data_nef_c25313_2mwd save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MWD BMRB 25309 BMRB 25310 BMRB 25311 BMRB 25314 BMRB 25315 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 433 SER start . . 2 A 434 GLU middle . . 3 A 435 TRP middle . . 4 A 436 THR middle . . 5 A 437 GLU middle . . 6 A 438 ARG middle . . 7 A 439 LYS middle . . 8 A 440 THR middle . . 9 A 441 ALA middle . . 10 A 442 ASP middle . . 11 A 443 GLY middle . false 12 A 444 LYS middle . . 13 A 445 THR middle . . 14 A 446 TYR middle . . 15 A 447 TYR middle . . 16 A 448 TYR middle . . 17 A 449 ASN middle . . 18 A 450 ASN middle . . 19 A 451 ARG middle . . 20 A 452 THR middle . . 21 A 453 LEU middle . . 22 A 454 GLU middle . . 23 A 455 SER middle . . 24 A 456 THR middle . . 25 A 457 TRP middle . . 26 A 458 GLU middle . . 27 A 459 LYS middle . . 28 A 460 PRO end . false stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 433 SER HA H 1 4.364 0.020 A 433 SER HBy H 1 3.819 0.020 A 433 SER HBx H 1 3.705 0.020 A 434 GLU H H 1 8.795 0.020 A 434 GLU HA H 1 4.011 0.020 A 434 GLU HBy H 1 1.686 0.020 A 434 GLU HBx H 1 1.632 0.020 A 434 GLU HGx H 1 1.784 0.020 A 435 TRP H H 1 7.984 0.020 A 435 TRP HA H 1 5.038 0.020 A 435 TRP HBy H 1 2.886 0.020 A 435 TRP HBx H 1 2.760 0.020 A 435 TRP HD1 H 1 7.033 0.020 A 435 TRP HE1 H 1 10.075 0.020 A 435 TRP HE3 H 1 7.079 0.020 A 435 TRP HH2 H 1 6.824 0.020 A 435 TRP HZ2 H 1 7.264 0.020 A 435 TRP HZ3 H 1 6.720 0.020 A 436 THR H H 1 9.444 0.020 A 436 THR HA H 1 4.520 0.020 A 436 THR HB H 1 3.899 0.020 A 436 THR HG2% H 1 1.084 0.020 A 437 GLU H H 1 8.548 0.020 A 437 GLU HA H 1 4.073 0.020 A 437 GLU HBy H 1 1.714 0.020 A 437 GLU HBx H 1 1.637 0.020 A 437 GLU HGx H 1 1.754 0.020 A 438 ARG H H 1 8.503 0.020 A 438 ARG HA H 1 4.159 0.020 A 438 ARG HBy H 1 1.072 0.020 A 438 ARG HBx H 1 -0.245 0.020 A 439 LYS H H 1 7.837 0.020 A 439 LYS HA H 1 5.303 0.020 A 439 LYS HBy H 1 1.437 0.020 A 439 LYS HBx H 1 1.385 0.020 A 439 LYS HDx H 1 1.251 0.020 A 439 LYS HEx H 1 2.653 0.020 A 439 LYS HGy H 1 1.328 0.020 A 439 LYS HGx H 1 1.100 0.020 A 440 THR H H 1 9.139 0.020 A 440 THR HA H 1 4.632 0.020 A 440 THR HB H 1 4.448 0.020 A 440 THR HG2% H 1 1.319 0.020 A 441 ALA H H 1 9.083 0.020 A 441 ALA HA H 1 3.971 0.020 A 441 ALA HB% H 1 1.272 0.020 A 442 ASP H H 1 7.870 0.020 A 442 ASP HA H 1 4.470 0.020 A 442 ASP HBy H 1 2.638 0.020 A 442 ASP HBx H 1 2.443 0.020 A 443 GLY H H 1 7.785 0.020 A 443 GLY HAx H 1 3.425 0.020 A 443 GLY HAy H 1 3.975 0.020 A 444 LYS H H 1 7.816 0.020 A 444 LYS HA H 1 4.360 0.020 A 444 LYS HBy H 1 1.829 0.020 A 444 LYS HBx H 1 1.350 0.020 A 444 LYS HDx H 1 1.150 0.020 A 444 LYS HEx H 1 2.556 0.020 A 444 LYS HGy H 1 1.258 0.020 A 444 LYS HGx H 1 1.186 0.020 A 445 THR H H 1 8.623 0.020 A 445 THR HA H 1 4.697 0.020 A 445 THR HB H 1 3.916 0.020 A 445 THR HG2% H 1 0.722 0.020 A 446 TYR H H 1 8.534 0.020 A 446 TYR HA H 1 4.358 0.020 A 446 TYR HBy H 1 2.401 0.020 A 446 TYR HBx H 1 2.134 0.020 A 446 TYR HDy H 1 6.568 0.020 A 446 TYR HEy H 1 6.169 0.020 A 447 TYR H H 1 8.718 0.020 A 447 TYR HA H 1 4.860 0.020 A 447 TYR HBy H 1 2.505 0.020 A 447 TYR HBx H 1 2.403 0.020 A 447 TYR HDy H 1 6.543 0.020 A 447 TYR HEy H 1 6.481 0.020 A 448 TYR H H 1 9.129 0.020 A 448 TYR HA H 1 5.295 0.020 A 448 TYR HBx H 1 2.426 0.020 A 448 TYR HBy H 1 2.520 0.020 A 448 TYR HDy H 1 6.708 0.020 A 448 TYR HEy H 1 6.395 0.020 A 449 ASN H H 1 8.091 0.020 A 449 ASN HA H 1 3.598 0.020 A 449 ASN HBy H 1 2.140 0.020 A 449 ASN HBx H 1 0.029 0.020 A 449 ASN HD2y H 1 6.921 0.020 A 449 ASN HD2x H 1 4.370 0.020 A 450 ASN H H 1 8.311 0.020 A 450 ASN HA H 1 3.967 0.020 A 450 ASN HBy H 1 2.544 0.020 A 450 ASN HBx H 1 2.498 0.020 A 450 ASN HD2y H 1 7.146 0.020 A 450 ASN HD2x H 1 6.905 0.020 A 451 ARG H H 1 8.323 0.020 A 451 ARG HA H 1 4.066 0.020 A 451 ARG HBy H 1 1.699 0.020 A 451 ARG HBx H 1 1.436 0.020 A 451 ARG HDy H 1 3.023 0.020 A 451 ARG HDx H 1 2.799 0.020 A 451 ARG HE H 1 7.633 0.020 A 451 ARG HGy H 1 1.263 0.020 A 451 ARG HGx H 1 1.075 0.020 A 452 THR H H 1 7.670 0.020 A 452 THR HA H 1 3.803 0.020 A 452 THR HB H 1 3.983 0.020 A 452 THR HG2% H 1 0.716 0.020 A 453 LEU H H 1 7.711 0.020 A 453 LEU HA H 1 3.513 0.020 A 453 LEU HBy H 1 1.860 0.020 A 453 LEU HBx H 1 1.519 0.020 A 453 LEU HDx% H 1 0.635 0.020 A 453 LEU HDy% H 1 0.561 0.020 A 453 LEU HG H 1 1.067 0.020 A 454 GLU H H 1 6.934 0.020 A 454 GLU HA H 1 4.100 0.020 A 454 GLU HBy H 1 1.752 0.020 A 454 GLU HBx H 1 1.525 0.020 A 454 GLU HGy H 1 2.015 0.020 A 454 GLU HGx H 1 1.904 0.020 A 455 SER H H 1 8.254 0.020 A 455 SER HA H 1 5.784 0.020 A 455 SER HBx H 1 3.454 0.020 A 456 THR H H 1 9.204 0.020 A 456 THR HA H 1 4.538 0.020 A 456 THR HB H 1 4.002 0.020 A 456 THR HG2% H 1 0.820 0.020 A 457 TRP H H 1 8.322 0.020 A 457 TRP HA H 1 4.719 0.020 A 457 TRP HBy H 1 3.443 0.020 A 457 TRP HBx H 1 2.941 0.020 A 457 TRP HD1 H 1 7.167 0.020 A 457 TRP HE1 H 1 9.888 0.020 A 457 TRP HE3 H 1 7.856 0.020 A 457 TRP HH2 H 1 6.824 0.020 A 457 TRP HZ2 H 1 7.091 0.020 A 457 TRP HZ3 H 1 6.676 0.020 A 458 GLU H H 1 7.805 0.020 A 458 GLU HA H 1 4.217 0.020 A 458 GLU HBy H 1 1.593 0.020 A 458 GLU HBx H 1 1.542 0.020 A 458 GLU HGx H 1 1.939 0.020 A 459 LYS H H 1 8.007 0.020 A 459 LYS HA H 1 2.627 0.020 A 459 LYS HBy H 1 1.246 0.020 A 459 LYS HBx H 1 1.157 0.020 A 459 LYS HDy H 1 0.859 0.020 A 459 LYS HDx H 1 0.548 0.020 A 459 LYS HGx H 1 1.021 0.020 A 460 PRO HA H 1 3.568 0.020 A 460 PRO HBy H 1 1.041 0.020 A 460 PRO HBx H 1 0.933 0.020 A 460 PRO HDy H 1 2.388 0.020 A 460 PRO HDx H 1 2.115 0.020 A 460 PRO HGy H 1 0.474 0.020 A 460 PRO HGx H 1 0.186 0.020 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type . save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 439 LYS HA A 440 THR H 1.0 1.85900769231 4.25239230769 2 2 A 439 LYS HA A 446 TYR H 1.0 2.24568461538 7.21691538462 3 3 A 455 SER HA A 456 THR H 1.0 2.15397692308 6.51382307692 4 4 A 455 SER HA A 449 ASN H 1.0 2.22297692308 7.04282307692 5 5 A 449 ASN H A 448 TYR HA 1.0 2.14490769231 6.44429230769 6 6 A 447 TYR HA A 448 TYR H 1.0 2.20945384615 6.93914615385 7 7 A 447 TYR HA A 438 ARG H 1.0 2.35444615385 8.05075384615 8 8 A 438 ARG HA A 439 LYS H 1.0 2.40613846154 8.44706153846 9 9 A 455 SER HA A 448 TYR HA 1.0 2.37586153846 8.21493846154 10 10 A 439 LYS HA A 445 THR HA 1.0 2.14061538462 6.41138461538 11 11 A 446 TYR HA A 447 TYR H 1.0 2.23255384615 7.11624615385 12 12 A 446 TYR H A 445 THR HA 1.0 2.21400000000 6.97400000000 13 13 A 435 TRP HA A 436 THR H 1.0 2.22055384615 7.02424615385 14 14 A 436 THR H A 449 ASN HA 1.0 2.28076153846 7.48583846154 15 15 A 436 THR HB A 437 GLU H 1.0 2.15670000000 6.53470000000 16 16 A 437 GLU H A 436 THR HA 1.0 2.09988461538 6.09911538462 17 17 A 438 ARG H A 437 GLU HA 1.0 2.15670000000 6.53470000000 18 18 A 448 TYR H A 437 GLU HA 1.0 2.26749230769 7.38410769231 19 19 A 456 THR H A 455 SER HBx 1.0 2.11412307692 6.20827692308 20 20 A 435 TRP HA A 450 ASN H 1.0 2.29290000000 7.57890000000 21 21 A 449 ASN HA A 450 ASN H 1.0 1.79374615385 3.75205384615 22 22 A 450 ASN HA A 451 ARG H 1.0 2.03873076923 5.63026923077 23 23 A 451 ARG HA A 452 THR H 1.0 2.14878461538 6.47401538462 24 24 A 452 THR HA A 453 LEU H 1.0 2.03280000000 5.58480000000 25 25 A 453 LEU HA A 454 GLU H 1.0 2.24180769231 7.18719230769 26 26 A 456 THR HA A 457 TRP H 1.0 2.12492307692 6.29107692308 27 27 A 444 LYS HA A 445 THR H 1.0 2.11908461538 6.24631538462 28 28 A 433 SER HA A 434 GLU H 1.0 2.11313076923 6.20066923077 29 29 A 434 GLU HA A 435 TRP H 1.0 2.17596923077 6.68243076923 30 30 A 434 GLU H A 433 SER HBy 1.0 2.11569230769 6.22030769231 31 31 A 434 GLU H A 433 SER HBx 1.0 2.15296153846 6.50603846154 32 32 A 435 TRP H A 433 SER HBx 1.0 2.29564615385 7.59995384615 33 33 A 440 THR HB A 441 ALA H 1.0 2.14086923077 6.41333076923 34 34 A 454 GLU HA A 455 SER H 1.0 2.22530769231 7.06069230769 35 35 A 457 TRP HBy A 458 GLU H 1.0 1.89883846154 4.55776153846 36 36 A 441 ALA H A 440 THR HA 1.0 2.22039230769 7.02300769231 37 37 A 440 THR H A 445 THR HA 1.0 2.26396153846 7.35703846154 38 38 A 441 ALA HA A 442 ASP H 1.0 2.22632307692 7.06847692308 39 39 A 442 ASP HA A 443 GLY H 1.0 2.38352307692 8.27367692308 40 40 A 446 TYR HA A 457 TRP HE3 1.0 2.08089230769 5.95350769231 41 41 A 435 TRP H A 434 GLU HBx 1.0 2.27683846154 7.45576153846 42 42 A 435 TRP H A 434 GLU HBy 1.0 2.22071538462 7.02548461538 43 43 A 436 THR H A 435 TRP HBy 1.0 2.21547692308 6.98532307692 44 44 A 436 THR H A 435 TRP HBx 1.0 2.36942307692 8.16557692308 45 45 A 437 GLU H A 436 THR HG2% 1.0 2.22200769231 7.03539230769 46 46 A 438 ARG H A 437 GLU HBy 1.0 2.34099230769 7.94760769231 47 47 A 439 LYS H A 438 ARG HBy 1.0 2.07800769231 5.93139230769 48 48 A 439 LYS H A 438 ARG HBx 1.0 2.24372307692 7.20187692308 49 49 A 438 ARG HBx A 446 TYR HD% 1.0 2.19782307692 6.84997692308 50 50 A 436 THR HG2% A 448 TYR HE% 1.0 2.26922307692 7.39737692308 51 51 A 440 THR H A 439 LYS HGy 1.0 2.14100769231 6.41439230769 52 52 A 440 THR H A 439 LYS HBy 1.0 2.19941538462 6.86218461538 53 53 A 440 THR H A 439 LYS HBx 1.0 2.15630769231 6.53169230769 54 54 A 442 ASP H A 441 ALA HB% 1.0 2.20040769231 6.86979230769 55 55 A 443 GLY H A 442 ASP HBy 1.0 2.22480000000 7.05680000000 56 56 A 443 GLY HAy A 444 LYS H 1.0 1.97226923077 5.12073076923 57 57 A 444 LYS H A 443 GLY HAx 1.0 2.18100000000 6.72100000000 58 58 A 445 THR H A 444 LYS HBy 1.0 2.12349230769 6.28010769231 59 59 A 445 THR H A 444 LYS HGy 1.0 2.34909230769 8.00970769231 60 60 A 445 THR H A 444 LYS HBx 1.0 2.27787692308 7.46372307692 61 61 A 446 TYR H A 445 THR HG2% 1.0 2.19122307692 6.79937692308 62 62 A 447 TYR H A 446 TYR HBy 1.0 1.85711538462 4.23788461538 63 63 A 447 TYR H A 446 TYR HBx 1.0 2.22120000000 7.02920000000 64 64 A 448 TYR H A 447 TYR HBy 1.0 2.18900769231 6.78239230769 65 65 A 449 ASN H A 448 TYR HBx 1.0 2.15933076923 6.55486923077 66 66 A 448 TYR HBx A 438 ARG HE 1.0 2.13964615385 6.40395384615 67 67 A 450 ASN H A 449 ASN HBy 1.0 2.14190769231 6.42129230769 68 68 A 450 ASN H A 449 ASN HBx 1.0 2.21328461538 6.96851538462 69 69 A 451 ARG H A 450 ASN HBy 1.0 2.16962307692 6.63377692308 70 70 A 451 ARG H A 450 ASN HBx 1.0 2.04263076923 5.66016923077 71 71 A 452 THR H A 451 ARG HGx 1.0 2.28378461538 7.50901538462 72 72 A 452 THR H A 451 ARG HGy 1.0 2.22431538462 7.05308461538 73 73 A 452 THR H A 451 ARG HBx 1.0 2.36942307692 8.16557692308 74 74 A 452 THR H A 451 ARG HBy 1.0 2.19953076923 6.86306923077 75 75 A 457 TRP H A 456 THR HG2% 1.0 2.25009230769 7.25070769231 76 76 A 453 LEU H A 452 THR HG2% 1.0 2.30153076923 7.64506923077 77 77 A 454 GLU H A 453 LEU HDy% 1.0 2.33102307692 7.87117692308 78 78 A 455 SER H A 454 GLU HGy 1.0 2.16927692308 6.63112307692 79 79 A 455 SER H A 454 GLU HGx 1.0 2.31950769231 7.78289230769 80 80 A 455 SER H A 454 GLU HBy 1.0 2.28150000000 7.49150000000 81 81 A 455 SER H A 454 GLU HBx 1.0 2.31101538462 7.71778461538 82 82 A 453 LEU H A 454 GLU H 1.0 2.21298461538 6.96621538462 83 83 A 452 THR H A 453 LEU H 1.0 1.88402307692 4.44417692308 84 84 A 451 ARG H A 452 THR H 1.0 2.12088461538 6.26011538462 85 85 A 451 ARG H A 453 LEU H 1.0 2.19593076923 6.83546923077 86 86 A 456 THR H A 447 TYR H 1.0 2.28900000000 7.54900000000 87 87 A 440 THR H A 444 LYS H 1.0 2.12603076923 6.29956923077 88 88 A 443 GLY H A 444 LYS H 1.0 1.72758461538 3.24481538462 89 89 A 448 TYR H A 436 THR H 1.0 2.31413076923 7.74166923077 90 90 A 458 GLU H A 457 TRP HBx 1.0 2.22946153846 7.09253846154 91 91 A 458 GLU HA A 459 LYS H 1.0 2.07016153846 5.87123846154 92 92 A 459 LYS H A 458 GLU HGx 1.0 2.12536153846 6.29443846154 93 93 A 459 LYS H A 458 GLU HBy 1.0 2.28816923077 7.54263076923 94 94 A 459 LYS HA A 460 PRO HDx 1.0 2.25025384615 7.25194615385 95 95 A 440 THR HB A 446 TYR HE% 1.0 2.27614615385 7.45045384615 96 96 A 448 TYR HBx A 446 TYR HE% 1.0 2.22233076923 7.03786923077 97 97 A 438 ARG HBy A 446 TYR HE% 1.0 2.22964615385 7.09395384615 98 98 A 438 ARG HBx A 446 TYR HE% 1.0 2.37703846154 8.22396153846 99 99 A 446 TYR HE% A 440 THR HG2% 1.0 2.37510000000 8.20910000000 100 100 A 448 TYR HBx A 438 ARG HDx 1.0 2.13990000000 6.40590000000 101 100 A 448 TYR HBx A 438 ARG HDy 1.0 2.13990000000 6.40590000000 102 101 A 458 GLU HA A 447 TYR HD% 1.0 2.29091538462 7.56368461538 103 102 A 458 GLU HA A 447 TYR HE% 1.0 2.20993846154 6.94286153846 104 103 A 450 ASN HA A 448 TYR HE% 1.0 2.24480769231 7.21019230769 105 104 A 453 LEU HA A 448 TYR HE% 1.0 2.23933846154 7.16826153846 106 105 A 455 SER HBx A 448 TYR HE% 1.0 2.22893076923 7.08846923077 107 106 A 455 SER HBx A 446 TYR HD% 1.0 2.20513846154 6.90606153846 108 107 A 455 SER HBx A 446 TYR HE% 1.0 2.16156923077 6.57203076923 109 108 A 446 TYR HD% A 440 THR HG2% 1.0 2.22756923077 7.07803076923 110 109 A 447 TYR HD% A 437 GLU HGx 1.0 2.18702307692 6.76717692308 111 110 A 456 THR HG2% A 447 TYR HD% 1.0 2.29860000000 7.62260000000 112 111 A 445 THR HG2% A 447 TYR HD% 1.0 2.23553076923 7.13906923077 113 112 A 445 THR HG2% A 447 TYR HE% 1.0 2.26264615385 7.34695384615 114 113 A 447 TYR HE% A 437 GLU HGx 1.0 2.23100769231 7.10439230769 115 114 A 460 PRO HDx A 447 TYR HE% 1.0 2.27183076923 7.41736923077 116 115 A 456 THR HG2% A 447 TYR HE% 1.0 2.30074615385 7.63905384615 117 116 A 448 TYR HE% A 453 LEU HBx 1.0 2.29541538462 7.59818461538 118 117 A 447 TYR HE% A 459 LYS HGx 1.0 2.28004615385 7.48035384615 119 118 A 447 TYR HD% A 459 LYS HGx 1.0 2.32315384615 7.81084615385 120 119 A 446 TYR HE% A 448 TYR HD% 1.0 2.18626153846 6.76133846154 121 120 A 446 TYR HE% A 448 TYR HD% 1.0 2.20975384615 6.94144615385 122 121 A 455 SER HA A 448 TYR HD% 1.0 2.25900000000 7.31900000000 123 122 A 447 TYR HD% A 435 TRP HE3 1.0 2.19521538462 6.82998461538 124 123 A 447 TYR HA A 435 TRP HE3 1.0 2.21607692308 6.98992307692 125 124 A 447 TYR HBy A 435 TRP HE3 1.0 2.29518461538 7.59641538462 126 125 A 455 SER HBx A 448 TYR HD% 1.0 2.19083076923 6.79636923077 127 126 A 436 THR HB A 448 TYR HD% 1.0 2.24725384615 7.22894615385 128 127 A 450 ASN HA A 448 TYR HD% 1.0 2.17952307692 6.70967692308 129 128 A 453 LEU HDy% A 448 TYR HD% 1.0 2.29426153846 7.58933846154 130 129 A 456 THR HG2% A 435 TRP HE3 1.0 2.21065384615 6.94834615385 131 130 A 449 ASN HBx A 435 TRP HE3 1.0 2.25768461538 7.30891538462 132 131 A 451 ARG HA A 435 TRP HH2 1.0 2.33130000000 7.87330000000 133 132 A 451 ARG HA A 435 TRP HZ3 1.0 2.22281538462 7.04158461538 134 133 A 447 TYR HBy A 435 TRP HZ3 1.0 2.16450000000 6.59450000000 135 134 A 456 THR HG2% A 435 TRP HZ3 1.0 2.24231538462 7.19108461538 136 135 A 456 THR HG2% A 435 TRP HH2 1.0 2.26689230769 7.37950769231 137 136 A 449 ASN HBx A 435 TRP HZ3 1.0 2.22789230769 7.08050769231 138 137 A 449 ASN HBx A 435 TRP HH2 1.0 2.24460000000 7.20860000000 139 138 A 456 THR HG2% A 435 TRP HZ2 1.0 2.23603846154 7.14296153846 140 139 A 449 ASN HD2x A 435 TRP HE1 1.0 2.35038461538 8.01961538462 141 140 A 435 TRP HE1 A 460 PRO HBy 1.0 2.17922307692 6.70737692308 142 141 A 435 TRP HE1 A 460 PRO HBx 1.0 2.25191538462 7.26468461538 143 142 A 446 TYR H A 438 ARG H 1.0 1.77306923077 3.59353076923 144 143 A 441 ALA H A 442 ASP H 1.0 2.34664615385 7.99095384615 145 144 A 434 GLU H A 435 TRP H 1.0 2.15323846154 6.50816153846 146 145 A 447 TYR H A 457 TRP HA 1.0 2.20513846154 6.90606153846 147 146 A 458 GLU H A 457 TRP HA 1.0 2.29950000000 7.62950000000 148 147 A 440 THR HA A 442 ASP H 1.0 2.22666923077 7.07113076923 149 148 A 457 TRP H A 458 GLU H 1.0 2.08509230769 5.98570769231 150 149 A 457 TRP HE3 A 446 TYR HBy 1.0 2.15127692308 6.49312307692 151 150 A 457 TRP HE3 A 446 TYR HBx 1.0 2.18706923077 6.76753076923 152 151 A 457 TRP HE3 A 444 LYS HBy 1.0 2.11303846154 6.19996153846 153 152 A 446 TYR HD% A 444 LYS HBy 1.0 2.23666153846 7.14773846154 154 153 A 444 LYS HBy A 457 TRP HH2 1.0 2.36748461538 8.15071538462 155 154 A 444 LYS HBy A 457 TRP HZ3 1.0 2.21944615385 7.01575384615 156 155 A 444 LYS HGy A 457 TRP HH2 1.0 2.35303846154 8.03996153846 157 156 A 444 LYS HGy A 457 TRP HZ3 1.0 2.27896153846 7.47203846154 158 157 A 444 LYS HBx A 457 TRP HZ3 1.0 2.20421538462 6.89898461538 159 158 A 446 TYR HBx A 457 TRP HZ3 1.0 2.15049230769 6.48710769231 160 159 A 446 TYR HBy A 457 TRP HZ3 1.0 2.22770769231 7.07909230769 161 160 A 439 LYS HA A 446 TYR HD% 1.0 2.22650769231 7.06989230769 162 161 A 439 LYS HA A 446 TYR HE% 1.0 2.22641538462 7.06918461538 163 162 A 435 TRP HA A 449 ASN HA 1.0 2.18856923077 6.77903076923 164 163 A 456 THR HG2% A 460 PRO HGy 1.0 2.26435384615 7.36004615385 165 164 A 456 THR HG2% A 460 PRO HGx 1.0 2.27801538462 7.46478461538 166 165 A 448 TYR HE% A 453 LEU HDy% 1.0 2.33496923077 7.90143076923 167 166 A 448 TYR H A 457 TRP HZ2 1.0 2.22297692308 7.04282307692 168 167 A 438 ARG HE A 448 TYR HBy 1.0 2.22371538462 7.04848461538 169 168 A 437 GLU HBy A 447 TYR HD% 1.0 2.16660000000 6.61060000000 170 169 A 437 GLU HBy A 447 TYR HE% 1.0 2.17700769231 6.69039230769 171 170 A 438 ARG H A 437 GLU HGx 1.0 2.28263076923 7.50016923077 172 171 A 437 GLU HA A 447 TYR HD% 1.0 2.24340000000 7.19940000000 173 172 A 437 GLU HA A 447 TYR HE% 1.0 2.20248461538 6.88571538462 174 173 A 447 TYR HD% A 460 PRO HDy 1.0 2.20841538462 6.93118461538 175 174 A 447 TYR HE% A 460 PRO HDy 1.0 2.20645384615 6.91614615385 176 175 A 457 TRP H A 456 THR HB 1.0 2.19371538462 6.81848461538 177 176 A 444 LYS HA A 446 TYR HD% 1.0 2.28985384615 7.55554615385 178 177 A 433 SER HA A 435 TRP H 1.0 2.33993076923 7.93946923077 179 178 A 435 TRP H A 434 GLU HGx 1.0 2.18665384615 6.76434615385 180 179 A 443 GLY H A 442 ASP HBx 1.0 2.20165384615 6.87934615385 181 180 A 442 ASP H A 443 GLY H 1.0 2.15910000000 6.55310000000 182 181 A 450 ASN H A 451 ARG H 1.0 1.25000000000 2.25000000000 183 182 A 457 TRP HZ3 A 444 LYS HGx 1.0 2.22789230769 7.08050769231 184 183 A 444 LYS HBx A 457 TRP HH2 1.0 2.32167692308 7.79952307692 185 184 A 440 THR HG2% A 457 TRP HZ3 1.0 2.27603076923 7.44956923077 186 185 A 440 THR HG2% A 457 TRP HH2 1.0 2.27141538462 7.41418461538 187 186 A 440 THR HG2% A 457 TRP HZ2 1.0 2.21730000000 6.99930000000 188 187 A 448 TYR HE% A 453 LEU HBy 1.0 2.30891538462 7.70168461538 189 188 A 448 TYR HE% A 450 ASN HBx 1.0 2.19740769231 6.84679230769 190 189 A 448 TYR H A 446 TYR HD% 1.0 2.39900769231 8.39239230769 191 190 A 434 GLU HBy A 435 TRP HD1 1.0 2.23292307692 7.11907692308 192 191 A 434 GLU HBx A 435 TRP HD1 1.0 2.15972307692 6.55787692308 193 192 A 458 GLU H A 456 THR HG2% 1.0 2.29426153846 7.58933846154 194 193 A 435 TRP H A 433 SER HBy 1.0 2.37360000000 8.19760000000 195 194 A 441 ALA H A 440 THR HG2% 1.0 2.19916153846 6.86023846154 196 195 A 456 THR H A 446 TYR HBy 1.0 2.23714615385 7.15145384615 197 196 A 456 THR H A 446 TYR HBx 1.0 2.23520769231 7.13659230769 198 197 A 455 SER HA A 446 TYR HD% 1.0 2.28244615385 7.49875384615 199 198 A 435 TRP HE1 A 460 PRO HGy 1.0 2.22463846154 7.05556153846 200 199 A 435 TRP HE1 A 460 PRO HGx 1.0 2.28694615385 7.53325384615 201 200 A 460 PRO HGy A 435 TRP HD1 1.0 2.22789230769 7.08050769231 202 201 A 460 PRO HGx A 435 TRP HD1 1.0 2.24395384615 7.20364615385 203 202 A 460 PRO HBx A 435 TRP HD1 1.0 2.29899230769 7.62560769231 204 203 A 460 PRO HBy A 435 TRP HD1 1.0 2.22546923077 7.06193076923 205 204 A 435 TRP HZ2 A 460 PRO HBy 1.0 2.16450000000 6.59450000000 206 205 A 435 TRP HZ2 A 460 PRO HGx 1.0 2.26809230769 7.38870769231 207 206 A 454 GLU H A 453 LEU HDx% 1.0 2.32520769231 7.82659230769 208 207 A 448 TYR HE% A 453 LEU HDx% 1.0 2.36298461538 8.11621538462 209 208 A 436 THR HG2% A 448 TYR HD% 1.0 2.27776153846 7.46283846154 210 209 A 454 GLU HGx A 435 TRP HH2 1.0 2.24416153846 7.20523846154 211 210 A 436 THR HG2% A 446 TYR HD% 1.0 2.21914615385 7.01345384615 212 211 A 452 THR HG2% A 449 ASN HD2y 1.0 2.24531538462 7.21408461538 213 212 A 435 TRP HE1 A 434 GLU HGx 1.0 2.23292307692 7.11907692308 214 213 A 438 ARG H A 437 GLU HBx 1.0 2.25313846154 7.27406153846 215 214 A 434 GLU HGx A 435 TRP HD1 1.0 2.14765384615 6.46534615385 216 215 A 440 THR H A 436 THR HG2% 1.0 2.26659230769 7.37720769231 217 216 A 437 GLU HBy A 445 THR HG2% 1.0 2.12344615385 6.27975384615 218 217 A 437 GLU HBy A 445 THR HG2% 1.0 2.17451538462 6.67128461538 219 218 A 439 LYS HBy A 445 THR HG2% 1.0 2.30524615385 7.67355384615 220 219 A 447 TYR HBy A 456 THR HG2% 1.0 2.22650769231 7.06989230769 221 220 A 456 THR HG2% A 447 TYR HBx 1.0 2.23767692308 7.15552307692 222 221 A 435 TRP HZ2 A 449 ASN HD2x 1.0 2.22754615385 7.07785384615 223 222 A 447 TYR HA A 437 GLU HA 1.0 2.23714615385 7.15145384615 224 223 A 445 THR HG2% A 439 LYS HDx 1.0 2.53846153846 9.46153846154 225 224 A 445 THR HG2% A 439 LYS HGx 1.0 2.53846153846 9.46153846154 stop_ save_