data_nef_c30263_5v1e 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 5V1E stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 20 ARG C 1 21 NH2 N stop_ 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 1 ARG start . . 2 A 2 GLN middle . . 3 A 3 TYR middle . . 4 A 4 MET middle . . 5 A 5 ARG middle . . 6 A 6 GLN middle . . 7 A 7 ILE middle . . 8 A 8 GLU middle . . 9 A 9 GLN middle . . 10 A 10 ALA middle . . 11 A 11 LEU middle . . 12 A 12 ARG middle . . 13 A 13 TYR middle . . 14 A 14 GLY middle . false 15 A 15 TYR middle . . 16 A 16 ARG middle . . 17 A 17 ILE middle . . 18 A 18 SER middle . . 19 A 19 ARG middle . . 20 A 20 ARG middle -OXT . 21 A 21 NH2 end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_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 1 ARG H1 H 1 8.6440 0.0000 A 1 ARG HA H 1 4.3910 0.0000 A 1 ARG HB2 H 1 2.0400 0.0000 A 1 ARG HD2 H 1 3.2200 0.0000 A 1 ARG HG2 H 1 1.8690 0.0000 A 1 ARG CA C 13 59.1300 0.0000 A 2 GLN H H 1 8.0690 0.0000 A 2 GLN HA H 1 4.0280 0.0000 A 2 GLN HBx H 1 2.2800 0.0000 A 2 GLN HE2x H 1 6.7830 0.0000 A 2 GLN HE2y H 1 7.3240 0.0000 A 2 GLN HGx H 1 2.5200 0.0000 A 2 GLN CA C 13 58.0150 0.0000 A 3 TYR H H 1 8.0690 0.0000 A 3 TYR HA H 1 4.6510 0.0000 A 3 TYR HBx H 1 3.1380 0.0000 A 3 TYR HDx H 1 7.1690 0.0000 A 3 TYR HEx H 1 6.8400 0.0000 A 3 TYR CA C 13 60.6060 0.0000 A 4 MET H H 1 8.0260 0.0000 A 4 MET HA H 1 4.2960 0.0000 A 4 MET HB2 H 1 2.2150 0.0000 A 4 MET HE% H 1 1.6300 0.0000 A 4 MET HG2 H 1 2.6700 0.0000 A 4 MET CA C 13 55.9150 0.0000 A 5 ARG H H 1 7.8050 0.0000 A 5 ARG HA H 1 4.1940 0.0000 A 5 ARG HB2 H 1 1.8340 0.0000 A 5 ARG HD2 H 1 3.2030 0.0000 A 5 ARG HG2 H 1 1.6760 0.0000 A 5 ARG CA C 13 59.3620 0.0000 A 6 GLN H H 1 8.1990 0.0000 A 6 GLN HA H 1 4.1060 0.0000 A 6 GLN HB2 H 1 1.5840 0.0000 A 6 GLN HE2x H 1 7.0760 0.0000 A 6 GLN HG2 H 1 1.8870 0.0000 A 6 GLN CA C 13 58.7100 0.0000 A 7 ILE H H 1 8.2660 0.0000 A 7 ILE HA H 1 3.7070 0.0000 A 7 ILE HB H 1 2.0700 0.0000 A 7 ILE HG12 H 1 1.4650 0.0000 A 7 ILE HG2% H 1 0.9250 0.0000 A 7 ILE CA C 13 65.2660 0.0000 A 8 GLU H H 1 8.4090 0.0000 A 8 GLU HA H 1 3.8440 0.0000 A 8 GLU HB2 H 1 2.3450 0.0000 A 8 GLU HG2 H 1 2.6900 0.0000 A 8 GLU CA C 13 59.7500 0.0000 A 9 GLN H H 1 8.0690 0.0000 A 9 GLN HA H 1 4.2040 0.0000 A 9 GLN HBx H 1 2.3400 0.0000 A 9 GLN HE21 H 1 6.7050 0.0000 A 9 GLN HE22 H 1 7.3250 0.0000 A 9 GLN HGx H 1 2.5200 0.0000 A 9 GLN CA C 13 56.4150 0.0000 A 10 ALA H H 1 8.1510 0.0000 A 10 ALA HA H 1 4.2140 0.0000 A 10 ALA HB% H 1 1.5820 0.0000 A 10 ALA CA C 13 56.3490 0.0000 A 11 LEU H H 1 8.2700 0.0000 A 11 LEU HA H 1 4.1540 0.0000 A 11 LEU HB2 H 1 1.9780 0.0000 A 11 LEU HDx% H 1 0.8800 0.0000 A 11 LEU HDy% H 1 0.8800 0.0000 A 11 LEU CA C 13 57.6920 0.0000 A 12 ARG H H 1 8.1180 0.0000 A 12 ARG HA H 1 4.0290 0.0000 A 12 ARG HB2 H 1 1.8590 0.0000 A 12 ARG HD2 H 1 3.2390 0.0000 A 12 ARG HG2 H 1 1.5720 0.0000 A 12 ARG CA C 13 58.5200 0.0000 A 13 TYR H H 1 8.0930 0.0000 A 13 TYR HA H 1 4.3640 0.0000 A 13 TYR HB2 H 1 3.2380 0.0000 A 13 TYR HD2 H 1 7.1220 0.0000 A 13 TYR HE1 H 1 6.8100 0.0000 A 13 TYR CA C 13 59.1490 0.0000 A 14 GLY H H 1 8.5510 0.0000 A 14 GLY HA2 H 1 3.7880 0.0000 A 14 GLY CA C 13 46.7300 0.0000 A 15 TYR H H 1 8.4210 0.0000 A 15 TYR HA H 1 4.2130 0.0000 A 15 TYR HB2 H 1 3.0670 0.0000 A 15 TYR HD1 H 1 7.0260 0.0000 A 15 TYR HE1 H 1 6.7840 0.0000 A 15 TYR CA C 13 59.3650 0.0000 A 16 ARG H H 1 7.6600 0.0000 A 16 ARG HA H 1 4.2780 0.0000 A 16 ARG HB2 H 1 2.1900 0.0000 A 16 ARG HD2 H 1 3.0480 0.0000 A 16 ARG HG2 H 1 1.6900 0.0000 A 16 ARG CA C 13 55.9150 0.0000 A 17 ILE H H 1 7.9840 0.0000 A 17 ILE HA H 1 4.0540 0.0000 A 17 ILE HB H 1 1.9200 0.0000 A 17 ILE HD1% H 1 0.8200 0.0000 A 17 ILE HG2% H 1 0.8500 0.0000 A 17 ILE CA C 13 58.6180 0.0000 A 18 SER H H 1 7.8100 0.0000 A 18 SER HA H 1 4.3640 0.0000 A 18 SER HB2 H 1 3.8870 0.0000 A 18 SER CA C 13 56.9630 0.0000 A 19 ARG H H 1 7.7210 0.0000 A 19 ARG HA H 1 4.2800 0.0000 A 19 ARG HB2 H 1 2.2200 0.0000 A 19 ARG HD2 H 1 3.0770 0.0000 A 19 ARG HG2 H 1 1.6300 0.0000 A 19 ARG CA C 13 55.9020 0.0000 A 20 ARG HA H 1 4.2140 0.0000 A 20 ARG HB2 H 1 1.9100 0.0000 A 20 ARG HD2 H 1 3.2000 0.0000 A 20 ARG HG2 H 1 1.6900 0.0000 A 20 ARG CA C 13 55.1200 0.0000 A 21 NH2 HN1 H 1 7.8510 0.0000 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 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 3 TYR H A 3 TYR HA 1.0 1.8 3.4 2 2 A 1 ARG H1 A 1 ARG HA 1.0 1.8 3.4 3 3 A 13 TYR H A 13 TYR HA 1.0 1.8 3.4 4 4 A 18 SER H A 18 SER HA 1.0 1.8 3.4 5 5 A 4 MET H A 4 MET HA 1.0 1.8 3.4 6 6 A 15 TYR H A 15 TYR HA 1.0 1.8 5.0 7 7 A 10 ALA H A 10 ALA HA 1.0 1.8 3.4 8 8 A 20 ARG H A 20 ARG HA 1.0 1.8 5.0 9 9 A 13 TYR HA A 16 ARG H 1.0 1.8 5.0 10 10 A 11 LEU H A 11 LEU HA 1.0 1.8 3.4 11 11 A 5 ARG H A 5 ARG HA 1.0 1.8 5.0 12 12 A 6 GLN H A 6 GLN HA 1.0 1.8 5.0 13 13 A 17 ILE H A 17 ILE HA 1.0 1.8 3.4 14 14 A 18 SER H A 18 SER HB2 1.0 1.8 5.0 15 14 A 18 SER H A 18 SER HBy 1.0 1.8 5.0 16 15 A 8 GLU H A 8 GLU HA 1.0 1.8 5.0 17 16 A 19 ARG H A 19 ARG HA 1.0 1.8 5.0 18 17 A 16 ARG H A 16 ARG HA 1.0 1.8 5.0 19 18 A 14 GLY H A 14 GLY HA2 1.0 1.8 3.4 20 18 A 14 GLY H A 14 GLY HAy 1.0 1.8 3.4 21 19 A 7 ILE H A 7 ILE HA 1.0 1.8 3.4 22 20 A 2 GLN H A 2 GLN HA 1.0 1.8 2.8 23 21 A 1 ARG H1 A 1 ARG HB2 1.0 1.8 3.4 24 21 A 1 ARG H1 A 1 ARG HBy 1.0 1.8 3.4 25 22 A 1 ARG HA A 1 ARG HB2 1.0 1.8 3.4 26 22 A 1 ARG HA A 1 ARG HBy 1.0 1.8 3.4 27 23 A 1 ARG HA A 1 ARG HGy 1.0 1.8 2.8 28 23 A 1 ARG HA A 1 ARG HG2 1.0 1.8 2.8 29 24 A 15 TYR H A 15 TYR HB2 1.0 1.8 5.0 30 24 A 15 TYR H A 15 TYR HBy 1.0 1.8 5.0 31 25 A 8 GLU HA A 8 GLU HG2 1.0 1.8 5.0 32 25 A 8 GLU HA A 8 GLU HGy 1.0 1.8 5.0 33 26 A 8 GLU HA A 8 GLU HB2 1.0 1.8 5.0 34 26 A 8 GLU HA A 8 GLU HBy 1.0 1.8 5.0 35 27 A 7 ILE H A 7 ILE HB 1.0 1.8 3.4 36 28 A 11 LEU H A 11 LEU HDx% 1.0 1.8 2.8 37 28 A 11 LEU H A 11 LEU HDy% 1.0 1.8 2.8 38 29 A 7 ILE HA A 7 ILE HG2% 1.0 1.8 2.8 39 30 A 17 ILE H A 17 ILE HB 1.0 1.8 5.0 40 31 A 17 ILE H A 17 ILE HD1% 1.0 1.8 3.4 41 32 A 17 ILE HA A 17 ILE HB 1.0 1.8 2.8 42 33 A 17 ILE HA A 17 ILE HG2% 1.0 1.8 2.8 43 34 A 3 TYR HA A 3 TYR HBx 1.0 1.8 5.0 44 34 A 3 TYR HA A 3 TYR HBy 1.0 1.8 5.0 45 35 A 3 TYR H A 3 TYR HBx 1.0 1.8 5.0 46 35 A 3 TYR H A 3 TYR HBy 1.0 1.8 5.0 47 36 A 9 GLN H A 9 GLN HGx 1.0 1.8 3.4 48 36 A 9 GLN H A 9 GLN HGy 1.0 1.8 3.4 49 37 A 9 GLN H A 9 GLN HBx 1.0 1.8 3.4 50 37 A 9 GLN H A 9 GLN HBy 1.0 1.8 3.4 51 38 A 9 GLN HA A 9 GLN HGx 1.0 1.8 5.0 52 38 A 9 GLN HGy A 9 GLN HA 1.0 1.8 5.0 53 39 A 9 GLN HA A 9 GLN HBx 1.0 1.8 3.4 54 39 A 9 GLN HBy A 9 GLN HA 1.0 1.8 3.4 55 40 A 20 ARG H A 20 ARG HD2 1.0 1.8 5.0 56 40 A 20 ARG H A 20 ARG HDy 1.0 1.8 5.0 57 41 A 20 ARG H A 20 ARG HB2 1.0 1.8 5.0 58 41 A 20 ARG H A 20 ARG HBy 1.0 1.8 5.0 59 42 A 20 ARG H A 20 ARG HG2 1.0 1.8 3.4 60 42 A 20 ARG H A 20 ARG HGy 1.0 1.8 3.4 61 43 A 5 ARG HA A 5 ARG HD2 1.0 1.8 5.0 62 43 A 5 ARG HA A 5 ARG HDy 1.0 1.8 5.0 63 44 A 5 ARG H A 5 ARG HD2 1.0 1.8 5.0 64 44 A 5 ARG H A 5 ARG HDy 1.0 1.8 5.0 65 45 A 20 ARG HA A 20 ARG HB2 1.0 1.8 2.8 66 45 A 20 ARG HA A 20 ARG HBy 1.0 1.8 2.8 67 46 A 5 ARG HA A 5 ARG HG2 1.0 1.8 5.0 68 46 A 5 ARG HA A 5 ARG HGy 1.0 1.8 5.0 69 47 A 5 ARG H A 4 MET HB2 1.0 1.8 5.0 70 47 A 5 ARG H A 4 MET HBy 1.0 1.8 5.0 71 48 A 5 ARG H A 5 ARG HG2 1.0 1.8 5.0 72 48 A 5 ARG H A 5 ARG HGy 1.0 1.8 5.0 73 49 A 5 ARG H A 5 ARG HB2 1.0 1.8 5.0 74 49 A 5 ARG H A 5 ARG HBy 1.0 1.8 5.0 75 50 A 15 TYR HA A 15 TYR HB2 1.0 1.8 2.8 76 50 A 15 TYR HA A 15 TYR HBy 1.0 1.8 2.8 77 51 A 4 MET H A 4 MET HB2 1.0 1.8 3.4 78 51 A 4 MET H A 4 MET HBy 1.0 1.8 3.4 79 52 A 4 MET HA A 4 MET HG2 1.0 1.8 5.0 80 52 A 4 MET HA A 4 MET HGy 1.0 1.8 5.0 81 53 A 16 ARG HA A 16 ARG HB2 1.0 1.8 3.4 82 53 A 16 ARG HA A 16 ARG HBy 1.0 1.8 3.4 83 54 A 2 GLN H A 2 GLN HBx 1.0 1.8 3.4 84 54 A 2 GLN H A 2 GLN HBy 1.0 1.8 3.4 85 55 A 2 GLN HA A 2 GLN HBx 1.0 1.8 3.4 86 55 A 2 GLN HA A 2 GLN HBy 1.0 1.8 3.4 87 56 A 2 GLN HA A 2 GLN HGx 1.0 1.8 3.4 88 56 A 2 GLN HA A 2 GLN HGy 1.0 1.8 3.4 89 57 A 18 SER HA A 18 SER HB2 1.0 1.8 3.4 90 57 A 18 SER HA A 18 SER HBy 1.0 1.8 3.4 91 58 A 3 TYR HE% A 2 GLN HE2x 1.0 1.8 2.8 92 58 A 2 GLN HE2y A 3 TYR HE% 1.0 1.8 2.8 93 59 A 12 ARG H A 12 ARG HA 1.0 1.8 2.8 94 60 A 8 GLU H A 8 GLU HB2 1.0 1.8 2.8 95 60 A 8 GLU H A 8 GLU HBy 1.0 1.8 2.8 96 61 A 7 ILE H A 7 ILE HG12 1.0 1.8 5.0 97 62 A 11 LEU H A 11 LEU HB2 1.0 1.8 3.4 98 62 A 11 LEU H A 11 LEU HBy 1.0 1.8 3.4 99 63 A 11 LEU HA A 11 LEU HDx% 1.0 1.8 5.0 100 63 A 11 LEU HA A 11 LEU HDy% 1.0 1.8 5.0 101 64 A 11 LEU HA A 11 LEU HB2 1.0 1.8 3.4 102 64 A 11 LEU HA A 11 LEU HBy 1.0 1.8 3.4 103 65 A 13 TYR HA A 13 TYR HB2 1.0 1.8 3.4 104 65 A 13 TYR HA A 13 TYR HBy 1.0 1.8 3.4 105 66 A 5 ARG HA A 5 ARG HB2 1.0 1.8 5.0 106 66 A 5 ARG HA A 5 ARG HBy 1.0 1.8 5.0 107 67 A 13 TYR HE% A 12 ARG HD2 1.0 1.8 5.0 108 67 A 13 TYR HE% A 12 ARG HDy 1.0 1.8 5.0 109 68 A 15 TYR HE% A 15 TYR HB2 1.0 1.8 5.0 110 68 A 15 TYR HBy A 15 TYR HE% 1.0 1.8 5.0 111 69 A 13 TYR HE% A 10 ALA HB% 1.0 1.8 5.0 112 70 A 3 TYR HE% A 4 MET HE% 1.0 1.8 5.0 113 71 A 13 TYR HD% A 13 TYR HB2 1.0 1.8 2.8 114 71 A 13 TYR HBy A 13 TYR HD% 1.0 1.8 2.8 115 72 A 4 MET HE% A 3 TYR HD% 1.0 1.8 5.0 116 73 A 6 GLN HE2y A 6 GLN HG2 1.0 1.8 3.4 117 73 A 6 GLN HE2x A 6 GLN HG2 1.0 1.8 3.4 118 73 A 6 GLN HGy A 6 GLN HE2x 1.0 1.8 3.4 119 73 A 6 GLN HE2y A 6 GLN HGy 1.0 1.8 3.4 120 74 A 6 GLN HE2y A 7 ILE HG12 1.0 1.8 5.0 121 74 A 6 GLN HE2x A 7 ILE HG12 1.0 1.8 5.0 122 75 A 19 ARG H A 19 ARG HG2 1.0 1.8 3.4 123 75 A 19 ARG H A 19 ARG HGy 1.0 1.8 3.4 124 76 A 16 ARG H A 16 ARG HG2 1.0 1.8 5.0 125 76 A 16 ARG H A 16 ARG HGy 1.0 1.8 5.0 126 77 A 19 ARG H A 19 ARG HD2 1.0 1.8 5.0 127 77 A 19 ARG H A 19 ARG HDy 1.0 1.8 5.0 128 78 A 19 ARG HA A 19 ARG HG2 1.0 1.8 5.0 129 78 A 19 ARG HA A 19 ARG HGy 1.0 1.8 5.0 130 79 A 13 TYR H A 13 TYR HB2 1.0 1.8 3.4 131 79 A 13 TYR H A 13 TYR HBy 1.0 1.8 3.4 132 80 A 6 GLN H A 6 GLN HG2 1.0 1.8 2.8 133 80 A 6 GLN H A 6 GLN HGy 1.0 1.8 2.8 134 81 A 6 GLN H A 6 GLN HB2 1.0 1.8 5.0 135 81 A 6 GLN H A 6 GLN HBy 1.0 1.8 5.0 136 82 A 12 ARG HA A 12 ARG HD2 1.0 1.8 5.0 137 82 A 12 ARG HA A 12 ARG HDy 1.0 1.8 5.0 138 83 A 12 ARG HA A 12 ARG HB2 1.0 1.8 5.0 139 83 A 12 ARG HA A 12 ARG HBy 1.0 1.8 5.0 140 84 A 17 ILE HA A 17 ILE HG1x 1.0 1.8 5.0 141 84 A 17 ILE HA A 17 ILE HG1y 1.0 1.8 5.0 142 85 A 17 ILE HA A 17 ILE HD1% 1.0 1.8 5.0 143 86 A 14 GLY HA2 A 17 ILE HG1x 1.0 1.8 5.0 144 86 A 14 GLY HAy A 17 ILE HG1x 1.0 1.8 5.0 145 86 A 17 ILE HG1y A 14 GLY HA2 1.0 1.8 5.0 146 86 A 14 GLY HAy A 17 ILE HG1y 1.0 1.8 5.0 147 87 A 17 ILE HA A 17 ILE HG2% 1.0 1.8 2.8 148 88 A 11 LEU HA A 11 LEU HDx% 1.0 1.8 5.0 149 88 A 11 LEU HA A 11 LEU HDy% 1.0 1.8 5.0 150 89 A 7 ILE HA A 7 ILE HG2% 1.0 1.8 2.8 151 90 A 17 ILE HA A 17 ILE HG1x 1.0 1.8 5.0 152 90 A 17 ILE HA A 17 ILE HG1y 1.0 1.8 5.0 153 91 A 5 ARG HA A 5 ARG HG2 1.0 1.8 5.0 154 91 A 5 ARG HA A 5 ARG HGy 1.0 1.8 5.0 155 92 A 19 ARG HA A 19 ARG HG2 1.0 1.8 5.0 156 92 A 19 ARG HA A 19 ARG HGy 1.0 1.8 5.0 157 93 A 6 GLN HA A 5 ARG HG2 1.0 1.8 5.0 158 93 A 6 GLN HA A 5 ARG HGy 1.0 1.8 5.0 159 94 A 12 ARG HA A 12 ARG HG2 1.0 1.8 3.4 160 94 A 12 ARG HA A 12 ARG HGy 1.0 1.8 3.4 161 95 A 6 GLN HA A 6 GLN HG2 1.0 1.8 5.0 162 95 A 6 GLN HA A 6 GLN HGy 1.0 1.8 5.0 163 96 A 1 ARG HA A 1 ARG HGy 1.0 1.8 3.4 164 96 A 1 ARG HA A 1 ARG HG2 1.0 1.8 3.4 165 97 A 1 ARG HA A 1 ARG HB2 1.0 1.8 5.0 166 97 A 1 ARG HA A 1 ARG HBy 1.0 1.8 5.0 167 98 A 12 ARG HA A 12 ARG HB2 1.0 1.8 2.8 168 98 A 12 ARG HA A 12 ARG HBy 1.0 1.8 2.8 169 99 A 2 GLN HA A 2 GLN HBx 1.0 1.8 3.4 170 99 A 2 GLN HA A 2 GLN HBy 1.0 1.8 3.4 171 100 A 11 LEU HA A 11 LEU HB2 1.0 1.8 5.0 172 100 A 11 LEU HA A 11 LEU HBy 1.0 1.8 5.0 173 101 A 7 ILE HA A 7 ILE HB 1.0 1.8 3.4 174 102 A 8 GLU HA A 8 GLU HB2 1.0 1.8 2.8 175 102 A 8 GLU HA A 8 GLU HBy 1.0 1.8 2.8 176 103 A 7 ILE HA A 6 GLN HG2 1.0 1.8 5.0 177 103 A 7 ILE HA A 6 GLN HGy 1.0 1.8 5.0 178 104 A 16 ARG HA A 16 ARG HB2 1.0 1.8 5.0 179 104 A 16 ARG HA A 16 ARG HBy 1.0 1.8 5.0 180 105 A 9 GLN HA A 9 GLN HBx 1.0 1.8 5.0 181 105 A 9 GLN HBy A 9 GLN HA 1.0 1.8 5.0 182 106 A 4 MET HA A 4 MET HG2 1.0 1.8 5.0 183 106 A 4 MET HA A 4 MET HGy 1.0 1.8 5.0 184 107 A 9 GLN HA A 9 GLN HGx 1.0 1.8 5.0 185 107 A 9 GLN HGy A 9 GLN HA 1.0 1.8 5.0 186 108 A 2 GLN HA A 2 GLN HGx 1.0 1.8 3.4 187 108 A 2 GLN HA A 2 GLN HGy 1.0 1.8 3.4 188 109 A 8 GLU HA A 8 GLU HG2 1.0 1.8 3.4 189 109 A 8 GLU HA A 8 GLU HGy 1.0 1.8 3.4 190 110 A 20 ARG HA A 20 ARG HD2 1.0 1.8 5.0 191 110 A 20 ARG HA A 20 ARG HDy 1.0 1.8 5.0 192 111 A 6 GLN HA A 5 ARG HD2 1.0 1.8 5.0 193 111 A 6 GLN HA A 5 ARG HDy 1.0 1.8 5.0 194 112 A 20 ARG HDy A 20 ARG HG2 1.0 1.8 2.8 195 112 A 20 ARG HD2 A 20 ARG HG2 1.0 1.8 2.8 196 112 A 20 ARG HGy A 20 ARG HD2 1.0 1.8 2.8 197 112 A 20 ARG HDy A 20 ARG HGy 1.0 1.8 2.8 198 113 A 1 ARG HDy A 1 ARG HGy 1.0 1.8 2.8 199 113 A 1 ARG HG2 A 1 ARG HD2 1.0 1.8 2.8 200 113 A 1 ARG HG2 A 1 ARG HDy 1.0 1.8 2.8 201 113 A 1 ARG HD2 A 1 ARG HGy 1.0 1.8 2.8 202 114 A 4 MET HE% A 3 TYR HBx 1.0 1.8 3.4 203 114 A 3 TYR HBy A 4 MET HE% 1.0 1.8 3.4 204 115 A 19 ARG HDy A 19 ARG HG2 1.0 1.8 2.8 205 115 A 19 ARG HD2 A 19 ARG HG2 1.0 1.8 2.8 206 115 A 19 ARG HGy A 19 ARG HD2 1.0 1.8 2.8 207 115 A 19 ARG HGy A 19 ARG HDy 1.0 1.8 2.8 208 116 A 1 ARG HG2 A 1 ARG HD2 1.0 1.8 2.8 209 116 A 1 ARG HG2 A 1 ARG HDy 1.0 1.8 2.8 210 117 A 12 ARG HDy A 12 ARG HG2 1.0 1.8 3.4 211 117 A 12 ARG HGy A 12 ARG HD2 1.0 1.8 3.4 212 117 A 12 ARG HDy A 12 ARG HGy 1.0 1.8 3.4 213 117 A 12 ARG HD2 A 12 ARG HG2 1.0 1.8 3.4 214 118 A 19 ARG HB2 A 19 ARG HD2 1.0 1.8 2.8 215 118 A 19 ARG HBy A 19 ARG HD2 1.0 1.8 2.8 216 118 A 19 ARG HDy A 19 ARG HB2 1.0 1.8 2.8 217 118 A 19 ARG HDy A 19 ARG HBy 1.0 1.8 2.8 218 119 A 1 ARG HB2 A 1 ARG HD2 1.0 1.8 2.8 219 119 A 1 ARG HBy A 1 ARG HD2 1.0 1.8 2.8 220 119 A 1 ARG HDy A 1 ARG HB2 1.0 1.8 2.8 221 119 A 1 ARG HBy A 1 ARG HDy 1.0 1.8 2.8 222 120 A 2 GLN HBy A 2 GLN HGx 1.0 1.8 3.4 223 120 A 2 GLN HBx A 2 GLN HGx 1.0 1.8 3.4 224 120 A 2 GLN HGy A 2 GLN HBx 1.0 1.8 3.4 225 120 A 2 GLN HBy A 2 GLN HGy 1.0 1.8 3.4 226 121 A 18 SER HA A 18 SER HB2 1.0 1.8 5.0 227 121 A 18 SER HA A 18 SER HBy 1.0 1.8 5.0 228 122 A 1 ARG HB2 A 1 ARG HD2 1.0 1.8 5.0 229 122 A 1 ARG HBy A 1 ARG HD2 1.0 1.8 5.0 230 122 A 1 ARG HDy A 1 ARG HB2 1.0 1.8 5.0 231 122 A 1 ARG HBy A 1 ARG HDy 1.0 1.8 5.0 232 123 A 19 ARG HB2 A 19 ARG HD2 1.0 1.8 5.0 233 123 A 19 ARG HBy A 19 ARG HD2 1.0 1.8 5.0 234 123 A 19 ARG HDy A 19 ARG HB2 1.0 1.8 5.0 235 123 A 19 ARG HDy A 19 ARG HBy 1.0 1.8 5.0 236 124 A 1 ARG HG2 A 1 ARG HD2 1.0 1.8 2.8 237 124 A 1 ARG HG2 A 1 ARG HDy 1.0 1.8 2.8 238 125 A 5 ARG HD2 A 5 ARG HG2 1.0 1.8 2.8 239 125 A 5 ARG HGy A 5 ARG HD2 1.0 1.8 2.8 240 125 A 5 ARG HDy A 5 ARG HGy 1.0 1.8 2.8 241 125 A 5 ARG HDy A 5 ARG HG2 1.0 1.8 2.8 242 126 A 19 ARG HDy A 19 ARG HG2 1.0 1.8 5.0 243 126 A 19 ARG HD2 A 19 ARG HG2 1.0 1.8 5.0 244 126 A 19 ARG HGy A 19 ARG HD2 1.0 1.8 5.0 245 126 A 19 ARG HGy A 19 ARG HDy 1.0 1.8 5.0 246 127 A 17 ILE HG2% A 17 ILE HG1x 1.0 1.8 2.8 247 127 A 17 ILE HG2% A 17 ILE HG1y 1.0 1.8 2.8 248 128 A 11 LEU HBy A 11 LEU HDx% 1.0 1.8 2.8 249 128 A 11 LEU HB2 A 11 LEU HDx% 1.0 1.8 2.8 250 128 A 11 LEU HDy% A 11 LEU HB2 1.0 1.8 2.8 251 128 A 11 LEU HDy% A 11 LEU HBy 1.0 1.8 2.8 252 129 A 6 GLN HG2 A 7 ILE HG12 1.0 1.8 5.0 253 129 A 6 GLN HGy A 7 ILE HG12 1.0 1.8 5.0 254 130 A 9 GLN H A 9 GLN HGx 1.0 1.8 2.8 255 130 A 9 GLN H A 9 GLN HGy 1.0 1.8 2.8 256 131 A 7 ILE H A 7 ILE HB 1.0 1.8 3.4 257 132 A 5 ARG HB2 A 6 GLN HE2x 1.0 1.8 5.0 258 132 A 5 ARG HBy A 6 GLN HE2x 1.0 1.8 5.0 259 132 A 6 GLN HE2y A 5 ARG HB2 1.0 1.8 5.0 260 132 A 5 ARG HBy A 6 GLN HE2y 1.0 1.8 5.0 261 133 A 5 ARG HGy A 6 GLN HE2x 1.0 1.8 5.0 262 133 A 5 ARG HG2 A 6 GLN HE2x 1.0 1.8 5.0 263 133 A 6 GLN HE2y A 5 ARG HG2 1.0 1.8 5.0 264 133 A 5 ARG HGy A 6 GLN HE2y 1.0 1.8 5.0 265 134 A 3 TYR HE% A 4 MET HE% 1.0 1.8 5.0 266 135 A 6 GLN HE2y A 7 ILE HG12 1.0 1.8 5.0 267 135 A 6 GLN HE2x A 7 ILE HG12 1.0 1.8 5.0 268 135 A 7 ILE HG1y A 6 GLN HE2x 1.0 1.8 5.0 269 135 A 6 GLN HE2y A 7 ILE HG1y 1.0 1.8 5.0 270 136 A 19 ARG H A 19 ARG HG2 1.0 1.8 5.0 271 136 A 19 ARG H A 19 ARG HGy 1.0 1.8 5.0 272 137 A 20 ARG H A 20 ARG HG2 1.0 1.8 5.0 273 137 A 20 ARG H A 20 ARG HGy 1.0 1.8 5.0 274 138 A 10 ALA H A 10 ALA HB% 1.0 1.8 3.4 275 139 A 20 ARG H A 20 ARG HB2 1.0 1.8 5.0 276 139 A 20 ARG H A 20 ARG HBy 1.0 1.8 5.0 277 140 A 17 ILE H A 17 ILE HB 1.0 1.8 5.0 278 141 A 1 ARG H1 A 1 ARG HG2 1.0 1.8 5.0 279 142 A 1 ARG H1 A 1 ARG HB2 1.0 1.8 5.0 280 142 A 1 ARG H1 A 1 ARG HBy 1.0 1.8 5.0 281 143 A 17 ILE H A 17 ILE HD1% 1.0 1.8 3.4 282 144 A 11 LEU H A 11 LEU HDx% 1.0 1.8 2.8 283 144 A 11 LEU H A 11 LEU HDy% 1.0 1.8 2.8 284 145 A 13 TYR HD% A 13 TYR HB2 1.0 1.8 3.4 285 145 A 13 TYR HBy A 13 TYR HD% 1.0 1.8 3.4 286 146 A 5 ARG H A 5 ARG HD2 1.0 1.8 5.0 287 146 A 5 ARG H A 5 ARG HDy 1.0 1.8 5.0 288 147 A 13 TYR H A 13 TYR HB2 1.0 1.8 3.4 289 147 A 13 TYR H A 13 TYR HBy 1.0 1.8 3.4 290 148 A 3 TYR H A 3 TYR HBx 1.0 1.8 3.4 291 148 A 3 TYR H A 3 TYR HBy 1.0 1.8 3.4 292 149 A 12 ARG H A 12 ARG HD2 1.0 1.8 5.0 293 149 A 12 ARG H A 12 ARG HDy 1.0 1.8 5.0 294 150 A 18 SER H A 18 SER HA 1.0 1.8 5.0 295 151 A 19 ARG H A 19 ARG HA 1.0 1.8 5.0 296 152 A 4 MET H A 4 MET HA 1.0 1.8 5.0 297 153 A 20 ARG H A 20 ARG HA 1.0 1.8 5.0 298 154 A 9 GLN H A 9 GLN HA 1.0 1.8 3.4 299 155 A 15 TYR H A 15 TYR HA 1.0 1.8 5.0 300 156 A 1 ARG H1 A 1 ARG HA 1.0 1.8 5.0 301 157 A 11 LEU H A 11 LEU HA 1.0 1.8 5.0 302 158 A 6 GLN H A 6 GLN HA 1.0 1.8 3.4 303 159 A 17 ILE H A 17 ILE HA 1.0 1.8 5.0 304 160 A 2 GLN H A 2 GLN HA 1.0 1.8 2.8 305 161 A 12 ARG H A 12 ARG HA 1.0 1.8 2.8 306 162 A 18 SER H A 18 SER HB2 1.0 1.8 5.0 307 162 A 18 SER H A 18 SER HBy 1.0 1.8 5.0 308 163 A 8 GLU H A 8 GLU HA 1.0 1.8 3.4 309 164 A 7 ILE H A 7 ILE HA 1.0 1.8 3.4 310 165 A 14 GLY H A 14 GLY HA2 1.0 1.8 2.8 311 165 A 14 GLY H A 14 GLY HAy 1.0 1.8 2.8 312 166 A 15 TYR HE% A 15 TYR HB2 1.0 1.8 5.0 313 166 A 15 TYR HBy A 15 TYR HE% 1.0 1.8 5.0 314 167 A 8 GLU H A 7 ILE HA 1.0 1.8 5.0 315 168 A 15 TYR H A 12 ARG HA 1.0 1.8 5.0 316 169 A 6 GLN HA A 8 GLU H 1.0 1.8 5.0 317 170 A 4 MET HA A 8 GLU H 1.0 1.8 5.0 318 171 A 11 LEU H A 8 GLU HA 1.0 1.8 5.0 319 172 A 10 ALA H A 7 ILE HA 1.0 1.8 5.0 320 173 A 4 MET HA A 6 GLN H 1.0 1.8 5.0 321 174 A 5 ARG HA A 6 GLN H 1.0 1.8 5.0 322 175 A 3 TYR HA A 4 MET H 1.0 1.8 5.0 323 176 A 18 SER HA A 19 ARG H 1.0 1.8 5.0 324 177 A 10 ALA HA A 11 LEU H 1.0 1.8 5.0 325 178 A 15 TYR H A 14 GLY HA2 1.0 1.8 5.0 326 178 A 15 TYR H A 14 GLY HAy 1.0 1.8 5.0 327 179 A 11 LEU HA A 12 ARG H 1.0 1.8 3.4 328 180 A 9 GLN H A 9 GLN HA 1.0 1.8 2.8 329 181 A 18 SER H A 17 ILE HA 1.0 1.8 3.4 330 182 A 13 TYR HA A 14 GLY H 1.0 1.8 5.0 331 183 A 1 ARG H1 A 2 GLN H 1.0 1.8 5.0 332 184 A 1 ARG H1 A 2 GLN H 1.0 1.8 5.0 333 185 A 13 TYR H A 14 GLY H 1.0 1.8 3.4 334 186 A 15 TYR H A 14 GLY H 1.0 1.8 5.0 335 187 A 15 TYR H A 14 GLY H 1.0 1.8 5.0 336 188 A 8 GLU H A 7 ILE H 1.0 1.8 5.0 337 189 A 8 GLU H A 7 ILE H 1.0 1.8 5.0 338 190 A 8 GLU H A 9 GLN H 1.0 1.8 3.4 339 191 A 8 GLU H A 9 GLN H 1.0 1.8 3.4 340 192 A 11 LEU H A 12 ARG H 1.0 1.8 3.4 341 193 A 10 ALA H A 11 LEU H 1.0 1.8 2.8 342 194 A 10 ALA H A 11 LEU H 1.0 1.8 2.8 343 195 A 11 LEU H A 12 ARG H 1.0 1.8 3.4 344 196 A 4 MET H A 6 GLN H 1.0 1.8 5.0 345 197 A 18 SER H A 17 ILE H 1.0 1.8 5.0 346 198 A 18 SER H A 17 ILE H 1.0 1.8 5.0 347 199 A 20 ARG H A 19 ARG H 1.0 1.8 5.0 348 200 A 20 ARG H A 19 ARG H 1.0 1.8 5.0 349 201 A 20 ARG H A 19 ARG HA 1.0 1.8 5.0 350 202 A 1 ARG HA A 2 GLN H 1.0 1.8 2.8 351 203 A 4 MET HA A 7 ILE H 1.0 1.8 5.0 352 204 A 10 ALA H A 8 GLU HA 1.0 1.8 5.0 353 205 A 15 TYR HA A 17 ILE H 1.0 1.8 5.0 354 206 A 8 GLU HA A 9 GLN H 1.0 1.8 5.0 355 207 A 19 ARG H A 18 SER HB2 1.0 1.8 5.0 356 207 A 18 SER HBy A 19 ARG H 1.0 1.8 5.0 357 208 A 1 ARG H1 A 1 ARG HD2 1.0 1.8 5.0 358 208 A 1 ARG H1 A 1 ARG HDy 1.0 1.8 5.0 359 209 A 14 GLY H A 13 TYR HB2 1.0 1.8 5.0 360 209 A 14 GLY H A 13 TYR HBy 1.0 1.8 5.0 361 210 A 4 MET HA A 5 ARG H 1.0 1.8 3.4 362 211 A 20 ARG H A 18 SER HB2 1.0 1.8 5.0 363 211 A 20 ARG H A 18 SER HBy 1.0 1.8 5.0 364 212 A 3 TYR HD% A 3 TYR HBx 1.0 1.8 2.8 365 212 A 3 TYR HBy A 3 TYR HD% 1.0 1.8 2.8 366 213 A 3 TYR HA A 3 TYR HD% 1.0 1.8 3.4 367 214 A 13 TYR HA A 13 TYR HD% 1.0 1.8 3.4 368 215 A 15 TYR HD% A 14 GLY HA2 1.0 1.8 5.0 369 215 A 14 GLY HAy A 15 TYR HD% 1.0 1.8 5.0 370 216 A 12 ARG HA A 15 TYR HD% 1.0 1.8 5.0 371 217 A 15 TYR HA A 15 TYR HD% 1.0 1.8 3.4 372 218 A 3 TYR HA A 3 TYR HE% 1.0 1.8 5.0 373 219 A 15 TYR HA A 15 TYR HE% 1.0 1.8 5.0 374 220 A 2 GLN HA A 2 GLN HE2x 1.0 1.8 5.0 375 220 A 2 GLN HA A 2 GLN HE2y 1.0 1.8 5.0 376 221 A 15 TYR HD% A 15 TYR HB2 1.0 1.8 2.8 377 221 A 15 TYR HBy A 15 TYR HD% 1.0 1.8 2.8 378 222 A 9 GLN HA A 9 GLN HE21 1.0 1.8 5.0 379 222 A 9 GLN HA A 9 GLN HE22 1.0 1.8 5.0 380 223 A 1 ARG HBy A 2 GLN HE2x 1.0 1.8 5.0 381 223 A 1 ARG HB2 A 2 GLN HE2x 1.0 1.8 5.0 382 223 A 2 GLN HE2y A 1 ARG HB2 1.0 1.8 5.0 383 223 A 1 ARG HBy A 2 GLN HE2y 1.0 1.8 5.0 384 224 A 2 GLN HE2y A 2 GLN HGx 1.0 1.8 5.0 385 224 A 2 GLN HE2x A 2 GLN HGx 1.0 1.8 5.0 386 224 A 2 GLN HGy A 2 GLN HE2x 1.0 1.8 5.0 387 224 A 2 GLN HGy A 2 GLN HE2y 1.0 1.8 5.0 388 225 A 3 TYR HE% A 1 ARG HB2 1.0 1.8 5.0 389 225 A 1 ARG HBy A 3 TYR HE% 1.0 1.8 5.0 390 226 A 9 GLN HE21 A 9 GLN HGx 1.0 1.8 5.0 391 226 A 9 GLN HE22 A 9 GLN HGx 1.0 1.8 5.0 392 226 A 9 GLN HGy A 9 GLN HE21 1.0 1.8 5.0 393 226 A 9 GLN HGy A 9 GLN HE22 1.0 1.8 5.0 394 227 A 5 ARG HBy A 6 GLN HE2x 1.0 1.8 5.0 395 227 A 5 ARG HB2 A 6 GLN HE2x 1.0 1.8 5.0 396 227 A 6 GLN HE2y A 5 ARG HB2 1.0 1.8 5.0 397 227 A 5 ARG HBy A 6 GLN HE2y 1.0 1.8 5.0 398 228 A 13 TYR HD% A 12 ARG HB2 1.0 1.8 5.0 399 228 A 13 TYR HD% A 12 ARG HBy 1.0 1.8 5.0 400 229 A 8 GLU H A 7 ILE HG2% 1.0 1.8 5.0 401 230 A 8 GLU H A 7 ILE HB 1.0 1.8 3.4 402 231 A 8 GLU H A 8 GLU HG2 1.0 1.8 5.0 403 231 A 8 GLU H A 8 GLU HGy 1.0 1.8 5.0 404 232 A 4 MET H A 4 MET HG2 1.0 1.8 3.4 405 232 A 4 MET H A 4 MET HGy 1.0 1.8 3.4 406 233 A 10 ALA H A 11 LEU HDx% 1.0 1.8 5.0 407 233 A 10 ALA H A 11 LEU HDy% 1.0 1.8 5.0 408 234 A 18 SER H A 17 ILE HD1% 1.0 1.8 5.0 409 235 A 11 LEU H A 10 ALA HB% 1.0 1.8 5.0 410 236 A 7 ILE H A 6 GLN HB2 1.0 1.8 5.0 411 236 A 7 ILE H A 6 GLN HBy 1.0 1.8 5.0 412 237 A 17 ILE H A 17 ILE HG1x 1.0 1.8 5.0 413 237 A 17 ILE H A 17 ILE HG1y 1.0 1.8 5.0 414 238 A 10 ALA H A 10 ALA HB% 1.0 1.8 5.0 415 239 A 3 TYR H A 4 MET HE% 1.0 1.8 5.0 416 240 A 10 ALA H A 9 GLN HGx 1.0 1.8 5.0 417 240 A 10 ALA H A 9 GLN HGy 1.0 1.8 5.0 418 241 A 7 ILE H A 8 GLU HB2 1.0 1.8 5.0 419 241 A 7 ILE H A 8 GLU HBy 1.0 1.8 5.0 420 242 A 13 TYR H A 12 ARG HB2 1.0 1.8 2.8 421 242 A 13 TYR H A 12 ARG HBy 1.0 1.8 2.8 422 243 A 12 ARG H A 12 ARG HB2 1.0 1.8 2.8 423 243 A 12 ARG H A 12 ARG HBy 1.0 1.8 2.8 424 244 A 6 GLN H A 7 ILE HB 1.0 1.8 5.0 425 245 A 3 TYR H A 2 GLN HBx 1.0 1.8 5.0 426 245 A 3 TYR H A 2 GLN HBy 1.0 1.8 5.0 427 246 A 10 ALA H A 8 GLU HB2 1.0 1.8 5.0 428 246 A 10 ALA H A 8 GLU HBy 1.0 1.8 5.0 429 247 A 4 MET H A 3 TYR HBx 1.0 1.8 5.0 430 247 A 4 MET H A 3 TYR HBy 1.0 1.8 5.0 431 248 A 13 TYR H A 12 ARG HD2 1.0 1.8 5.0 432 248 A 13 TYR H A 12 ARG HDy 1.0 1.8 5.0 433 249 A 12 ARG H A 12 ARG HD2 1.0 1.8 5.0 434 249 A 12 ARG H A 12 ARG HDy 1.0 1.8 5.0 435 250 A 6 GLN H A 5 ARG HD2 1.0 1.8 5.0 436 250 A 6 GLN H A 5 ARG HDy 1.0 1.8 5.0 437 251 A 6 GLN H A 3 TYR HBx 1.0 1.8 5.0 438 251 A 6 GLN H A 3 TYR HBy 1.0 1.8 5.0 439 252 A 14 GLY H A 13 TYR HD% 1.0 1.8 5.0 440 253 A 14 GLY H A 15 TYR HD% 1.0 1.8 5.0 441 254 A 12 ARG H A 13 TYR HD% 1.0 1.8 5.0 442 255 A 15 TYR H A 15 TYR HD% 1.0 1.8 5.0 443 256 A 4 MET H A 3 TYR HD% 1.0 1.8 5.0 444 257 A 3 TYR H A 3 TYR HD% 1.0 1.8 3.4 445 258 A 2 GLN H A 3 TYR HE% 1.0 1.8 5.0 446 259 A 13 TYR H A 14 GLY H 1.0 1.8 5.0 447 260 A 7 ILE HA A 10 ALA HB% 1.0 1.8 5.0 448 261 A 16 ARG HA A 16 ARG HD2 1.0 1.8 5.0 449 261 A 16 ARG HA A 16 ARG HDy 1.0 1.8 5.0 450 262 A 7 ILE H A 8 GLU HG2 1.0 1.8 5.0 451 262 A 7 ILE H A 8 GLU HGy 1.0 1.8 5.0 452 263 A 18 SER H A 17 ILE HG1x 1.0 1.8 5.0 453 263 A 18 SER H A 17 ILE HG1y 1.0 1.8 5.0 454 264 A 18 SER H A 19 ARG HG2 1.0 1.8 5.0 455 264 A 18 SER H A 19 ARG HGy 1.0 1.8 5.0 456 265 A 5 ARG H A 6 GLN HG2 1.0 1.8 5.0 457 265 A 5 ARG H A 6 GLN HGy 1.0 1.8 5.0 458 266 A 14 GLY H A 13 TYR HD% 1.0 1.8 5.0 459 267 A 14 GLY H A 15 TYR HD% 1.0 1.8 5.0 460 268 A 15 TYR H A 15 TYR HD% 1.0 1.8 5.0 461 269 A 3 TYR H A 3 TYR HD% 1.0 1.8 2.8 462 270 A 12 ARG H A 13 TYR HD% 1.0 1.8 5.0 463 271 A 3 TYR H A 3 TYR HE% 1.0 1.8 3.4 464 272 A 2 GLN H A 2 GLN HE2x 1.0 1.8 5.0 465 272 A 2 GLN H A 2 GLN HE2y 1.0 1.8 5.0 466 273 A 15 TYR H A 15 TYR HE% 1.0 1.8 5.0 467 274 A 17 ILE HA A 16 ARG HD2 1.0 1.8 5.0 468 274 A 17 ILE HA A 16 ARG HDy 1.0 1.8 5.0 469 275 A 2 GLN HA A 1 ARG HB2 1.0 1.8 5.0 470 275 A 2 GLN HA A 1 ARG HBy 1.0 1.8 5.0 471 276 A 6 GLN HA A 7 ILE HG12 1.0 1.8 5.0 472 277 A 7 ILE HA A 7 ILE HG12 1.0 1.8 5.0 473 278 A 17 ILE HD1% A 14 GLY HA2 1.0 1.8 5.0 474 278 A 14 GLY HAy A 17 ILE HD1% 1.0 1.8 5.0 475 279 A 18 SER HA A 17 ILE HD1% 1.0 1.8 5.0 476 280 A 16 ARG HDy A 16 ARG HG2 1.0 1.8 5.0 477 280 A 16 ARG HD2 A 16 ARG HG2 1.0 1.8 5.0 478 280 A 16 ARG HGy A 16 ARG HD2 1.0 1.8 5.0 479 280 A 16 ARG HGy A 16 ARG HDy 1.0 1.8 5.0 480 281 A 20 ARG HBy A 20 ARG HD2 1.0 1.8 2.8 481 281 A 20 ARG HB2 A 20 ARG HD2 1.0 1.8 2.8 482 281 A 20 ARG HDy A 20 ARG HB2 1.0 1.8 2.8 483 281 A 20 ARG HDy A 20 ARG HBy 1.0 1.8 2.8 484 282 A 7 ILE HB A 7 ILE HG12 1.0 1.8 5.0 485 283 A 7 ILE HG2% A 6 GLN HG2 1.0 1.8 5.0 486 283 A 7 ILE HG2% A 6 GLN HGy 1.0 1.8 5.0 487 284 A 6 GLN HG2 A 7 ILE HG12 1.0 1.8 5.0 488 284 A 6 GLN HGy A 7 ILE HG12 1.0 1.8 5.0 489 285 A 17 ILE HG2% A 17 ILE HG1x 1.0 1.8 2.8 490 285 A 17 ILE HG2% A 17 ILE HG1y 1.0 1.8 2.8 491 286 A 17 ILE HB A 17 ILE HG1x 1.0 1.8 2.8 492 286 A 17 ILE HB A 17 ILE HG1y 1.0 1.8 2.8 493 287 A 7 ILE HB A 7 ILE HG12 1.0 1.8 5.0 494 288 A 7 ILE HA A 7 ILE HG12 1.0 1.8 3.4 495 289 A 17 ILE HD1% A 14 GLY HA2 1.0 1.8 5.0 496 289 A 14 GLY HAy A 17 ILE HD1% 1.0 1.8 5.0 497 290 A 14 GLY HA2 A 17 ILE HG1x 1.0 1.8 5.0 498 290 A 14 GLY HAy A 17 ILE HG1x 1.0 1.8 5.0 499 290 A 17 ILE HG1y A 14 GLY HA2 1.0 1.8 5.0 500 290 A 14 GLY HAy A 17 ILE HG1y 1.0 1.8 5.0 501 291 A 7 ILE HA A 10 ALA HB% 1.0 1.8 5.0 502 292 A 17 ILE HB A 18 SER HB2 1.0 1.8 5.0 503 292 A 18 SER HBy A 17 ILE HB 1.0 1.8 5.0 504 293 A 8 GLU HA A 7 ILE HB 1.0 1.8 5.0 505 294 A 19 ARG HA A 20 ARG HB2 1.0 1.8 5.0 506 294 A 19 ARG HA A 20 ARG HBy 1.0 1.8 5.0 507 295 A 20 ARG HA A 20 ARG HB2 1.0 1.8 2.8 508 295 A 20 ARG HA A 20 ARG HBy 1.0 1.8 2.8 509 296 A 5 ARG HA A 5 ARG HB2 1.0 1.8 5.0 510 296 A 5 ARG HA A 5 ARG HBy 1.0 1.8 5.0 511 297 A 11 LEU HBy A 11 LEU HDx% 1.0 1.8 2.8 512 297 A 11 LEU HB2 A 11 LEU HDx% 1.0 1.8 2.8 513 297 A 11 LEU HDy% A 11 LEU HB2 1.0 1.8 2.8 514 297 A 11 LEU HDy% A 11 LEU HBy 1.0 1.8 2.8 515 298 A 7 ILE HG2% A 7 ILE HG12 1.0 1.8 3.4 516 299 A 7 ILE HG2% A 7 ILE HG12 1.0 1.8 3.4 517 300 A 1 ARG HDy A 2 GLN HGx 1.0 1.8 5.0 518 300 A 1 ARG HD2 A 2 GLN HGx 1.0 1.8 5.0 519 300 A 2 GLN HGy A 1 ARG HD2 1.0 1.8 5.0 520 300 A 2 GLN HGy A 1 ARG HDy 1.0 1.8 5.0 521 301 A 7 ILE HA A 7 ILE HB 1.0 1.8 5.0 522 302 A 2 GLN HA A 2 GLN HE2x 1.0 1.8 5.0 523 302 A 2 GLN HA A 2 GLN HE2y 1.0 1.8 5.0 524 303 A 12 ARG HA A 15 TYR HD% 1.0 1.8 5.0 525 304 A 5 ARG HA A 6 GLN HE2x 1.0 1.8 5.0 526 304 A 5 ARG HA A 6 GLN HE2y 1.0 1.8 5.0 527 305 A 9 GLN HE22 A 9 GLN HGx 1.0 1.8 3.4 528 305 A 9 GLN HE21 A 9 GLN HGx 1.0 1.8 3.4 529 305 A 9 GLN HGy A 9 GLN HE21 1.0 1.8 3.4 530 305 A 9 GLN HGy A 9 GLN HE22 1.0 1.8 3.4 531 306 A 4 MET H A 4 MET HG2 1.0 1.8 5.0 532 306 A 4 MET H A 4 MET HGy 1.0 1.8 5.0 533 307 A 8 GLU H A 8 GLU HG2 1.0 1.8 5.0 534 307 A 8 GLU H A 8 GLU HGy 1.0 1.8 5.0 535 308 A 15 TYR H A 15 TYR HB2 1.0 1.8 5.0 536 308 A 15 TYR H A 15 TYR HBy 1.0 1.8 5.0 537 309 A 14 GLY H A 13 TYR HB2 1.0 1.8 5.0 538 309 A 14 GLY H A 13 TYR HBy 1.0 1.8 5.0 539 310 A 8 GLU H A 7 ILE HA 1.0 1.8 5.0 540 311 A 15 TYR H A 14 GLY HA2 1.0 1.8 5.0 541 311 A 15 TYR H A 14 GLY HAy 1.0 1.8 5.0 542 312 A 11 LEU H A 8 GLU HA 1.0 1.8 5.0 543 313 A 8 GLU HA A 9 GLN H 1.0 1.8 3.4 544 314 A 20 ARG H A 19 ARG HA 1.0 1.8 5.0 545 315 A 13 TYR HE% A 12 ARG HD2 1.0 1.8 5.0 546 315 A 13 TYR HE% A 12 ARG HDy 1.0 1.8 5.0 547 316 A 1 ARG H1 A 1 ARG HD2 1.0 1.8 5.0 548 316 A 1 ARG H1 A 1 ARG HDy 1.0 1.8 5.0 549 317 A 8 GLU H A 9 GLN HGx 1.0 1.8 5.0 550 317 A 8 GLU H A 9 GLN HGy 1.0 1.8 5.0 551 318 A 8 GLU H A 8 GLU HB2 1.0 1.8 2.8 552 318 A 8 GLU H A 8 GLU HBy 1.0 1.8 2.8 553 319 A 8 GLU H A 9 GLN HBx 1.0 1.8 5.0 554 319 A 8 GLU H A 9 GLN HBy 1.0 1.8 5.0 555 320 A 8 GLU H A 7 ILE HB 1.0 1.8 5.0 556 321 A 7 ILE H A 8 GLU HB2 1.0 1.8 5.0 557 321 A 7 ILE H A 8 GLU HBy 1.0 1.8 5.0 558 322 A 11 LEU H A 11 LEU HB2 1.0 1.8 3.4 559 322 A 11 LEU H A 11 LEU HBy 1.0 1.8 3.4 560 323 A 9 GLN H A 8 GLU HB2 1.0 1.8 3.4 561 323 A 8 GLU HBy A 9 GLN H 1.0 1.8 3.4 562 324 A 2 GLN H A 1 ARG HB2 1.0 1.8 2.8 563 324 A 2 GLN H A 1 ARG HBy 1.0 1.8 2.8 564 325 A 3 TYR H A 2 GLN HBx 1.0 1.8 3.4 565 325 A 3 TYR H A 2 GLN HBy 1.0 1.8 3.4 566 326 A 11 LEU H A 10 ALA HB% 1.0 1.8 5.0 567 327 A 8 GLU H A 7 ILE HG2% 1.0 1.8 5.0 568 328 A 18 SER H A 17 ILE HG2% 1.0 1.8 5.0 569 329 A 18 SER H A 17 ILE HA 1.0 1.8 5.0 570 330 A 10 ALA H A 9 GLN HA 1.0 1.8 3.4 571 331 A 5 ARG HA A 7 ILE H 1.0 1.8 5.0 572 332 A 1 ARG HBy A 2 GLN HE2x 1.0 1.8 5.0 573 332 A 1 ARG HB2 A 2 GLN HE2x 1.0 1.8 5.0 574 332 A 2 GLN HE2y A 1 ARG HB2 1.0 1.8 5.0 575 332 A 1 ARG HBy A 2 GLN HE2y 1.0 1.8 5.0 576 333 A 6 GLN HA A 8 GLU H 1.0 1.8 5.0 577 334 A 15 TYR H A 12 ARG HA 1.0 1.8 5.0 578 335 A 10 ALA H A 7 ILE HA 1.0 1.8 5.0 579 336 A 7 ILE HA A 9 GLN H 1.0 1.8 5.0 580 337 A 6 GLN HA A 9 GLN H 1.0 1.8 5.0 581 338 A 11 LEU HA A 12 ARG H 1.0 1.8 5.0 582 339 A 4 MET HA A 7 ILE H 1.0 1.8 5.0 583 340 A 2 GLN HBx A 2 GLN HGx 1.0 1.8 2.8 584 340 A 2 GLN HGy A 2 GLN HBx 1.0 1.8 2.8 585 340 A 2 GLN HBy A 2 GLN HGy 1.0 1.8 2.8 586 340 A 2 GLN HBy A 2 GLN HGx 1.0 1.8 2.8 587 341 A 9 GLN HBx A 9 GLN HGx 1.0 1.8 2.8 588 341 A 9 GLN HGy A 9 GLN HBx 1.0 1.8 2.8 589 341 A 9 GLN HGy A 9 GLN HBy 1.0 1.8 2.8 590 341 A 9 GLN HBy A 9 GLN HGx 1.0 1.8 2.8 591 342 A 8 GLU HBy A 8 GLU HG2 1.0 1.8 2.8 592 342 A 8 GLU HB2 A 8 GLU HG2 1.0 1.8 2.8 593 342 A 8 GLU HGy A 8 GLU HB2 1.0 1.8 2.8 594 342 A 8 GLU HGy A 8 GLU HBy 1.0 1.8 2.8 595 343 A 4 MET HBy A 4 MET HG2 1.0 1.8 2.8 596 343 A 4 MET HGy A 4 MET HB2 1.0 1.8 2.8 597 343 A 4 MET HBy A 4 MET HGy 1.0 1.8 2.8 598 343 A 4 MET HB2 A 4 MET HG2 1.0 1.8 2.8 599 344 A 1 ARG HBy A 2 GLN HGx 1.0 1.8 5.0 600 344 A 1 ARG HB2 A 2 GLN HGx 1.0 1.8 5.0 601 344 A 2 GLN HGy A 1 ARG HB2 1.0 1.8 5.0 602 344 A 1 ARG HBy A 2 GLN HGy 1.0 1.8 5.0 603 345 A 7 ILE HB A 8 GLU HG2 1.0 1.8 5.0 604 345 A 8 GLU HGy A 7 ILE HB 1.0 1.8 5.0 605 346 A 6 GLN H A 7 ILE HB 1.0 1.8 5.0 606 347 A 16 ARG H A 16 ARG HA 1.0 1.8 5.0 607 348 A 13 TYR H A 13 TYR HA 1.0 1.8 5.0 608 349 A 13 TYR HA A 16 ARG H 1.0 1.8 5.0 609 350 A 6 GLN HA A 5 ARG HD2 1.0 1.8 5.0 610 350 A 6 GLN HA A 5 ARG HDy 1.0 1.8 5.0 611 351 A 6 GLN HA A 9 GLN H 1.0 1.8 5.0 612 352 A 6 GLN H A 3 TYR HBx 1.0 1.8 5.0 613 352 A 6 GLN H A 3 TYR HBy 1.0 1.8 5.0 614 353 A 4 MET H A 6 GLN H 1.0 1.8 5.0 615 354 A 19 ARG H A 18 SER HB2 1.0 1.8 5.0 616 354 A 18 SER HBy A 19 ARG H 1.0 1.8 5.0 617 355 A 7 ILE H A 7 ILE HG12 1.0 1.8 5.0 618 356 A 6 GLN H A 5 ARG HB2 1.0 1.8 5.0 619 356 A 6 GLN H A 5 ARG HBy 1.0 1.8 5.0 620 357 A 4 MET HA A 8 GLU H 1.0 1.8 5.0 621 358 A 13 TYR HE% A 10 ALA HB% 1.0 1.8 5.0 stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 3 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 8012.820 . . . . 2 ppm . . 8012.820 . . . . 3 ppm . . 8012.820 . . . . stop_ save_