0.410 17732 2204 1 10 . 1 1 454 454 ALA N N 454 124.700 124.700 123.424 1.276 17732 2205 1 10 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.213 0.357 17732 2206 1 10 . 1 1 454 454 ALA CA C 454 51.200 51.200 52.946 -1.746 17732 2207 1 10 . 1 1 454 454 ALA H H 454 8.060 8.060 7.323 0.737 17732 2208 1 10 . 1 1 455 455 VAL N N 455 119.700 119.700 116.911 2.789 17732 2209 1 10 . 1 1 455 455 VAL HA H 455 4.370 4.370 4.407 -0.037 17732 2210 1 10 . 1 1 455 455 VAL CA C 455 61.400 61.400 61.801 -0.401 17732 2211 1 10 . 1 1 455 455 VAL H H 455 8.190 8.190 7.805 0.385 17732 2212 1 10 . 1 1 456 456 VAL N N 456 129.400 129.400 124.520 4.880 17732 2213 1 10 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.675 -0.365 17732 2214 1 10 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.515 1.385 17732 2215 1 10 . 1 1 456 456 VAL H H 456 9.220 9.220 9.083 0.137 17732 2216 1 10 . 1 1 457 457 THR N N 457 125.000 125.000 121.615 3.385 17732 2217 1 10 . 1 1 457 457 THR HA H 457 5.160 5.160 5.180 -0.020 17732 2218 1 10 . 1 1 457 457 THR CA C 457 61.100 61.100 61.074 0.026 17732 2219 1 10 . 1 1 457 457 THR H H 457 8.560 8.560 8.318 0.242 17732 2220 1 10 . 1 1 458 458 THR N N 458 120.600 120.600 122.342 -1.742 17732 2221 1 10 . 1 1 458 458 THR HA H 458 4.550 4.550 4.639 -0.089 17732 2222 1 10 . 1 1 458 458 THR CA C 458 60.600 60.600 61.605 -1.004 17732 2223 1 10 . 1 1 458 458 THR H H 458 8.560 8.560 8.453 0.107 17732 2224 1 10 . 1 1 459 459 TYR N N 459 122.500 122.500 125.431 -2.931 17732 2225 1 10 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.708 0.232 17732 2226 1 10 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.690 0.110 17732 2227 1 10 . 1 1 459 459 TYR H H 459 8.870 8.870 8.858 0.012 17732 2228 1 10 . 1 1 460 460 GLU N N 460 123.200 123.200 125.465 -2.265 17732 2229 1 10 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.698 -0.068 17732 2230 1 10 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.417 0.183 17732 2231 1 10 . 1 1 460 460 GLU H H 460 9.150 9.150 8.836 0.314 17732 2232 1 10 . 1 1 461 461 GLY N N 461 112.700 112.700 111.807 0.893 17732 2233 1 10 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.676 -0.776 17732 2234 1 10 . 1 1 461 461 GLY H H 461 8.330 8.330 8.471 -0.141 17732 2235 1 10 . 1 1 462 462 LYS N N 462 118.300 118.300 122.794 -4.494 17732 2236 1 10 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.333 0.157 17732 2237 1 10 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.339 -1.339 17732 2238 1 10 . 1 1 462 462 LYS H H 462 8.050 8.050 8.156 -0.106 17732 2239 1 10 . 1 1 463 463 HIS N N 463 123.900 123.900 119.150 4.750 17732 2240 1 10 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.740 -0.140 17732 2241 1 10 . 1 1 463 463 HIS CA C 463 57.200 57.200 55.834 1.366 17732 2242 1 10 . 1 1 463 463 HIS H H 463 8.470 8.470 8.289 0.181 17732 2243 1 10 . 1 1 464 464 ASN N N 464 124.400 124.400 120.026 4.374 17732 2244 1 10 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.764 0.185 17732 2245 1 10 . 1 1 464 464 ASN CA C 464 51.500 51.500 53.695 -2.195 17732 2246 1 10 . 1 1 464 464 ASN H H 464 8.360 8.360 9.135 -0.775 17732 2247 1 10 . 1 1 465 465 HIS N N 465 112.100 112.100 118.149 -6.049 17732 2248 1 10 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.605 0.265 17732 2249 1 10 . 1 1 465 465 HIS CA C 465 52.900 52.900 55.910 -3.010 17732 2250 1 10 . 1 1 465 465 HIS H H 465 6.830 6.830 7.914 -1.084 17732 2251 1 10 . 1 1 466 466 ASP N N 466 120.300 120.300 116.878 3.422 17732 2252 1 10 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.451 0.169 17732 2253 1 10 . 1 1 466 466 ASP CA C 466 54.000 54.000 53.583 0.417 17732 2254 1 10 . 1 1 466 466 ASP H H 466 8.780 8.780 7.419 1.361 17732 2255 1 10 . 1 1 467 467 LEU N N 467 124.200 124.200 122.547 1.653 17732 2256 1 10 . 1 1 467 467 LEU HA H 467 4.040 4.040 3.841 0.200 17732 2257 1 10 . 1 1 467 467 LEU CA C 467 54.100 54.100 54.066 0.034 17732 2258 1 10 . 1 1 467 467 LEU H H 467 8.530 8.530 8.242 0.288 17732 2259 1 10 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.473 -0.123 17732 2260 1 10 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.800 0.500 17732 2261 1 11 . 1 1 408 408 LEU N N 408 122.600 122.600 121.732 0.868 17732 2262 1 11 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.744 -0.484 17732 2263 1 11 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.130 0.870 17732 2264 1 11 . 1 1 408 408 LEU H H 408 8.090 8.090 8.679 -0.589 17732 2265 1 11 . 1 1 409 409 ASP N N 409 122.500 122.500 121.329 1.171 17732 2266 1 11 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.565 0.075 17732 2267 1 11 . 1 1 409 409 ASP CA C 409 55.100 55.100 54.966 0.134 17732 2268 1 11 . 1 1 409 409 ASP H H 409 8.140 8.140 8.471 -0.331 17732 2269 1 11 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.653 -0.153 17732 2270 1 11 . 1 1 410 410 ASP CA C 410 53.200 53.200 54.590 -1.389 17732 2271 1 11 . 1 1 410 410 ASP H H 410 8.570 8.570 8.674 -0.104 17732 2272 1 11 . 1 1 411 411 GLY N N 411 108.400 108.400 106.598 1.802 17732 2273 1 11 . 1 1 411 411 GLY CA C 411 45.300 45.300 44.922 0.377 17732 2274 1 11 . 1 1 411 411 GLY H H 411 8.520 8.520 8.258 0.262 17732 2275 1 11 . 1 1 412 412 TYR N N 412 118.600 118.600 120.844 -2.244 17732 2276 1 11 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.616 -0.266 17732 2277 1 11 . 1 1 412 412 TYR CA C 412 58.000 58.000 56.214 1.786 17732 2278 1 11 . 1 1 412 412 TYR H H 412 8.160 8.160 7.975 0.185 17732 2279 1 11 . 1 1 413 413 ARG N N 413 121.100 121.100 121.167 -0.067 17732 2280 1 11 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.489 0.291 17732 2281 1 11 . 1 1 413 413 ARG CA C 413 55.100 55.100 56.235 -1.135 17732 2282 1 11 . 1 1 413 413 ARG H H 413 8.750 8.750 8.540 0.210 17732 2283 1 11 . 1 1 414 414 TRP N N 414 120.600 120.600 123.284 -2.684 17732 2284 1 11 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.430 0.150 17732 2285 1 11 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.203 -0.103 17732 2286 1 11 . 1 1 414 414 TRP H H 414 8.250 8.250 8.650 -0.400 17732 2287 1 11 . 1 1 415 415 ARG N N 415 122.900 122.900 123.456 -0.556 17732 2288 1 11 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.828 0.452 17732 2289 1 11 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.504 0.096 17732 2290 1 11 . 1 1 415 415 ARG H H 415 9.450 9.450 9.124 0.326 17732 2291 1 11 . 1 1 416 416 LYS N N 416 134.700 134.700 128.277 6.423 17732 2292 1 11 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.599 0.761 17732 2293 1 11 . 1 1 416 416 LYS CA C 416 57.000 57.000 57.112 -0.112 17732 2294 1 11 . 1 1 416 416 LYS H H 416 11.120 11.120 8.737 2.383 17732 2295 1 11 . 1 1 417 417 TYR N N 417 118.600 118.600 118.300 0.300 17732 2296 1 11 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.414 0.846 17732 2297 1 11 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.401 -1.401 17732 2298 1 11 . 1 1 417 417 TYR H H 417 8.900 8.900 7.589 1.311 17732 2299 1 11 . 1 1 418 418 GLY N N 418 105.300 105.300 110.820 -5.520 17732 2300 1 11 . 1 1 418 418 GLY CA C 418 45.900 45.900 45.129 0.771 17732 2301 1 11 . 1 1 418 418 GLY H H 418 6.990 6.990 8.624 -1.634 17732 2302 1 11 . 1 1 419 419 GLN N N 419 122.600 122.600 122.203 0.397 17732 2303 1 11 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.437 1.043 17732 2304 1 11 . 1 1 419 419 GLN CA C 419 56.600 56.600 55.519 1.081 17732 2305 1 11 . 1 1 419 419 GLN H H 419 9.000 9.000 8.318 0.682 17732 2306 1 11 . 1 1 420 420 LYS N N 420 123.000 123.000 127.055 -4.055 17732 2307 1 11 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.518 0.382 17732 2308 1 11 . 1 1 420 420 LYS CA C 420 52.800 52.800 55.044 -2.244 17732 2309 1 11 . 1 1 420 420 LYS H H 420 9.140 9.140 8.132 1.008 17732 2310 1 11 . 1 1 421 421 VAL N N 421 122.800 122.800 122.485 0.315 17732 2311 1 11 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.452 -0.172 17732 2312 1 11 . 1 1 421 421 VAL CA C 421 63.100 63.100 60.006 3.094 17732 2313 1 11 . 1 1 421 421 VAL H H 421 8.550 8.550 8.339 0.211 17732 2314 1 11 . 1 1 422 422 VAL N N 422 128.600 128.600 122.826 5.774 17732 2315 1 11 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.630 -0.060 17732 2316 1 11 . 1 1 422 422 VAL CA C 422 60.200 60.200 60.004 0.196 17732 2317 1 11 . 1 1 422 422 VAL H H 422 9.500 9.500 8.297 1.203 17732 2318 1 11 . 1 1 423 423 LYS N N 423 123.800 123.800 126.627 -2.827 17732 2319 1 11 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.264 -0.324 17732 2320 1 11 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.231 2.068 17732 2321 1 11 . 1 1 423 423 LYS H H 423 8.880 8.880 8.579 0.301 17732 2322 1 11 . 1 1 424 424 GLY N N 424 110.800 110.800 107.297 3.503 17732 2323 1 11 . 1 1 424 424 GLY CA C 424 45.300 45.300 45.928 -0.628 17732 2324 1 11 . 1 1 424 424 GLY H H 424 8.600 8.600 8.692 -0.092 17732 2325 1 11 . 1 1 425 425 ASN N N 425 119.800 119.800 116.748 3.052 17732 2326 1 11 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.087 0.053 17732 2327 1 11 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.853 -1.753 17732 2328 1 11 . 1 1 425 425 ASN H H 425 7.600 7.600 7.870 -0.270 17732 2329 1 11 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.186 0.114 17732 2330 1 11 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.265 -0.865 17732 2331 1 11 . 1 1 427 427 TYR N N 427 121.100 121.100 119.914 1.186 17732 2332 1 11 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.627 0.263 17732 2333 1 11 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.474 -0.374 17732 2334 1 11 . 1 1 427 427 TYR H H 427 8.120 8.120 7.931 0.189 17732 2335 1 11 . 1 1 428 428 PRO HA H 428 4.420 4.420 5.167 -0.747 17732 2336 1 11 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.276 1.024 17732 2337 1 11 . 1 1 429 429 ARG N N 429 124.900 124.900 123.427 1.473 17732 2338 1 11 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.387 0.293 17732 2339 1 11 . 1 1 429 429 ARG CA C 429 55.000 55.000 56.114 -1.114 17732 2340 1 11 . 1 1 429 429 ARG H H 429 9.280 9.280 9.019 0.261 17732 2341 1 11 . 1 1 430 430 SER N N 430 122.200 122.200 115.922 6.278 17732 2342 1 11 . 1 1 430 430 SER HA H 430 4.960 4.960 4.654 0.306 17732 2343 1 11 . 1 1 430 430 SER CA C 430 59.300 59.300 57.817 1.483 17732 2344 1 11 . 1 1 430 430 SER H H 430 9.100 9.100 8.238 0.862 17732 2345 1 11 . 1 1 431 431 TYR N N 431 122.100 122.100 126.136 -4.036 17732 2346 1 11 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.762 -0.102 17732 2347 1 11 . 1 1 431 431 TYR CA C 431 57.400 57.400 58.152 -0.752 17732 2348 1 11 . 1 1 431 431 TYR H H 431 7.590 7.590 7.719 -0.129 17732 2349 1 11 . 1 1 432 432 TYR N N 432 120.300 120.300 124.672 -4.372 17732 2350 1 11 . 1 1 432 432 TYR HA H 432 5.720 5.720 5.021 0.699 17732 2351 1 11 . 1 1 432 432 TYR CA C 432 57.100 57.100 57.894 -0.794 17732 2352 1 11 . 1 1 432 432 TYR H H 432 9.370 9.370 8.698 0.672 17732 2353 1 11 . 1 1 433 433 LYS N N 433 121.500 121.500 123.656 -2.156 17732 2354 1 11 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.374 0.456 17732 2355 1 11 . 1 1 433 433 LYS CA C 433 54.200 54.200 55.022 -0.822 17732 2356 1 11 . 1 1 433 433 LYS H H 433 9.960 9.960 9.090 0.870 17732 2357 1 11 . 1 1 434 434 CYS N N 434 128.700 128.700 126.360 2.340 17732 2358 1 11 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.418 -1.218 17732 2359 1 11 . 1 1 434 434 CYS CA C 434 60.300 60.300 56.318 3.982 17732 2360 1 11 . 1 1 434 434 CYS H H 434 8.440 8.440 9.480 -1.040 17732 2361 1 11 . 1 1 435 435 THR N N 435 118.000 118.000 120.360 -2.360 17732 2362 1 11 . 1 1 435 435 THR HA H 435 4.270 4.270 5.040 -0.770 17732 2363 1 11 . 1 1 435 435 THR CA C 435 62.800 62.800 61.056 1.744 17732 2364 1 11 . 1 1 435 435 THR H H 435 8.200 8.200 8.119 0.081 17732 2365 1 11 . 1 1 436 436 THR N N 436 127.500 127.500 113.104 14.396 17732 2366 1 11 . 1 1 436 436 THR HA H 436 4.230 4.230 4.424 -0.194 17732 2367 1 11 . 1 1 436 436 THR CA C 436 63.300 63.300 60.822 2.478 17732 2368 1 11 . 1 1 436 436 THR H H 436 8.880 8.880 7.996 0.884 17732 2369 1 11 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.186 0.084 17732 2370 1 11 . 1 1 438 438 GLY N N 438 112.800 112.800 110.175 2.625 17732 2371 1 11 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.549 0.851 17732 2372 1 11 . 1 1 438 438 GLY H H 438 8.870 8.870 8.593 0.277 17732 2373 1 11 . 1 1 439 439 CYS N N 439 123.900 123.900 119.356 4.544 17732 2374 1 11 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.885 -0.285 17732 2375 1 11 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.412 2.288 17732 2376 1 11 . 1 1 439 439 CYS H H 439 7.870 7.870 8.342 -0.472 17732 2377 1 11 . 1 1 440 440 GLY N N 440 113.300 113.300 114.140 -0.840 17732 2378 1 11 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.482 -0.082 17732 2379 1 11 . 1 1 440 440 GLY H H 440 9.070 9.070 8.391 0.679 17732 2380 1 11 . 1 1 441 441 VAL N N 441 123.400 123.400 123.722 -0.322 17732 2381 1 11 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.459 -0.349 17732 2382 1 11 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.913 4.587 17732 2383 1 11 . 1 1 441 441 VAL H H 441 8.230 8.230 7.721 0.509 17732 2384 1 11 . 1 1 442 442 ARG N N 442 126.100 126.100 122.741 3.359 17732 2385 1 11 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.744 -0.094 17732 2386 1 11 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.577 -0.277 17732 2387 1 11 . 1 1 442 442 ARG H H 442 8.340 8.340 8.439 -0.099 17732 2388 1 11 . 1 1 443 443 LYS N N 443 120.700 120.700 121.116 -0.416 17732 2389 1 11 . 1 1 443 443 LYS HA H 443 5.110 5.110 4.984 0.126 17732 2390 1 11 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.616 -0.616 17732 2391 1 11 . 1 1 443 443 LYS H H 443 9.340 9.340 9.104 0.236 17732 2392 1 11 . 1 1 444 444 HIS N N 444 122.000 122.000 120.332 1.668 17732 2393 1 11 . 1 1 444 444 HIS HA H 444 5.700 5.700 4.893 0.807 17732 2394 1 11 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.295 -3.295 17732 2395 1 11 . 1 1 444 444 HIS H H 444 8.860 8.860 8.445 0.415 17732 2396 1 11 . 1 1 445 445 VAL N N 445 121.200 121.200 122.746 -1.546 17732 2397 1 11 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.121 -0.311 17732 2398 1 11 . 1 1 445 445 VAL CA C 445 61.600 61.600 61.274 0.326 17732 2399 1 11 . 1 1 445 445 VAL H H 445 8.560 8.560 7.955 0.605 17732 2400 1 11 . 1 1 446 446 GLU N N 446 125.100 125.100 124.865 0.235 17732 2401 1 11 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.781 0.129 17732 2402 1 11 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.057 0.343 17732 2403 1 11 . 1 1 446 446 GLU H H 446 8.680 8.680 8.001 0.679 17732 2404 1 11 . 1 1 447 447 ARG N N 447 122.400 122.400 120.040 2.360 17732 2405 1 11 . 1 1 447 447 ARG HA H 447 4.690 4.690 5.059 -0.369 17732 2406 1 11 . 1 1 447 447 ARG CA C 447 55.400 55.400 54.816 0.584 17732 2407 1 11 . 1 1 447 447 ARG H H 447 8.660 8.660 8.505 0.155 17732 2408 1 11 . 1 1 448 448 ALA N N 448 125.000 125.000 124.069 0.931 17732 2409 1 11 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.377 -0.157 17732 2410 1 11 . 1 1 448 448 ALA CA C 448 52.300 52.300 50.974 1.326 17732 2411 1 11 . 1 1 448 448 ALA H H 448 8.100 8.100 8.223 -0.123 17732 2412 1 11 . 1 1 449 449 ALA N N 449 123.700 123.700 125.955 -2.255 17732 2413 1 11 . 1 1 449 449 ALA HA H 449 4.220 4.220 4.042 0.178 17732 2414 1 11 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.081 1.119 17732 2415 1 11 . 1 1 449 449 ALA H H 449 8.550 8.550 8.646 -0.096 17732 2416 1 11 . 1 1 450 450 THR N N 450 102.500 102.500 105.415 -2.915 17732 2417 1 11 . 1 1 450 450 THR HA H 450 4.340 4.340 4.488 -0.148 17732 2418 1 11 . 1 1 450 450 THR CA C 450 61.300 61.300 61.084 0.216 17732 2419 1 11 . 1 1 450 450 THR H H 450 7.600 7.600 7.527 0.073 17732 2420 1 11 . 1 1 451 451 ASP N N 451 118.200 118.200 122.075 -3.875 17732 2421 1 11 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.826 0.084 17732 2422 1 11 . 1 1 451 451 ASP CA C 451 52.000 52.000 53.573 -1.573 17732 2423 1 11 . 1 1 451 451 ASP H H 451 7.060 7.060 7.904 -0.844 17732 2424 1 11 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.325 -0.025 17732 2425 1 11 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.400 -0.399 17732 2426 1 11 . 1 1 453 453 LYS N N 453 117.000 117.000 114.949 2.051 17732 2427 1 11 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.370 -0.210 17732 2428 1 11 . 1 1 453 453 LYS CA C 453 56.700 56.700 55.522 1.178 17732 2429 1 11 . 1 1 453 453 LYS H H 453 7.880 7.880 8.290 -0.410 17732 2430 1 11 . 1 1 454 454 ALA N N 454 124.700 124.700 124.007 0.693 17732 2431 1 11 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.498 0.072 17732 2432 1 11 . 1 1 454 454 ALA CA C 454 51.200 51.200 51.446 -0.246 17732 2433 1 11 . 1 1 454 454 ALA H H 454 8.060 8.060 7.741 0.319 17732 2434 1 11 . 1 1 455 455 VAL N N 455 119.700 119.700 123.720 -4.020 17732 2435 1 11 . 1 1 455 455 VAL HA H 455 4.370 4.370 5.172 -0.802 17732 2436 1 11 . 1 1 455 455 VAL CA C 455 61.400 61.400 60.658 0.742 17732 2437 1 11 . 1 1 455 455 VAL H H 455 8.190 8.190 8.270 -0.080 17732 2438 1 11 . 1 1 456 456 VAL N N 456 129.400 129.400 122.283 7.117 17732 2439 1 11 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.641 -0.331 17732 2440 1 11 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.368 1.532 17732 2441 1 11 . 1 1 456 456 VAL H H 456 9.220 9.220 8.790 0.430 17732 2442 1 11 . 1 1 457 457 THR N N 457 125.000 125.000 121.434 3.566 17732 2443 1 11 . 1 1 457 457 THR HA H 457 5.160 5.160 5.417 -0.257 17732 2444 1 11 . 1 1 457 457 THR CA C 457 61.100 61.100 60.938 0.162 17732 2445 1 11 . 1 1 457 457 THR H H 457 8.560 8.560 8.228 0.332 17732 2446 1 11 . 1 1 458 458 THR N N 458 120.600 120.600 122.700 -2.100 17732 2447 1 11 . 1 1 458 458 THR HA H 458 4.550 4.550 4.715 -0.165 17732 2448 1 11 . 1 1 458 458 THR CA C 458 60.600 60.600 61.437 -0.837 17732 2449 1 11 . 1 1 458 458 THR H H 458 8.560 8.560 8.296 0.264 17732 2450 1 11 . 1 1 459 459 TYR N N 459 122.500 122.500 125.568 -3.068 17732 2451 1 11 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.654 0.286 17732 2452 1 11 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.717 0.083 17732 2453 1 11 . 1 1 459 459 TYR H H 459 8.870 8.870 8.904 -0.034 17732 2454 1 11 . 1 1 460 460 GLU N N 460 123.200 123.200 125.322 -2.122 17732 2455 1 11 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.664 -0.034 17732 2456 1 11 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.313 0.287 17732 2457 1 11 . 1 1 460 460 GLU H H 460 9.150 9.150 8.652 0.498 17732 2458 1 11 . 1 1 461 461 GLY N N 461 112.700 112.700 112.368 0.332 17732 2459 1 11 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.435 -0.535 17732 2460 1 11 . 1 1 461 461 GLY H H 461 8.330 8.330 8.202 0.128 17732 2461 1 11 . 1 1 462 462 LYS N N 462 118.300 118.300 122.110 -3.810 17732 2462 1 11 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.268 0.222 17732 2463 1 11 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.123 -1.123 17732 2464 1 11 . 1 1 462 462 LYS H H 462 8.050 8.050 8.306 -0.256 17732 2465 1 11 . 1 1 463 463 HIS N N 463 123.900 123.900 117.864 6.036 17732 2466 1 11 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.481 0.119 17732 2467 1 11 . 1 1 463 463 HIS CA C 463 57.200 57.200 55.865 1.335 17732 2468 1 11 . 1 1 463 463 HIS H H 463 8.470 8.470 8.249 0.221 17732 2469 1 11 . 1 1 464 464 ASN N N 464 124.400 124.400 121.758 2.642 17732 2470 1 11 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.658 0.292 17732 2471 1 11 . 1 1 464 464 ASN CA C 464 51.500 51.500 54.337 -2.837 17732 2472 1 11 . 1 1 464 464 ASN H H 464 8.360 8.360 8.808 -0.448 17732 2473 1 11 . 1 1 465 465 HIS N N 465 112.100 112.100 115.422 -3.322 17732 2474 1 11 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.605 0.265 17732 2475 1 11 . 1 1 465 465 HIS CA C 465 52.900 52.900 56.247 -3.347 17732 2476 1 11 . 1 1 465 465 HIS H H 465 6.830 6.830 7.331 -0.501 17732 2477 1 11 . 1 1 466 466 ASP N N 466 120.300 120.300 118.431 1.869 17732 2478 1 11 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.595 0.025 17732 2479 1 11 . 1 1 466 466 ASP CA C 466 54.000 54.000 54.647 -0.646 17732 2480 1 11 . 1 1 466 466 ASP H H 466 8.780 8.780 8.430 0.350 17732 2481 1 11 . 1 1 467 467 LEU N N 467 124.200 124.200 121.051 3.149 17732 2482 1 11 . 1 1 467 467 LEU HA H 467 4.040 4.040 5.037 -0.997 17732 2483 1 11 . 1 1 467 467 LEU CA C 467 54.100 54.100 54.134 -0.034 17732 2484 1 11 . 1 1 467 467 LEU H H 467 8.530 8.530 8.321 0.209 17732 2485 1 11 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.581 -0.231 17732 2486 1 11 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.644 0.656 17732 2487 1 12 . 1 1 408 408 LEU N N 408 122.600 122.600 121.347 1.253 17732 2488 1 12 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.589 -0.329 17732 2489 1 12 . 1 1 408 408 LEU CA C 408 55.000 55.000 55.664 -0.664 17732 2490 1 12 . 1 1 408 408 LEU H H 408 8.090 8.090 7.647 0.443 17732 2491 1 12 . 1 1 409 409 ASP N N 409 122.500 122.500 120.096 2.404 17732 2492 1 12 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.906 -0.266 17732 2493 1 12 . 1 1 409 409 ASP CA C 409 55.100 55.100 54.714 0.386 17732 2494 1 12 . 1 1 409 409 ASP H H 409 8.140 8.140 8.515 -0.375 17732 2495 1 12 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.785 -0.285 17732 2496 1 12 . 1 1 410 410 ASP CA C 410 53.200 53.200 54.344 -1.144 17732 2497 1 12 . 1 1 410 410 ASP H H 410 8.570 8.570 8.434 0.136 17732 2498 1 12 . 1 1 411 411 GLY N N 411 108.400 108.400 106.626 1.774 17732 2499 1 12 . 1 1 411 411 GLY CA C 411 45.300 45.300 45.790 -0.490 17732 2500 1 12 . 1 1 411 411 GLY H H 411 8.520 8.520 7.959 0.561 17732 2501 1 12 . 1 1 412 412 TYR N N 412 118.600 118.600 118.685 -0.085 17732 2502 1 12 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.723 -0.373 17732 2503 1 12 . 1 1 412 412 TYR CA C 412 58.000 58.000 56.186 1.814 17732 2504 1 12 . 1 1 412 412 TYR H H 412 8.160 8.160 7.900 0.260 17732 2505 1 12 . 1 1 413 413 ARG N N 413 121.100 121.100 119.542 1.558 17732 2506 1 12 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.655 0.125 17732 2507 1 12 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.393 -0.293 17732 2508 1 12 . 1 1 413 413 ARG H H 413 8.750 8.750 8.422 0.328 17732 2509 1 12 . 1 1 414 414 TRP N N 414 120.600 120.600 123.271 -2.671 17732 2510 1 12 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.093 0.487 17732 2511 1 12 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.317 -0.217 17732 2512 1 12 . 1 1 414 414 TRP H H 414 8.250 8.250 8.689 -0.439 17732 2513 1 12 . 1 1 415 415 ARG N N 415 122.900 122.900 123.830 -0.930 17732 2514 1 12 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.878 0.402 17732 2515 1 12 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.326 0.274 17732 2516 1 12 . 1 1 415 415 ARG H H 415 9.450 9.450 8.591 0.859 17732 2517 1 12 . 1 1 416 416 LYS N N 416 134.700 134.700 128.078 6.622 17732 2518 1 12 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.639 0.721 17732 2519 1 12 . 1 1 416 416 LYS CA C 416 57.000 57.000 57.663 -0.663 17732 2520 1 12 . 1 1 416 416 LYS H H 416 11.120 11.120 9.026 2.094 17732 2521 1 12 . 1 1 417 417 TYR N N 417 118.600 118.600 121.598 -2.998 17732 2522 1 12 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.448 0.812 17732 2523 1 12 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.552 -1.552 17732 2524 1 12 . 1 1 417 417 TYR H H 417 8.900 8.900 7.787 1.113 17732 2525 1 12 . 1 1 418 418 GLY N N 418 105.300 105.300 111.764 -6.464 17732 2526 1 12 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.802 1.098 17732 2527 1 12 . 1 1 418 418 GLY H H 418 6.990 6.990 8.627 -1.637 17732 2528 1 12 . 1 1 419 419 GLN N N 419 122.600 122.600 120.786 1.814 17732 2529 1 12 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.249 1.231 17732 2530 1 12 . 1 1 419 419 GLN CA C 419 56.600 56.600 56.110 0.490 17732 2531 1 12 . 1 1 419 419 GLN H H 419 9.000 9.000 8.302 0.698 17732 2532 1 12 . 1 1 420 420 LYS N N 420 123.000 123.000 126.622 -3.622 17732 2533 1 12 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.747 0.153 17732 2534 1 12 . 1 1 420 420 LYS CA C 420 52.800 52.800 54.627 -1.827 17732 2535 1 12 . 1 1 420 420 LYS H H 420 9.140 9.140 8.336 0.804 17732 2536 1 12 . 1 1 421 421 VAL N N 421 122.800 122.800 120.541 2.259 17732 2537 1 12 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.522 -0.242 17732 2538 1 12 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.851 3.249 17732 2539 1 12 . 1 1 421 421 VAL H H 421 8.550 8.550 8.323 0.227 17732 2540 1 12 . 1 1 422 422 VAL N N 422 128.600 128.600 121.535 7.065 17732 2541 1 12 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.613 -0.043 17732 2542 1 12 . 1 1 422 422 VAL CA C 422 60.200 60.200 59.847 0.353 17732 2543 1 12 . 1 1 422 422 VAL H H 422 9.500 9.500 8.388 1.112 17732 2544 1 12 . 1 1 423 423 LYS N N 423 123.800 123.800 126.328 -2.528 17732 2545 1 12 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.236 -0.296 17732 2546 1 12 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.370 1.930 17732 2547 1 12 . 1 1 423 423 LYS H H 423 8.880 8.880 8.720 0.160 17732 2548 1 12 . 1 1 424 424 GLY N N 424 110.800 110.800 107.070 3.730 17732 2549 1 12 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.229 -0.929 17732 2550 1 12 . 1 1 424 424 GLY H H 424 8.600 8.600 8.669 -0.069 17732 2551 1 12 . 1 1 425 425 ASN N N 425 119.800 119.800 116.997 2.803 17732 2552 1 12 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.063 0.077 17732 2553 1 12 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.713 -1.613 17732 2554 1 12 . 1 1 425 425 ASN H H 425 7.600 7.600 7.857 -0.257 17732 2555 1 12 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.202 0.098 17732 2556 1 12 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.214 -0.814 17732 2557 1 12 . 1 1 427 427 TYR N N 427 121.100 121.100 120.426 0.674 17732 2558 1 12 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.625 0.265 17732 2559 1 12 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.431 -0.331 17732 2560 1 12 . 1 1 427 427 TYR H H 427 8.120 8.120 7.893 0.227 17732 2561 1 12 . 1 1 428 428 PRO HA H 428 4.420 4.420 4.827 -0.407 17732 2562 1 12 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.511 0.789 17732 2563 1 12 . 1 1 429 429 ARG N N 429 124.900 124.900 124.491 0.409 17732 2564 1 12 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.329 0.351 17732 2565 1 12 . 1 1 429 429 ARG CA C 429 55.000 55.000 56.024 -1.024 17732 2566 1 12 . 1 1 429 429 ARG H H 429 9.280 9.280 8.866 0.414 17732 2567 1 12 . 1 1 430 430 SER N N 430 122.200 122.200 117.821 4.379 17732 2568 1 12 . 1 1 430 430 SER HA H 430 4.960 4.960 4.812 0.148 17732 2569 1 12 . 1 1 430 430 SER CA C 430 59.300 59.300 57.397 1.903 17732 2570 1 12 . 1 1 430 430 SER H H 430 9.100 9.100 7.991 1.109 17732 2571 1 12 . 1 1 431 431 TYR N N 431 122.100 122.100 122.630 -0.530 17732 2572 1 12 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.797 -0.137 17732 2573 1 12 . 1 1 431 431 TYR CA C 431 57.400 57.400 56.705 0.696 17732 2574 1 12 . 1 1 431 431 TYR H H 431 7.590 7.590 8.044 -0.454 17732 2575 1 12 . 1 1 432 432 TYR N N 432 120.300 120.300 124.248 -3.948 17732 2576 1 12 . 1 1 432 432 TYR HA H 432 5.720 5.720 4.905 0.815 17732 2577 1 12 . 1 1 432 432 TYR CA C 432 57.100 57.100 58.165 -1.065 17732 2578 1 12 . 1 1 432 432 TYR H H 432 9.370 9.370 8.772 0.598 17732 2579 1 12 . 1 1 433 433 LYS N N 433 121.500 121.500 125.674 -4.174 17732 2580 1 12 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.236 0.594 17732 2581 1 12 . 1 1 433 433 LYS CA C 433 54.200 54.200 55.198 -0.998 17732 2582 1 12 . 1 1 433 433 LYS H H 433 9.960 9.960 8.650 1.310 17732 2583 1 12 . 1 1 434 434 CYS N N 434 128.700 128.700 127.470 1.230 17732 2584 1 12 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.157 -0.957 17732 2585 1 12 . 1 1 434 434 CYS CA C 434 60.300 60.300 58.024 2.276 17732 2586 1 12 . 1 1 434 434 CYS H H 434 8.440 8.440 9.393 -0.953 17732 2587 1 12 . 1 1 435 435 THR N N 435 118.000 118.000 122.852 -4.852 17732 2588 1 12 . 1 1 435 435 THR HA H 435 4.270 4.270 4.918 -0.647 17732 2589 1 12 . 1 1 435 435 THR CA C 435 62.800 62.800 60.895 1.905 17732 2590 1 12 . 1 1 435 435 THR H H 435 8.200 8.200 8.027 0.173 17732 2591 1 12 . 1 1 436 436 THR N N 436 127.500 127.500 118.716 8.784 17732 2592 1 12 . 1 1 436 436 THR HA H 436 4.230 4.230 4.518 -0.288 17732 2593 1 12 . 1 1 436 436 THR CA C 436 63.300 63.300 61.089 2.211 17732 2594 1 12 . 1 1 436 436 THR H H 436 8.880 8.880 8.021 0.859 17732 2595 1 12 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.195 0.075 17732 2596 1 12 . 1 1 438 438 GLY N N 438 112.800 112.800 109.235 3.565 17732 2597 1 12 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.703 0.697 17732 2598 1 12 . 1 1 438 438 GLY H H 438 8.870 8.870 8.241 0.629 17732 2599 1 12 . 1 1 439 439 CYS N N 439 123.900 123.900 119.668 4.232 17732 2600 1 12 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.882 -0.282 17732 2601 1 12 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.242 2.458 17732 2602 1 12 . 1 1 439 439 CYS H H 439 7.870 7.870 8.377 -0.507 17732 2603 1 12 . 1 1 440 440 GLY N N 440 113.300 113.300 113.281 0.019 17732 2604 1 12 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.265 0.135 17732 2605 1 12 . 1 1 440 440 GLY H H 440 9.070 9.070 8.363 0.707 17732 2606 1 12 . 1 1 441 441 VAL N N 441 123.400 123.400 123.367 0.033 17732 2607 1 12 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.380 -0.270 17732 2608 1 12 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.960 4.540 17732 2609 1 12 . 1 1 441 441 VAL H H 441 8.230 8.230 7.674 0.556 17732 2610 1 12 . 1 1 442 442 ARG N N 442 126.100 126.100 122.787 3.313 17732 2611 1 12 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.413 0.237 17732 2612 1 12 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.862 -0.562 17732 2613 1 12 . 1 1 442 442 ARG H H 442 8.340 8.340 8.374 -0.034 17732 2614 1 12 . 1 1 443 443 LYS N N 443 120.700 120.700 121.784 -1.084 17732 2615 1 12 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.046 0.064 17732 2616 1 12 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.957 -0.957 17732 2617 1 12 . 1 1 443 443 LYS H H 443 9.340 9.340 9.109 0.231 17732 2618 1 12 . 1 1 444 444 HIS N N 444 122.000 122.000 122.665 -0.665 17732 2619 1 12 . 1 1 444 444 HIS HA H 444 5.700 5.700 4.890 0.810 17732 2620 1 12 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.165 -3.165 17732 2621 1 12 . 1 1 444 444 HIS H H 444 8.860 8.860 8.527 0.333 17732 2622 1 12 . 1 1 445 445 VAL N N 445 121.200 121.200 122.650 -1.450 17732 2623 1 12 . 1 1 445 445 VAL HA H 445 4.810 4.810 4.902 -0.092 17732 2624 1 12 . 1 1 445 445 VAL CA C 445 61.600 61.600 60.642 0.958 17732 2625 1 12 . 1 1 445 445 VAL H H 445 8.560 8.560 7.879 0.681 17732 2626 1 12 . 1 1 446 446 GLU N N 446 125.100 125.100 125.493 -0.393 17732 2627 1 12 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.632 0.278 17732 2628 1 12 . 1 1 446 446 GLU CA C 446 54.400 54.400 53.804 0.596 17732 2629 1 12 . 1 1 446 446 GLU H H 446 8.680 8.680 8.760 -0.080 17732 2630 1 12 . 1 1 447 447 ARG N N 447 122.400 122.400 121.114 1.286 17732 2631 1 12 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.418 0.272 17732 2632 1 12 . 1 1 447 447 ARG CA C 447 55.400 55.400 55.031 0.369 17732 2633 1 12 . 1 1 447 447 ARG H H 447 8.660 8.660 8.489 0.171 17732 2634 1 12 . 1 1 448 448 ALA N N 448 125.000 125.000 124.318 0.682 17732 2635 1 12 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.407 -0.187 17732 2636 1 12 . 1 1 448 448 ALA CA C 448 52.300 52.300 50.433 1.867 17732 2637 1 12 . 1 1 448 448 ALA H H 448 8.100 8.100 7.744 0.356 17732 2638 1 12 . 1 1 449 449 ALA N N 449 123.700 123.700 127.394 -3.694 17732 2639 1 12 . 1 1 449 449 ALA HA H 449 4.220 4.220 3.913 0.307 17732 2640 1 12 . 1 1 449 449 ALA CA C 449 55.200 55.200 55.162 0.038 17732 2641 1 12 . 1 1 449 449 ALA H H 449 8.550 8.550 8.721 -0.171 17732 2642 1 12 . 1 1 450 450 THR N N 450 102.500 102.500 107.308 -4.808 17732 2643 1 12 . 1 1 450 450 THR HA H 450 4.340 4.340 4.226 0.114 17732 2644 1 12 . 1 1 450 450 THR CA C 450 61.300 61.300 63.490 -2.190 17732 2645 1 12 . 1 1 450 450 THR H H 450 7.600 7.600 7.829 -0.229 17732 2646 1 12 . 1 1 451 451 ASP N N 451 118.200 118.200 121.919 -3.719 17732 2647 1 12 . 1 1 451 451 ASP HA H 451 4.910 4.910 5.015 -0.105 17732 2648 1 12 . 1 1 451 451 ASP CA C 451 52.000 52.000 51.293 0.707 17732 2649 1 12 . 1 1 451 451 ASP H H 451 7.060 7.060 7.966 -0.906 17732 2650 1 12 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.508 -0.208 17732 2651 1 12 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.276 -0.276 17732 2652 1 12 . 1 1 453 453 LYS N N 453 117.000 117.000 117.610 -0.610 17732 2653 1 12 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.300 -0.140 17732 2654 1 12 . 1 1 453 453 LYS CA C 453 56.700 56.700 56.582 0.118 17732 2655 1 12 . 1 1 453 453 LYS H H 453 7.880 7.880 8.396 -0.516 17732 2656 1 12 . 1 1 454 454 ALA N N 454 124.700 124.700 122.125 2.575 17732 2657 1 12 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.159 0.411 17732 2658 1 12 . 1 1 454 454 ALA CA C 454 51.200 51.200 52.692 -1.492 17732 2659 1 12 . 1 1 454 454 ALA H H 454 8.060 8.060 7.938 0.122 17732 2660 1 12 . 1 1 455 455 VAL N N 455 119.700 119.700 115.667 4.033 17732 2661 1 12 . 1 1 455 455 VAL HA H 455 4.370 4.370 3.903 0.467 17732 2662 1 12 . 1 1 455 455 VAL CA C 455 61.400 61.400 62.987 -1.587 17732 2663 1 12 . 1 1 455 455 VAL H H 455 8.190 8.190 7.741 0.449 17732 2664 1 12 . 1 1 456 456 VAL N N 456 129.400 129.400 121.214 8.186 17732 2665 1 12 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.543 -0.233 17732 2666 1 12 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.677 1.223 17732 2667 1 12 . 1 1 456 456 VAL H H 456 9.220 9.220 8.873 0.347 17732 2668 1 12 . 1 1 457 457 THR N N 457 125.000 125.000 122.069 2.931 17732 2669 1 12 . 1 1 457 457 THR HA H 457 5.160 5.160 5.359 -0.199 17732 2670 1 12 . 1 1 457 457 THR CA C 457 61.100 61.100 60.911 0.189 17732 2671 1 12 . 1 1 457 457 THR H H 457 8.560 8.560 8.434 0.126 17732 2672 1 12 . 1 1 458 458 THR N N 458 120.600 120.600 123.110 -2.510 17732 2673 1 12 . 1 1 458 458 THR HA H 458 4.550 4.550 4.752 -0.202 17732 2674 1 12 . 1 1 458 458 THR CA C 458 60.600 60.600 61.683 -1.083 17732 2675 1 12 . 1 1 458 458 THR H H 458 8.560 8.560 8.367 0.193 17732 2676 1 12 . 1 1 459 459 TYR N N 459 122.500 122.500 126.572 -4.072 17732 2677 1 12 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.852 0.088 17732 2678 1 12 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.851 -0.051 17732 2679 1 12 . 1 1 459 459 TYR H H 459 8.870 8.870 9.010 -0.140 17732 2680 1 12 . 1 1 460 460 GLU N N 460 123.200 123.200 125.503 -2.303 17732 2681 1 12 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.714 -0.084 17732 2682 1 12 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.936 -0.336 17732 2683 1 12 . 1 1 460 460 GLU H H 460 9.150 9.150 8.529 0.621 17732 2684 1 12 . 1 1 461 461 GLY N N 461 112.700 112.700 112.260 0.440 17732 2685 1 12 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.513 -0.613 17732 2686 1 12 . 1 1 461 461 GLY H H 461 8.330 8.330 8.393 -0.063 17732 2687 1 12 . 1 1 462 462 LYS N N 462 118.300 118.300 122.689 -4.389 17732 2688 1 12 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.241 0.249 17732 2689 1 12 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.642 -1.642 17732 2690 1 12 . 1 1 462 462 LYS H H 462 8.050 8.050 8.254 -0.204 17732 2691 1 12 . 1 1 463 463 HIS N N 463 123.900 123.900 117.009 6.891 17732 2692 1 12 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.566 0.034 17732 2693 1 12 . 1 1 463 463 HIS CA C 463 57.200 57.200 55.400 1.800 17732 2694 1 12 . 1 1 463 463 HIS H H 463 8.470 8.470 8.223 0.247 17732 2695 1 12 . 1 1 464 464 ASN N N 464 124.400 124.400 120.058 4.342 17732 2696 1 12 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.822 0.128 17732 2697 1 12 . 1 1 464 464 ASN CA C 464 51.500 51.500 52.702 -1.202 17732 2698 1 12 . 1 1 464 464 ASN H H 464 8.360 8.360 8.234 0.126 17732 2699 1 12 . 1 1 465 465 HIS N N 465 112.100 112.100 115.287 -3.187 17732 2700 1 12 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.826 0.044 17732 2701 1 12 . 1 1 465 465 HIS CA C 465 52.900 52.900 53.995 -1.095 17732 2702 1 12 . 1 1 465 465 HIS H H 465 6.830 6.830 7.750 -0.920 17732 2703 1 12 . 1 1 466 466 ASP N N 466 120.300 120.300 119.629 0.671 17732 2704 1 12 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.366 0.254 17732 2705 1 12 . 1 1 466 466 ASP CA C 466 54.000 54.000 55.767 -1.767 17732 2706 1 12 . 1 1 466 466 ASP H H 466 8.780 8.780 8.173 0.607 17732 2707 1 12 . 1 1 467 467 LEU N N 467 124.200 124.200 122.161 2.039 17732 2708 1 12 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.609 -0.569 17732 2709 1 12 . 1 1 467 467 LEU CA C 467 54.100 54.100 52.670 1.430 17732 2710 1 12 . 1 1 467 467 LEU H H 467 8.530 8.530 8.272 0.258 17732 2711 1 12 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.363 -0.013 17732 2712 1 12 . 1 1 468 468 PRO CA C 468 63.300 63.300 63.965 -0.665 17732 2713 1 13 . 1 1 408 408 LEU N N 408 122.600 122.600 126.346 -3.746 17732 2714 1 13 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.523 -0.263 17732 2715 1 13 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.270 0.730 17732 2716 1 13 . 1 1 408 408 LEU H H 408 8.090 8.090 8.787 -0.697 17732 2717 1 13 . 1 1 409 409 ASP N N 409 122.500 122.500 120.477 2.023 17732 2718 1 13 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.350 0.290 17732 2719 1 13 . 1 1 409 409 ASP CA C 409 55.100 55.100 55.791 -0.691 17732 2720 1 13 . 1 1 409 409 ASP H H 409 8.140 8.140 8.163 -0.023 17732 2721 1 13 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.664 -0.164 17732 2722 1 13 . 1 1 410 410 ASP CA C 410 53.200 53.200 53.673 -0.473 17732 2723 1 13 . 1 1 410 410 ASP H H 410 8.570 8.570 8.234 0.336 17732 2724 1 13 . 1 1 411 411 GLY N N 411 108.400 108.400 108.477 -0.077 17732 2725 1 13 . 1 1 411 411 GLY CA C 411 45.300 45.300 45.161 0.139 17732 2726 1 13 . 1 1 411 411 GLY H H 411 8.520 8.520 7.959 0.561 17732 2727 1 13 . 1 1 412 412 TYR N N 412 118.600 118.600 118.217 0.383 17732 2728 1 13 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.765 -0.415 17732 2729 1 13 . 1 1 412 412 TYR CA C 412 58.000 58.000 56.276 1.724 17732 2730 1 13 . 1 1 412 412 TYR H H 412 8.160 8.160 7.925 0.235 17732 2731 1 13 . 1 1 413 413 ARG N N 413 121.100 121.100 121.867 -0.767 17732 2732 1 13 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.474 0.306 17732 2733 1 13 . 1 1 413 413 ARG CA C 413 55.100 55.100 56.361 -1.261 17732 2734 1 13 . 1 1 413 413 ARG H H 413 8.750 8.750 8.550 0.200 17732 2735 1 13 . 1 1 414 414 TRP N N 414 120.600 120.600 124.597 -3.997 17732 2736 1 13 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.565 0.015 17732 2737 1 13 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.164 -0.064 17732 2738 1 13 . 1 1 414 414 TRP H H 414 8.250 8.250 8.588 -0.338 17732 2739 1 13 . 1 1 415 415 ARG N N 415 122.900 122.900 125.004 -2.104 17732 2740 1 13 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.843 0.437 17732 2741 1 13 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.268 0.332 17732 2742 1 13 . 1 1 415 415 ARG H H 415 9.450 9.450 9.498 -0.048 17732 2743 1 13 . 1 1 416 416 LYS N N 416 134.700 134.700 129.265 5.435 17732 2744 1 13 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.665 0.695 17732 2745 1 13 . 1 1 416 416 LYS CA C 416 57.000 57.000 57.294 -0.294 17732 2746 1 13 . 1 1 416 416 LYS H H 416 11.120 11.120 8.943 2.177 17732 2747 1 13 . 1 1 417 417 TYR N N 417 118.600 118.600 121.384 -2.784 17732 2748 1 13 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.461 0.799 17732 2749 1 13 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.279 -1.280 17732 2750 1 13 . 1 1 417 417 TYR H H 417 8.900 8.900 7.580 1.320 17732 2751 1 13 . 1 1 418 418 GLY N N 418 105.300 105.300 110.778 -5.478 17732 2752 1 13 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.995 0.905 17732 2753 1 13 . 1 1 418 418 GLY H H 418 6.990 6.990 8.579 -1.589 17732 2754 1 13 . 1 1 419 419 GLN N N 419 122.600 122.600 121.749 0.851 17732 2755 1 13 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.216 1.264 17732 2756 1 13 . 1 1 419 419 GLN CA C 419 56.600 56.600 55.940 0.660 17732 2757 1 13 . 1 1 419 419 GLN H H 419 9.000 9.000 8.222 0.778 17732 2758 1 13 . 1 1 420 420 LYS N N 420 123.000 123.000 126.982 -3.982 17732 2759 1 13 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.686 0.214 17732 2760 1 13 . 1 1 420 420 LYS CA C 420 52.800 52.800 54.771 -1.971 17732 2761 1 13 . 1 1 420 420 LYS H H 420 9.140 9.140 8.315 0.825 17732 2762 1 13 . 1 1 421 421 VAL N N 421 122.800 122.800 120.460 2.340 17732 2763 1 13 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.380 -0.100 17732 2764 1 13 . 1 1 421 421 VAL CA C 421 63.100 63.100 60.172 2.928 17732 2765 1 13 . 1 1 421 421 VAL H H 421 8.550 8.550 8.293 0.257 17732 2766 1 13 . 1 1 422 422 VAL N N 422 128.600 128.600 123.757 4.843 17732 2767 1 13 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.623 -0.053 17732 2768 1 13 . 1 1 422 422 VAL CA C 422 60.200 60.200 60.313 -0.113 17732 2769 1 13 . 1 1 422 422 VAL H H 422 9.500 9.500 8.822 0.678 17732 2770 1 13 . 1 1 423 423 LYS N N 423 123.800 123.800 126.726 -2.926 17732 2771 1 13 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.304 -0.364 17732 2772 1 13 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.340 1.960 17732 2773 1 13 . 1 1 423 423 LYS H H 423 8.880 8.880 8.567 0.313 17732 2774 1 13 . 1 1 424 424 GLY N N 424 110.800 110.800 106.251 4.549 17732 2775 1 13 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.126 -0.826 17732 2776 1 13 . 1 1 424 424 GLY H H 424 8.600 8.600 8.659 -0.059 17732 2777 1 13 . 1 1 425 425 ASN N N 425 119.800 119.800 116.990 2.810 17732 2778 1 13 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.111 0.029 17732 2779 1 13 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.291 -1.191 17732 2780 1 13 . 1 1 425 425 ASN H H 425 7.600 7.600 7.796 -0.196 17732 2781 1 13 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.166 0.134 17732 2782 1 13 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.600 -1.200 17732 2783 1 13 . 1 1 427 427 TYR N N 427 121.100 121.100 117.994 3.106 17732 2784 1 13 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.689 0.201 17732 2785 1 13 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.215 -0.115 17732 2786 1 13 . 1 1 427 427 TYR H H 427 8.120 8.120 8.105 0.015 17732 2787 1 13 . 1 1 428 428 PRO HA H 428 4.420 4.420 4.936 -0.516 17732 2788 1 13 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.442 0.858 17732 2789 1 13 . 1 1 429 429 ARG N N 429 124.900 124.900 125.312 -0.412 17732 2790 1 13 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.415 0.265 17732 2791 1 13 . 1 1 429 429 ARG CA C 429 55.000 55.000 56.142 -1.142 17732 2792 1 13 . 1 1 429 429 ARG H H 429 9.280 9.280 8.924 0.356 17732 2793 1 13 . 1 1 430 430 SER N N 430 122.200 122.200 119.228 2.972 17732 2794 1 13 . 1 1 430 430 SER HA H 430 4.960 4.960 4.701 0.259 17732 2795 1 13 . 1 1 430 430 SER CA C 430 59.300 59.300 57.890 1.410 17732 2796 1 13 . 1 1 430 430 SER H H 430 9.100 9.100 8.262 0.838 17732 2797 1 13 . 1 1 431 431 TYR N N 431 122.100 122.100 125.322 -3.222 17732 2798 1 13 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.745 -0.085 17732 2799 1 13 . 1 1 431 431 TYR CA C 431 57.400 57.400 57.065 0.335 17732 2800 1 13 . 1 1 431 431 TYR H H 431 7.590 7.590 8.025 -0.435 17732 2801 1 13 . 1 1 432 432 TYR N N 432 120.300 120.300 124.250 -3.950 17732 2802 1 13 . 1 1 432 432 TYR HA H 432 5.720 5.720 4.728 0.992 17732 2803 1 13 . 1 1 432 432 TYR CA C 432 57.100 57.100 58.484 -1.384 17732 2804 1 13 . 1 1 432 432 TYR H H 432 9.370 9.370 8.179 1.191 17732 2805 1 13 . 1 1 433 433 LYS N N 433 121.500 121.500 124.354 -2.854 17732 2806 1 13 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.325 0.505 17732 2807 1 13 . 1 1 433 433 LYS CA C 433 54.200 54.200 55.251 -1.051 17732 2808 1 13 . 1 1 433 433 LYS H H 433 9.960 9.960 8.510 1.450 17732 2809 1 13 . 1 1 434 434 CYS N N 434 128.700 128.700 124.660 4.040 17732 2810 1 13 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.430 -1.230 17732 2811 1 13 . 1 1 434 434 CYS CA C 434 60.300 60.300 56.210 4.090 17732 2812 1 13 . 1 1 434 434 CYS H H 434 8.440 8.440 9.333 -0.893 17732 2813 1 13 . 1 1 435 435 THR N N 435 118.000 118.000 122.917 -4.917 17732 2814 1 13 . 1 1 435 435 THR HA H 435 4.270 4.270 5.018 -0.748 17732 2815 1 13 . 1 1 435 435 THR CA C 435 62.800 62.800 60.909 1.891 17732 2816 1 13 . 1 1 435 435 THR H H 435 8.200 8.200 8.110 0.090 17732 2817 1 13 . 1 1 436 436 THR N N 436 127.500 127.500 116.968 10.532 17732 2818 1 13 . 1 1 436 436 THR HA H 436 4.230 4.230 4.478 -0.248 17732 2819 1 13 . 1 1 436 436 THR CA C 436 63.300 63.300 60.455 2.845 17732 2820 1 13 . 1 1 436 436 THR H H 436 8.880 8.880 7.773 1.107 17732 2821 1 13 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.220 0.050 17732 2822 1 13 . 1 1 438 438 GLY N N 438 112.800 112.800 104.190 8.610 17732 2823 1 13 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.148 1.252 17732 2824 1 13 . 1 1 438 438 GLY H H 438 8.870 8.870 8.191 0.679 17732 2825 1 13 . 1 1 439 439 CYS N N 439 123.900 123.900 119.408 4.492 17732 2826 1 13 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.797 -0.197 17732 2827 1 13 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.745 1.955 17732 2828 1 13 . 1 1 439 439 CYS H H 439 7.870 7.870 7.829 0.041 17732 2829 1 13 . 1 1 440 440 GLY N N 440 113.300 113.300 112.990 0.310 17732 2830 1 13 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.366 0.034 17732 2831 1 13 . 1 1 440 440 GLY H H 440 9.070 9.070 8.380 0.690 17732 2832 1 13 . 1 1 441 441 VAL N N 441 123.400 123.400 123.052 0.348 17732 2833 1 13 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.491 -0.381 17732 2834 1 13 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.817 4.683 17732 2835 1 13 . 1 1 441 441 VAL H H 441 8.230 8.230 8.052 0.178 17732 2836 1 13 . 1 1 442 442 ARG N N 442 126.100 126.100 121.582 4.518 17732 2837 1 13 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.581 0.069 17732 2838 1 13 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.337 -0.037 17732 2839 1 13 . 1 1 442 442 ARG H H 442 8.340 8.340 8.393 -0.053 17732 2840 1 13 . 1 1 443 443 LYS N N 443 120.700 120.700 119.386 1.314 17732 2841 1 13 . 1 1 443 443 LYS HA H 443 5.110 5.110 4.857 0.253 17732 2842 1 13 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.860 -0.860 17732 2843 1 13 . 1 1 443 443 LYS H H 443 9.340 9.340 8.664 0.676 17732 2844 1 13 . 1 1 444 444 HIS N N 444 122.000 122.000 119.025 2.975 17732 2845 1 13 . 1 1 444 444 HIS HA H 444 5.700 5.700 4.996 0.704 17732 2846 1 13 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.294 -3.294 17732 2847 1 13 . 1 1 444 444 HIS H H 444 8.860 8.860 8.184 0.676 17732 2848 1 13 . 1 1 445 445 VAL N N 445 121.200 121.200 124.311 -3.111 17732 2849 1 13 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.049 -0.239 17732 2850 1 13 . 1 1 445 445 VAL CA C 445 61.600 61.600 60.527 1.073 17732 2851 1 13 . 1 1 445 445 VAL H H 445 8.560 8.560 8.120 0.440 17732 2852 1 13 . 1 1 446 446 GLU N N 446 125.100 125.100 125.493 -0.393 17732 2853 1 13 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.797 0.113 17732 2854 1 13 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.293 0.107 17732 2855 1 13 . 1 1 446 446 GLU H H 446 8.680 8.680 8.857 -0.177 17732 2856 1 13 . 1 1 447 447 ARG N N 447 122.400 122.400 121.914 0.486 17732 2857 1 13 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.286 0.404 17732 2858 1 13 . 1 1 447 447 ARG CA C 447 55.400 55.400 54.981 0.419 17732 2859 1 13 . 1 1 447 447 ARG H H 447 8.660 8.660 8.732 -0.072 17732 2860 1 13 . 1 1 448 448 ALA N N 448 125.000 125.000 127.463 -2.463 17732 2861 1 13 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.069 0.151 17732 2862 1 13 . 1 1 448 448 ALA CA C 448 52.300 52.300 52.651 -0.351 17732 2863 1 13 . 1 1 448 448 ALA H H 448 8.100 8.100 8.567 -0.467 17732 2864 1 13 . 1 1 449 449 ALA N N 449 123.700 123.700 124.960 -1.260 17732 2865 1 13 . 1 1 449 449 ALA HA H 449 4.220 4.220 4.183 0.037 17732 2866 1 13 . 1 1 449 449 ALA CA C 449 55.200 55.200 53.925 1.275 17732 2867 1 13 . 1 1 449 449 ALA H H 449 8.550 8.550 8.635 -0.085 17732 2868 1 13 . 1 1 450 450 THR N N 450 102.500 102.500 106.641 -4.141 17732 2869 1 13 . 1 1 450 450 THR HA H 450 4.340 4.340 4.562 -0.222 17732 2870 1 13 . 1 1 450 450 THR CA C 450 61.300 61.300 61.289 0.011 17732 2871 1 13 . 1 1 450 450 THR H H 450 7.600 7.600 7.771 -0.171 17732 2872 1 13 . 1 1 451 451 ASP N N 451 118.200 118.200 121.215 -3.015 17732 2873 1 13 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.827 0.083 17732 2874 1 13 . 1 1 451 451 ASP CA C 451 52.000 52.000 53.895 -1.895 17732 2875 1 13 . 1 1 451 451 ASP H H 451 7.060 7.060 7.659 -0.599 17732 2876 1 13 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.108 0.192 17732 2877 1 13 . 1 1 452 452 PRO CA C 452 64.000 64.000 63.967 0.033 17732 2878 1 13 . 1 1 453 453 LYS N N 453 117.000 117.000 116.278 0.722 17732 2879 1 13 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.296 -0.136 17732 2880 1 13 . 1 1 453 453 LYS CA C 453 56.700 56.700 56.407 0.293 17732 2881 1 13 . 1 1 453 453 LYS H H 453 7.880 7.880 8.050 -0.170 17732 2882 1 13 . 1 1 454 454 ALA N N 454 124.700 124.700 122.608 2.092 17732 2883 1 13 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.196 0.374 17732 2884 1 13 . 1 1 454 454 ALA CA C 454 51.200 51.200 53.086 -1.886 17732 2885 1 13 . 1 1 454 454 ALA H H 454 8.060 8.060 7.399 0.661 17732 2886 1 13 . 1 1 455 455 VAL N N 455 119.700 119.700 115.911 3.789 17732 2887 1 13 . 1 1 455 455 VAL HA H 455 4.370 4.370 3.913 0.457 17732 2888 1 13 . 1 1 455 455 VAL CA C 455 61.400 61.400 62.393 -0.993 17732 2889 1 13 . 1 1 455 455 VAL H H 455 8.190 8.190 7.782 0.408 17732 2890 1 13 . 1 1 456 456 VAL N N 456 129.400 129.400 124.059 5.341 17732 2891 1 13 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.536 -0.226 17732 2892 1 13 . 1 1 456 456 VAL CA C 456 61.900 61.900 59.867 2.033 17732 2893 1 13 . 1 1 456 456 VAL H H 456 9.220 9.220 8.843 0.377 17732 2894 1 13 . 1 1 457 457 THR N N 457 125.000 125.000 123.112 1.888 17732 2895 1 13 . 1 1 457 457 THR HA H 457 5.160 5.160 5.308 -0.148 17732 2896 1 13 . 1 1 457 457 THR CA C 457 61.100 61.100 60.803 0.297 17732 2897 1 13 . 1 1 457 457 THR H H 457 8.560 8.560 8.268 0.292 17732 2898 1 13 . 1 1 458 458 THR N N 458 120.600 120.600 123.000 -2.400 17732 2899 1 13 . 1 1 458 458 THR HA H 458 4.550 4.550 4.624 -0.074 17732 2900 1 13 . 1 1 458 458 THR CA C 458 60.600 60.600 62.038 -1.438 17732 2901 1 13 . 1 1 458 458 THR H H 458 8.560 8.560 8.719 -0.159 17732 2902 1 13 . 1 1 459 459 TYR N N 459 122.500 122.500 126.565 -4.065 17732 2903 1 13 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.701 0.239 17732 2904 1 13 . 1 1 459 459 TYR CA C 459 57.800 57.800 58.096 -0.296 17732 2905 1 13 . 1 1 459 459 TYR H H 459 8.870 8.870 8.953 -0.083 17732 2906 1 13 . 1 1 460 460 GLU N N 460 123.200 123.200 125.953 -2.753 17732 2907 1 13 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.670 -0.040 17732 2908 1 13 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.201 0.399 17732 2909 1 13 . 1 1 460 460 GLU H H 460 9.150 9.150 8.589 0.561 17732 2910 1 13 . 1 1 461 461 GLY N N 461 112.700 112.700 111.627 1.073 17732 2911 1 13 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.312 -0.412 17732 2912 1 13 . 1 1 461 461 GLY H H 461 8.330 8.330 8.016 0.314 17732 2913 1 13 . 1 1 462 462 LYS N N 462 118.300 118.300 121.702 -3.402 17732 2914 1 13 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.273 0.217 17732 2915 1 13 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.382 -1.382 17732 2916 1 13 . 1 1 462 462 LYS H H 462 8.050 8.050 8.290 -0.240 17732 2917 1 13 . 1 1 463 463 HIS N N 463 123.900 123.900 117.856 6.044 17732 2918 1 13 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.723 -0.123 17732 2919 1 13 . 1 1 463 463 HIS CA C 463 57.200 57.200 55.344 1.855 17732 2920 1 13 . 1 1 463 463 HIS H H 463 8.470 8.470 8.262 0.208 17732 2921 1 13 . 1 1 464 464 ASN N N 464 124.400 124.400 118.552 5.848 17732 2922 1 13 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.879 0.071 17732 2923 1 13 . 1 1 464 464 ASN CA C 464 51.500 51.500 53.030 -1.530 17732 2924 1 13 . 1 1 464 464 ASN H H 464 8.360 8.360 8.987 -0.627 17732 2925 1 13 . 1 1 465 465 HIS N N 465 112.100 112.100 116.470 -4.370 17732 2926 1 13 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.700 0.170 17732 2927 1 13 . 1 1 465 465 HIS CA C 465 52.900 52.900 55.782 -2.882 17732 2928 1 13 . 1 1 465 465 HIS H H 465 6.830 6.830 7.587 -0.757 17732 2929 1 13 . 1 1 466 466 ASP N N 466 120.300 120.300 117.607 2.693 17732 2930 1 13 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.531 0.089 17732 2931 1 13 . 1 1 466 466 ASP CA C 466 54.000 54.000 53.417 0.583 17732 2932 1 13 . 1 1 466 466 ASP H H 466 8.780 8.780 7.899 0.881 17732 2933 1 13 . 1 1 467 467 LEU N N 467 124.200 124.200 122.530 1.670 17732 2934 1 13 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.896 -0.857 17732 2935 1 13 . 1 1 467 467 LEU CA C 467 54.100 54.100 53.187 0.913 17732 2936 1 13 . 1 1 467 467 LEU H H 467 8.530 8.530 8.261 0.269 17732 2937 1 13 . 1 1 468 468 PRO HA H 468 4.350 4.350 5.142 -0.792 17732 2938 1 13 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.616 0.684 17732 2939 1 14 . 1 1 408 408 LEU N N 408 122.600 122.600 120.333 2.267 17732 2940 1 14 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.737 -0.477 17732 2941 1 14 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.809 0.191 17732 2942 1 14 . 1 1 408 408 LEU H H 408 8.090 8.090 7.983 0.107 17732 2943 1 14 . 1 1 409 409 ASP N N 409 122.500 122.500 121.160 1.340 17732 2944 1 14 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.906 -0.266 17732 2945 1 14 . 1 1 409 409 ASP CA C 409 55.100 55.100 54.235 0.865 17732 2946 1 14 . 1 1 409 409 ASP H H 409 8.140 8.140 8.100 0.040 17732 2947 1 14 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.421 0.079 17732 2948 1 14 . 1 1 410 410 ASP CA C 410 53.200 53.200 55.396 -2.196 17732 2949 1 14 . 1 1 410 410 ASP H H 410 8.570 8.570 8.429 0.141 17732 2950 1 14 . 1 1 411 411 GLY N N 411 108.400 108.400 103.838 4.562 17732 2951 1 14 . 1 1 411 411 GLY CA C 411 45.300 45.300 44.649 0.651 17732 2952 1 14 . 1 1 411 411 GLY H H 411 8.520 8.520 8.002 0.518 17732 2953 1 14 . 1 1 412 412 TYR N N 412 118.600 118.600 118.869 -0.269 17732 2954 1 14 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.592 -0.242 17732 2955 1 14 . 1 1 412 412 TYR CA C 412 58.000 58.000 56.291 1.709 17732 2956 1 14 . 1 1 412 412 TYR H H 412 8.160 8.160 7.859 0.301 17732 2957 1 14 . 1 1 413 413 ARG N N 413 121.100 121.100 120.343 0.757 17732 2958 1 14 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.676 0.104 17732 2959 1 14 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.169 -0.069 17732 2960 1 14 . 1 1 413 413 ARG H H 413 8.750 8.750 8.493 0.257 17732 2961 1 14 . 1 1 414 414 TRP N N 414 120.600 120.600 123.308 -2.708 17732 2962 1 14 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.246 0.334 17732 2963 1 14 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.538 -0.438 17732 2964 1 14 . 1 1 414 414 TRP H H 414 8.250 8.250 8.695 -0.445 17732 2965 1 14 . 1 1 415 415 ARG N N 415 122.900 122.900 123.202 -0.302 17732 2966 1 14 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.836 0.444 17732 2967 1 14 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.751 -0.151 17732 2968 1 14 . 1 1 415 415 ARG H H 415 9.450 9.450 9.348 0.102 17732 2969 1 14 . 1 1 416 416 LYS N N 416 134.700 134.700 127.692 7.008 17732 2970 1 14 . 1 1 416 416 LYS HA H 416 4.360 4.360 4.058 0.302 17732 2971 1 14 . 1 1 416 416 LYS CA C 416 57.000 57.000 56.331 0.668 17732 2972 1 14 . 1 1 416 416 LYS H H 416 11.120 11.120 8.849 2.271 17732 2973 1 14 . 1 1 417 417 TYR N N 417 118.600 118.600 125.231 -6.631 17732 2974 1 14 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.633 0.627 17732 2975 1 14 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.140 -1.140 17732 2976 1 14 . 1 1 417 417 TYR H H 417 8.900 8.900 8.078 0.822 17732 2977 1 14 . 1 1 418 418 GLY N N 418 105.300 105.300 108.414 -3.114 17732 2978 1 14 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.588 1.312 17732 2979 1 14 . 1 1 418 418 GLY H H 418 6.990 6.990 8.400 -1.410 17732 2980 1 14 . 1 1 419 419 GLN N N 419 122.600 122.600 120.033 2.567 17732 2981 1 14 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.557 0.923 17732 2982 1 14 . 1 1 419 419 GLN CA C 419 56.600 56.600 55.844 0.756 17732 2983 1 14 . 1 1 419 419 GLN H H 419 9.000 9.000 8.190 0.810 17732 2984 1 14 . 1 1 420 420 LYS N N 420 123.000 123.000 125.470 -2.470 17732 2985 1 14 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.586 0.314 17732 2986 1 14 . 1 1 420 420 LYS CA C 420 52.800 52.800 56.757 -3.957 17732 2987 1 14 . 1 1 420 420 LYS H H 420 9.140 9.140 8.668 0.472 17732 2988 1 14 . 1 1 421 421 VAL N N 421 122.800 122.800 121.076 1.724 17732 2989 1 14 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.300 -0.020 17732 2990 1 14 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.877 3.223 17732 2991 1 14 . 1 1 421 421 VAL H H 421 8.550 8.550 8.239 0.311 17732 2992 1 14 . 1 1 422 422 VAL N N 422 128.600 128.600 121.996 6.604 17732 2993 1 14 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.562 0.008 17732 2994 1 14 . 1 1 422 422 VAL CA C 422 60.200 60.200 60.605 -0.405 17732 2995 1 14 . 1 1 422 422 VAL H H 422 9.500 9.500 8.023 1.477 17732 2996 1 14 . 1 1 423 423 LYS N N 423 123.800 123.800 127.603 -3.803 17732 2997 1 14 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.292 -0.352 17732 2998 1 14 . 1 1 423 423 LYS CA C 423 58.300 58.300 57.103 1.197 17732 2999 1 14 . 1 1 423 423 LYS H H 423 8.880 8.880 8.868 0.012 17732 3000 1 14 . 1 1 424 424 GLY N N 424 110.800 110.800 111.451 -0.651 17732 3001 1 14 . 1 1 424 424 GLY CA C 424 45.300 45.300 45.320 -0.020 17732 3002 1 14 . 1 1 424 424 GLY H H 424 8.600 8.600 8.712 -0.112 17732 3003 1 14 . 1 1 425 425 ASN N N 425 119.800 119.800 119.185 0.615 17732 3004 1 14 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.109 0.031 17732 3005 1 14 . 1 1 425 425 ASN CA C 425 50.100 50.100 50.992 -0.892 17732 3006 1 14 . 1 1 425 425 ASN H H 425 7.600 7.600 7.830 -0.230 17732 3007 1 14 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.258 0.042 17732 3008 1 14 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.224 -0.824 17732 3009 1 14 . 1 1 427 427 TYR N N 427 121.100 121.100 122.175 -1.075 17732 3010 1 14 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.619 0.271 17732 3011 1 14 . 1 1 427 427 TYR CA C 427 55.100 55.100 56.347 -1.247 17732 3012 1 14 . 1 1 427 427 TYR H H 427 8.120 8.120 7.713 0.407 17732 3013 1 14 . 1 1 428 428 PRO HA H 428 4.420 4.420 4.749 -0.329 17732 3014 1 14 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.510 0.790 17732 3015 1 14 . 1 1 429 429 ARG N N 429 124.900 124.900 125.488 -0.588 17732 3016 1 14 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.202 0.478 17732 3017 1 14 . 1 1 429 429 ARG CA C 429 55.000 55.000 56.412 -1.412 17732 3018 1 14 . 1 1 429 429 ARG H H 429 9.280 9.280 8.273 1.007 17732 3019 1 14 . 1 1 430 430 SER N N 430 122.200 122.200 120.192 2.008 17732 3020 1 14 . 1 1 430 430 SER HA H 430 4.960 4.960 4.588 0.372 17732 3021 1 14 . 1 1 430 430 SER CA C 430 59.300 59.300 57.383 1.917 17732 3022 1 14 . 1 1 430 430 SER H H 430 9.100 9.100 7.950 1.150 17732 3023 1 14 . 1 1 431 431 TYR N N 431 122.100 122.100 125.530 -3.430 17732 3024 1 14 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.604 0.056 17732 3025 1 14 . 1 1 431 431 TYR CA C 431 57.400 57.400 57.376 0.024 17732 3026 1 14 . 1 1 431 431 TYR H H 431 7.590 7.590 8.266 -0.676 17732 3027 1 14 . 1 1 432 432 TYR N N 432 120.300 120.300 122.154 -1.854 17732 3028 1 14 . 1 1 432 432 TYR HA H 432 5.720 5.720 4.643 1.077 17732 3029 1 14 . 1 1 432 432 TYR CA C 432 57.100 57.100 60.035 -2.935 17732 3030 1 14 . 1 1 432 432 TYR H H 432 9.370 9.370 8.282 1.088 17732 3031 1 14 . 1 1 433 433 LYS N N 433 121.500 121.500 119.500 2.000 17732 3032 1 14 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.124 0.706 17732 3033 1 14 . 1 1 433 433 LYS CA C 433 54.200 54.200 55.930 -1.730 17732 3034 1 14 . 1 1 433 433 LYS H H 433 9.960 9.960 8.651 1.309 17732 3035 1 14 . 1 1 434 434 CYS N N 434 128.700 128.700 126.015 2.685 17732 3036 1 14 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.356 -1.156 17732 3037 1 14 . 1 1 434 434 CYS CA C 434 60.300 60.300 57.571 2.729 17732 3038 1 14 . 1 1 434 434 CYS H H 434 8.440 8.440 9.095 -0.655 17732 3039 1 14 . 1 1 435 435 THR N N 435 118.000 118.000 121.290 -3.290 17732 3040 1 14 . 1 1 435 435 THR HA H 435 4.270 4.270 5.021 -0.751 17732 3041 1 14 . 1 1 435 435 THR CA C 435 62.800 62.800 61.276 1.524 17732 3042 1 14 . 1 1 435 435 THR H H 435 8.200 8.200 8.050 0.150 17732 3043 1 14 . 1 1 436 436 THR N N 436 127.500 127.500 119.232 8.268 17732 3044 1 14 . 1 1 436 436 THR HA H 436 4.230 4.230 4.455 -0.225 17732 3045 1 14 . 1 1 436 436 THR CA C 436 63.300 63.300 61.868 1.432 17732 3046 1 14 . 1 1 436 436 THR H H 436 8.880 8.880 8.012 0.868 17732 3047 1 14 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.111 0.159 17732 3048 1 14 . 1 1 438 438 GLY N N 438 112.800 112.800 110.061 2.739 17732 3049 1 14 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.499 0.901 17732 3050 1 14 . 1 1 438 438 GLY H H 438 8.870 8.870 8.222 0.648 17732 3051 1 14 . 1 1 439 439 CYS N N 439 123.900 123.900 119.766 4.134 17732 3052 1 14 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.855 -0.255 17732 3053 1 14 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.461 2.239 17732 3054 1 14 . 1 1 439 439 CYS H H 439 7.870 7.870 8.618 -0.748 17732 3055 1 14 . 1 1 440 440 GLY N N 440 113.300 113.300 114.047 -0.747 17732 3056 1 14 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.022 0.379 17732 3057 1 14 . 1 1 440 440 GLY H H 440 9.070 9.070 8.339 0.731 17732 3058 1 14 . 1 1 441 441 VAL N N 441 123.400 123.400 123.233 0.167 17732 3059 1 14 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.294 -0.184 17732 3060 1 14 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.551 4.949 17732 3061 1 14 . 1 1 441 441 VAL H H 441 8.230 8.230 7.580 0.650 17732 3062 1 14 . 1 1 442 442 ARG N N 442 126.100 126.100 122.508 3.592 17732 3063 1 14 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.210 0.440 17732 3064 1 14 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.352 -0.052 17732 3065 1 14 . 1 1 442 442 ARG H H 442 8.340 8.340 8.547 -0.207 17732 3066 1 14 . 1 1 443 443 LYS N N 443 120.700 120.700 121.571 -0.871 17732 3067 1 14 . 1 1 443 443 LYS HA H 443 5.110 5.110 4.952 0.158 17732 3068 1 14 . 1 1 443 443 LYS CA C 443 54.000 54.000 55.137 -1.137 17732 3069 1 14 . 1 1 443 443 LYS H H 443 9.340 9.340 8.623 0.717 17732 3070 1 14 . 1 1 444 444 HIS N N 444 122.000 122.000 122.038 -0.038 17732 3071 1 14 . 1 1 444 444 HIS HA H 444 5.700 5.700 5.213 0.487 17732 3072 1 14 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.300 -3.300 17732 3073 1 14 . 1 1 444 444 HIS H H 444 8.860 8.860 8.145 0.715 17732 3074 1 14 . 1 1 445 445 VAL N N 445 121.200 121.200 123.889 -2.689 17732 3075 1 14 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.230 -0.420 17732 3076 1 14 . 1 1 445 445 VAL CA C 445 61.600 61.600 61.120 0.480 17732 3077 1 14 . 1 1 445 445 VAL H H 445 8.560 8.560 8.065 0.495 17732 3078 1 14 . 1 1 446 446 GLU N N 446 125.100 125.100 125.627 -0.527 17732 3079 1 14 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.713 0.197 17732 3080 1 14 . 1 1 446 446 GLU CA C 446 54.400 54.400 53.933 0.467 17732 3081 1 14 . 1 1 446 446 GLU H H 446 8.680 8.680 8.636 0.044 17732 3082 1 14 . 1 1 447 447 ARG N N 447 122.400 122.400 119.433 2.967 17732 3083 1 14 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.546 0.144 17732 3084 1 14 . 1 1 447 447 ARG CA C 447 55.400 55.400 54.506 0.894 17732 3085 1 14 . 1 1 447 447 ARG H H 447 8.660 8.660 8.364 0.296 17732 3086 1 14 . 1 1 448 448 ALA N N 448 125.000 125.000 123.173 1.827 17732 3087 1 14 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.520 -0.300 17732 3088 1 14 . 1 1 448 448 ALA CA C 448 52.300 52.300 50.297 2.003 17732 3089 1 14 . 1 1 448 448 ALA H H 448 8.100 8.100 8.107 -0.007 17732 3090 1 14 . 1 1 449 449 ALA N N 449 123.700 123.700 127.722 -4.022 17732 3091 1 14 . 1 1 449 449 ALA HA H 449 4.220 4.220 4.117 0.103 17732 3092 1 14 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.946 0.254 17732 3093 1 14 . 1 1 449 449 ALA H H 449 8.550 8.550 8.746 -0.196 17732 3094 1 14 . 1 1 450 450 THR N N 450 102.500 102.500 108.075 -5.575 17732 3095 1 14 . 1 1 450 450 THR HA H 450 4.340 4.340 4.251 0.089 17732 3096 1 14 . 1 1 450 450 THR CA C 450 61.300 61.300 63.228 -1.928 17732 3097 1 14 . 1 1 450 450 THR H H 450 7.600 7.600 7.874 -0.274 17732 3098 1 14 . 1 1 451 451 ASP N N 451 118.200 118.200 120.610 -2.410 17732 3099 1 14 . 1 1 451 451 ASP HA H 451 4.910 4.910 5.039 -0.129 17732 3100 1 14 . 1 1 451 451 ASP CA C 451 52.000 52.000 50.979 1.021 17732 3101 1 14 . 1 1 451 451 ASP H H 451 7.060 7.060 7.947 -0.887 17732 3102 1 14 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.286 0.014 17732 3103 1 14 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.370 -0.370 17732 3104 1 14 . 1 1 453 453 LYS N N 453 117.000 117.000 115.732 1.268 17732 3105 1 14 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.201 -0.041 17732 3106 1 14 . 1 1 453 453 LYS CA C 453 56.700 56.700 56.925 -0.225 17732 3107 1 14 . 1 1 453 453 LYS H H 453 7.880 7.880 8.441 -0.561 17732 3108 1 14 . 1 1 454 454 ALA N N 454 124.700 124.700 123.124 1.576 17732 3109 1 14 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.589 -0.019 17732 3110 1 14 . 1 1 454 454 ALA CA C 454 51.200 51.200 51.138 0.062 17732 3111 1 14 . 1 1 454 454 ALA H H 454 8.060 8.060 7.318 0.742 17732 3112 1 14 . 1 1 455 455 VAL N N 455 119.700 119.700 122.524 -2.824 17732 3113 1 14 . 1 1 455 455 VAL HA H 455 4.370 4.370 4.531 -0.161 17732 3114 1 14 . 1 1 455 455 VAL CA C 455 61.400 61.400 61.061 0.339 17732 3115 1 14 . 1 1 455 455 VAL H H 455 8.190 8.190 8.312 -0.122 17732 3116 1 14 . 1 1 456 456 VAL N N 456 129.400 129.400 121.558 7.842 17732 3117 1 14 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.627 -0.317 17732 3118 1 14 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.968 0.932 17732 3119 1 14 . 1 1 456 456 VAL H H 456 9.220 9.220 8.747 0.473 17732 3120 1 14 . 1 1 457 457 THR N N 457 125.000 125.000 124.375 0.625 17732 3121 1 14 . 1 1 457 457 THR HA H 457 5.160 5.160 5.314 -0.154 17732 3122 1 14 . 1 1 457 457 THR CA C 457 61.100 61.100 60.691 0.409 17732 3123 1 14 . 1 1 457 457 THR H H 457 8.560 8.560 8.339 0.221 17732 3124 1 14 . 1 1 458 458 THR N N 458 120.600 120.600 122.990 -2.390 17732 3125 1 14 . 1 1 458 458 THR HA H 458 4.550 4.550 4.680 -0.130 17732 3126 1 14 . 1 1 458 458 THR CA C 458 60.600 60.600 61.304 -0.704 17732 3127 1 14 . 1 1 458 458 THR H H 458 8.560 8.560 8.546 0.014 17732 3128 1 14 . 1 1 459 459 TYR N N 459 122.500 122.500 126.407 -3.907 17732 3129 1 14 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.779 0.161 17732 3130 1 14 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.981 -0.181 17732 3131 1 14 . 1 1 459 459 TYR H H 459 8.870 8.870 8.897 -0.027 17732 3132 1 14 . 1 1 460 460 GLU N N 460 123.200 123.200 125.738 -2.538 17732 3133 1 14 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.738 -0.108 17732 3134 1 14 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.858 -0.259 17732 3135 1 14 . 1 1 460 460 GLU H H 460 9.150 9.150 8.568 0.582 17732 3136 1 14 . 1 1 461 461 GLY N N 461 112.700 112.700 111.205 1.495 17732 3137 1 14 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.650 -0.750 17732 3138 1 14 . 1 1 461 461 GLY H H 461 8.330 8.330 8.357 -0.027 17732 3139 1 14 . 1 1 462 462 LYS N N 462 118.300 118.300 123.318 -5.018 17732 3140 1 14 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.367 0.123 17732 3141 1 14 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.750 -1.750 17732 3142 1 14 . 1 1 462 462 LYS H H 462 8.050 8.050 8.183 -0.133 17732 3143 1 14 . 1 1 463 463 HIS N N 463 123.900 123.900 121.388 2.512 17732 3144 1 14 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.541 0.059 17732 3145 1 14 . 1 1 463 463 HIS CA C 463 57.200 57.200 56.640 0.560 17732 3146 1 14 . 1 1 463 463 HIS H H 463 8.470 8.470 8.374 0.096 17732 3147 1 14 . 1 1 464 464 ASN N N 464 124.400 124.400 118.135 6.265 17732 3148 1 14 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.807 0.143 17732 3149 1 14 . 1 1 464 464 ASN CA C 464 51.500 51.500 53.624 -2.124 17732 3150 1 14 . 1 1 464 464 ASN H H 464 8.360 8.360 8.599 -0.239 17732 3151 1 14 . 1 1 465 465 HIS N N 465 112.100 112.100 117.484 -5.384 17732 3152 1 14 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.827 0.043 17732 3153 1 14 . 1 1 465 465 HIS CA C 465 52.900 52.900 53.685 -0.785 17732 3154 1 14 . 1 1 465 465 HIS H H 465 6.830 6.830 7.871 -1.041 17732 3155 1 14 . 1 1 466 466 ASP N N 466 120.300 120.300 118.936 1.364 17732 3156 1 14 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.205 0.415 17732 3157 1 14 . 1 1 466 466 ASP CA C 466 54.000 54.000 56.847 -2.847 17732 3158 1 14 . 1 1 466 466 ASP H H 466 8.780 8.780 8.046 0.735 17732 3159 1 14 . 1 1 467 467 LEU N N 467 124.200 124.200 120.897 3.303 17732 3160 1 14 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.935 -0.895 17732 3161 1 14 . 1 1 467 467 LEU CA C 467 54.100 54.100 52.293 1.807 17732 3162 1 14 . 1 1 467 467 LEU H H 467 8.530 8.530 8.007 0.523 17732 3163 1 14 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.520 -0.170 17732 3164 1 14 . 1 1 468 468 PRO CA C 468 63.300 63.300 63.247 0.053 17732 3165 1 15 . 1 1 408 408 LEU N N 408 122.600 122.600 119.108 3.492 17732 3166 1 15 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.223 0.037 17732 3167 1 15 . 1 1 408 408 LEU CA C 408 55.000 55.000 56.489 -1.489 17732 3168 1 15 . 1 1 408 408 LEU H H 408 8.090 8.090 8.308 -0.218 17732 3169 1 15 . 1 1 409 409 ASP N N 409 122.500 122.500 119.392 3.108 17732 3170 1 15 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.767 -0.127 17732 3171 1 15 . 1 1 409 409 ASP CA C 409 55.100 55.100 54.370 0.730 17732 3172 1 15 . 1 1 409 409 ASP H H 409 8.140 8.140 7.998 0.142 17732 3173 1 15 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.968 -0.468 17732 3174 1 15 . 1 1 410 410 ASP CA C 410 53.200 53.200 53.609 -0.409 17732 3175 1 15 . 1 1 410 410 ASP H H 410 8.570 8.570 8.707 -0.137 17732 3176 1 15 . 1 1 411 411 GLY N N 411 108.400 108.400 108.024 0.376 17732 3177 1 15 . 1 1 411 411 GLY CA C 411 45.300 45.300 46.434 -1.134 17732 3178 1 15 . 1 1 411 411 GLY H H 411 8.520 8.520 8.679 -0.159 17732 3179 1 15 . 1 1 412 412 TYR N N 412 118.600 118.600 119.407 -0.807 17732 3180 1 15 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.903 -0.553 17732 3181 1 15 . 1 1 412 412 TYR CA C 412 58.000 58.000 55.635 2.365 17732 3182 1 15 . 1 1 412 412 TYR H H 412 8.160 8.160 8.096 0.064 17732 3183 1 15 . 1 1 413 413 ARG N N 413 121.100 121.100 120.380 0.720 17732 3184 1 15 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.673 0.107 17732 3185 1 15 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.414 -0.314 17732 3186 1 15 . 1 1 413 413 ARG H H 413 8.750 8.750 8.623 0.127 17732 3187 1 15 . 1 1 414 414 TRP N N 414 120.600 120.600 124.316 -3.716 17732 3188 1 15 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.152 0.428 17732 3189 1 15 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.357 -0.257 17732 3190 1 15 . 1 1 414 414 TRP H H 414 8.250 8.250 8.722 -0.472 17732 3191 1 15 . 1 1 415 415 ARG N N 415 122.900 122.900 124.115 -1.215 17732 3192 1 15 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.899 0.381 17732 3193 1 15 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.150 0.450 17732 3194 1 15 . 1 1 415 415 ARG H H 415 9.450 9.450 8.650 0.800 17732 3195 1 15 . 1 1 416 416 LYS N N 416 134.700 134.700 127.363 7.337 17732 3196 1 15 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.768 0.592 17732 3197 1 15 . 1 1 416 416 LYS CA C 416 57.000 57.000 56.313 0.687 17732 3198 1 15 . 1 1 416 416 LYS H H 416 11.120 11.120 8.806 2.314 17732 3199 1 15 . 1 1 417 417 TYR N N 417 118.600 118.600 122.985 -4.385 17732 3200 1 15 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.590 0.670 17732 3201 1 15 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.489 -1.489 17732 3202 1 15 . 1 1 417 417 TYR H H 417 8.900 8.900 7.905 0.995 17732 3203 1 15 . 1 1 418 418 GLY N N 418 105.300 105.300 112.387 -7.087 17732 3204 1 15 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.801 1.099 17732 3205 1 15 . 1 1 418 418 GLY H H 418 6.990 6.990 8.320 -1.330 17732 3206 1 15 . 1 1 419 419 GLN N N 419 122.600 122.600 119.118 3.482 17732 3207 1 15 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.708 0.772 17732 3208 1 15 . 1 1 419 419 GLN CA C 419 56.600 56.600 55.662 0.938 17732 3209 1 15 . 1 1 419 419 GLN H H 419 9.000 9.000 8.427 0.573 17732 3210 1 15 . 1 1 420 420 LYS N N 420 123.000 123.000 125.503 -2.503 17732 3211 1 15 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.782 0.118 17732 3212 1 15 . 1 1 420 420 LYS CA C 420 52.800 52.800 55.537 -2.737 17732 3213 1 15 . 1 1 420 420 LYS H H 420 9.140 9.140 8.469 0.671 17732 3214 1 15 . 1 1 421 421 VAL N N 421 122.800 122.800 121.494 1.306 17732 3215 1 15 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.441 -0.161 17732 3216 1 15 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.948 3.152 17732 3217 1 15 . 1 1 421 421 VAL H H 421 8.550 8.550 8.367 0.183 17732 3218 1 15 . 1 1 422 422 VAL N N 422 128.600 128.600 122.969 5.631 17732 3219 1 15 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.550 0.020 17732 3220 1 15 . 1 1 422 422 VAL CA C 422 60.200 60.200 59.561 0.639 17732 3221 1 15 . 1 1 422 422 VAL H H 422 9.500 9.500 8.125 1.375 17732 3222 1 15 . 1 1 423 423 LYS N N 423 123.800 123.800 124.722 -0.922 17732 3223 1 15 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.288 -0.348 17732 3224 1 15 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.281 2.019 17732 3225 1 15 . 1 1 423 423 LYS H H 423 8.880 8.880 8.622 0.258 17732 3226 1 15 . 1 1 424 424 GLY N N 424 110.800 110.800 106.361 4.439 17732 3227 1 15 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.033 -0.733 17732 3228 1 15 . 1 1 424 424 GLY H H 424 8.600 8.600 8.575 0.025 17732 3229 1 15 . 1 1 425 425 ASN N N 425 119.800 119.800 117.680 2.120 17732 3230 1 15 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.110 0.030 17732 3231 1 15 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.594 -1.494 17732 3232 1 15 . 1 1 425 425 ASN H H 425 7.600 7.600 7.725 -0.125 17732 3233 1 15 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.322 -0.022 17732 3234 1 15 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.451 -1.051 17732 3235 1 15 . 1 1 427 427 TYR N N 427 121.100 121.100 119.106 1.994 17732 3236 1 15 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.651 0.239 17732 3237 1 15 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.080 0.021 17732 3238 1 15 . 1 1 427 427 TYR H H 427 8.120 8.120 7.984 0.136 17732 3239 1 15 . 1 1 428 428 PRO HA H 428 4.420 4.420 5.183 -0.763 17732 3240 1 15 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.242 1.058 17732 3241 1 15 . 1 1 429 429 ARG N N 429 124.900 124.900 122.869 2.031 17732 3242 1 15 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.685 -0.005 17732 3243 1 15 . 1 1 429 429 ARG CA C 429 55.000 55.000 54.950 0.050 17732 3244 1 15 . 1 1 429 429 ARG H H 429 9.280 9.280 8.886 0.394 17732 3245 1 15 . 1 1 430 430 SER N N 430 122.200 122.200 113.895 8.305 17732 3246 1 15 . 1 1 430 430 SER HA H 430 4.960 4.960 4.550 0.410 17732 3247 1 15 . 1 1 430 430 SER CA C 430 59.300 59.300 57.638 1.662 17732 3248 1 15 . 1 1 430 430 SER H H 430 9.100 9.100 7.866 1.234 17732 3249 1 15 . 1 1 431 431 TYR N N 431 122.100 122.100 121.731 0.369 17732 3250 1 15 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.777 -0.117 17732 3251 1 15 . 1 1 431 431 TYR CA C 431 57.400 57.400 56.352 1.048 17732 3252 1 15 . 1 1 431 431 TYR H H 431 7.590 7.590 7.959 -0.369 17732 3253 1 15 . 1 1 432 432 TYR N N 432 120.300 120.300 124.531 -4.231 17732 3254 1 15 . 1 1 432 432 TYR HA H 432 5.720 5.720 5.151 0.569 17732 3255 1 15 . 1 1 432 432 TYR CA C 432 57.100 57.100 57.429 -0.329 17732 3256 1 15 . 1 1 432 432 TYR H H 432 9.370 9.370 8.214 1.156 17732 3257 1 15 . 1 1 433 433 LYS N N 433 121.500 121.500 123.251 -1.751 17732 3258 1 15 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.282 0.548 17732 3259 1 15 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.260 -0.060 17732 3260 1 15 . 1 1 433 433 LYS H H 433 9.960 9.960 8.548 1.412 17732 3261 1 15 . 1 1 434 434 CYS N N 434 128.700 128.700 125.486 3.214 17732 3262 1 15 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.168 -0.968 17732 3263 1 15 . 1 1 434 434 CYS CA C 434 60.300 60.300 57.368 2.932 17732 3264 1 15 . 1 1 434 434 CYS H H 434 8.440 8.440 8.990 -0.550 17732 3265 1 15 . 1 1 435 435 THR N N 435 118.000 118.000 121.893 -3.893 17732 3266 1 15 . 1 1 435 435 THR HA H 435 4.270 4.270 5.180 -0.910 17732 3267 1 15 . 1 1 435 435 THR CA C 435 62.800 62.800 60.648 2.152 17732 3268 1 15 . 1 1 435 435 THR H H 435 8.200 8.200 8.186 0.014 17732 3269 1 15 . 1 1 436 436 THR N N 436 127.500 127.500 114.754 12.746 17732 3270 1 15 . 1 1 436 436 THR HA H 436 4.230 4.230 4.557 -0.327 17732 3271 1 15 . 1 1 436 436 THR CA C 436 63.300 63.300 60.849 2.451 17732 3272 1 15 . 1 1 436 436 THR H H 436 8.880 8.880 7.811 1.069 17732 3273 1 15 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.322 -0.052 17732 3274 1 15 . 1 1 438 438 GLY N N 438 112.800 112.800 104.940 7.860 17732 3275 1 15 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.203 1.197 17732 3276 1 15 . 1 1 438 438 GLY H H 438 8.870 8.870 8.376 0.494 17732 3277 1 15 . 1 1 439 439 CYS N N 439 123.900 123.900 119.558 4.342 17732 3278 1 15 . 1 1 439 439 CYS HA H 439 4.600 4.600 5.197 -0.597 17732 3279 1 15 . 1 1 439 439 CYS CA C 439 60.700 60.700 57.854 2.846 17732 3280 1 15 . 1 1 439 439 CYS H H 439 7.870 7.870 7.231 0.639 17732 3281 1 15 . 1 1 440 440 GLY N N 440 113.300 113.300 114.952 -1.652 17732 3282 1 15 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.731 -0.331 17732 3283 1 15 . 1 1 440 440 GLY H H 440 9.070 9.070 8.354 0.716 17732 3284 1 15 . 1 1 441 441 VAL N N 441 123.400 123.400 123.480 -0.080 17732 3285 1 15 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.399 -0.289 17732 3286 1 15 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.233 5.267 17732 3287 1 15 . 1 1 441 441 VAL H H 441 8.230 8.230 8.249 -0.019 17732 3288 1 15 . 1 1 442 442 ARG N N 442 126.100 126.100 121.686 4.414 17732 3289 1 15 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.188 0.462 17732 3290 1 15 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.287 0.013 17732 3291 1 15 . 1 1 442 442 ARG H H 442 8.340 8.340 8.217 0.123 17732 3292 1 15 . 1 1 443 443 LYS N N 443 120.700 120.700 119.127 1.573 17732 3293 1 15 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.073 0.037 17732 3294 1 15 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.716 -0.716 17732 3295 1 15 . 1 1 443 443 LYS H H 443 9.340 9.340 8.626 0.714 17732 3296 1 15 . 1 1 444 444 HIS N N 444 122.000 122.000 117.985 4.015 17732 3297 1 15 . 1 1 444 444 HIS HA H 444 5.700 5.700 5.026 0.674 17732 3298 1 15 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.607 -3.607 17732 3299 1 15 . 1 1 444 444 HIS H H 444 8.860 8.860 8.361 0.499 17732 3300 1 15 . 1 1 445 445 VAL N N 445 121.200 121.200 121.599 -0.399 17732 3301 1 15 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.056 -0.246 17732 3302 1 15 . 1 1 445 445 VAL CA C 445 61.600 61.600 61.009 0.591 17732 3303 1 15 . 1 1 445 445 VAL H H 445 8.560 8.560 8.057 0.503 17732 3304 1 15 . 1 1 446 446 GLU N N 446 125.100 125.100 125.566 -0.466 17732 3305 1 15 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.743 0.167 17732 3306 1 15 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.417 -0.017 17732 3307 1 15 . 1 1 446 446 GLU H H 446 8.680 8.680 8.573 0.107 17732 3308 1 15 . 1 1 447 447 ARG N N 447 122.400 122.400 121.508 0.892 17732 3309 1 15 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.623 0.067 17732 3310 1 15 . 1 1 447 447 ARG CA C 447 55.400 55.400 54.689 0.711 17732 3311 1 15 . 1 1 447 447 ARG H H 447 8.660 8.660 8.651 0.009 17732 3312 1 15 . 1 1 448 448 ALA N N 448 125.000 125.000 127.385 -2.385 17732 3313 1 15 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.241 -0.021 17732 3314 1 15 . 1 1 448 448 ALA CA C 448 52.300 52.300 51.862 0.438 17732 3315 1 15 . 1 1 448 448 ALA H H 448 8.100 8.100 8.166 -0.066 17732 3316 1 15 . 1 1 449 449 ALA N N 449 123.700 123.700 129.315 -5.615 17732 3317 1 15 . 1 1 449 449 ALA HA H 449 4.220 4.220 3.795 0.425 17732 3318 1 15 . 1 1 449 449 ALA CA C 449 55.200 55.200 55.059 0.141 17732 3319 1 15 . 1 1 449 449 ALA H H 449 8.550 8.550 9.456 -0.906 17732 3320 1 15 . 1 1 450 450 THR N N 450 102.500 102.500 110.477 -7.977 17732 3321 1 15 . 1 1 450 450 THR HA H 450 4.340 4.340 4.260 0.081 17732 3322 1 15 . 1 1 450 450 THR CA C 450 61.300 61.300 62.281 -0.981 17732 3323 1 15 . 1 1 450 450 THR H H 450 7.600 7.600 8.175 -0.575 17732 3324 1 15 . 1 1 451 451 ASP N N 451 118.200 118.200 120.312 -2.112 17732 3325 1 15 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.882 0.028 17732 3326 1 15 . 1 1 451 451 ASP CA C 451 52.000 52.000 52.955 -0.955 17732 3327 1 15 . 1 1 451 451 ASP H H 451 7.060 7.060 8.029 -0.969 17732 3328 1 15 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.083 0.217 17732 3329 1 15 . 1 1 452 452 PRO CA C 452 64.000 64.000 65.314 -1.314 17732 3330 1 15 . 1 1 453 453 LYS N N 453 117.000 117.000 115.338 1.662 17732 3331 1 15 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.255 -0.095 17732 3332 1 15 . 1 1 453 453 LYS CA C 453 56.700 56.700 55.451 1.249 17732 3333 1 15 . 1 1 453 453 LYS H H 453 7.880 7.880 8.230 -0.350 17732 3334 1 15 . 1 1 454 454 ALA N N 454 124.700 124.700 123.666 1.034 17732 3335 1 15 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.566 0.004 17732 3336 1 15 . 1 1 454 454 ALA CA C 454 51.200 51.200 51.386 -0.186 17732 3337 1 15 . 1 1 454 454 ALA H H 454 8.060 8.060 8.013 0.047 17732 3338 1 15 . 1 1 455 455 VAL N N 455 119.700 119.700 123.764 -4.064 17732 3339 1 15 . 1 1 455 455 VAL HA H 455 4.370 4.370 4.877 -0.507 17732 3340 1 15 . 1 1 455 455 VAL CA C 455 61.400 61.400 60.436 0.964 17732 3341 1 15 . 1 1 455 455 VAL H H 455 8.190 8.190 8.368 -0.178 17732 3342 1 15 . 1 1 456 456 VAL N N 456 129.400 129.400 125.487 3.913 17732 3343 1 15 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.638 -0.328 17732 3344 1 15 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.173 1.726 17732 3345 1 15 . 1 1 456 456 VAL H H 456 9.220 9.220 9.050 0.170 17732 3346 1 15 . 1 1 457 457 THR N N 457 125.000 125.000 123.671 1.329 17732 3347 1 15 . 1 1 457 457 THR HA H 457 5.160 5.160 5.448 -0.288 17732 3348 1 15 . 1 1 457 457 THR CA C 457 61.100 61.100 60.854 0.246 17732 3349 1 15 . 1 1 457 457 THR H H 457 8.560 8.560 8.263 0.297 17732 3350 1 15 . 1 1 458 458 THR N N 458 120.600 120.600 123.246 -2.646 17732 3351 1 15 . 1 1 458 458 THR HA H 458 4.550 4.550 4.751 -0.201 17732 3352 1 15 . 1 1 458 458 THR CA C 458 60.600 60.600 61.663 -1.063 17732 3353 1 15 . 1 1 458 458 THR H H 458 8.560 8.560 8.713 -0.153 17732 3354 1 15 . 1 1 459 459 TYR N N 459 122.500 122.500 127.030 -4.530 17732 3355 1 15 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.672 0.268 17732 3356 1 15 . 1 1 459 459 TYR CA C 459 57.800 57.800 56.931 0.869 17732 3357 1 15 . 1 1 459 459 TYR H H 459 8.870 8.870 9.079 -0.209 17732 3358 1 15 . 1 1 460 460 GLU N N 460 123.200 123.200 126.635 -3.435 17732 3359 1 15 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.543 0.087 17732 3360 1 15 . 1 1 460 460 GLU CA C 460 55.600 55.600 54.512 1.088 17732 3361 1 15 . 1 1 460 460 GLU H H 460 9.150 9.150 9.036 0.114 17732 3362 1 15 . 1 1 461 461 GLY N N 461 112.700 112.700 112.839 -0.139 17732 3363 1 15 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.537 -0.637 17732 3364 1 15 . 1 1 461 461 GLY H H 461 8.330 8.330 7.773 0.557 17732 3365 1 15 . 1 1 462 462 LYS N N 462 118.300 118.300 120.824 -2.524 17732 3366 1 15 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.417 0.073 17732 3367 1 15 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.303 -1.303 17732 3368 1 15 . 1 1 462 462 LYS H H 462 8.050 8.050 8.245 -0.195 17732 3369 1 15 . 1 1 463 463 HIS N N 463 123.900 123.900 116.998 6.902 17732 3370 1 15 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.615 -0.015 17732 3371 1 15 . 1 1 463 463 HIS CA C 463 57.200 57.200 56.206 0.994 17732 3372 1 15 . 1 1 463 463 HIS H H 463 8.470 8.470 8.528 -0.058 17732 3373 1 15 . 1 1 464 464 ASN N N 464 124.400 124.400 118.978 5.422 17732 3374 1 15 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.526 0.424 17732 3375 1 15 . 1 1 464 464 ASN CA C 464 51.500 51.500 55.388 -3.888 17732 3376 1 15 . 1 1 464 464 ASN H H 464 8.360 8.360 8.785 -0.425 17732 3377 1 15 . 1 1 465 465 HIS N N 465 112.100 112.100 115.183 -3.083 17732 3378 1 15 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.853 0.017 17732 3379 1 15 . 1 1 465 465 HIS CA C 465 52.900 52.900 54.805 -1.905 17732 3380 1 15 . 1 1 465 465 HIS H H 465 6.830 6.830 7.593 -0.763 17732 3381 1 15 . 1 1 466 466 ASP N N 466 120.300 120.300 124.128 -3.828 17732 3382 1 15 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.519 0.101 17732 3383 1 15 . 1 1 466 466 ASP CA C 466 54.000 54.000 56.341 -2.341 17732 3384 1 15 . 1 1 466 466 ASP H H 466 8.780 8.780 8.880 -0.100 17732 3385 1 15 . 1 1 467 467 LEU N N 467 124.200 124.200 119.496 4.704 17732 3386 1 15 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.339 -0.299 17732 3387 1 15 . 1 1 467 467 LEU CA C 467 54.100 54.100 51.976 2.124 17732 3388 1 15 . 1 1 467 467 LEU H H 467 8.530 8.530 8.147 0.383 17732 3389 1 15 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.178 0.172 17732 3390 1 15 . 1 1 468 468 PRO CA C 468 63.300 63.300 63.560 -0.261 17732 3391 1 16 . 1 1 408 408 LEU N N 408 122.600 122.600 121.097 1.503 17732 3392 1 16 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.676 -0.416 17732 3393 1 16 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.039 0.961 17732 3394 1 16 . 1 1 408 408 LEU H H 408 8.090 8.090 8.151 -0.061 17732 3395 1 16 . 1 1 409 409 ASP N N 409 122.500 122.500 123.657 -1.157 17732 3396 1 16 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.920 -0.280 17732 3397 1 16 . 1 1 409 409 ASP CA C 409 55.100 55.100 54.376 0.724 17732 3398 1 16 . 1 1 409 409 ASP H H 409 8.140 8.140 8.592 -0.452 17732 3399 1 16 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.796 -0.296 17732 3400 1 16 . 1 1 410 410 ASP CA C 410 53.200 53.200 54.544 -1.344 17732 3401 1 16 . 1 1 410 410 ASP H H 410 8.570 8.570 8.098 0.472 17732 3402 1 16 . 1 1 411 411 GLY N N 411 108.400 108.400 107.696 0.704 17732 3403 1 16 . 1 1 411 411 GLY CA C 411 45.300 45.300 45.712 -0.413 17732 3404 1 16 . 1 1 411 411 GLY H H 411 8.520 8.520 8.256 0.264 17732 3405 1 16 . 1 1 412 412 TYR N N 412 118.600 118.600 115.822 2.778 17732 3406 1 16 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.280 0.070 17732 3407 1 16 . 1 1 412 412 TYR CA C 412 58.000 58.000 56.977 1.023 17732 3408 1 16 . 1 1 412 412 TYR H H 412 8.160 8.160 7.591 0.569 17732 3409 1 16 . 1 1 413 413 ARG N N 413 121.100 121.100 121.545 -0.445 17732 3410 1 16 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.598 0.182 17732 3411 1 16 . 1 1 413 413 ARG CA C 413 55.100 55.100 56.521 -1.421 17732 3412 1 16 . 1 1 413 413 ARG H H 413 8.750 8.750 8.538 0.212 17732 3413 1 16 . 1 1 414 414 TRP N N 414 120.600 120.600 123.572 -2.972 17732 3414 1 16 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.243 0.337 17732 3415 1 16 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.544 -0.445 17732 3416 1 16 . 1 1 414 414 TRP H H 414 8.250 8.250 8.656 -0.406 17732 3417 1 16 . 1 1 415 415 ARG N N 415 122.900 122.900 123.152 -0.252 17732 3418 1 16 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.825 0.455 17732 3419 1 16 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.785 -0.186 17732 3420 1 16 . 1 1 415 415 ARG H H 415 9.450 9.450 8.665 0.785 17732 3421 1 16 . 1 1 416 416 LYS N N 416 134.700 134.700 129.207 5.493 17732 3422 1 16 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.731 0.629 17732 3423 1 16 . 1 1 416 416 LYS CA C 416 57.000 57.000 56.670 0.329 17732 3424 1 16 . 1 1 416 416 LYS H H 416 11.120 11.120 8.829 2.291 17732 3425 1 16 . 1 1 417 417 TYR N N 417 118.600 118.600 125.117 -6.517 17732 3426 1 16 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.630 0.630 17732 3427 1 16 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.043 -1.043 17732 3428 1 16 . 1 1 417 417 TYR H H 417 8.900 8.900 8.564 0.336 17732 3429 1 16 . 1 1 418 418 GLY N N 418 105.300 105.300 111.552 -6.252 17732 3430 1 16 . 1 1 418 418 GLY CA C 418 45.900 45.900 45.084 0.816 17732 3431 1 16 . 1 1 418 418 GLY H H 418 6.990 6.990 8.397 -1.407 17732 3432 1 16 . 1 1 419 419 GLN N N 419 122.600 122.600 120.075 2.525 17732 3433 1 16 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.571 0.909 17732 3434 1 16 . 1 1 419 419 GLN CA C 419 56.600 56.600 55.892 0.708 17732 3435 1 16 . 1 1 419 419 GLN H H 419 9.000 9.000 8.365 0.635 17732 3436 1 16 . 1 1 420 420 LYS N N 420 123.000 123.000 125.995 -2.995 17732 3437 1 16 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.693 0.207 17732 3438 1 16 . 1 1 420 420 LYS CA C 420 52.800 52.800 54.651 -1.851 17732 3439 1 16 . 1 1 420 420 LYS H H 420 9.140 9.140 8.249 0.891 17732 3440 1 16 . 1 1 421 421 VAL N N 421 122.800 122.800 122.289 0.511 17732 3441 1 16 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.560 -0.280 17732 3442 1 16 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.961 3.139 17732 3443 1 16 . 1 1 421 421 VAL H H 421 8.550 8.550 8.427 0.123 17732 3444 1 16 . 1 1 422 422 VAL N N 422 128.600 128.600 122.355 6.245 17732 3445 1 16 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.685 -0.115 17732 3446 1 16 . 1 1 422 422 VAL CA C 422 60.200 60.200 60.221 -0.021 17732 3447 1 16 . 1 1 422 422 VAL H H 422 9.500 9.500 8.361 1.139 17732 3448 1 16 . 1 1 423 423 LYS N N 423 123.800 123.800 124.034 -0.234 17732 3449 1 16 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.313 -0.373 17732 3450 1 16 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.034 2.266 17732 3451 1 16 . 1 1 423 423 LYS H H 423 8.880 8.880 8.644 0.236 17732 3452 1 16 . 1 1 424 424 GLY N N 424 110.800 110.800 106.338 4.462 17732 3453 1 16 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.022 -0.722 17732 3454 1 16 . 1 1 424 424 GLY H H 424 8.600 8.600 8.632 -0.032 17732 3455 1 16 . 1 1 425 425 ASN N N 425 119.800 119.800 117.416 2.384 17732 3456 1 16 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.144 -0.004 17732 3457 1 16 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.807 -1.708 17732 3458 1 16 . 1 1 425 425 ASN H H 425 7.600 7.600 7.753 -0.153 17732 3459 1 16 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.171 0.129 17732 3460 1 16 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.339 -0.939 17732 3461 1 16 . 1 1 427 427 TYR N N 427 121.100 121.100 119.266 1.834 17732 3462 1 16 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.628 0.262 17732 3463 1 16 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.659 -0.559 17732 3464 1 16 . 1 1 427 427 TYR H H 427 8.120 8.120 7.938 0.182 17732 3465 1 16 . 1 1 428 428 PRO HA H 428 4.420 4.420 5.072 -0.652 17732 3466 1 16 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.192 1.108 17732 3467 1 16 . 1 1 429 429 ARG N N 429 124.900 124.900 123.434 1.466 17732 3468 1 16 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.515 0.165 17732 3469 1 16 . 1 1 429 429 ARG CA C 429 55.000 55.000 56.029 -1.029 17732 3470 1 16 . 1 1 429 429 ARG H H 429 9.280 9.280 8.920 0.360 17732 3471 1 16 . 1 1 430 430 SER N N 430 122.200 122.200 114.791 7.409 17732 3472 1 16 . 1 1 430 430 SER HA H 430 4.960 4.960 4.626 0.334 17732 3473 1 16 . 1 1 430 430 SER CA C 430 59.300 59.300 57.396 1.904 17732 3474 1 16 . 1 1 430 430 SER H H 430 9.100 9.100 7.670 1.430 17732 3475 1 16 . 1 1 431 431 TYR N N 431 122.100 122.100 122.811 -0.711 17732 3476 1 16 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.632 0.028 17732 3477 1 16 . 1 1 431 431 TYR CA C 431 57.400 57.400 55.936 1.464 17732 3478 1 16 . 1 1 431 431 TYR H H 431 7.590 7.590 8.211 -0.621 17732 3479 1 16 . 1 1 432 432 TYR N N 432 120.300 120.300 124.272 -3.972 17732 3480 1 16 . 1 1 432 432 TYR HA H 432 5.720 5.720 4.859 0.861 17732 3481 1 16 . 1 1 432 432 TYR CA C 432 57.100 57.100 59.089 -1.989 17732 3482 1 16 . 1 1 432 432 TYR H H 432 9.370 9.370 9.227 0.143 17732 3483 1 16 . 1 1 433 433 LYS N N 433 121.500 121.500 125.886 -4.386 17732 3484 1 16 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.492 0.338 17732 3485 1 16 . 1 1 433 433 LYS CA C 433 54.200 54.200 55.044 -0.844 17732 3486 1 16 . 1 1 433 433 LYS H H 433 9.960 9.960 9.042 0.918 17732 3487 1 16 . 1 1 434 434 CYS N N 434 128.700 128.700 127.880 0.820 17732 3488 1 16 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.056 -0.856 17732 3489 1 16 . 1 1 434 434 CYS CA C 434 60.300 60.300 57.079 3.221 17732 3490 1 16 . 1 1 434 434 CYS H H 434 8.440 8.440 9.523 -1.083 17732 3491 1 16 . 1 1 435 435 THR N N 435 118.000 118.000 120.956 -2.956 17732 3492 1 16 . 1 1 435 435 THR HA H 435 4.270 4.270 4.772 -0.502 17732 3493 1 16 . 1 1 435 435 THR CA C 435 62.800 62.800 60.972 1.828 17732 3494 1 16 . 1 1 435 435 THR H H 435 8.200 8.200 7.976 0.224 17732 3495 1 16 . 1 1 436 436 THR N N 436 127.500 127.500 115.744 11.756 17732 3496 1 16 . 1 1 436 436 THR HA H 436 4.230 4.230 4.289 -0.059 17732 3497 1 16 . 1 1 436 436 THR CA C 436 63.300 63.300 61.408 1.892 17732 3498 1 16 . 1 1 436 436 THR H H 436 8.880 8.880 7.745 1.135 17732 3499 1 16 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.166 0.104 17732 3500 1 16 . 1 1 438 438 GLY N N 438 112.800 112.800 109.272 3.528 17732 3501 1 16 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.660 0.740 17732 3502 1 16 . 1 1 438 438 GLY H H 438 8.870 8.870 8.129 0.741 17732 3503 1 16 . 1 1 439 439 CYS N N 439 123.900 123.900 119.305 4.595 17732 3504 1 16 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.871 -0.271 17732 3505 1 16 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.198 2.502 17732 3506 1 16 . 1 1 439 439 CYS H H 439 7.870 7.870 8.423 -0.553 17732 3507 1 16 . 1 1 440 440 GLY N N 440 113.300 113.300 112.285 1.015 17732 3508 1 16 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.317 0.083 17732 3509 1 16 . 1 1 440 440 GLY H H 440 9.070 9.070 8.278 0.792 17732 3510 1 16 . 1 1 441 441 VAL N N 441 123.400 123.400 123.508 -0.108 17732 3511 1 16 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.564 -0.454 17732 3512 1 16 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.374 5.126 17732 3513 1 16 . 1 1 441 441 VAL H H 441 8.230 8.230 8.187 0.043 17732 3514 1 16 . 1 1 442 442 ARG N N 442 126.100 126.100 121.764 4.336 17732 3515 1 16 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.879 -0.229 17732 3516 1 16 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.287 0.013 17732 3517 1 16 . 1 1 442 442 ARG H H 442 8.340 8.340 8.514 -0.174 17732 3518 1 16 . 1 1 443 443 LYS N N 443 120.700 120.700 121.682 -0.982 17732 3519 1 16 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.334 -0.224 17732 3520 1 16 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.985 -0.985 17732 3521 1 16 . 1 1 443 443 LYS H H 443 9.340 9.340 9.370 -0.030 17732 3522 1 16 . 1 1 444 444 HIS N N 444 122.000 122.000 123.584 -1.584 17732 3523 1 16 . 1 1 444 444 HIS HA H 444 5.700 5.700 5.424 0.276 17732 3524 1 16 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.724 -3.724 17732 3525 1 16 . 1 1 444 444 HIS H H 444 8.860 8.860 8.448 0.412 17732 3526 1 16 . 1 1 445 445 VAL N N 445 121.200 121.200 123.658 -2.458 17732 3527 1 16 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.127 -0.317 17732 3528 1 16 . 1 1 445 445 VAL CA C 445 61.600 61.600 61.155 0.445 17732 3529 1 16 . 1 1 445 445 VAL H H 445 8.560 8.560 7.630 0.930 17732 3530 1 16 . 1 1 446 446 GLU N N 446 125.100 125.100 126.183 -1.083 17732 3531 1 16 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.785 0.125 17732 3532 1 16 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.175 0.225 17732 3533 1 16 . 1 1 446 446 GLU H H 446 8.680 8.680 8.295 0.385 17732 3534 1 16 . 1 1 447 447 ARG N N 447 122.400 122.400 122.993 -0.593 17732 3535 1 16 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.755 -0.065 17732 3536 1 16 . 1 1 447 447 ARG CA C 447 55.400 55.400 54.739 0.661 17732 3537 1 16 . 1 1 447 447 ARG H H 447 8.660 8.660 8.611 0.049 17732 3538 1 16 . 1 1 448 448 ALA N N 448 125.000 125.000 127.178 -2.178 17732 3539 1 16 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.149 0.071 17732 3540 1 16 . 1 1 448 448 ALA CA C 448 52.300 52.300 52.317 -0.017 17732 3541 1 16 . 1 1 448 448 ALA H H 448 8.100 8.100 8.562 -0.462 17732 3542 1 16 . 1 1 449 449 ALA N N 449 123.700 123.700 125.575 -1.875 17732 3543 1 16 . 1 1 449 449 ALA HA H 449 4.220 4.220 4.236 -0.016 17732 3544 1 16 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.514 0.686 17732 3545 1 16 . 1 1 449 449 ALA H H 449 8.550 8.550 8.627 -0.077 17732 3546 1 16 . 1 1 450 450 THR N N 450 102.500 102.500 110.349 -7.849 17732 3547 1 16 . 1 1 450 450 THR HA H 450 4.340 4.340 4.489 -0.149 17732 3548 1 16 . 1 1 450 450 THR CA C 450 61.300 61.300 61.599 -0.299 17732 3549 1 16 . 1 1 450 450 THR H H 450 7.600 7.600 7.393 0.207 17732 3550 1 16 . 1 1 451 451 ASP N N 451 118.200 118.200 121.486 -3.286 17732 3551 1 16 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.758 0.152 17732 3552 1 16 . 1 1 451 451 ASP CA C 451 52.000 52.000 54.150 -2.150 17732 3553 1 16 . 1 1 451 451 ASP H H 451 7.060 7.060 7.615 -0.555 17732 3554 1 16 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.016 0.284 17732 3555 1 16 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.722 -0.722 17732 3556 1 16 . 1 1 453 453 LYS N N 453 117.000 117.000 115.526 1.474 17732 3557 1 16 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.258 -0.098 17732 3558 1 16 . 1 1 453 453 LYS CA C 453 56.700 56.700 56.493 0.207 17732 3559 1 16 . 1 1 453 453 LYS H H 453 7.880 7.880 8.298 -0.418 17732 3560 1 16 . 1 1 454 454 ALA N N 454 124.700 124.700 123.453 1.247 17732 3561 1 16 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.651 -0.081 17732 3562 1 16 . 1 1 454 454 ALA CA C 454 51.200 51.200 51.052 0.148 17732 3563 1 16 . 1 1 454 454 ALA H H 454 8.060 8.060 8.191 -0.131 17732 3564 1 16 . 1 1 455 455 VAL N N 455 119.700 119.700 125.055 -5.355 17732 3565 1 16 . 1 1 455 455 VAL HA H 455 4.370 4.370 5.163 -0.793 17732 3566 1 16 . 1 1 455 455 VAL CA C 455 61.400 61.400 60.525 0.875 17732 3567 1 16 . 1 1 455 455 VAL H H 455 8.190 8.190 8.363 -0.173 17732 3568 1 16 . 1 1 456 456 VAL N N 456 129.400 129.400 122.281 7.119 17732 3569 1 16 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.626 -0.316 17732 3570 1 16 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.275 1.625 17732 3571 1 16 . 1 1 456 456 VAL H H 456 9.220 9.220 9.015 0.205 17732 3572 1 16 . 1 1 457 457 THR N N 457 125.000 125.000 121.552 3.448 17732 3573 1 16 . 1 1 457 457 THR HA H 457 5.160 5.160 5.435 -0.275 17732 3574 1 16 . 1 1 457 457 THR CA C 457 61.100 61.100 60.633 0.466 17732 3575 1 16 . 1 1 457 457 THR H H 457 8.560 8.560 8.286 0.274 17732 3576 1 16 . 1 1 458 458 THR N N 458 120.600 120.600 121.809 -1.209 17732 3577 1 16 . 1 1 458 458 THR HA H 458 4.550 4.550 4.668 -0.118 17732 3578 1 16 . 1 1 458 458 THR CA C 458 60.600 60.600 61.469 -0.869 17732 3579 1 16 . 1 1 458 458 THR H H 458 8.560 8.560 8.258 0.302 17732 3580 1 16 . 1 1 459 459 TYR N N 459 122.500 122.500 124.140 -1.640 17732 3581 1 16 . 1 1 459 459 TYR HA H 459 4.940 4.940 5.153 -0.213 17732 3582 1 16 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.326 0.474 17732 3583 1 16 . 1 1 459 459 TYR H H 459 8.870 8.870 8.769 0.101 17732 3584 1 16 . 1 1 460 460 GLU N N 460 123.200 123.200 124.693 -1.493 17732 3585 1 16 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.752 -0.122 17732 3586 1 16 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.829 -0.229 17732 3587 1 16 . 1 1 460 460 GLU H H 460 9.150 9.150 8.857 0.293 17732 3588 1 16 . 1 1 461 461 GLY N N 461 112.700 112.700 112.355 0.345 17732 3589 1 16 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.565 -0.664 17732 3590 1 16 . 1 1 461 461 GLY H H 461 8.330 8.330 8.392 -0.062 17732 3591 1 16 . 1 1 462 462 LYS N N 462 118.300 118.300 121.865 -3.565 17732 3592 1 16 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.374 0.116 17732 3593 1 16 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.275 -1.275 17732 3594 1 16 . 1 1 462 462 LYS H H 462 8.050 8.050 8.411 -0.360 17732 3595 1 16 . 1 1 463 463 HIS N N 463 123.900 123.900 118.170 5.730 17732 3596 1 16 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.738 -0.138 17732 3597 1 16 . 1 1 463 463 HIS CA C 463 57.200 57.200 55.766 1.434 17732 3598 1 16 . 1 1 463 463 HIS H H 463 8.470 8.470 8.454 0.016 17732 3599 1 16 . 1 1 464 464 ASN N N 464 124.400 124.400 122.949 1.451 17732 3600 1 16 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.883 0.067 17732 3601 1 16 . 1 1 464 464 ASN CA C 464 51.500 51.500 52.678 -1.177 17732 3602 1 16 . 1 1 464 464 ASN H H 464 8.360 8.360 8.924 -0.564 17732 3603 1 16 . 1 1 465 465 HIS N N 465 112.100 112.100 116.320 -4.220 17732 3604 1 16 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.696 0.174 17732 3605 1 16 . 1 1 465 465 HIS CA C 465 52.900 52.900 55.012 -2.112 17732 3606 1 16 . 1 1 465 465 HIS H H 465 6.830 6.830 7.331 -0.501 17732 3607 1 16 . 1 1 466 466 ASP N N 466 120.300 120.300 120.227 0.073 17732 3608 1 16 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.751 -0.131 17732 3609 1 16 . 1 1 466 466 ASP CA C 466 54.000 54.000 53.852 0.148 17732 3610 1 16 . 1 1 466 466 ASP H H 466 8.780 8.780 8.448 0.332 17732 3611 1 16 . 1 1 467 467 LEU N N 467 124.200 124.200 123.105 1.095 17732 3612 1 16 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.927 -0.887 17732 3613 1 16 . 1 1 467 467 LEU CA C 467 54.100 54.100 53.194 0.906 17732 3614 1 16 . 1 1 467 467 LEU H H 467 8.530 8.530 8.422 0.108 17732 3615 1 16 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.694 -0.344 17732 3616 1 16 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.456 0.844 17732 3617 1 17 . 1 1 408 408 LEU N N 408 122.600 122.600 122.706 -0.106 17732 3618 1 17 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.671 -0.411 17732 3619 1 17 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.484 0.516 17732 3620 1 17 . 1 1 408 408 LEU H H 408 8.090 8.090 8.371 -0.281 17732 3621 1 17 . 1 1 409 409 ASP N N 409 122.500 122.500 123.284 -0.784 17732 3622 1 17 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.591 0.049 17732 3623 1 17 . 1 1 409 409 ASP CA C 409 55.100 55.100 54.701 0.399 17732 3624 1 17 . 1 1 409 409 ASP H H 409 8.140 8.140 8.387 -0.247 17732 3625 1 17 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.661 -0.161 17732 3626 1 17 . 1 1 410 410 ASP CA C 410 53.200 53.200 53.927 -0.727 17732 3627 1 17 . 1 1 410 410 ASP H H 410 8.570 8.570 9.022 -0.452 17732 3628 1 17 . 1 1 411 411 GLY N N 411 108.400 108.400 106.762 1.638 17732 3629 1 17 . 1 1 411 411 GLY CA C 411 45.300 45.300 44.957 0.343 17732 3630 1 17 . 1 1 411 411 GLY H H 411 8.520 8.520 7.971 0.549 17732 3631 1 17 . 1 1 412 412 TYR N N 412 118.600 118.600 118.368 0.232 17732 3632 1 17 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.769 -0.419 17732 3633 1 17 . 1 1 412 412 TYR CA C 412 58.000 58.000 55.268 2.732 17732 3634 1 17 . 1 1 412 412 TYR H H 412 8.160 8.160 7.702 0.458 17732 3635 1 17 . 1 1 413 413 ARG N N 413 121.100 121.100 121.496 -0.396 17732 3636 1 17 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.664 0.116 17732 3637 1 17 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.073 0.027 17732 3638 1 17 . 1 1 413 413 ARG H H 413 8.750 8.750 8.643 0.107 17732 3639 1 17 . 1 1 414 414 TRP N N 414 120.600 120.600 125.031 -4.431 17732 3640 1 17 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.451 0.129 17732 3641 1 17 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.208 -0.108 17732 3642 1 17 . 1 1 414 414 TRP H H 414 8.250 8.250 8.763 -0.513 17732 3643 1 17 . 1 1 415 415 ARG N N 415 122.900 122.900 123.811 -0.911 17732 3644 1 17 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.884 0.396 17732 3645 1 17 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.844 -0.244 17732 3646 1 17 . 1 1 415 415 ARG H H 415 9.450 9.450 9.506 -0.056 17732 3647 1 17 . 1 1 416 416 LYS N N 416 134.700 134.700 128.609 6.091 17732 3648 1 17 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.728 0.632 17732 3649 1 17 . 1 1 416 416 LYS CA C 416 57.000 57.000 57.261 -0.261 17732 3650 1 17 . 1 1 416 416 LYS H H 416 11.120 11.120 8.935 2.185 17732 3651 1 17 . 1 1 417 417 TYR N N 417 118.600 118.600 117.909 0.691 17732 3652 1 17 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.419 0.841 17732 3653 1 17 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.662 -1.662 17732 3654 1 17 . 1 1 417 417 TYR H H 417 8.900 8.900 7.623 1.277 17732 3655 1 17 . 1 1 418 418 GLY N N 418 105.300 105.300 110.318 -5.018 17732 3656 1 17 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.950 0.950 17732 3657 1 17 . 1 1 418 418 GLY H H 418 6.990 6.990 8.618 -1.628 17732 3658 1 17 . 1 1 419 419 GLN N N 419 122.600 122.600 121.353 1.247 17732 3659 1 17 . 1 1 419 419 GLN HA H 419 5.480 5.480 3.931 1.549 17732 3660 1 17 . 1 1 419 419 GLN CA C 419 56.600 56.600 56.748 -0.148 17732 3661 1 17 . 1 1 419 419 GLN H H 419 9.000 9.000 8.036 0.964 17732 3662 1 17 . 1 1 420 420 LYS N N 420 123.000 123.000 124.184 -1.184 17732 3663 1 17 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.658 0.242 17732 3664 1 17 . 1 1 420 420 LYS CA C 420 52.800 52.800 54.895 -2.095 17732 3665 1 17 . 1 1 420 420 LYS H H 420 9.140 9.140 8.283 0.857 17732 3666 1 17 . 1 1 421 421 VAL N N 421 122.800 122.800 121.573 1.227 17732 3667 1 17 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.337 -0.057 17732 3668 1 17 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.884 3.216 17732 3669 1 17 . 1 1 421 421 VAL H H 421 8.550 8.550 8.305 0.245 17732 3670 1 17 . 1 1 422 422 VAL N N 422 128.600 128.600 122.334 6.266 17732 3671 1 17 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.633 -0.063 17732 3672 1 17 . 1 1 422 422 VAL CA C 422 60.200 60.200 60.167 0.033 17732 3673 1 17 . 1 1 422 422 VAL H H 422 9.500 9.500 8.208 1.292 17732 3674 1 17 . 1 1 423 423 LYS N N 423 123.800 123.800 126.462 -2.662 17732 3675 1 17 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.286 -0.346 17732 3676 1 17 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.679 1.621 17732 3677 1 17 . 1 1 423 423 LYS H H 423 8.880 8.880 8.612 0.268 17732 3678 1 17 . 1 1 424 424 GLY N N 424 110.800 110.800 106.275 4.525 17732 3679 1 17 . 1 1 424 424 GLY CA C 424 45.300 45.300 45.970 -0.670 17732 3680 1 17 . 1 1 424 424 GLY H H 424 8.600 8.600 8.656 -0.056 17732 3681 1 17 . 1 1 425 425 ASN N N 425 119.800 119.800 116.954 2.846 17732 3682 1 17 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.069 0.071 17732 3683 1 17 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.165 -1.065 17732 3684 1 17 . 1 1 425 425 ASN H H 425 7.600 7.600 7.824 -0.224 17732 3685 1 17 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.242 0.058 17732 3686 1 17 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.488 -1.088 17732 3687 1 17 . 1 1 427 427 TYR N N 427 121.100 121.100 119.275 1.825 17732 3688 1 17 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.664 0.226 17732 3689 1 17 . 1 1 427 427 TYR CA C 427 55.100 55.100 54.941 0.159 17732 3690 1 17 . 1 1 427 427 TYR H H 427 8.120 8.120 7.985 0.135 17732 3691 1 17 . 1 1 428 428 PRO HA H 428 4.420 4.420 4.804 -0.384 17732 3692 1 17 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.434 0.866 17732 3693 1 17 . 1 1 429 429 ARG N N 429 124.900 124.900 124.109 0.791 17732 3694 1 17 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.472 0.208 17732 3695 1 17 . 1 1 429 429 ARG CA C 429 55.000 55.000 56.497 -1.497 17732 3696 1 17 . 1 1 429 429 ARG H H 429 9.280 9.280 8.900 0.380 17732 3697 1 17 . 1 1 430 430 SER N N 430 122.200 122.200 116.876 5.324 17732 3698 1 17 . 1 1 430 430 SER HA H 430 4.960 4.960 4.764 0.196 17732 3699 1 17 . 1 1 430 430 SER CA C 430 59.300 59.300 57.590 1.710 17732 3700 1 17 . 1 1 430 430 SER H H 430 9.100 9.100 8.181 0.919 17732 3701 1 17 . 1 1 431 431 TYR N N 431 122.100 122.100 125.134 -3.034 17732 3702 1 17 . 1 1 431 431 TYR HA H 431 4.660 4.660 5.105 -0.445 17732 3703 1 17 . 1 1 431 431 TYR CA C 431 57.400 57.400 56.380 1.020 17732 3704 1 17 . 1 1 431 431 TYR H H 431 7.590 7.590 8.049 -0.459 17732 3705 1 17 . 1 1 432 432 TYR N N 432 120.300 120.300 124.182 -3.882 17732 3706 1 17 . 1 1 432 432 TYR HA H 432 5.720 5.720 4.911 0.809 17732 3707 1 17 . 1 1 432 432 TYR CA C 432 57.100 57.100 58.525 -1.425 17732 3708 1 17 . 1 1 432 432 TYR H H 432 9.370 9.370 8.307 1.063 17732 3709 1 17 . 1 1 433 433 LYS N N 433 121.500 121.500 123.758 -2.258 17732 3710 1 17 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.260 0.570 17732 3711 1 17 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.957 -0.757 17732 3712 1 17 . 1 1 433 433 LYS H H 433 9.960 9.960 9.371 0.589 17732 3713 1 17 . 1 1 434 434 CYS N N 434 128.700 128.700 125.698 3.002 17732 3714 1 17 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.462 -1.262 17732 3715 1 17 . 1 1 434 434 CYS CA C 434 60.300 60.300 56.164 4.136 17732 3716 1 17 . 1 1 434 434 CYS H H 434 8.440 8.440 9.308 -0.868 17732 3717 1 17 . 1 1 435 435 THR N N 435 118.000 118.000 123.536 -5.536 17732 3718 1 17 . 1 1 435 435 THR HA H 435 4.270 4.270 5.020 -0.750 17732 3719 1 17 . 1 1 435 435 THR CA C 435 62.800 62.800 60.757 2.043 17732 3720 1 17 . 1 1 435 435 THR H H 435 8.200 8.200 8.149 0.051 17732 3721 1 17 . 1 1 436 436 THR N N 436 127.500 127.500 118.707 8.793 17732 3722 1 17 . 1 1 436 436 THR HA H 436 4.230 4.230 4.383 -0.153 17732 3723 1 17 . 1 1 436 436 THR CA C 436 63.300 63.300 60.845 2.455 17732 3724 1 17 . 1 1 436 436 THR H H 436 8.880 8.880 7.812 1.068 17732 3725 1 17 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.094 0.176 17732 3726 1 17 . 1 1 438 438 GLY N N 438 112.800 112.800 108.834 3.966 17732 3727 1 17 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.648 0.752 17732 3728 1 17 . 1 1 438 438 GLY H H 438 8.870 8.870 8.171 0.699 17732 3729 1 17 . 1 1 439 439 CYS N N 439 123.900 123.900 119.621 4.279 17732 3730 1 17 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.756 -0.156 17732 3731 1 17 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.011 2.689 17732 3732 1 17 . 1 1 439 439 CYS H H 439 7.870 7.870 8.353 -0.483 17732 3733 1 17 . 1 1 440 440 GLY N N 440 113.300 113.300 113.226 0.074 17732 3734 1 17 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.403 -0.003 17732 3735 1 17 . 1 1 440 440 GLY H H 440 9.070 9.070 8.624 0.446 17732 3736 1 17 . 1 1 441 441 VAL N N 441 123.400 123.400 123.565 -0.165 17732 3737 1 17 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.457 -0.347 17732 3738 1 17 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.247 5.253 17732 3739 1 17 . 1 1 441 441 VAL H H 441 8.230 8.230 8.168 0.062 17732 3740 1 17 . 1 1 442 442 ARG N N 442 126.100 126.100 121.171 4.929 17732 3741 1 17 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.708 -0.058 17732 3742 1 17 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.445 -0.145 17732 3743 1 17 . 1 1 442 442 ARG H H 442 8.340 8.340 8.316 0.024 17732 3744 1 17 . 1 1 443 443 LYS N N 443 120.700 120.700 118.662 2.038 17732 3745 1 17 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.127 -0.017 17732 3746 1 17 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.742 -0.742 17732 3747 1 17 . 1 1 443 443 LYS H H 443 9.340 9.340 8.621 0.719 17732 3748 1 17 . 1 1 444 444 HIS N N 444 122.000 122.000 117.795 4.205 17732 3749 1 17 . 1 1 444 444 HIS HA H 444 5.700 5.700 5.058 0.642 17732 3750 1 17 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.210 -3.210 17732 3751 1 17 . 1 1 444 444 HIS H H 444 8.860 8.860 8.378 0.482 17732 3752 1 17 . 1 1 445 445 VAL N N 445 121.200 121.200 122.364 -1.164 17732 3753 1 17 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.291 -0.481 17732 3754 1 17 . 1 1 445 445 VAL CA C 445 61.600 61.600 60.457 1.143 17732 3755 1 17 . 1 1 445 445 VAL H H 445 8.560 8.560 8.303 0.257 17732 3756 1 17 . 1 1 446 446 GLU N N 446 125.100 125.100 125.283 -0.183 17732 3757 1 17 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.771 0.139 17732 3758 1 17 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.723 -0.323 17732 3759 1 17 . 1 1 446 446 GLU H H 446 8.680 8.680 8.342 0.338 17732 3760 1 17 . 1 1 447 447 ARG N N 447 122.400 122.400 120.225 2.175 17732 3761 1 17 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.467 0.223 17732 3762 1 17 . 1 1 447 447 ARG CA C 447 55.400 55.400 54.881 0.519 17732 3763 1 17 . 1 1 447 447 ARG H H 447 8.660 8.660 8.510 0.150 17732 3764 1 17 . 1 1 448 448 ALA N N 448 125.000 125.000 123.978 1.022 17732 3765 1 17 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.236 -0.016 17732 3766 1 17 . 1 1 448 448 ALA CA C 448 52.300 52.300 51.569 0.731 17732 3767 1 17 . 1 1 448 448 ALA H H 448 8.100 8.100 8.509 -0.409 17732 3768 1 17 . 1 1 449 449 ALA N N 449 123.700 123.700 125.627 -1.927 17732 3769 1 17 . 1 1 449 449 ALA HA H 449 4.220 4.220 4.088 0.132 17732 3770 1 17 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.672 0.528 17732 3771 1 17 . 1 1 449 449 ALA H H 449 8.550 8.550 8.590 -0.040 17732 3772 1 17 . 1 1 450 450 THR N N 450 102.500 102.500 106.083 -3.583 17732 3773 1 17 . 1 1 450 450 THR HA H 450 4.340 4.340 4.549 -0.209 17732 3774 1 17 . 1 1 450 450 THR CA C 450 61.300 61.300 60.825 0.475 17732 3775 1 17 . 1 1 450 450 THR H H 450 7.600 7.600 7.536 0.064 17732 3776 1 17 . 1 1 451 451 ASP N N 451 118.200 118.200 120.999 -2.799 17732 3777 1 17 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.812 0.098 17732 3778 1 17 . 1 1 451 451 ASP CA C 451 52.000 52.000 54.167 -2.167 17732 3779 1 17 . 1 1 451 451 ASP H H 451 7.060 7.060 7.638 -0.578 17732 3780 1 17 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.300 0.000 17732 3781 1 17 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.617 -0.617 17732 3782 1 17 . 1 1 453 453 LYS N N 453 117.000 117.000 115.825 1.175 17732 3783 1 17 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.299 -0.139 17732 3784 1 17 . 1 1 453 453 LYS CA C 453 56.700 56.700 55.893 0.807 17732 3785 1 17 . 1 1 453 453 LYS H H 453 7.880 7.880 8.119 -0.239 17732 3786 1 17 . 1 1 454 454 ALA N N 454 124.700 124.700 123.173 1.527 17732 3787 1 17 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.162 0.408 17732 3788 1 17 . 1 1 454 454 ALA CA C 454 51.200 51.200 52.574 -1.374 17732 3789 1 17 . 1 1 454 454 ALA H H 454 8.060 8.060 7.983 0.077 17732 3790 1 17 . 1 1 455 455 VAL N N 455 119.700 119.700 116.500 3.200 17732 3791 1 17 . 1 1 455 455 VAL HA H 455 4.370 4.370 4.637 -0.267 17732 3792 1 17 . 1 1 455 455 VAL CA C 455 61.400 61.400 62.083 -0.683 17732 3793 1 17 . 1 1 455 455 VAL H H 455 8.190 8.190 8.010 0.180 17732 3794 1 17 . 1 1 456 456 VAL N N 456 129.400 129.400 120.614 8.786 17732 3795 1 17 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.665 -0.355 17732 3796 1 17 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.720 1.180 17732 3797 1 17 . 1 1 456 456 VAL H H 456 9.220 9.220 8.874 0.346 17732 3798 1 17 . 1 1 457 457 THR N N 457 125.000 125.000 121.777 3.223 17732 3799 1 17 . 1 1 457 457 THR HA H 457 5.160 5.160 5.697 -0.537 17732 3800 1 17 . 1 1 457 457 THR CA C 457 61.100 61.100 60.958 0.142 17732 3801 1 17 . 1 1 457 457 THR H H 457 8.560 8.560 8.383 0.177 17732 3802 1 17 . 1 1 458 458 THR N N 458 120.600 120.600 122.861 -2.261 17732 3803 1 17 . 1 1 458 458 THR HA H 458 4.550 4.550 4.750 -0.200 17732 3804 1 17 . 1 1 458 458 THR CA C 458 60.600 60.600 61.860 -1.260 17732 3805 1 17 . 1 1 458 458 THR H H 458 8.560 8.560 8.502 0.058 17732 3806 1 17 . 1 1 459 459 TYR N N 459 122.500 122.500 126.247 -3.747 17732 3807 1 17 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.798 0.142 17732 3808 1 17 . 1 1 459 459 TYR CA C 459 57.800 57.800 56.975 0.825 17732 3809 1 17 . 1 1 459 459 TYR H H 459 8.870 8.870 9.006 -0.136 17732 3810 1 17 . 1 1 460 460 GLU N N 460 123.200 123.200 125.899 -2.699 17732 3811 1 17 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.705 -0.075 17732 3812 1 17 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.023 0.577 17732 3813 1 17 . 1 1 460 460 GLU H H 460 9.150 9.150 8.700 0.450 17732 3814 1 17 . 1 1 461 461 GLY N N 461 112.700 112.700 112.371 0.329 17732 3815 1 17 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.974 -1.074 17732 3816 1 17 . 1 1 461 461 GLY H H 461 8.330 8.330 8.316 0.014 17732 3817 1 17 . 1 1 462 462 LYS N N 462 118.300 118.300 120.756 -2.456 17732 3818 1 17 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.375 0.115 17732 3819 1 17 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.578 -1.578 17732 3820 1 17 . 1 1 462 462 LYS H H 462 8.050 8.050 8.140 -0.090 17732 3821 1 17 . 1 1 463 463 HIS N N 463 123.900 123.900 120.279 3.621 17732 3822 1 17 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.671 -0.071 17732 3823 1 17 . 1 1 463 463 HIS CA C 463 57.200 57.200 55.968 1.232 17732 3824 1 17 . 1 1 463 463 HIS H H 463 8.470 8.470 8.243 0.227 17732 3825 1 17 . 1 1 464 464 ASN N N 464 124.400 124.400 124.256 0.144 17732 3826 1 17 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.822 0.128 17732 3827 1 17 . 1 1 464 464 ASN CA C 464 51.500 51.500 52.448 -0.948 17732 3828 1 17 . 1 1 464 464 ASN H H 464 8.360 8.360 8.856 -0.496 17732 3829 1 17 . 1 1 465 465 HIS N N 465 112.100 112.100 116.313 -4.213 17732 3830 1 17 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.709 0.161 17732 3831 1 17 . 1 1 465 465 HIS CA C 465 52.900 52.900 54.826 -1.926 17732 3832 1 17 . 1 1 465 465 HIS H H 465 6.830 6.830 7.237 -0.407 17732 3833 1 17 . 1 1 466 466 ASP N N 466 120.300 120.300 120.998 -0.698 17732 3834 1 17 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.687 -0.067 17732 3835 1 17 . 1 1 466 466 ASP CA C 466 54.000 54.000 53.697 0.303 17732 3836 1 17 . 1 1 466 466 ASP H H 466 8.780 8.780 8.323 0.457 17732 3837 1 17 . 1 1 467 467 LEU N N 467 124.200 124.200 122.339 1.861 17732 3838 1 17 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.535 -0.495 17732 3839 1 17 . 1 1 467 467 LEU CA C 467 54.100 54.100 54.066 0.034 17732 3840 1 17 . 1 1 467 467 LEU H H 467 8.530 8.530 8.362 0.168 17732 3841 1 17 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.712 -0.362 17732 3842 1 17 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.664 0.636 17732 3843 1 18 . 1 1 408 408 LEU N N 408 122.600 122.600 124.267 -1.667 17732 3844 1 18 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.639 -0.379 17732 3845 1 18 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.442 0.558 17732 3846 1 18 . 1 1 408 408 LEU H H 408 8.090 8.090 8.293 -0.203 17732 3847 1 18 . 1 1 409 409 ASP N N 409 122.500 122.500 122.025 0.475 17732 3848 1 18 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.538 0.102 17732 3849 1 18 . 1 1 409 409 ASP CA C 409 55.100 55.100 55.662 -0.562 17732 3850 1 18 . 1 1 409 409 ASP H H 409 8.140 8.140 8.338 -0.199 17732 3851 1 18 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.870 -0.370 17732 3852 1 18 . 1 1 410 410 ASP CA C 410 53.200 53.200 54.588 -1.388 17732 3853 1 18 . 1 1 410 410 ASP H H 410 8.570 8.570 8.365 0.205 17732 3854 1 18 . 1 1 411 411 GLY N N 411 108.400 108.400 107.392 1.008 17732 3855 1 18 . 1 1 411 411 GLY CA C 411 45.300 45.300 45.922 -0.622 17732 3856 1 18 . 1 1 411 411 GLY H H 411 8.520 8.520 8.413 0.107 17732 3857 1 18 . 1 1 412 412 TYR N N 412 118.600 118.600 119.567 -0.967 17732 3858 1 18 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.544 -0.194 17732 3859 1 18 . 1 1 412 412 TYR CA C 412 58.000 58.000 56.673 1.327 17732 3860 1 18 . 1 1 412 412 TYR H H 412 8.160 8.160 8.156 0.004 17732 3861 1 18 . 1 1 413 413 ARG N N 413 121.100 121.100 120.498 0.602 17732 3862 1 18 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.653 0.127 17732 3863 1 18 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.359 -0.259 17732 3864 1 18 . 1 1 413 413 ARG H H 413 8.750 8.750 8.492 0.258 17732 3865 1 18 . 1 1 414 414 TRP N N 414 120.600 120.600 125.531 -4.931 17732 3866 1 18 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.037 0.543 17732 3867 1 18 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.415 -0.315 17732 3868 1 18 . 1 1 414 414 TRP H H 414 8.250 8.250 8.748 -0.498 17732 3869 1 18 . 1 1 415 415 ARG N N 415 122.900 122.900 123.987 -1.087 17732 3870 1 18 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.925 0.355 17732 3871 1 18 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.534 0.066 17732 3872 1 18 . 1 1 415 415 ARG H H 415 9.450 9.450 8.429 1.021 17732 3873 1 18 . 1 1 416 416 LYS N N 416 134.700 134.700 126.159 8.541 17732 3874 1 18 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.728 0.632 17732 3875 1 18 . 1 1 416 416 LYS CA C 416 57.000 57.000 56.920 0.080 17732 3876 1 18 . 1 1 416 416 LYS H H 416 11.120 11.120 8.752 2.368 17732 3877 1 18 . 1 1 417 417 TYR N N 417 118.600 118.600 120.912 -2.312 17732 3878 1 18 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.455 0.805 17732 3879 1 18 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.509 -1.509 17732 3880 1 18 . 1 1 417 417 TYR H H 417 8.900 8.900 7.762 1.138 17732 3881 1 18 . 1 1 418 418 GLY N N 418 105.300 105.300 110.599 -5.299 17732 3882 1 18 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.705 1.195 17732 3883 1 18 . 1 1 418 418 GLY H H 418 6.990 6.990 8.567 -1.577 17732 3884 1 18 . 1 1 419 419 GLN N N 419 122.600 122.600 119.823 2.777 17732 3885 1 18 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.243 1.237 17732 3886 1 18 . 1 1 419 419 GLN CA C 419 56.600 56.600 56.292 0.308 17732 3887 1 18 . 1 1 419 419 GLN H H 419 9.000 9.000 8.214 0.786 17732 3888 1 18 . 1 1 420 420 LYS N N 420 123.000 123.000 128.094 -5.094 17732 3889 1 18 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.653 0.247 17732 3890 1 18 . 1 1 420 420 LYS CA C 420 52.800 52.800 55.533 -2.733 17732 3891 1 18 . 1 1 420 420 LYS H H 420 9.140 9.140 8.203 0.937 17732 3892 1 18 . 1 1 421 421 VAL N N 421 122.800 122.800 122.934 -0.134 17732 3893 1 18 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.669 -0.389 17732 3894 1 18 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.832 3.268 17732 3895 1 18 . 1 1 421 421 VAL H H 421 8.550 8.550 8.305 0.245 17732 3896 1 18 . 1 1 422 422 VAL N N 422 128.600 128.600 123.890 4.710 17732 3897 1 18 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.618 -0.048 17732 3898 1 18 . 1 1 422 422 VAL CA C 422 60.200 60.200 59.449 0.751 17732 3899 1 18 . 1 1 422 422 VAL H H 422 9.500 9.500 8.611 0.889 17732 3900 1 18 . 1 1 423 423 LYS N N 423 123.800 123.800 126.528 -2.728 17732 3901 1 18 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.265 -0.325 17732 3902 1 18 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.283 2.017 17732 3903 1 18 . 1 1 423 423 LYS H H 423 8.880 8.880 8.459 0.421 17732 3904 1 18 . 1 1 424 424 GLY N N 424 110.800 110.800 107.110 3.690 17732 3905 1 18 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.244 -0.944 17732 3906 1 18 . 1 1 424 424 GLY H H 424 8.600 8.600 8.705 -0.105 17732 3907 1 18 . 1 1 425 425 ASN N N 425 119.800 119.800 116.623 3.177 17732 3908 1 18 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.052 0.088 17732 3909 1 18 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.878 -1.778 17732 3910 1 18 . 1 1 425 425 ASN H H 425 7.600 7.600 7.699 -0.099 17732 3911 1 18 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.271 0.029 17732 3912 1 18 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.270 -0.870 17732 3913 1 18 . 1 1 427 427 TYR N N 427 121.100 121.100 120.177 0.923 17732 3914 1 18 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.627 0.263 17732 3915 1 18 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.276 -0.176 17732 3916 1 18 . 1 1 427 427 TYR H H 427 8.120 8.120 7.581 0.539 17732 3917 1 18 . 1 1 428 428 PRO HA H 428 4.420 4.420 5.120 -0.700 17732 3918 1 18 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.335 0.965 17732 3919 1 18 . 1 1 429 429 ARG N N 429 124.900 124.900 124.439 0.461 17732 3920 1 18 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.539 0.141 17732 3921 1 18 . 1 1 429 429 ARG CA C 429 55.000 55.000 56.277 -1.277 17732 3922 1 18 . 1 1 429 429 ARG H H 429 9.280 9.280 9.034 0.246 17732 3923 1 18 . 1 1 430 430 SER N N 430 122.200 122.200 116.568 5.632 17732 3924 1 18 . 1 1 430 430 SER HA H 430 4.960 4.960 4.774 0.186 17732 3925 1 18 . 1 1 430 430 SER CA C 430 59.300 59.300 57.590 1.710 17732 3926 1 18 . 1 1 430 430 SER H H 430 9.100 9.100 8.204 0.896 17732 3927 1 18 . 1 1 431 431 TYR N N 431 122.100 122.100 124.289 -2.189 17732 3928 1 18 . 1 1 431 431 TYR HA H 431 4.660 4.660 5.097 -0.437 17732 3929 1 18 . 1 1 431 431 TYR CA C 431 57.400 57.400 56.395 1.005 17732 3930 1 18 . 1 1 431 431 TYR H H 431 7.590 7.590 8.137 -0.547 17732 3931 1 18 . 1 1 432 432 TYR N N 432 120.300 120.300 124.519 -4.219 17732 3932 1 18 . 1 1 432 432 TYR HA H 432 5.720 5.720 5.188 0.532 17732 3933 1 18 . 1 1 432 432 TYR CA C 432 57.100 57.100 57.447 -0.347 17732 3934 1 18 . 1 1 432 432 TYR H H 432 9.370 9.370 8.972 0.398 17732 3935 1 18 . 1 1 433 433 LYS N N 433 121.500 121.500 123.959 -2.459 17732 3936 1 18 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.303 0.527 17732 3937 1 18 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.410 -0.210 17732 3938 1 18 . 1 1 433 433 LYS H H 433 9.960 9.960 8.771 1.189 17732 3939 1 18 . 1 1 434 434 CYS N N 434 128.700 128.700 127.535 1.165 17732 3940 1 18 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.206 -1.006 17732 3941 1 18 . 1 1 434 434 CYS CA C 434 60.300 60.300 57.476 2.824 17732 3942 1 18 . 1 1 434 434 CYS H H 434 8.440 8.440 9.193 -0.753 17732 3943 1 18 . 1 1 435 435 THR N N 435 118.000 118.000 121.517 -3.517 17732 3944 1 18 . 1 1 435 435 THR HA H 435 4.270 4.270 4.891 -0.621 17732 3945 1 18 . 1 1 435 435 THR CA C 435 62.800 62.800 60.827 1.973 17732 3946 1 18 . 1 1 435 435 THR H H 435 8.200 8.200 8.166 0.034 17732 3947 1 18 . 1 1 436 436 THR N N 436 127.500 127.500 112.231 15.269 17732 3948 1 18 . 1 1 436 436 THR HA H 436 4.230 4.230 4.466 -0.236 17732 3949 1 18 . 1 1 436 436 THR CA C 436 63.300 63.300 61.037 2.263 17732 3950 1 18 . 1 1 436 436 THR H H 436 8.880 8.880 7.886 0.994 17732 3951 1 18 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.112 0.158 17732 3952 1 18 . 1 1 438 438 GLY N N 438 112.800 112.800 110.111 2.689 17732 3953 1 18 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.524 0.876 17732 3954 1 18 . 1 1 438 438 GLY H H 438 8.870 8.870 8.549 0.321 17732 3955 1 18 . 1 1 439 439 CYS N N 439 123.900 123.900 119.674 4.226 17732 3956 1 18 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.912 -0.312 17732 3957 1 18 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.189 2.511 17732 3958 1 18 . 1 1 439 439 CYS H H 439 7.870 7.870 8.443 -0.573 17732 3959 1 18 . 1 1 440 440 GLY N N 440 113.300 113.300 112.430 0.870 17732 3960 1 18 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.229 0.171 17732 3961 1 18 . 1 1 440 440 GLY H H 440 9.070 9.070 8.285 0.785 17732 3962 1 18 . 1 1 441 441 VAL N N 441 123.400 123.400 123.764 -0.364 17732 3963 1 18 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.517 -0.407 17732 3964 1 18 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.349 5.151 17732 3965 1 18 . 1 1 441 441 VAL H H 441 8.230 8.230 8.696 -0.466 17732 3966 1 18 . 1 1 442 442 ARG N N 442 126.100 126.100 122.954 3.146 17732 3967 1 18 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.159 0.491 17732 3968 1 18 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.453 -0.153 17732 3969 1 18 . 1 1 442 442 ARG H H 442 8.340 8.340 8.331 0.009 17732 3970 1 18 . 1 1 443 443 LYS N N 443 120.700 120.700 121.881 -1.181 17732 3971 1 18 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.091 0.019 17732 3972 1 18 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.855 -0.855 17732 3973 1 18 . 1 1 443 443 LYS H H 443 9.340 9.340 8.999 0.341 17732 3974 1 18 . 1 1 444 444 HIS N N 444 122.000 122.000 122.640 -0.640 17732 3975 1 18 . 1 1 444 444 HIS HA H 444 5.700 5.700 5.058 0.642 17732 3976 1 18 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.499 -3.499 17732 3977 1 18 . 1 1 444 444 HIS H H 444 8.860 8.860 8.079 0.781 17732 3978 1 18 . 1 1 445 445 VAL N N 445 121.200 121.200 124.396 -3.196 17732 3979 1 18 . 1 1 445 445 VAL HA H 445 4.810 4.810 4.836 -0.026 17732 3980 1 18 . 1 1 445 445 VAL CA C 445 61.600 61.600 61.449 0.151 17732 3981 1 18 . 1 1 445 445 VAL H H 445 8.560 8.560 8.953 -0.393 17732 3982 1 18 . 1 1 446 446 GLU N N 446 125.100 125.100 127.112 -2.012 17732 3983 1 18 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.784 0.127 17732 3984 1 18 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.138 0.263 17732 3985 1 18 . 1 1 446 446 GLU H H 446 8.680 8.680 8.337 0.343 17732 3986 1 18 . 1 1 447 447 ARG N N 447 122.400 122.400 121.667 0.733 17732 3987 1 18 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.584 0.106 17732 3988 1 18 . 1 1 447 447 ARG CA C 447 55.400 55.400 55.007 0.393 17732 3989 1 18 . 1 1 447 447 ARG H H 447 8.660 8.660 8.542 0.118 17732 3990 1 18 . 1 1 448 448 ALA N N 448 125.000 125.000 124.901 0.099 17732 3991 1 18 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.477 -0.257 17732 3992 1 18 . 1 1 448 448 ALA CA C 448 52.300 52.300 50.456 1.844 17732 3993 1 18 . 1 1 448 448 ALA H H 448 8.100 8.100 7.995 0.105 17732 3994 1 18 . 1 1 449 449 ALA N N 449 123.700 123.700 128.370 -4.670 17732 3995 1 18 . 1 1 449 449 ALA HA H 449 4.220 4.220 3.849 0.371 17732 3996 1 18 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.990 0.210 17732 3997 1 18 . 1 1 449 449 ALA H H 449 8.550 8.550 8.636 -0.086 17732 3998 1 18 . 1 1 450 450 THR N N 450 102.500 102.500 107.474 -4.974 17732 3999 1 18 . 1 1 450 450 THR HA H 450 4.340 4.340 4.386 -0.046 17732 4000 1 18 . 1 1 450 450 THR CA C 450 61.300 61.300 61.604 -0.304 17732 4001 1 18 . 1 1 450 450 THR H H 450 7.600 7.600 7.526 0.074 17732 4002 1 18 . 1 1 451 451 ASP N N 451 118.200 118.200 120.863 -2.663 17732 4003 1 18 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.938 -0.028 17732 4004 1 18 . 1 1 451 451 ASP CA C 451 52.000 52.000 52.938 -0.938 17732 4005 1 18 . 1 1 451 451 ASP H H 451 7.060 7.060 8.082 -1.022 17732 4006 1 18 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.057 0.243 17732 4007 1 18 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.568 -0.568 17732 4008 1 18 . 1 1 453 453 LYS N N 453 117.000 117.000 115.291 1.709 17732 4009 1 18 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.184 -0.024 17732 4010 1 18 . 1 1 453 453 LYS CA C 453 56.700 56.700 57.124 -0.424 17732 4011 1 18 . 1 1 453 453 LYS H H 453 7.880 7.880 8.371 -0.491 17732 4012 1 18 . 1 1 454 454 ALA N N 454 124.700 124.700 123.020 1.680 17732 4013 1 18 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.509 0.061 17732 4014 1 18 . 1 1 454 454 ALA CA C 454 51.200 51.200 51.307 -0.107 17732 4015 1 18 . 1 1 454 454 ALA H H 454 8.060 8.060 7.976 0.084 17732 4016 1 18 . 1 1 455 455 VAL N N 455 119.700 119.700 123.981 -4.281 17732 4017 1 18 . 1 1 455 455 VAL HA H 455 4.370 4.370 4.773 -0.403 17732 4018 1 18 . 1 1 455 455 VAL CA C 455 61.400 61.400 59.774 1.626 17732 4019 1 18 . 1 1 455 455 VAL H H 455 8.190 8.190 8.343 -0.153 17732 4020 1 18 . 1 1 456 456 VAL N N 456 129.400 129.400 122.471 6.929 17732 4021 1 18 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.575 -0.265 17732 4022 1 18 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.826 1.074 17732 4023 1 18 . 1 1 456 456 VAL H H 456 9.220 9.220 8.856 0.364 17732 4024 1 18 . 1 1 457 457 THR N N 457 125.000 125.000 122.147 2.853 17732 4025 1 18 . 1 1 457 457 THR HA H 457 5.160 5.160 5.134 0.026 17732 4026 1 18 . 1 1 457 457 THR CA C 457 61.100 61.100 60.738 0.362 17732 4027 1 18 . 1 1 457 457 THR H H 457 8.560 8.560 8.376 0.184 17732 4028 1 18 . 1 1 458 458 THR N N 458 120.600 120.600 122.592 -1.992 17732 4029 1 18 . 1 1 458 458 THR HA H 458 4.550 4.550 4.628 -0.078 17732 4030 1 18 . 1 1 458 458 THR CA C 458 60.600 60.600 61.412 -0.812 17732 4031 1 18 . 1 1 458 458 THR H H 458 8.560 8.560 8.198 0.362 17732 4032 1 18 . 1 1 459 459 TYR N N 459 122.500 122.500 125.378 -2.878 17732 4033 1 18 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.918 0.022 17732 4034 1 18 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.404 0.396 17732 4035 1 18 . 1 1 459 459 TYR H H 459 8.870 8.870 8.869 0.001 17732 4036 1 18 . 1 1 460 460 GLU N N 460 123.200 123.200 125.419 -2.219 17732 4037 1 18 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.630 0.000 17732 4038 1 18 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.556 0.044 17732 4039 1 18 . 1 1 460 460 GLU H H 460 9.150 9.150 8.720 0.430 17732 4040 1 18 . 1 1 461 461 GLY N N 461 112.700 112.700 113.009 -0.309 17732 4041 1 18 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.319 -0.418 17732 4042 1 18 . 1 1 461 461 GLY H H 461 8.330 8.330 8.307 0.023 17732 4043 1 18 . 1 1 462 462 LYS N N 462 118.300 118.300 120.735 -2.435 17732 4044 1 18 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.227 0.263 17732 4045 1 18 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.252 -1.252 17732 4046 1 18 . 1 1 462 462 LYS H H 462 8.050 8.050 8.150 -0.100 17732 4047 1 18 . 1 1 463 463 HIS N N 463 123.900 123.900 117.179 6.721 17732 4048 1 18 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.638 -0.038 17732 4049 1 18 . 1 1 463 463 HIS CA C 463 57.200 57.200 55.723 1.477 17732 4050 1 18 . 1 1 463 463 HIS H H 463 8.470 8.470 8.255 0.215 17732 4051 1 18 . 1 1 464 464 ASN N N 464 124.400 124.400 120.979 3.421 17732 4052 1 18 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.753 0.197 17732 4053 1 18 . 1 1 464 464 ASN CA C 464 51.500 51.500 52.468 -0.968 17732 4054 1 18 . 1 1 464 464 ASN H H 464 8.360 8.360 8.515 -0.155 17732 4055 1 18 . 1 1 465 465 HIS N N 465 112.100 112.100 113.947 -1.847 17732 4056 1 18 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.765 0.105 17732 4057 1 18 . 1 1 465 465 HIS CA C 465 52.900 52.900 53.905 -1.005 17732 4058 1 18 . 1 1 465 465 HIS H H 465 6.830 6.830 7.530 -0.700 17732 4059 1 18 . 1 1 466 466 ASP N N 466 120.300 120.300 120.338 -0.038 17732 4060 1 18 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.334 0.286 17732 4061 1 18 . 1 1 466 466 ASP CA C 466 54.000 54.000 56.075 -2.075 17732 4062 1 18 . 1 1 466 466 ASP H H 466 8.780 8.780 8.391 0.389 17732 4063 1 18 . 1 1 467 467 LEU N N 467 124.200 124.200 122.517 1.683 17732 4064 1 18 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.041 -0.001 17732 4065 1 18 . 1 1 467 467 LEU CA C 467 54.100 54.100 52.274 1.826 17732 4066 1 18 . 1 1 467 467 LEU H H 467 8.530 8.530 8.167 0.363 17732 4067 1 18 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.561 -0.211 17732 4068 1 18 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.149 1.151 17732 4069 1 19 . 1 1 408 408 LEU N N 408 122.600 122.600 121.040 1.560 17732 4070 1 19 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.719 -0.459 17732 4071 1 19 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.438 0.562 17732 4072 1 19 . 1 1 408 408 LEU H H 408 8.090 8.090 8.094 -0.004 17732 4073 1 19 . 1 1 409 409 ASP N N 409 122.500 122.500 121.183 1.317 17732 4074 1 19 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.743 -0.103 17732 4075 1 19 . 1 1 409 409 ASP CA C 409 55.100 55.100 54.449 0.651 17732 4076 1 19 . 1 1 409 409 ASP H H 409 8.140 8.140 8.522 -0.382 17732 4077 1 19 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.697 -0.197 17732 4078 1 19 . 1 1 410 410 ASP CA C 410 53.200 53.200 54.739 -1.539 17732 4079 1 19 . 1 1 410 410 ASP H H 410 8.570 8.570 8.308 0.262 17732 4080 1 19 . 1 1 411 411 GLY N N 411 108.400 108.400 107.422 0.978 17732 4081 1 19 . 1 1 411 411 GLY CA C 411 45.300 45.300 45.315 -0.015 17732 4082 1 19 . 1 1 411 411 GLY H H 411 8.520 8.520 8.466 0.054 17732 4083 1 19 . 1 1 412 412 TYR N N 412 118.600 118.600 115.600 3.000 17732 4084 1 19 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.307 0.043 17732 4085 1 19 . 1 1 412 412 TYR CA C 412 58.000 58.000 56.822 1.177 17732 4086 1 19 . 1 1 412 412 TYR H H 412 8.160 8.160 7.492 0.668 17732 4087 1 19 . 1 1 413 413 ARG N N 413 121.100 121.100 121.758 -0.658 17732 4088 1 19 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.510 0.270 17732 4089 1 19 . 1 1 413 413 ARG CA C 413 55.100 55.100 56.322 -1.222 17732 4090 1 19 . 1 1 413 413 ARG H H 413 8.750 8.750 8.421 0.329 17732 4091 1 19 . 1 1 414 414 TRP N N 414 120.600 120.600 123.686 -3.086 17732 4092 1 19 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.421 0.159 17732 4093 1 19 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.341 -0.241 17732 4094 1 19 . 1 1 414 414 TRP H H 414 8.250 8.250 8.609 -0.359 17732 4095 1 19 . 1 1 415 415 ARG N N 415 122.900 122.900 123.053 -0.153 17732 4096 1 19 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.906 0.374 17732 4097 1 19 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.595 0.005 17732 4098 1 19 . 1 1 415 415 ARG H H 415 9.450 9.450 9.406 0.044 17732 4099 1 19 . 1 1 416 416 LYS N N 416 134.700 134.700 127.727 6.973 17732 4100 1 19 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.376 0.984 17732 4101 1 19 . 1 1 416 416 LYS CA C 416 57.000 57.000 57.581 -0.581 17732 4102 1 19 . 1 1 416 416 LYS H H 416 11.120 11.120 8.853 2.267 17732 4103 1 19 . 1 1 417 417 TYR N N 417 118.600 118.600 119.042 -0.442 17732 4104 1 19 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.406 0.854 17732 4105 1 19 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.527 -1.527 17732 4106 1 19 . 1 1 417 417 TYR H H 417 8.900 8.900 7.684 1.216 17732 4107 1 19 . 1 1 418 418 GLY N N 418 105.300 105.300 111.106 -5.806 17732 4108 1 19 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.937 0.963 17732 4109 1 19 . 1 1 418 418 GLY H H 418 6.990 6.990 8.622 -1.632 17732 4110 1 19 . 1 1 419 419 GLN N N 419 122.600 122.600 121.940 0.660 17732 4111 1 19 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.307 1.173 17732 4112 1 19 . 1 1 419 419 GLN CA C 419 56.600 56.600 55.636 0.964 17732 4113 1 19 . 1 1 419 419 GLN H H 419 9.000 9.000 8.352 0.648 17732 4114 1 19 . 1 1 420 420 LYS N N 420 123.000 123.000 126.827 -3.827 17732 4115 1 19 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.447 0.453 17732 4116 1 19 . 1 1 420 420 LYS CA C 420 52.800 52.800 55.473 -2.673 17732 4117 1 19 . 1 1 420 420 LYS H H 420 9.140 9.140 8.069 1.071 17732 4118 1 19 . 1 1 421 421 VAL N N 421 122.800 122.800 121.194 1.606 17732 4119 1 19 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.276 0.004 17732 4120 1 19 . 1 1 421 421 VAL CA C 421 63.100 63.100 60.184 2.916 17732 4121 1 19 . 1 1 421 421 VAL H H 421 8.550 8.550 8.328 0.222 17732 4122 1 19 . 1 1 422 422 VAL N N 422 128.600 128.600 122.983 5.617 17732 4123 1 19 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.602 -0.032 17732 4124 1 19 . 1 1 422 422 VAL CA C 422 60.200 60.200 60.463 -0.263 17732 4125 1 19 . 1 1 422 422 VAL H H 422 9.500 9.500 8.103 1.397 17732 4126 1 19 . 1 1 423 423 LYS N N 423 123.800 123.800 126.846 -3.046 17732 4127 1 19 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.346 -0.406 17732 4128 1 19 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.538 1.762 17732 4129 1 19 . 1 1 423 423 LYS H H 423 8.880 8.880 8.788 0.092 17732 4130 1 19 . 1 1 424 424 GLY N N 424 110.800 110.800 111.974 -1.174 17732 4131 1 19 . 1 1 424 424 GLY CA C 424 45.300 45.300 45.114 0.186 17732 4132 1 19 . 1 1 424 424 GLY H H 424 8.600 8.600 8.799 -0.199 17732 4133 1 19 . 1 1 425 425 ASN N N 425 119.800 119.800 118.536 1.264 17732 4134 1 19 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.180 -0.040 17732 4135 1 19 . 1 1 425 425 ASN CA C 425 50.100 50.100 50.767 -0.667 17732 4136 1 19 . 1 1 425 425 ASN H H 425 7.600 7.600 7.948 -0.348 17732 4137 1 19 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.186 0.114 17732 4138 1 19 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.224 -0.824 17732 4139 1 19 . 1 1 427 427 TYR N N 427 121.100 121.100 119.706 1.394 17732 4140 1 19 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.588 0.302 17732 4141 1 19 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.688 -0.588 17732 4142 1 19 . 1 1 427 427 TYR H H 427 8.120 8.120 7.645 0.475 17732 4143 1 19 . 1 1 428 428 PRO HA H 428 4.420 4.420 4.765 -0.345 17732 4144 1 19 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.612 0.688 17732 4145 1 19 . 1 1 429 429 ARG N N 429 124.900 124.900 124.325 0.575 17732 4146 1 19 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.226 0.454 17732 4147 1 19 . 1 1 429 429 ARG CA C 429 55.000 55.000 56.805 -1.805 17732 4148 1 19 . 1 1 429 429 ARG H H 429 9.280 9.280 8.895 0.385 17732 4149 1 19 . 1 1 430 430 SER N N 430 122.200 122.200 118.335 3.865 17732 4150 1 19 . 1 1 430 430 SER HA H 430 4.960 4.960 4.724 0.236 17732 4151 1 19 . 1 1 430 430 SER CA C 430 59.300 59.300 57.785 1.515 17732 4152 1 19 . 1 1 430 430 SER H H 430 9.100 9.100 8.336 0.764 17732 4153 1 19 . 1 1 431 431 TYR N N 431 122.100 122.100 123.838 -1.738 17732 4154 1 19 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.988 -0.328 17732 4155 1 19 . 1 1 431 431 TYR CA C 431 57.400 57.400 56.443 0.957 17732 4156 1 19 . 1 1 431 431 TYR H H 431 7.590 7.590 8.042 -0.452 17732 4157 1 19 . 1 1 432 432 TYR N N 432 120.300 120.300 123.119 -2.819 17732 4158 1 19 . 1 1 432 432 TYR HA H 432 5.720 5.720 5.044 0.676 17732 4159 1 19 . 1 1 432 432 TYR CA C 432 57.100 57.100 58.013 -0.913 17732 4160 1 19 . 1 1 432 432 TYR H H 432 9.370 9.370 8.380 0.990 17732 4161 1 19 . 1 1 433 433 LYS N N 433 121.500 121.500 123.557 -2.057 17732 4162 1 19 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.331 0.499 17732 4163 1 19 . 1 1 433 433 LYS CA C 433 54.200 54.200 55.123 -0.923 17732 4164 1 19 . 1 1 433 433 LYS H H 433 9.960 9.960 9.383 0.577 17732 4165 1 19 . 1 1 434 434 CYS N N 434 128.700 128.700 126.649 2.051 17732 4166 1 19 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.410 -1.210 17732 4167 1 19 . 1 1 434 434 CYS CA C 434 60.300 60.300 56.810 3.490 17732 4168 1 19 . 1 1 434 434 CYS H H 434 8.440 8.440 9.444 -1.004 17732 4169 1 19 . 1 1 435 435 THR N N 435 118.000 118.000 120.634 -2.634 17732 4170 1 19 . 1 1 435 435 THR HA H 435 4.270 4.270 4.735 -0.465 17732 4171 1 19 . 1 1 435 435 THR CA C 435 62.800 62.800 60.706 2.094 17732 4172 1 19 . 1 1 435 435 THR H H 435 8.200 8.200 8.059 0.141 17732 4173 1 19 . 1 1 436 436 THR N N 436 127.500 127.500 115.979 11.521 17732 4174 1 19 . 1 1 436 436 THR HA H 436 4.230 4.230 4.439 -0.209 17732 4175 1 19 . 1 1 436 436 THR CA C 436 63.300 63.300 60.856 2.444 17732 4176 1 19 . 1 1 436 436 THR H H 436 8.880 8.880 7.872 1.008 17732 4177 1 19 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.145 0.125 17732 4178 1 19 . 1 1 438 438 GLY N N 438 112.800 112.800 108.662 4.138 17732 4179 1 19 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.566 0.834 17732 4180 1 19 . 1 1 438 438 GLY H H 438 8.870 8.870 8.292 0.578 17732 4181 1 19 . 1 1 439 439 CYS N N 439 123.900 123.900 119.552 4.348 17732 4182 1 19 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.767 -0.167 17732 4183 1 19 . 1 1 439 439 CYS CA C 439 60.700 60.700 57.908 2.792 17732 4184 1 19 . 1 1 439 439 CYS H H 439 7.870 7.870 8.315 -0.445 17732 4185 1 19 . 1 1 440 440 GLY N N 440 113.300 113.300 113.751 -0.451 17732 4186 1 19 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.443 -0.043 17732 4187 1 19 . 1 1 440 440 GLY H H 440 9.070 9.070 8.599 0.471 17732 4188 1 19 . 1 1 441 441 VAL N N 441 123.400 123.400 123.048 0.352 17732 4189 1 19 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.385 -0.275 17732 4190 1 19 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.560 4.940 17732 4191 1 19 . 1 1 441 441 VAL H H 441 8.230 8.230 7.552 0.678 17732 4192 1 19 . 1 1 442 442 ARG N N 442 126.100 126.100 121.905 4.195 17732 4193 1 19 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.762 -0.112 17732 4194 1 19 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.668 -0.368 17732 4195 1 19 . 1 1 442 442 ARG H H 442 8.340 8.340 8.516 -0.176 17732 4196 1 19 . 1 1 443 443 LYS N N 443 120.700 120.700 121.005 -0.305 17732 4197 1 19 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.277 -0.167 17732 4198 1 19 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.775 -0.775 17732 4199 1 19 . 1 1 443 443 LYS H H 443 9.340 9.340 9.231 0.109 17732 4200 1 19 . 1 1 444 444 HIS N N 444 122.000 122.000 121.049 0.951 17732 4201 1 19 . 1 1 444 444 HIS HA H 444 5.700 5.700 4.635 1.065 17732 4202 1 19 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.787 -3.787 17732 4203 1 19 . 1 1 444 444 HIS H H 444 8.860 8.860 8.670 0.190 17732 4204 1 19 . 1 1 445 445 VAL N N 445 121.200 121.200 126.045 -4.845 17732 4205 1 19 . 1 1 445 445 VAL HA H 445 4.810 4.810 4.839 -0.029 17732 4206 1 19 . 1 1 445 445 VAL CA C 445 61.600 61.600 61.082 0.518 17732 4207 1 19 . 1 1 445 445 VAL H H 445 8.560 8.560 7.810 0.750 17732 4208 1 19 . 1 1 446 446 GLU N N 446 125.100 125.100 126.049 -0.949 17732 4209 1 19 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.638 0.272 17732 4210 1 19 . 1 1 446 446 GLU CA C 446 54.400 54.400 53.763 0.637 17732 4211 1 19 . 1 1 446 446 GLU H H 446 8.680 8.680 8.292 0.388 17732 4212 1 19 . 1 1 447 447 ARG N N 447 122.400 122.400 122.716 -0.316 17732 4213 1 19 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.342 0.348 17732 4214 1 19 . 1 1 447 447 ARG CA C 447 55.400 55.400 55.131 0.269 17732 4215 1 19 . 1 1 447 447 ARG H H 447 8.660 8.660 8.575 0.085 17732 4216 1 19 . 1 1 448 448 ALA N N 448 125.000 125.000 127.334 -2.334 17732 4217 1 19 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.009 0.211 17732 4218 1 19 . 1 1 448 448 ALA CA C 448 52.300 52.300 52.410 -0.110 17732 4219 1 19 . 1 1 448 448 ALA H H 448 8.100 8.100 8.446 -0.346 17732 4220 1 19 . 1 1 449 449 ALA N N 449 123.700 123.700 125.249 -1.549 17732 4221 1 19 . 1 1 449 449 ALA HA H 449 4.220 4.220 4.044 0.176 17732 4222 1 19 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.476 0.724 17732 4223 1 19 . 1 1 449 449 ALA H H 449 8.550 8.550 8.492 0.058 17732 4224 1 19 . 1 1 450 450 THR N N 450 102.500 102.500 104.461 -1.961 17732 4225 1 19 . 1 1 450 450 THR HA H 450 4.340 4.340 4.411 -0.071 17732 4226 1 19 . 1 1 450 450 THR CA C 450 61.300 61.300 60.870 0.430 17732 4227 1 19 . 1 1 450 450 THR H H 450 7.600 7.600 7.382 0.218 17732 4228 1 19 . 1 1 451 451 ASP N N 451 118.200 118.200 120.976 -2.776 17732 4229 1 19 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.880 0.030 17732 4230 1 19 . 1 1 451 451 ASP CA C 451 52.000 52.000 53.469 -1.469 17732 4231 1 19 . 1 1 451 451 ASP H H 451 7.060 7.060 7.857 -0.797 17732 4232 1 19 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.374 -0.074 17732 4233 1 19 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.102 -0.102 17732 4234 1 19 . 1 1 453 453 LYS N N 453 117.000 117.000 115.426 1.574 17732 4235 1 19 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.336 -0.176 17732 4236 1 19 . 1 1 453 453 LYS CA C 453 56.700 56.700 55.454 1.246 17732 4237 1 19 . 1 1 453 453 LYS H H 453 7.880 7.880 8.086 -0.206 17732 4238 1 19 . 1 1 454 454 ALA N N 454 124.700 124.700 122.797 1.903 17732 4239 1 19 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.173 0.397 17732 4240 1 19 . 1 1 454 454 ALA CA C 454 51.200 51.200 53.149 -1.949 17732 4241 1 19 . 1 1 454 454 ALA H H 454 8.060 8.060 7.367 0.693 17732 4242 1 19 . 1 1 455 455 VAL N N 455 119.700 119.700 116.179 3.521 17732 4243 1 19 . 1 1 455 455 VAL HA H 455 4.370 4.370 3.840 0.530 17732 4244 1 19 . 1 1 455 455 VAL CA C 455 61.400 61.400 62.361 -0.961 17732 4245 1 19 . 1 1 455 455 VAL H H 455 8.190 8.190 7.748 0.442 17732 4246 1 19 . 1 1 456 456 VAL N N 456 129.400 129.400 124.357 5.043 17732 4247 1 19 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.483 -0.173 17732 4248 1 19 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.375 1.525 17732 4249 1 19 . 1 1 456 456 VAL H H 456 9.220 9.220 8.647 0.573 17732 4250 1 19 . 1 1 457 457 THR N N 457 125.000 125.000 122.725 2.275 17732 4251 1 19 . 1 1 457 457 THR HA H 457 5.160 5.160 5.324 -0.164 17732 4252 1 19 . 1 1 457 457 THR CA C 457 61.100 61.100 60.525 0.575 17732 4253 1 19 . 1 1 457 457 THR H H 457 8.560 8.560 8.309 0.251 17732 4254 1 19 . 1 1 458 458 THR N N 458 120.600 120.600 122.716 -2.116 17732 4255 1 19 . 1 1 458 458 THR HA H 458 4.550 4.550 4.600 -0.050 17732 4256 1 19 . 1 1 458 458 THR CA C 458 60.600 60.600 61.319 -0.719 17732 4257 1 19 . 1 1 458 458 THR H H 458 8.560 8.560 8.539 0.021 17732 4258 1 19 . 1 1 459 459 TYR N N 459 122.500 122.500 126.051 -3.551 17732 4259 1 19 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.856 0.084 17732 4260 1 19 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.852 -0.052 17732 4261 1 19 . 1 1 459 459 TYR H H 459 8.870 8.870 8.876 -0.006 17732 4262 1 19 . 1 1 460 460 GLU N N 460 123.200 123.200 125.656 -2.456 17732 4263 1 19 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.791 -0.161 17732 4264 1 19 . 1 1 460 460 GLU CA C 460 55.600 55.600 56.091 -0.491 17732 4265 1 19 . 1 1 460 460 GLU H H 460 9.150 9.150 8.634 0.516 17732 4266 1 19 . 1 1 461 461 GLY N N 461 112.700 112.700 111.250 1.450 17732 4267 1 19 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.631 -0.731 17732 4268 1 19 . 1 1 461 461 GLY H H 461 8.330 8.330 8.410 -0.080 17732 4269 1 19 . 1 1 462 462 LYS N N 462 118.300 118.300 122.921 -4.621 17732 4270 1 19 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.379 0.111 17732 4271 1 19 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.560 -1.560 17732 4272 1 19 . 1 1 462 462 LYS H H 462 8.050 8.050 8.193 -0.143 17732 4273 1 19 . 1 1 463 463 HIS N N 463 123.900 123.900 122.132 1.768 17732 4274 1 19 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.688 -0.088 17732 4275 1 19 . 1 1 463 463 HIS CA C 463 57.200 57.200 56.254 0.946 17732 4276 1 19 . 1 1 463 463 HIS H H 463 8.470 8.470 8.516 -0.046 17732 4277 1 19 . 1 1 464 464 ASN N N 464 124.400 124.400 123.085 1.315 17732 4278 1 19 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.846 0.104 17732 4279 1 19 . 1 1 464 464 ASN CA C 464 51.500 51.500 52.541 -1.041 17732 4280 1 19 . 1 1 464 464 ASN H H 464 8.360 8.360 8.906 -0.546 17732 4281 1 19 . 1 1 465 465 HIS N N 465 112.100 112.100 115.184 -3.084 17732 4282 1 19 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.856 0.014 17732 4283 1 19 . 1 1 465 465 HIS CA C 465 52.900 52.900 54.876 -1.976 17732 4284 1 19 . 1 1 465 465 HIS H H 465 6.830 6.830 7.189 -0.359 17732 4285 1 19 . 1 1 466 466 ASP N N 466 120.300 120.300 122.906 -2.606 17732 4286 1 19 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.376 0.244 17732 4287 1 19 . 1 1 466 466 ASP CA C 466 54.000 54.000 55.725 -1.725 17732 4288 1 19 . 1 1 466 466 ASP H H 466 8.780 8.780 8.671 0.109 17732 4289 1 19 . 1 1 467 467 LEU N N 467 124.200 124.200 116.896 7.304 17732 4290 1 19 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.793 -0.753 17732 4291 1 19 . 1 1 467 467 LEU CA C 467 54.100 54.100 53.534 0.566 17732 4292 1 19 . 1 1 467 467 LEU H H 467 8.530 8.530 8.057 0.473 17732 4293 1 19 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.565 -0.215 17732 4294 1 19 . 1 1 468 468 PRO CA C 468 63.300 63.300 63.413 -0.113 17732 4295 1 20 . 1 1 408 408 LEU N N 408 122.600 122.600 124.768 -2.168 17732 4296 1 20 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.544 -0.284 17732 4297 1 20 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.444 0.556 17732 4298 1 20 . 1 1 408 408 LEU H H 408 8.090 8.090 7.757 0.333 17732 4299 1 20 . 1 1 409 409 ASP N N 409 122.500 122.500 118.956 3.544 17732 4300 1 20 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.868 -0.228 17732 4301 1 20 . 1 1 409 409 ASP CA C 409 55.100 55.100 54.804 0.296 17732 4302 1 20 . 1 1 409 409 ASP H H 409 8.140 8.140 8.195 -0.055 17732 4303 1 20 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.666 -0.166 17732 4304 1 20 . 1 1 410 410 ASP CA C 410 53.200 53.200 54.010 -0.810 17732 4305 1 20 . 1 1 410 410 ASP H H 410 8.570 8.570 8.849 -0.279 17732 4306 1 20 . 1 1 411 411 GLY N N 411 108.400 108.400 107.677 0.723 17732 4307 1 20 . 1 1 411 411 GLY CA C 411 45.300 45.300 44.839 0.461 17732 4308 1 20 . 1 1 411 411 GLY H H 411 8.520 8.520 7.815 0.705 17732 4309 1 20 . 1 1 412 412 TYR N N 412 118.600 118.600 119.052 -0.452 17732 4310 1 20 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.681 -0.331 17732 4311 1 20 . 1 1 412 412 TYR CA C 412 58.000 58.000 55.874 2.126 17732 4312 1 20 . 1 1 412 412 TYR H H 412 8.160 8.160 7.746 0.414 17732 4313 1 20 . 1 1 413 413 ARG N N 413 121.100 121.100 120.519 0.581 17732 4314 1 20 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.703 0.077 17732 4315 1 20 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.419 -0.319 17732 4316 1 20 . 1 1 413 413 ARG H H 413 8.750 8.750 8.558 0.192 17732 4317 1 20 . 1 1 414 414 TRP N N 414 120.600 120.600 124.282 -3.682 17732 4318 1 20 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.244 0.336 17732 4319 1 20 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.549 -0.449 17732 4320 1 20 . 1 1 414 414 TRP H H 414 8.250 8.250 8.765 -0.515 17732 4321 1 20 . 1 1 415 415 ARG N N 415 122.900 122.900 123.385 -0.485 17732 4322 1 20 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.915 0.365 17732 4323 1 20 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.467 0.133 17732 4324 1 20 . 1 1 415 415 ARG H H 415 9.450 9.450 9.031 0.419 17732 4325 1 20 . 1 1 416 416 LYS N N 416 134.700 134.700 127.090 7.610 17732 4326 1 20 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.886 0.474 17732 4327 1 20 . 1 1 416 416 LYS CA C 416 57.000 57.000 56.516 0.485 17732 4328 1 20 . 1 1 416 416 LYS H H 416 11.120 11.120 8.875 2.245 17732 4329 1 20 . 1 1 417 417 TYR N N 417 118.600 118.600 122.610 -4.010 17732 4330 1 20 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.509 0.751 17732 4331 1 20 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.655 -1.655 17732 4332 1 20 . 1 1 417 417 TYR H H 417 8.900 8.900 7.910 0.990 17732 4333 1 20 . 1 1 418 418 GLY N N 418 105.300 105.300 112.523 -7.223 17732 4334 1 20 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.533 1.367 17732 4335 1 20 . 1 1 418 418 GLY H H 418 6.990 6.990 8.357 -1.367 17732 4336 1 20 . 1 1 419 419 GLN N N 419 122.600 122.600 119.849 2.751 17732 4337 1 20 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.617 0.863 17732 4338 1 20 . 1 1 419 419 GLN CA C 419 56.600 56.600 55.683 0.917 17732 4339 1 20 . 1 1 419 419 GLN H H 419 9.000 9.000 8.457 0.543 17732 4340 1 20 . 1 1 420 420 LYS N N 420 123.000 123.000 124.114 -1.114 17732 4341 1 20 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.719 0.181 17732 4342 1 20 . 1 1 420 420 LYS CA C 420 52.800 52.800 54.782 -1.982 17732 4343 1 20 . 1 1 420 420 LYS H H 420 9.140 9.140 8.097 1.043 17732 4344 1 20 . 1 1 421 421 VAL N N 421 122.800 122.800 121.493 1.307 17732 4345 1 20 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.631 -0.351 17732 4346 1 20 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.384 3.716 17732 4347 1 20 . 1 1 421 421 VAL H H 421 8.550 8.550 8.410 0.140 17732 4348 1 20 . 1 1 422 422 VAL N N 422 128.600 128.600 124.902 3.698 17732 4349 1 20 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.545 0.025 17732 4350 1 20 . 1 1 422 422 VAL CA C 422 60.200 60.200 59.360 0.840 17732 4351 1 20 . 1 1 422 422 VAL H H 422 9.500 9.500 8.274 1.226 17732 4352 1 20 . 1 1 423 423 LYS N N 423 123.800 123.800 125.292 -1.492 17732 4353 1 20 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.217 -0.277 17732 4354 1 20 . 1 1 423 423 LYS CA C 423 58.300 58.300 57.048 1.252 17732 4355 1 20 . 1 1 423 423 LYS H H 423 8.880 8.880 8.705 0.175 17732 4356 1 20 . 1 1 424 424 GLY N N 424 110.800 110.800 107.340 3.460 17732 4357 1 20 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.088 -0.788 17732 4358 1 20 . 1 1 424 424 GLY H H 424 8.600 8.600 8.698 -0.098 17732 4359 1 20 . 1 1 425 425 ASN N N 425 119.800 119.800 117.331 2.469 17732 4360 1 20 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.046 0.094 17732 4361 1 20 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.282 -1.182 17732 4362 1 20 . 1 1 425 425 ASN H H 425 7.600 7.600 7.780 -0.180 17732 4363 1 20 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.312 -0.012 17732 4364 1 20 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.290 -0.890 17732 4365 1 20 . 1 1 427 427 TYR N N 427 121.100 121.100 118.802 2.298 17732 4366 1 20 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.675 0.215 17732 4367 1 20 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.065 0.035 17732 4368 1 20 . 1 1 427 427 TYR H H 427 8.120 8.120 8.300 -0.180 17732 4369 1 20 . 1 1 428 428 PRO HA H 428 4.420 4.420 5.179 -0.759 17732 4370 1 20 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.248 1.052 17732 4371 1 20 . 1 1 429 429 ARG N N 429 124.900 124.900 123.526 1.374 17732 4372 1 20 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.458 0.222 17732 4373 1 20 . 1 1 429 429 ARG CA C 429 55.000 55.000 55.566 -0.566 17732 4374 1 20 . 1 1 429 429 ARG H H 429 9.280 9.280 9.154 0.126 17732 4375 1 20 . 1 1 430 430 SER N N 430 122.200 122.200 113.903 8.297 17732 4376 1 20 . 1 1 430 430 SER HA H 430 4.960 4.960 4.764 0.196 17732 4377 1 20 . 1 1 430 430 SER CA C 430 59.300 59.300 57.642 1.659 17732 4378 1 20 . 1 1 430 430 SER H H 430 9.100 9.100 7.935 1.165 17732 4379 1 20 . 1 1 431 431 TYR N N 431 122.100 122.100 122.291 -0.191 17732 4380 1 20 . 1 1 431 431 TYR HA H 431 4.660 4.660 5.004 -0.344 17732 4381 1 20 . 1 1 431 431 TYR CA C 431 57.400 57.400 56.416 0.984 17732 4382 1 20 . 1 1 431 431 TYR H H 431 7.590 7.590 8.108 -0.518 17732 4383 1 20 . 1 1 432 432 TYR N N 432 120.300 120.300 124.672 -4.372 17732 4384 1 20 . 1 1 432 432 TYR HA H 432 5.720 5.720 5.090 0.630 17732 4385 1 20 . 1 1 432 432 TYR CA C 432 57.100 57.100 57.760 -0.660 17732 4386 1 20 . 1 1 432 432 TYR H H 432 9.370 9.370 8.253 1.117 17732 4387 1 20 . 1 1 433 433 LYS N N 433 121.500 121.500 123.033 -1.533 17732 4388 1 20 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.376 0.454 17732 4389 1 20 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.231 -0.031 17732 4390 1 20 . 1 1 433 433 LYS H H 433 9.960 9.960 9.004 0.956 17732 4391 1 20 . 1 1 434 434 CYS N N 434 128.700 128.700 125.746 2.954 17732 4392 1 20 . 1 1 434 434 CYS HA H 434 4.200 4.200 4.989 -0.789 17732 4393 1 20 . 1 1 434 434 CYS CA C 434 60.300 60.300 57.093 3.207 17732 4394 1 20 . 1 1 434 434 CYS H H 434 8.440 8.440 9.146 -0.706 17732 4395 1 20 . 1 1 435 435 THR N N 435 118.000 118.000 121.583 -3.583 17732 4396 1 20 . 1 1 435 435 THR HA H 435 4.270 4.270 4.901 -0.631 17732 4397 1 20 . 1 1 435 435 THR CA C 435 62.800 62.800 60.789 2.011 17732 4398 1 20 . 1 1 435 435 THR H H 435 8.200 8.200 8.156 0.044 17732 4399 1 20 . 1 1 436 436 THR N N 436 127.500 127.500 112.035 15.465 17732 4400 1 20 . 1 1 436 436 THR HA H 436 4.230 4.230 4.389 -0.159 17732 4401 1 20 . 1 1 436 436 THR CA C 436 63.300 63.300 61.281 2.019 17732 4402 1 20 . 1 1 436 436 THR H H 436 8.880 8.880 7.734 1.145 17732 4403 1 20 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.204 0.066 17732 4404 1 20 . 1 1 438 438 GLY N N 438 112.800 112.800 103.223 9.577 17732 4405 1 20 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.181 1.219 17732 4406 1 20 . 1 1 438 438 GLY H H 438 8.870 8.870 8.253 0.617 17732 4407 1 20 . 1 1 439 439 CYS N N 439 123.900 123.900 119.518 4.382 17732 4408 1 20 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.748 -0.148 17732 4409 1 20 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.624 2.076 17732 4410 1 20 . 1 1 439 439 CYS H H 439 7.870 7.870 7.813 0.057 17732 4411 1 20 . 1 1 440 440 GLY N N 440 113.300 113.300 112.038 1.262 17732 4412 1 20 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.265 0.135 17732 4413 1 20 . 1 1 440 440 GLY H H 440 9.070 9.070 8.128 0.942 17732 4414 1 20 . 1 1 441 441 VAL N N 441 123.400 123.400 123.310 0.090 17732 4415 1 20 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.448 -0.338 17732 4416 1 20 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.391 5.109 17732 4417 1 20 . 1 1 441 441 VAL H H 441 8.230 8.230 8.811 -0.581 17732 4418 1 20 . 1 1 442 442 ARG N N 442 126.100 126.100 121.744 4.356 17732 4419 1 20 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.304 0.346 17732 4420 1 20 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.912 -0.612 17732 4421 1 20 . 1 1 442 442 ARG H H 442 8.340 8.340 8.451 -0.111 17732 4422 1 20 . 1 1 443 443 LYS N N 443 120.700 120.700 119.364 1.336 17732 4423 1 20 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.248 -0.138 17732 4424 1 20 . 1 1 443 443 LYS CA C 443 54.000 54.000 55.037 -1.037 17732 4425 1 20 . 1 1 443 443 LYS H H 443 9.340 9.340 8.931 0.409 17732 4426 1 20 . 1 1 444 444 HIS N N 444 122.000 122.000 121.238 0.762 17732 4427 1 20 . 1 1 444 444 HIS HA H 444 5.700 5.700 4.731 0.969 17732 4428 1 20 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.638 -3.638 17732 4429 1 20 . 1 1 444 444 HIS H H 444 8.860 8.860 8.339 0.521 17732 4430 1 20 . 1 1 445 445 VAL N N 445 121.200 121.200 127.480 -6.280 17732 4431 1 20 . 1 1 445 445 VAL HA H 445 4.810 4.810 4.925 -0.115 17732 4432 1 20 . 1 1 445 445 VAL CA C 445 61.600 61.600 61.079 0.521 17732 4433 1 20 . 1 1 445 445 VAL H H 445 8.560 8.560 8.091 0.469 17732 4434 1 20 . 1 1 446 446 GLU N N 446 125.100 125.100 126.318 -1.218 17732 4435 1 20 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.630 0.280 17732 4436 1 20 . 1 1 446 446 GLU CA C 446 54.400 54.400 53.804 0.596 17732 4437 1 20 . 1 1 446 446 GLU H H 446 8.680 8.680 8.618 0.062 17732 4438 1 20 . 1 1 447 447 ARG N N 447 122.400 122.400 121.574 0.826 17732 4439 1 20 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.365 0.325 17732 4440 1 20 . 1 1 447 447 ARG CA C 447 55.400 55.400 54.982 0.418 17732 4441 1 20 . 1 1 447 447 ARG H H 447 8.660 8.660 8.589 0.071 17732 4442 1 20 . 1 1 448 448 ALA N N 448 125.000 125.000 122.866 2.134 17732 4443 1 20 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.464 -0.244 17732 4444 1 20 . 1 1 448 448 ALA CA C 448 52.300 52.300 50.665 1.635 17732 4445 1 20 . 1 1 448 448 ALA H H 448 8.100 8.100 7.915 0.185 17732 4446 1 20 . 1 1 449 449 ALA N N 449 123.700 123.700 127.635 -3.935 17732 4447 1 20 . 1 1 449 449 ALA HA H 449 4.220 4.220 3.928 0.292 17732 4448 1 20 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.850 0.350 17732 4449 1 20 . 1 1 449 449 ALA H H 449 8.550 8.550 8.579 -0.029 17732 4450 1 20 . 1 1 450 450 THR N N 450 102.500 102.500 106.084 -3.584 17732 4451 1 20 . 1 1 450 450 THR HA H 450 4.340 4.340 4.258 0.082 17732 4452 1 20 . 1 1 450 450 THR CA C 450 61.300 61.300 61.915 -0.615 17732 4453 1 20 . 1 1 450 450 THR H H 450 7.600 7.600 7.529 0.071 17732 4454 1 20 . 1 1 451 451 ASP N N 451 118.200 118.200 122.175 -3.975 17732 4455 1 20 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.980 -0.070 17732 4456 1 20 . 1 1 451 451 ASP CA C 451 52.000 52.000 51.359 0.641 17732 4457 1 20 . 1 1 451 451 ASP H H 451 7.060 7.060 7.789 -0.729 17732 4458 1 20 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.063 0.237 17732 4459 1 20 . 1 1 452 452 PRO CA C 452 64.000 64.000 63.840 0.160 17732 4460 1 20 . 1 1 453 453 LYS N N 453 117.000 117.000 116.161 0.839 17732 4461 1 20 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.299 -0.139 17732 4462 1 20 . 1 1 453 453 LYS CA C 453 56.700 56.700 55.866 0.834 17732 4463 1 20 . 1 1 453 453 LYS H H 453 7.880 7.880 7.825 0.055 17732 4464 1 20 . 1 1 454 454 ALA N N 454 124.700 124.700 122.696 2.004 17732 4465 1 20 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.140 0.430 17732 4466 1 20 . 1 1 454 454 ALA CA C 454 51.200 51.200 53.974 -2.774 17732 4467 1 20 . 1 1 454 454 ALA H H 454 8.060 8.060 7.296 0.764 17732 4468 1 20 . 1 1 455 455 VAL N N 455 119.700 119.700 116.244 3.456 17732 4469 1 20 . 1 1 455 455 VAL HA H 455 4.370 4.370 3.862 0.508 17732 4470 1 20 . 1 1 455 455 VAL CA C 455 61.400 61.400 62.512 -1.112 17732 4471 1 20 . 1 1 455 455 VAL H H 455 8.190 8.190 7.978 0.212 17732 4472 1 20 . 1 1 456 456 VAL N N 456 129.400 129.400 122.484 6.916 17732 4473 1 20 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.600 -0.290 17732 4474 1 20 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.685 1.215 17732 4475 1 20 . 1 1 456 456 VAL H H 456 9.220 9.220 8.940 0.280 17732 4476 1 20 . 1 1 457 457 THR N N 457 125.000 125.000 121.277 3.723 17732 4477 1 20 . 1 1 457 457 THR HA H 457 5.160 5.160 5.295 -0.135 17732 4478 1 20 . 1 1 457 457 THR CA C 457 61.100 61.100 60.752 0.348 17732 4479 1 20 . 1 1 457 457 THR H H 457 8.560 8.560 8.216 0.344 17732 4480 1 20 . 1 1 458 458 THR N N 458 120.600 120.600 122.668 -2.068 17732 4481 1 20 . 1 1 458 458 THR HA H 458 4.550 4.550 4.682 -0.132 17732 4482 1 20 . 1 1 458 458 THR CA C 458 60.600 60.600 61.437 -0.837 17732 4483 1 20 . 1 1 458 458 THR H H 458 8.560 8.560 8.545 0.015 17732 4484 1 20 . 1 1 459 459 TYR N N 459 122.500 122.500 126.566 -4.066 17732 4485 1 20 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.797 0.143 17732 4486 1 20 . 1 1 459 459 TYR CA C 459 57.800 57.800 58.157 -0.357 17732 4487 1 20 . 1 1 459 459 TYR H H 459 8.870 8.870 8.958 -0.088 17732 4488 1 20 . 1 1 460 460 GLU N N 460 123.200 123.200 125.883 -2.683 17732 4489 1 20 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.750 -0.120 17732 4490 1 20 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.826 -0.226 17732 4491 1 20 . 1 1 460 460 GLU H H 460 9.150 9.150 8.642 0.508 17732 4492 1 20 . 1 1 461 461 GLY N N 461 112.700 112.700 112.185 0.515 17732 4493 1 20 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.484 -0.584 17732 4494 1 20 . 1 1 461 461 GLY H H 461 8.330 8.330 8.369 -0.039 17732 4495 1 20 . 1 1 462 462 LYS N N 462 118.300 118.300 122.442 -4.142 17732 4496 1 20 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.427 0.063 17732 4497 1 20 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.526 -1.526 17732 4498 1 20 . 1 1 462 462 LYS H H 462 8.050 8.050 8.299 -0.249 17732 4499 1 20 . 1 1 463 463 HIS N N 463 123.900 123.900 118.498 5.402 17732 4500 1 20 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.607 -0.007 17732 4501 1 20 . 1 1 463 463 HIS CA C 463 57.200 57.200 55.464 1.736 17732 4502 1 20 . 1 1 463 463 HIS H H 463 8.470 8.470 8.415 0.055 17732 4503 1 20 . 1 1 464 464 ASN N N 464 124.400 124.400 121.173 3.227 17732 4504 1 20 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.783 0.167 17732 4505 1 20 . 1 1 464 464 ASN CA C 464 51.500 51.500 52.642 -1.142 17732 4506 1 20 . 1 1 464 464 ASN H H 464 8.360 8.360 8.707 -0.347 17732 4507 1 20 . 1 1 465 465 HIS N N 465 112.100 112.100 114.938 -2.838 17732 4508 1 20 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.717 0.153 17732 4509 1 20 . 1 1 465 465 HIS CA C 465 52.900 52.900 53.706 -0.806 17732 4510 1 20 . 1 1 465 465 HIS H H 465 6.830 6.830 7.400 -0.570 17732 4511 1 20 . 1 1 466 466 ASP N N 466 120.300 120.300 121.175 -0.875 17732 4512 1 20 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.297 0.323 17732 4513 1 20 . 1 1 466 466 ASP CA C 466 54.000 54.000 55.845 -1.845 17732 4514 1 20 . 1 1 466 466 ASP H H 466 8.780 8.780 8.352 0.428 17732 4515 1 20 . 1 1 467 467 LEU N N 467 124.200 124.200 122.445 1.755 17732 4516 1 20 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.872 -0.832 17732 4517 1 20 . 1 1 467 467 LEU CA C 467 54.100 54.100 52.734 1.366 17732 4518 1 20 . 1 1 467 467 LEU H H 467 8.530 8.530 8.273 0.257 17732 4519 1 20 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.686 -0.336 17732 4520 1 20 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.436 0.864 17732 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 55 3.805 -0.638 3.786 17732 2 1 1 "Average Difference" HA 65 0.363 -0.058 0.362 17732 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 17732 4 1 1 "Average Difference" CA 60 1.447 -0.136 1.452 17732 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 17732 6 1 1 "Average Difference" HN 56 0.633 -0.217 0.600 17732 7 1 2 "Average Difference" N 55 3.561 -0.405 3.570 17732 8 1 2 "Average Difference" HA 65 0.388 -0.042 0.389 17732 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 17732 10 1 2 "Average Difference" CA 60 1.493 -0.218 1.489 17732 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 17732 12 1 2 "Average Difference" HN 56 0.611 -0.214 0.577 17732 13 1 3 "Average Difference" N 55 3.970 -0.669 3.949 17732 14 1 3 "Average Difference" HA 65 0.384 -0.078 0.379 17732 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 17732 16 1 3 "Average Difference" CA 60 1.456 -0.140 1.461 17732 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 17732 18 1 3 "Average Difference" HN 56 0.639 -0.190 0.616 17732 19 1 4 "Average Difference" N 55 3.846 -0.206 3.876 17732 20 1 4 "Average Difference" HA 65 0.442 -0.044 0.443 17732 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 17732 22 1 4 "Average Difference" CA 60 1.499 -0.189 1.500 17732 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 17732 24 1 4 "Average Difference" HN 56 0.669 -0.114 0.665 17732 25 1 5 "Average Difference" N 55 3.713 -0.663 3.687 17732 26 1 5 "Average Difference" HA 65 0.429 -0.072 0.426 17732 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 17732 28 1 5 "Average Difference" CA 60 1.516 -0.072 1.527 17732 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 17732 30 1 5 "Average Difference" HN 56 0.692 -0.171 0.676 17732 31 1 6 "Average Difference" N 55 3.936 -0.458 3.945 17732 32 1 6 "Average Difference" HA 65 0.418 -0.051 0.418 17732 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 17732 34 1 6 "Average Difference" CA 60 1.501 -0.134 1.508 17732 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 17732 36 1 6 "Average Difference" HN 56 0.662 -0.181 0.643 17732 37 1 7 "Average Difference" N 55 3.941 -1.024 3.841 17732 38 1 7 "Average Difference" HA 65 0.378 -0.051 0.378 17732 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 17732 40 1 7 "Average Difference" CA 60 1.474 -0.115 1.482 17732 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 17732 42 1 7 "Average Difference" HN 56 0.640 -0.184 0.618 17732 43 1 8 "Average Difference" N 55 3.753 -0.805 3.699 17732 44 1 8 "Average Difference" HA 65 0.394 -0.027 0.396 17732 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 17732 46 1 8 "Average Difference" CA 60 1.535 -0.199 1.535 17732 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 17732 48 1 8 "Average Difference" HN 56 0.628 -0.193 0.603 17732 49 1 9 "Average Difference" N 55 3.638 -0.545 3.630 17732 50 1 9 "Average Difference" HA 65 0.395 -0.041 0.396 17732 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 17732 52 1 9 "Average Difference" CA 60 1.476 -0.147 1.481 17732 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 17732 54 1 9 "Average Difference" HN 56 0.668 -0.178 0.650 17732 55 1 10 "Average Difference" N 55 3.804 -0.274 3.830 17732 56 1 10 "Average Difference" HA 65 0.383 -0.089 0.375 17732 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 17732 58 1 10 "Average Difference" CA 60 1.469 -0.104 1.477 17732 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 17732 60 1 10 "Average Difference" HN 56 0.678 -0.152 0.667 17732 61 1 11 "Average Difference" N 55 3.658 -0.563 3.647 17732 62 1 11 "Average Difference" HA 65 0.428 -0.025 0.431 17732 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 17732 64 1 11 "Average Difference" CA 60 1.522 -0.158 1.526 17732 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 17732 66 1 11 "Average Difference" HN 56 0.634 -0.184 0.612 17732 67 1 12 "Average Difference" N 55 3.558 -0.478 3.558 17732 68 1 12 "Average Difference" HA 65 0.394 -0.075 0.390 17732 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 17732 70 1 12 "Average Difference" CA 60 1.440 -0.070 1.450 17732 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 17732 72 1 12 "Average Difference" HN 56 0.650 -0.220 0.617 17732 73 1 13 "Average Difference" N 55 3.709 -0.464 3.714 17732 74 1 13 "Average Difference" HA 65 0.423 -0.049 0.424 17732 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 17732 76 1 13 "Average Difference" CA 60 1.521 -0.140 1.528 17732 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 17732 78 1 13 "Average Difference" HN 56 0.663 -0.217 0.632 17732 79 1 14 "Average Difference" N 55 3.443 -0.272 3.464 17732 80 1 14 "Average Difference" HA 65 0.389 -0.055 0.388 17732 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 17732 82 1 14 "Average Difference" CA 60 1.574 -0.049 1.587 17732 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 17732 84 1 14 "Average Difference" HN 56 0.688 -0.238 0.651 17732 85 1 15 "Average Difference" N 55 4.176 -0.605 4.170 17732 86 1 15 "Average Difference" HA 65 0.386 -0.009 0.388 17732 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 17732 88 1 15 "Average Difference" CA 60 1.639 -0.215 1.638 17732 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 17732 90 1 15 "Average Difference" HN 56 0.660 -0.178 0.642 17732 91 1 16 "Average Difference" N 55 3.741 -0.237 3.768 17732 92 1 16 "Average Difference" HA 65 0.375 0.019 0.378 17732 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 17732 94 1 16 "Average Difference" CA 60 1.487 -0.171 1.490 17732 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 17732 96 1 16 "Average Difference" HN 56 0.629 -0.165 0.613 17732 97 1 17 "Average Difference" N 55 3.372 -0.636 3.342 17732 98 1 17 "Average Difference" HA 65 0.417 -0.026 0.420 17732 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 17732 100 1 17 "Average Difference" CA 60 1.532 -0.204 1.531 17732 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 17732 102 1 17 "Average Difference" HN 56 0.625 -0.181 0.603 17732 103 1 18 "Average Difference" N 55 3.826 -0.234 3.854 17732 104 1 18 "Average Difference" HA 65 0.388 -0.054 0.388 17732 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 17732 106 1 18 "Average Difference" CA 60 1.480 -0.224 1.475 17732 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 17732 108 1 18 "Average Difference" HN 56 0.640 -0.176 0.621 17732 109 1 19 "Average Difference" N 55 3.340 -0.385 3.348 17732 110 1 19 "Average Difference" HA 65 0.412 -0.076 0.408 17732 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 17732 112 1 19 "Average Difference" CA 60 1.503 -0.077 1.514 17732 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 17732 114 1 19 "Average Difference" HN 56 0.645 -0.209 0.616 17732 115 1 20 "Average Difference" N 55 4.179 -0.784 4.142 17732 116 1 20 "Average Difference" HA 65 0.376 -0.046 0.376 17732 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 17732 118 1 20 "Average Difference" CA 60 1.502 -0.265 1.491 17732 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 17732 120 1 20 "Average Difference" HN 56 0.635 -0.226 0.599 17732 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 17732 _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 1 408 408 LEU N N 408 122.600 122.600 121.797 0.803 17732 2 1 . 1 1 408 408 LEU HA H 408 4.260 4.260 4.507 -0.247 17732 3 1 . 1 1 408 408 LEU CA C 408 55.000 55.000 54.945 0.055 17732 4 1 . 1 1 408 408 LEU H H 408 8.090 8.090 8.248 -0.157 17732 5 1 . 1 1 409 409 ASP N N 409 122.500 122.500 120.503 1.997 17732 6 1 . 1 1 409 409 ASP HA H 409 4.640 4.640 4.706 -0.066 17732 7 1 . 1 1 409 409 ASP CA C 409 55.100 55.100 54.773 0.327 17732 8 1 . 1 1 409 409 ASP H H 409 8.140 8.140 8.311 -0.171 17732 9 1 . 1 1 410 410 ASP HA H 410 4.500 4.500 4.670 -0.170 17732 10 1 . 1 1 410 410 ASP CA C 410 53.200 53.200 54.425 -1.225 17732 11 1 . 1 1 410 410 ASP H H 410 8.570 8.570 8.584 -0.014 17732 12 1 . 1 1 411 411 GLY N N 411 108.400 108.400 106.917 1.483 17732 13 1 . 1 1 411 411 GLY CA C 411 45.300 45.300 45.179 0.121 17732 14 1 . 1 1 411 411 GLY H H 411 8.520 8.520 8.118 0.402 17732 15 1 . 1 1 412 412 TYR N N 412 118.600 118.600 117.946 0.654 17732 16 1 . 1 1 412 412 TYR HA H 412 4.350 4.350 4.573 -0.223 17732 17 1 . 1 1 412 412 TYR CA C 412 58.000 58.000 56.593 1.407 17732 18 1 . 1 1 412 412 TYR H H 412 8.160 8.160 7.880 0.280 17732 19 1 . 1 1 413 413 ARG N N 413 121.100 121.100 120.959 0.141 17732 20 1 . 1 1 413 413 ARG HA H 413 4.780 4.780 4.622 0.158 17732 21 1 . 1 1 413 413 ARG CA C 413 55.100 55.100 55.667 -0.567 17732 22 1 . 1 1 413 413 ARG H H 413 8.750 8.750 8.549 0.201 17732 23 1 . 1 1 414 414 TRP N N 414 120.600 120.600 124.243 -3.643 17732 24 1 . 1 1 414 414 TRP HA H 414 5.580 5.580 5.257 0.323 17732 25 1 . 1 1 414 414 TRP CA C 414 56.100 56.100 56.305 -0.206 17732 26 1 . 1 1 414 414 TRP H H 414 8.250 8.250 8.721 -0.471 17732 27 1 . 1 1 415 415 ARG N N 415 122.900 122.900 123.898 -0.998 17732 28 1 . 1 1 415 415 ARG HA H 415 5.280 5.280 4.864 0.416 17732 29 1 . 1 1 415 415 ARG CA C 415 54.600 54.600 54.600 -0.000 17732 30 1 . 1 1 415 415 ARG H H 415 9.450 9.450 8.888 0.562 17732 31 1 . 1 1 416 416 LYS N N 416 134.700 134.700 128.180 6.520 17732 32 1 . 1 1 416 416 LYS HA H 416 4.360 4.360 3.700 0.660 17732 33 1 . 1 1 416 416 LYS CA C 416 57.000 57.000 56.986 0.014 17732 34 1 . 1 1 416 416 LYS H H 416 11.120 11.120 8.851 2.269 17732 35 1 . 1 1 417 417 TYR N N 417 118.600 118.600 121.125 -2.525 17732 36 1 . 1 1 417 417 TYR HA H 417 5.260 5.260 4.498 0.762 17732 37 1 . 1 1 417 417 TYR CA C 417 56.000 56.000 57.496 -1.496 17732 38 1 . 1 1 417 417 TYR H H 417 8.900 8.900 7.841 1.059 17732 39 1 . 1 1 418 418 GLY N N 418 105.300 105.300 111.100 -5.800 17732 40 1 . 1 1 418 418 GLY CA C 418 45.900 45.900 44.867 1.033 17732 41 1 . 1 1 418 418 GLY H H 418 6.990 6.990 8.542 -1.552 17732 42 1 . 1 1 419 419 GLN N N 419 122.600 122.600 120.790 1.809 17732 43 1 . 1 1 419 419 GLN HA H 419 5.480 5.480 4.334 1.146 17732 44 1 . 1 1 419 419 GLN CA C 419 56.600 56.600 55.994 0.606 17732 45 1 . 1 1 419 419 GLN H H 419 9.000 9.000 8.283 0.717 17732 46 1 . 1 1 420 420 LYS N N 420 123.000 123.000 126.018 -3.018 17732 47 1 . 1 1 420 420 LYS HA H 420 4.900 4.900 4.634 0.266 17732 48 1 . 1 1 420 420 LYS CA C 420 52.800 52.800 55.135 -2.335 17732 49 1 . 1 1 420 420 LYS H H 420 9.140 9.140 8.280 0.860 17732 50 1 . 1 1 421 421 VAL N N 421 122.800 122.800 121.715 1.085 17732 51 1 . 1 1 421 421 VAL HA H 421 4.280 4.280 4.487 -0.207 17732 52 1 . 1 1 421 421 VAL CA C 421 63.100 63.100 59.865 3.235 17732 53 1 . 1 1 421 421 VAL H H 421 8.550 8.550 8.327 0.223 17732 54 1 . 1 1 422 422 VAL N N 422 128.600 128.600 122.829 5.771 17732 55 1 . 1 1 422 422 VAL HA H 422 4.570 4.570 4.609 -0.040 17732 56 1 . 1 1 422 422 VAL CA C 422 60.200 60.200 59.886 0.314 17732 57 1 . 1 1 422 422 VAL H H 422 9.500 9.500 8.342 1.158 17732 58 1 . 1 1 423 423 LYS N N 423 123.800 123.800 125.989 -2.189 17732 59 1 . 1 1 423 423 LYS HA H 423 3.940 3.940 4.263 -0.323 17732 60 1 . 1 1 423 423 LYS CA C 423 58.300 58.300 56.611 1.689 17732 61 1 . 1 1 423 423 LYS H H 423 8.880 8.880 8.616 0.264 17732 62 1 . 1 1 424 424 GLY N N 424 110.800 110.800 107.310 3.490 17732 63 1 . 1 1 424 424 GLY CA C 424 45.300 45.300 46.004 -0.704 17732 64 1 . 1 1 424 424 GLY H H 424 8.600 8.600 8.674 -0.074 17732 65 1 . 1 1 425 425 ASN N N 425 119.800 119.800 117.163 2.637 17732 66 1 . 1 1 425 425 ASN HA H 425 5.140 5.140 5.067 0.073 17732 67 1 . 1 1 425 425 ASN CA C 425 50.100 50.100 51.517 -1.417 17732 68 1 . 1 1 425 425 ASN H H 425 7.600 7.600 7.794 -0.194 17732 69 1 . 1 1 426 426 PRO HA H 426 4.300 4.300 4.241 0.059 17732 70 1 . 1 1 426 426 PRO CA C 426 63.400 63.400 64.348 -0.948 17732 71 1 . 1 1 427 427 TYR N N 427 121.100 121.100 119.422 1.678 17732 72 1 . 1 1 427 427 TYR HA H 427 4.890 4.890 4.652 0.238 17732 73 1 . 1 1 427 427 TYR CA C 427 55.100 55.100 55.258 -0.158 17732 74 1 . 1 1 427 427 TYR H H 427 8.120 8.120 7.983 0.137 17732 75 1 . 1 1 428 428 PRO HA H 428 4.420 4.420 4.972 -0.552 17732 76 1 . 1 1 428 428 PRO CA C 428 63.300 63.300 62.346 0.954 17732 77 1 . 1 1 429 429 ARG N N 429 124.900 124.900 123.980 0.920 17732 78 1 . 1 1 429 429 ARG HA H 429 4.680 4.680 4.475 0.205 17732 79 1 . 1 1 429 429 ARG CA C 429 55.000 55.000 55.911 -0.911 17732 80 1 . 1 1 429 429 ARG H H 429 9.280 9.280 8.909 0.371 17732 81 1 . 1 1 430 430 SER N N 430 122.200 122.200 116.745 5.455 17732 82 1 . 1 1 430 430 SER HA H 430 4.960 4.960 4.711 0.249 17732 83 1 . 1 1 430 430 SER CA C 430 59.300 59.300 57.567 1.733 17732 84 1 . 1 1 430 430 SER H H 430 9.100 9.100 8.194 0.906 17732 85 1 . 1 1 431 431 TYR N N 431 122.100 122.100 123.865 -1.765 17732 86 1 . 1 1 431 431 TYR HA H 431 4.660 4.660 4.883 -0.223 17732 87 1 . 1 1 431 431 TYR CA C 431 57.400 57.400 56.748 0.652 17732 88 1 . 1 1 431 431 TYR H H 431 7.590 7.590 8.074 -0.484 17732 89 1 . 1 1 432 432 TYR N N 432 120.300 120.300 124.004 -3.704 17732 90 1 . 1 1 432 432 TYR HA H 432 5.720 5.720 4.970 0.750 17732 91 1 . 1 1 432 432 TYR CA C 432 57.100 57.100 58.115 -1.015 17732 92 1 . 1 1 432 432 TYR H H 432 9.370 9.370 8.599 0.771 17732 93 1 . 1 1 433 433 LYS N N 433 121.500 121.500 124.008 -2.508 17732 94 1 . 1 1 433 433 LYS HA H 433 5.830 5.830 5.357 0.473 17732 95 1 . 1 1 433 433 LYS CA C 433 54.200 54.200 54.769 -0.569 17732 96 1 . 1 1 433 433 LYS H H 433 9.960 9.960 8.780 1.180 17732 97 1 . 1 1 434 434 CYS N N 434 128.700 128.700 126.513 2.187 17732 98 1 . 1 1 434 434 CYS HA H 434 4.200 4.200 5.209 -1.009 17732 99 1 . 1 1 434 434 CYS CA C 434 60.300 60.300 57.252 3.048 17732 100 1 . 1 1 434 434 CYS H H 434 8.440 8.440 9.249 -0.809 17732 101 1 . 1 1 435 435 THR N N 435 118.000 118.000 121.792 -3.792 17732 102 1 . 1 1 435 435 THR HA H 435 4.270 4.270 4.979 -0.709 17732 103 1 . 1 1 435 435 THR CA C 435 62.800 62.800 60.872 1.928 17732 104 1 . 1 1 435 435 THR H H 435 8.200 8.200 8.118 0.082 17732 105 1 . 1 1 436 436 THR N N 436 127.500 127.500 114.894 12.606 17732 106 1 . 1 1 436 436 THR HA H 436 4.230 4.230 4.439 -0.209 17732 107 1 . 1 1 436 436 THR CA C 436 63.300 63.300 60.875 2.425 17732 108 1 . 1 1 436 436 THR H H 436 8.880 8.880 7.843 1.037 17732 109 1 . 1 1 437 437 PRO HA H 437 4.270 4.270 4.176 0.094 17732 110 1 . 1 1 438 438 GLY N N 438 112.800 112.800 108.143 4.656 17732 111 1 . 1 1 438 438 GLY CA C 438 45.400 45.400 44.471 0.929 17732 112 1 . 1 1 438 438 GLY H H 438 8.870 8.870 8.360 0.510 17732 113 1 . 1 1 439 439 CYS N N 439 123.900 123.900 119.639 4.261 17732 114 1 . 1 1 439 439 CYS HA H 439 4.600 4.600 4.868 -0.268 17732 115 1 . 1 1 439 439 CYS CA C 439 60.700 60.700 58.249 2.451 17732 116 1 . 1 1 439 439 CYS H H 439 7.870 7.870 8.163 -0.293 17732 117 1 . 1 1 440 440 GLY N N 440 113.300 113.300 113.364 -0.064 17732 118 1 . 1 1 440 440 GLY CA C 440 45.400 45.400 45.375 0.025 17732 119 1 . 1 1 440 440 GLY H H 440 9.070 9.070 8.389 0.680 17732 120 1 . 1 1 441 441 VAL N N 441 123.400 123.400 123.658 -0.258 17732 121 1 . 1 1 441 441 VAL HA H 441 4.110 4.110 4.403 -0.293 17732 122 1 . 1 1 441 441 VAL CA C 441 65.500 65.500 60.522 4.978 17732 123 1 . 1 1 441 441 VAL H H 441 8.230 8.230 8.322 -0.092 17732 124 1 . 1 1 442 442 ARG N N 442 126.100 126.100 122.422 3.678 17732 125 1 . 1 1 442 442 ARG HA H 442 5.650 5.650 5.387 0.263 17732 126 1 . 1 1 442 442 ARG CA C 442 54.300 54.300 54.590 -0.290 17732 127 1 . 1 1 442 442 ARG H H 442 8.340 8.340 8.532 -0.192 17732 128 1 . 1 1 443 443 LYS N N 443 120.700 120.700 120.912 -0.212 17732 129 1 . 1 1 443 443 LYS HA H 443 5.110 5.110 5.094 0.016 17732 130 1 . 1 1 443 443 LYS CA C 443 54.000 54.000 54.865 -0.865 17732 131 1 . 1 1 443 443 LYS H H 443 9.340 9.340 8.967 0.373 17732 132 1 . 1 1 444 444 HIS N N 444 122.000 122.000 121.200 0.800 17732 133 1 . 1 1 444 444 HIS HA H 444 5.700 5.700 4.978 0.722 17732 134 1 . 1 1 444 444 HIS CA C 444 51.000 51.000 54.456 -3.456 17732 135 1 . 1 1 444 444 HIS H H 444 8.860 8.860 8.394 0.466 17732 136 1 . 1 1 445 445 VAL N N 445 121.200 121.200 123.486 -2.286 17732 137 1 . 1 1 445 445 VAL HA H 445 4.810 4.810 5.081 -0.271 17732 138 1 . 1 1 445 445 VAL CA C 445 61.600 61.600 60.787 0.813 17732 139 1 . 1 1 445 445 VAL H H 445 8.560 8.560 8.203 0.357 17732 140 1 . 1 1 446 446 GLU N N 446 125.100 125.100 125.775 -0.675 17732 141 1 . 1 1 446 446 GLU HA H 446 4.910 4.910 4.748 0.162 17732 142 1 . 1 1 446 446 GLU CA C 446 54.400 54.400 54.191 0.210 17732 143 1 . 1 1 446 446 GLU H H 446 8.680 8.680 8.402 0.277 17732 144 1 . 1 1 447 447 ARG N N 447 122.400 122.400 121.836 0.564 17732 145 1 . 1 1 447 447 ARG HA H 447 4.690 4.690 4.571 0.119 17732 146 1 . 1 1 447 447 ARG CA C 447 55.400 55.400 55.093 0.307 17732 147 1 . 1 1 447 447 ARG H H 447 8.660 8.660 8.611 0.049 17732 148 1 . 1 1 448 448 ALA N N 448 125.000 125.000 125.257 -0.257 17732 149 1 . 1 1 448 448 ALA HA H 448 4.220 4.220 4.275 -0.055 17732 150 1 . 1 1 448 448 ALA CA C 448 52.300 52.300 51.477 0.823 17732 151 1 . 1 1 448 448 ALA H H 448 8.100 8.100 8.193 -0.093 17732 152 1 . 1 1 449 449 ALA N N 449 123.700 123.700 126.422 -2.722 17732 153 1 . 1 1 449 449 ALA HA H 449 4.220 4.220 3.970 0.250 17732 154 1 . 1 1 449 449 ALA CA C 449 55.200 55.200 54.593 0.607 17732 155 1 . 1 1 449 449 ALA H H 449 8.550 8.550 8.685 -0.135 17732 156 1 . 1 1 450 450 THR N N 450 102.500 102.500 107.003 -4.503 17732 157 1 . 1 1 450 450 THR HA H 450 4.340 4.340 4.374 -0.034 17732 158 1 . 1 1 450 450 THR CA C 450 61.300 61.300 61.898 -0.598 17732 159 1 . 1 1 450 450 THR H H 450 7.600 7.600 7.697 -0.097 17732 160 1 . 1 1 451 451 ASP N N 451 118.200 118.200 121.438 -3.238 17732 161 1 . 1 1 451 451 ASP HA H 451 4.910 4.910 4.894 0.016 17732 162 1 . 1 1 451 451 ASP CA C 451 52.000 52.000 52.792 -0.792 17732 163 1 . 1 1 451 451 ASP H H 451 7.060 7.060 7.858 -0.798 17732 164 1 . 1 1 452 452 PRO HA H 452 4.300 4.300 4.203 0.097 17732 165 1 . 1 1 452 452 PRO CA C 452 64.000 64.000 64.397 -0.396 17732 166 1 . 1 1 453 453 LYS N N 453 117.000 117.000 115.960 1.041 17732 167 1 . 1 1 453 453 LYS HA H 453 4.160 4.160 4.301 -0.141 17732 168 1 . 1 1 453 453 LYS CA C 453 56.700 56.700 56.106 0.594 17732 169 1 . 1 1 453 453 LYS H H 453 7.880 7.880 8.197 -0.317 17732 170 1 . 1 1 454 454 ALA N N 454 124.700 124.700 123.203 1.497 17732 171 1 . 1 1 454 454 ALA HA H 454 4.570 4.570 4.385 0.185 17732 172 1 . 1 1 454 454 ALA CA C 454 51.200 51.200 52.111 -0.911 17732 173 1 . 1 1 454 454 ALA H H 454 8.060 8.060 7.637 0.423 17732 174 1 . 1 1 455 455 VAL N N 455 119.700 119.700 120.213 -0.513 17732 175 1 . 1 1 455 455 VAL HA H 455 4.370 4.370 4.528 -0.158 17732 176 1 . 1 1 455 455 VAL CA C 455 61.400 61.400 61.392 0.008 17732 177 1 . 1 1 455 455 VAL H H 455 8.190 8.190 8.111 0.079 17732 178 1 . 1 1 456 456 VAL N N 456 129.400 129.400 122.643 6.757 17732 179 1 . 1 1 456 456 VAL HA H 456 4.310 4.310 4.586 -0.276 17732 180 1 . 1 1 456 456 VAL CA C 456 61.900 61.900 60.446 1.453 17732 181 1 . 1 1 456 456 VAL H H 456 9.220 9.220 8.866 0.354 17732 182 1 . 1 1 457 457 THR N N 457 125.000 125.000 121.895 3.105 17732 183 1 . 1 1 457 457 THR HA H 457 5.160 5.160 5.323 -0.163 17732 184 1 . 1 1 457 457 THR CA C 457 61.100 61.100 60.797 0.303 17732 185 1 . 1 1 457 457 THR H H 457 8.560 8.560 8.304 0.256 17732 186 1 . 1 1 458 458 THR N N 458 120.600 120.600 122.642 -2.042 17732 187 1 . 1 1 458 458 THR HA H 458 4.550 4.550 4.638 -0.088 17732 188 1 . 1 1 458 458 THR CA C 458 60.600 60.600 61.482 -0.882 17732 189 1 . 1 1 458 458 THR H H 458 8.560 8.560 8.452 0.108 17732 190 1 . 1 1 459 459 TYR N N 459 122.500 122.500 125.852 -3.352 17732 191 1 . 1 1 459 459 TYR HA H 459 4.940 4.940 4.798 0.142 17732 192 1 . 1 1 459 459 TYR CA C 459 57.800 57.800 57.662 0.138 17732 193 1 . 1 1 459 459 TYR H H 459 8.870 8.870 8.891 -0.021 17732 194 1 . 1 1 460 460 GLU N N 460 123.200 123.200 125.637 -2.437 17732 195 1 . 1 1 460 460 GLU HA H 460 4.630 4.630 4.698 -0.068 17732 196 1 . 1 1 460 460 GLU CA C 460 55.600 55.600 55.507 0.093 17732 197 1 . 1 1 460 460 GLU H H 460 9.150 9.150 8.753 0.397 17732 198 1 . 1 1 461 461 GLY N N 461 112.700 112.700 112.197 0.503 17732 199 1 . 1 1 461 461 GLY CA C 461 43.900 43.900 44.575 -0.675 17732 200 1 . 1 1 461 461 GLY H H 461 8.330 8.330 8.276 0.054 17732 201 1 . 1 1 462 462 LYS N N 462 118.300 118.300 121.632 -3.332 17732 202 1 . 1 1 462 462 LYS HA H 462 4.490 4.490 4.361 0.129 17732 203 1 . 1 1 462 462 LYS CA C 462 54.000 54.000 55.302 -1.302 17732 204 1 . 1 1 462 462 LYS H H 462 8.050 8.050 8.241 -0.190 17732 205 1 . 1 1 463 463 HIS N N 463 123.900 123.900 119.291 4.609 17732 206 1 . 1 1 463 463 HIS HA H 463 4.600 4.600 4.595 0.005 17732 207 1 . 1 1 463 463 HIS CA C 463 57.200 57.200 55.998 1.202 17732 208 1 . 1 1 463 463 HIS H H 463 8.470 8.470 8.352 0.118 17732 209 1 . 1 1 464 464 ASN N N 464 124.400 124.400 120.666 3.734 17732 210 1 . 1 1 464 464 ASN HA H 464 4.950 4.950 4.780 0.170 17732 211 1 . 1 1 464 464 ASN CA C 464 51.500 51.500 53.209 -1.709 17732 212 1 . 1 1 464 464 ASN H H 464 8.360 8.360 8.739 -0.379 17732 213 1 . 1 1 465 465 HIS N N 465 112.100 112.100 115.657 -3.556 17732 214 1 . 1 1 465 465 HIS HA H 465 4.870 4.870 4.767 0.103 17732 215 1 . 1 1 465 465 HIS CA C 465 52.900 52.900 54.793 -1.893 17732 216 1 . 1 1 465 465 HIS H H 465 6.830 6.830 7.467 -0.637 17732 217 1 . 1 1 466 466 ASP N N 466 120.300 120.300 120.434 -0.134 17732 218 1 . 1 1 466 466 ASP HA H 466 4.620 4.620 4.458 0.162 17732 219 1 . 1 1 466 466 ASP CA C 466 54.000 54.000 55.308 -1.308 17732 220 1 . 1 1 466 466 ASP H H 466 8.780 8.780 8.384 0.396 17732 221 1 . 1 1 467 467 LEU N N 467 124.200 124.200 120.670 3.530 17732 222 1 . 1 1 467 467 LEU HA H 467 4.040 4.040 4.600 -0.560 17732 223 1 . 1 1 467 467 LEU CA C 467 54.100 54.100 53.309 0.791 17732 224 1 . 1 1 467 467 LEU H H 467 8.530 8.530 8.132 0.398 17732 225 1 . 1 1 468 468 PRO HA H 468 4.350 4.350 4.564 -0.214 17732 226 1 . 1 1 468 468 PRO CA C 468 63.300 63.300 62.856 0.444 17732 stop_ save_