data_nef_c34479_6xti 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 6XTI 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 13 CYS SG 1 17 CYS SG 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 GLY start . false 2 A 2 GLY middle . false 3 A 3 GLY middle . false 4 A 4 GLY middle . false 5 A 5 ARG middle . . 6 A 6 GLY middle . false 7 A 7 TYR middle . . 8 A 8 GLU middle . . 9 A 9 TYR middle . . 10 A 10 ASN middle . . 11 A 11 LYS middle . . 12 A 12 GLN middle . . 13 A 13 CYS middle -HG . 14 A 14 LEU middle . . 15 A 15 ILE middle . . 16 A 16 PHE middle . . 17 A 17 CYS end -HG . 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 GLY H1 H 1 8.19 0.02 A 1 GLY HAy H 1 3.87 0.02 A 1 GLY HAx H 1 3.57 0.02 A 1 GLY CA C 13 43.3 0.3 A 1 GLY N N 15 104.6 0.3 A 2 GLY H H 1 8.19 0.02 A 2 GLY HAy H 1 4.04 0.02 A 2 GLY HAx H 1 3.50 0.02 A 2 GLY CA C 13 42.5 0.3 A 2 GLY N N 15 116.8 0.3 A 3 GLY H H 1 7.25 0.02 A 3 GLY HAy H 1 4.10 0.02 A 3 GLY HAx H 1 3.27 0.02 A 3 GLY CA C 13 40.4 0.3 A 3 GLY N N 15 102.0 0.3 A 4 GLY H H 1 8.68 0.02 A 4 GLY HAx H 1 3.35 0.02 A 4 GLY HAy H 1 3.88 0.02 A 4 GLY CA C 13 43.1 0.3 A 4 GLY N N 15 107.5 0.3 A 5 ARG H H 1 8.23 0.02 A 5 ARG HA H 1 5.27 0.02 A 5 ARG HBx H 1 1.43 0.02 A 5 ARG HBy H 1 1.49 0.02 A 5 ARG HD2 H 1 3.09 0.02 A 5 ARG HG2 H 1 1.37 0.02 A 5 ARG CA C 13 49.4 0.3 A 5 ARG CB C 13 31.3 0.3 A 5 ARG CD C 13 39.7 0.3 A 5 ARG CG C 13 24.9 0.3 A 5 ARG N N 15 120.1 0.3 A 6 GLY H H 1 7.53 0.02 A 6 GLY HAy H 1 4.04 0.02 A 6 GLY HAx H 1 3.17 0.02 A 6 GLY CA C 13 44.0 0.3 A 6 GLY N N 15 106.7 0.3 A 7 TYR HA H 1 4.29 0.02 A 7 TYR HBx H 1 2.39 0.02 A 7 TYR HBy H 1 3.41 0.02 A 7 TYR HD2 H 1 7.01 0.02 A 7 TYR HE2 H 1 6.69 0.02 A 7 TYR CA C 13 54.4 0.3 A 7 TYR CB C 13 35.3 0.3 A 7 TYR CD2 C 13 129.1 0.3 A 7 TYR CE2 C 13 114.8 0.3 A 7 TYR CG C 13 155.6 0.3 A 8 GLU H H 1 8.34 0.02 A 8 GLU HA H 1 4.18 0.02 A 8 GLU HBx H 1 1.87 0.02 A 8 GLU HBy H 1 1.96 0.02 A 8 GLU HG2 H 1 2.13 0.02 A 8 GLU CA C 13 54.3 0.3 A 8 GLU CB C 13 26.6 0.3 A 8 GLU CD C 13 174.5 0.3 A 8 GLU CG C 13 35.3 0.3 A 8 GLU N N 15 114.2 0.3 A 9 TYR H H 1 8.60 0.02 A 9 TYR HA H 1 4.06 0.02 A 9 TYR HBx H 1 2.92 0.02 A 9 TYR HBy H 1 2.95 0.02 A 9 TYR HD1 H 1 7.04 0.02 A 9 TYR HE1 H 1 6.67 0.02 A 9 TYR CA C 13 57.7 0.3 A 9 TYR CB C 13 34.5 0.3 A 9 TYR CD2 C 13 129.6 0.3 A 9 TYR CE2 C 13 114.8 0.3 A 9 TYR CG C 13 155.9 0.3 A 9 TYR N N 15 121.2 0.3 A 10 ASN H H 1 7.12 0.02 A 10 ASN HA H 1 4.33 0.02 A 10 ASN HBx H 1 2.33 0.02 A 10 ASN HBy H 1 3.03 0.02 A 10 ASN HD21 H 1 8.09 0.02 A 10 ASN HD22 H 1 5.93 0.02 A 10 ASN CA C 13 48.1 0.3 A 10 ASN CB C 13 34.3 0.3 A 10 ASN N N 15 111.5 0.3 A 11 LYS H H 1 7.97 0.02 A 11 LYS HA H 1 3.86 0.02 A 11 LYS HBy H 1 2.05 0.02 A 11 LYS HBx H 1 2.02 0.02 A 11 LYS HDy H 1 1.55 0.02 A 11 LYS HDx H 1 1.52 0.02 A 11 LYS HE2 H 1 2.75 0.02 A 11 LYS HG2 H 1 1.26 0.02 A 11 LYS HZ1 H 1 5.35 0.02 A 11 LYS HZ2 H 1 5.35 0.02 A 11 LYS HZ3 H 1 5.35 0.02 A 11 LYS CA C 13 53.9 0.3 A 11 LYS CB C 13 25.5 0.3 A 11 LYS CD C 13 26.4 0.3 A 11 LYS CE C 13 38.5 0.3 A 11 LYS CG C 13 21.8 0.3 A 11 LYS N N 15 108.0 0.3 A 12 GLN H H 1 6.58 0.02 A 12 GLN HA H 1 4.51 0.02 A 12 GLN HB2 H 1 1.74 0.02 A 12 GLN HE21 H 1 7.55 0.02 A 12 GLN HE22 H 1 7.10 0.02 A 12 GLN HGy H 1 2.28 0.02 A 12 GLN HGx H 1 1.95 0.02 A 12 GLN CA C 13 50.3 0.3 A 12 GLN CB C 13 26.3 0.3 A 12 GLN CG C 13 30.5 0.3 A 12 GLN N N 15 113.9 0.3 A 14 LEU H H 1 8.19 0.02 A 14 LEU HA H 1 4.36 0.02 A 14 LEU HBy H 1 1.86 0.02 A 14 LEU HBx H 1 1.30 0.02 A 14 LEU HD1% H 1 0.95 0.02 A 14 LEU HD2% H 1 0.80 0.02 A 14 LEU HG H 1 1.45 0.02 A 14 LEU CA C 13 52.4 0.3 A 14 LEU CB C 13 41.9 0.3 A 14 LEU CD1 C 13 21.1 0.3 A 14 LEU CD2 C 13 23.6 0.3 A 14 LEU CG C 13 24.8 0.3 A 15 ILE H H 1 7.11 0.02 A 15 ILE HA H 1 3.85 0.02 A 15 ILE HB H 1 1.65 0.02 A 15 ILE HD1% H 1 0.68 0.02 A 15 ILE HG1y H 1 1.24 0.02 A 15 ILE HG1x H 1 0.78 0.02 A 15 ILE HG2% H 1 0.34 0.02 A 15 ILE CD1 C 13 10.6 0.3 A 15 ILE CG1 C 13 24.4 0.3 A 15 ILE CG2 C 13 14.2 0.3 A 15 ILE N N 15 103.5 0.3 A 16 PHE HB2 H 1 3.00 0.02 A 16 PHE HD2 H 1 7.30 0.02 A 16 PHE HE2 H 1 7.24 0.02 A 16 PHE HZ H 1 7.17 0.02 A 16 PHE CD2 C 13 129.0 0.3 A 16 PHE CE2 C 13 127.8 0.3 A 16 PHE CG C 13 156.3 0.3 A 16 PHE CZ C 13 125.7 0.3 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 2 GLY H A 3 GLY H 1.0 0.0 3.11 2 2 A 7 TYR HA A 7 TYR HD2 1.0 0.0 3.20 3 3 A 5 ARG HA A 13 CYS H 1.0 0.0 3.03 4 4 A 5 ARG HA A 12 GLN HA 1.0 0.0 2.53 5 5 A 5 ARG HA A 4 GLY HAy 1.0 0.0 4.71 6 6 A 3 GLY H A 13 CYS H 1.0 0.0 3.55 7 7 A 17 CYS H A 17 CYS HBy 1.0 0.0 3.91 8 8 A 11 LYS HA A 11 LYS HDx 1.0 0.0 4.19 9 9 A 14 LEU HBy A 14 LEU HD2% 1.0 0.0 3.56 10 10 A 11 LYS HA A 11 LYS HDy 1.0 0.0 4.19 11 11 A 9 TYR H A 8 GLU HBx 1.0 0.0 4.49 12 12 A 8 GLU H A 8 GLU HBx 1.0 0.0 3.66 13 13 A 13 CYS H A 13 CYS HBx 1.0 0.0 3.38 14 14 A 5 ARG H A 4 GLY HAx 1.0 0.0 3.32 15 15 A 8 GLU H A 8 GLU HGy 1.0 0.0 5.40 16 16 A 14 LEU HBx A 14 LEU HD2% 1.0 0.0 3.56 17 17 A 7 TYR HBy A 14 LEU HD2% 1.0 0.0 5.25 18 18 A 15 ILE H A 15 ILE HD1% 1.0 0.0 4.68 19 19 A 15 ILE HD1% A 16 PHE HD2 1.0 0.0 4.44 20 20 A 15 ILE HD1% A 15 ILE HG2% 1.0 0.0 2.67 21 21 A 7 TYR HBx A 14 LEU HD2% 1.0 0.0 5.25 22 22 A 7 TYR HBx A 14 LEU HD1% 1.0 0.0 5.25 23 23 A 15 ILE H A 14 LEU H 1.0 0.0 3.10 24 24 A 9 TYR H A 9 TYR HA 1.0 0.0 2.87 25 25 A 17 CYS HA A 13 CYS HBx 1.0 0.0 4.09 26 26 A 10 ASN H A 9 TYR HBx 1.0 0.0 3.37 27 27 A 9 TYR H A 9 TYR HBx 1.0 0.0 4.11 28 28 A 16 PHE HD2 A 16 PHE HA 1.0 0.0 3.36 29 29 A 16 PHE HD2 A 15 ILE HG2% 1.0 0.0 3.46 30 30 A 9 TYR HE1 A 9 TYR HBx 1.0 0.0 5.43 31 31 A 9 TYR H A 10 ASN H 1.0 0.0 4.37 32 32 A 10 ASN H A 10 ASN HBy 1.0 0.0 3.79 33 33 A 10 ASN H A 9 TYR HBy 1.0 0.0 3.37 34 34 A 10 ASN H A 11 LYS H 1.0 0.0 4.13 35 35 A 10 ASN H A 10 ASN HBx 1.0 0.0 3.79 36 36 A 9 TYR H A 8 GLU HA 1.0 0.0 2.71 37 37 A 9 TYR H A 9 TYR HBy 1.0 0.0 4.11 38 38 A 9 TYR H A 8 GLU HBy 1.0 0.0 4.49 39 39 A 15 ILE HG2% A 15 ILE HG1y 1.0 0.0 3.46 40 40 A 15 ILE HG2% A 16 PHE HZ 1.0 0.0 3.96 41 41 A 15 ILE H A 15 ILE HG2% 1.0 0.0 4.24 42 42 A 15 ILE HG2% A 15 ILE HA 1.0 0.0 3.91 43 43 A 14 LEU H A 14 LEU HD2% 1.0 0.0 4.62 44 44 A 14 LEU H A 14 LEU HG 1.0 0.0 4.59 45 45 A 14 LEU H A 14 LEU HD1% 1.0 0.0 4.62 46 46 A 15 ILE HD1% A 15 ILE HB 1.0 0.0 2.99 47 47 A 15 ILE H A 15 ILE HB 1.0 0.0 4.10 48 48 A 13 CYS H A 12 GLN HGx 1.0 0.0 3.69 49 49 A 12 GLN HA A 12 GLN HGx 1.0 0.0 3.59 50 50 A 12 GLN H A 12 GLN HGx 1.0 0.0 4.54 51 51 A 14 LEU HD1% A 14 LEU HBx 1.0 0.0 3.56 52 52 A 13 CYS H A 12 GLN HA 1.0 0.0 2.98 53 53 A 12 GLN HA A 12 GLN HGy 1.0 0.0 3.59 54 54 A 13 CYS H A 13 CYS HBy 1.0 0.0 3.38 55 55 A 17 CYS HA A 13 CYS HBy 1.0 0.0 4.09 56 56 A 5 ARG H A 4 GLY HAy 1.0 0.0 3.32 57 57 A 7 TYR HD2 A 8 GLU H 1.0 0.0 3.26 58 58 A 8 GLU H A 7 TYR HBx 1.0 0.0 3.80 59 59 A 8 GLU H A 8 GLU HG2 1.0 0.0 5.40 60 60 A 8 GLU H A 7 TYR HBy 1.0 0.0 3.80 61 61 A 8 GLU H A 8 GLU HA 1.0 0.0 2.90 62 62 A 8 GLU HA A 14 LEU HD2% 1.0 0.0 2.87 63 63 A 9 TYR HE1 A 9 TYR HBy 1.0 0.0 5.43 64 64 A 16 PHE HA A 16 PHE HE2 1.0 0.0 4.96 65 65 A 15 ILE HD1% A 16 PHE HE2 1.0 0.0 3.26 66 66 A 16 PHE HE2 A 16 PHE HB2 1.0 0.0 5.46 67 67 A 15 ILE HG2% A 16 PHE HE2 1.0 0.0 3.43 68 68 A 5 ARG H A 4 GLY H 1.0 0.0 4.39 69 69 A 3 GLY H A 4 GLY H 1.0 0.0 3.72 70 70 A 16 PHE HE2 A 16 PHE HBy 1.0 0.0 5.46 71 71 A 11 LYS H A 11 LYS HBy 1.0 0.0 4.05 72 72 A 15 ILE HG2% A 15 ILE HG1x 1.0 0.0 3.46 73 73 A 8 GLU H A 8 GLU HBy 1.0 0.0 3.66 74 74 A 14 LEU HA A 14 LEU HD2% 1.0 0.0 4.11 75 75 A 14 LEU HG A 14 LEU HA 1.0 0.0 3.55 76 76 A 11 LYS H A 11 LYS HBx 1.0 0.0 4.05 77 77 A 14 LEU HBy A 14 LEU HD1% 1.0 0.0 3.56 78 78 A 8 GLU HA A 14 LEU HD1% 1.0 0.0 2.87 79 79 A 14 LEU HA A 14 LEU HD1% 1.0 0.0 4.11 80 80 A 7 TYR HA A 7 TYR HE2 1.0 0.0 4.81 81 81 A 15 ILE HD1% A 15 ILE HA 1.0 0.0 4.20 82 82 A 13 CYS H A 12 GLN HGy 1.0 0.0 3.69 83 83 A 5 ARG HA A 6 GLY H 1.0 0.0 2.73 84 84 A 5 ARG H A 6 GLY H 1.0 0.0 4.48 85 85 A 12 GLN HA A 6 GLY H 1.0 0.0 3.55 86 86 A 11 LYS H A 12 GLN H 1.0 0.0 2.79 87 87 A 12 GLN H A 12 GLN HGy 1.0 0.0 4.54 88 88 A 5 ARG HA A 4 GLY HAx 1.0 0.0 4.71 89 89 A 17 CYS H A 16 PHE HA 1.0 0.0 3.15 90 90 A 17 CYS H A 17 CYS HBx 1.0 0.0 3.91 91 91 A 3 GLY H A 2 GLY HAy 1.0 0.0 2.98 92 91 A 3 GLY H A 2 GLY HAx 1.0 0.0 2.98 93 92 A 5 ARG HA A 4 GLY HAy 1.0 0.0 4.17 94 92 A 5 ARG HA A 4 GLY HAx 1.0 0.0 4.17 95 93 A 5 ARG H A 5 ARG HG2 1.0 0.0 4.28 96 93 A 5 ARG H A 5 ARG HGy 1.0 0.0 4.28 97 94 A 5 ARG H A 5 ARG HD2 1.0 0.0 3.29 98 94 A 5 ARG H A 5 ARG HDy 1.0 0.0 3.29 99 95 A 5 ARG H A 13 CYS HBx 1.0 0.0 3.57 100 95 A 5 ARG H A 13 CYS HBy 1.0 0.0 3.57 101 96 A 5 ARG HA A 5 ARG HG2 1.0 0.0 2.86 102 96 A 5 ARG HA A 5 ARG HGy 1.0 0.0 2.86 103 97 A 5 ARG HBx A 5 ARG HG2 1.0 0.0 2.45 104 97 A 5 ARG HBy A 5 ARG HG2 1.0 0.0 2.45 105 97 A 5 ARG HGy A 5 ARG HBx 1.0 0.0 2.45 106 97 A 5 ARG HGy A 5 ARG HBy 1.0 0.0 2.45 107 98 A 5 ARG HBx A 5 ARG HD2 1.0 0.0 2.71 108 98 A 5 ARG HBy A 5 ARG HD2 1.0 0.0 2.71 109 98 A 5 ARG HDy A 5 ARG HBx 1.0 0.0 2.71 110 98 A 5 ARG HDy A 5 ARG HBy 1.0 0.0 2.71 111 99 A 5 ARG HDy A 5 ARG HG2 1.0 0.0 2.62 112 99 A 5 ARG HD2 A 5 ARG HG2 1.0 0.0 2.62 113 99 A 5 ARG HGy A 5 ARG HD2 1.0 0.0 2.62 114 99 A 5 ARG HGy A 5 ARG HDy 1.0 0.0 2.62 115 100 A 6 GLY H A 5 ARG HG2 1.0 0.0 3.83 116 100 A 6 GLY H A 5 ARG HGy 1.0 0.0 3.83 117 101 A 6 GLY H A 6 GLY HAy 1.0 0.0 2.91 118 101 A 6 GLY H A 6 GLY HAx 1.0 0.0 2.91 119 102 A 13 CYS HA A 6 GLY HAy 1.0 0.0 3.20 120 102 A 6 GLY HAx A 13 CYS HA 1.0 0.0 3.20 121 103 A 14 LEU H A 6 GLY HAy 1.0 0.0 3.84 122 103 A 14 LEU H A 6 GLY HAx 1.0 0.0 3.84 123 104 A 8 GLU H A 7 TYR HBy 1.0 0.0 3.40 124 104 A 8 GLU H A 7 TYR HBx 1.0 0.0 3.40 125 105 A 14 LEU H A 7 TYR HBy 1.0 0.0 4.03 126 105 A 14 LEU H A 7 TYR HBx 1.0 0.0 4.03 127 106 A 7 TYR HBx A 14 LEU HBx 1.0 0.0 2.84 128 106 A 7 TYR HBy A 14 LEU HBx 1.0 0.0 2.84 129 106 A 14 LEU HBy A 7 TYR HBy 1.0 0.0 2.84 130 106 A 7 TYR HBx A 14 LEU HBy 1.0 0.0 2.84 131 107 A 14 LEU HD1% A 7 TYR HBy 1.0 0.0 5.25 132 108 A 7 TYR HD2 A 14 LEU HD2% 1.0 0.0 3.52 133 108 A 7 TYR HD2 A 14 LEU HD1% 1.0 0.0 3.52 134 109 A 8 GLU H A 14 LEU HBx 1.0 0.0 3.59 135 109 A 8 GLU H A 14 LEU HBy 1.0 0.0 3.59 136 110 A 8 GLU HA A 14 LEU HBx 1.0 0.0 3.28 137 110 A 8 GLU HA A 14 LEU HBy 1.0 0.0 3.28 138 111 A 8 GLU HA A 14 LEU HD2% 1.0 0.0 2.52 139 111 A 8 GLU HA A 14 LEU HD1% 1.0 0.0 2.52 140 112 A 9 TYR H A 8 GLU HBy 1.0 0.0 3.88 141 112 A 9 TYR H A 8 GLU HBx 1.0 0.0 3.88 142 113 A 14 LEU HA A 8 GLU HBy 1.0 0.0 3.38 143 113 A 14 LEU HA A 8 GLU HBx 1.0 0.0 3.38 144 114 A 14 LEU HA A 8 GLU HG2 1.0 0.0 3.49 145 114 A 14 LEU HA A 8 GLU HGy 1.0 0.0 3.49 146 115 A 8 GLU HGy A 14 LEU HBx 1.0 0.0 4.00 147 115 A 8 GLU HG2 A 14 LEU HBx 1.0 0.0 4.00 148 115 A 14 LEU HBy A 8 GLU HG2 1.0 0.0 4.00 149 115 A 8 GLU HGy A 14 LEU HBy 1.0 0.0 4.00 150 116 A 8 GLU HG2 A 14 LEU HD2% 1.0 0.0 3.22 151 116 A 8 GLU HGy A 14 LEU HD2% 1.0 0.0 3.22 152 116 A 14 LEU HD1% A 8 GLU HG2 1.0 0.0 3.22 153 116 A 8 GLU HGy A 14 LEU HD1% 1.0 0.0 3.22 154 117 A 11 LYS H A 11 LYS HG2 1.0 0.0 2.78 155 117 A 11 LYS H A 11 LYS HGy 1.0 0.0 2.78 156 118 A 11 LYS HA A 11 LYS HG2 1.0 0.0 3.64 157 118 A 11 LYS HA A 11 LYS HGy 1.0 0.0 3.64 158 119 A 11 LYS HA A 11 LYS HE2 1.0 0.0 5.07 159 119 A 11 LYS HA A 11 LYS HEy 1.0 0.0 5.07 160 120 A 11 LYS HBy A 11 LYS HG2 1.0 0.0 2.40 161 120 A 11 LYS HBx A 11 LYS HG2 1.0 0.0 2.40 162 120 A 11 LYS HGy A 11 LYS HBx 1.0 0.0 2.40 163 120 A 11 LYS HGy A 11 LYS HBy 1.0 0.0 2.40 164 121 A 11 LYS HBy A 11 LYS HE2 1.0 0.0 3.60 165 121 A 11 LYS HBx A 11 LYS HE2 1.0 0.0 3.60 166 121 A 11 LYS HEy A 11 LYS HBx 1.0 0.0 3.60 167 121 A 11 LYS HEy A 11 LYS HBy 1.0 0.0 3.60 168 122 A 11 LYS HZ% A 11 LYS HBx 1.0 0.0 4.26 169 122 A 11 LYS HBy A 11 LYS HZ% 1.0 0.0 4.26 170 123 A 11 LYS HDy A 11 LYS HG2 1.0 0.0 2.55 171 123 A 11 LYS HDx A 11 LYS HG2 1.0 0.0 2.55 172 123 A 11 LYS HGy A 11 LYS HDx 1.0 0.0 2.55 173 123 A 11 LYS HGy A 11 LYS HDy 1.0 0.0 2.55 174 124 A 11 LYS HEy A 11 LYS HG2 1.0 0.0 2.80 175 124 A 11 LYS HE2 A 11 LYS HG2 1.0 0.0 2.80 176 124 A 11 LYS HGy A 11 LYS HE2 1.0 0.0 2.80 177 124 A 11 LYS HGy A 11 LYS HEy 1.0 0.0 2.80 178 125 A 11 LYS HZ% A 11 LYS HG2 1.0 0.0 4.14 179 125 A 11 LYS HGy A 11 LYS HZ% 1.0 0.0 4.14 180 126 A 11 LYS HDy A 11 LYS HE2 1.0 0.0 2.63 181 126 A 11 LYS HEy A 11 LYS HDx 1.0 0.0 2.63 182 126 A 11 LYS HEy A 11 LYS HDy 1.0 0.0 2.63 183 126 A 11 LYS HDx A 11 LYS HE2 1.0 0.0 2.63 184 127 A 12 GLN H A 12 GLN HB2 1.0 0.0 2.97 185 127 A 12 GLN H A 12 GLN HBy 1.0 0.0 2.97 186 128 A 12 GLN HA A 12 GLN HB2 1.0 0.0 2.95 187 128 A 12 GLN HA A 12 GLN HBy 1.0 0.0 2.95 188 129 A 12 GLN HBy A 12 GLN HGx 1.0 0.0 2.46 189 129 A 12 GLN HB2 A 12 GLN HGx 1.0 0.0 2.46 190 129 A 12 GLN HGy A 12 GLN HB2 1.0 0.0 2.46 191 129 A 12 GLN HBy A 12 GLN HGy 1.0 0.0 2.46 192 130 A 13 CYS H A 12 GLN HB2 1.0 0.0 2.74 193 130 A 13 CYS H A 12 GLN HBy 1.0 0.0 2.74 194 131 A 13 CYS HA A 13 CYS HBx 1.0 0.0 2.98 195 131 A 13 CYS HBy A 13 CYS HA 1.0 0.0 2.98 196 132 A 14 LEU H A 14 LEU HBx 1.0 0.0 3.28 197 132 A 14 LEU H A 14 LEU HBy 1.0 0.0 3.28 198 133 A 14 LEU HA A 14 LEU HBx 1.0 0.0 2.74 199 133 A 14 LEU HA A 14 LEU HBy 1.0 0.0 2.74 200 134 A 15 ILE H A 15 ILE HG1x 1.0 0.0 4.14 201 134 A 15 ILE H A 15 ILE HG1y 1.0 0.0 4.14 202 135 A 15 ILE HA A 15 ILE HG1x 1.0 0.0 3.01 203 135 A 15 ILE HA A 15 ILE HG1y 1.0 0.0 3.01 204 136 A 16 PHE HD2 A 16 PHE HB2 1.0 0.0 3.25 205 136 A 16 PHE HD2 A 16 PHE HBy 1.0 0.0 3.25 206 137 A 2 GLY H A 2 GLY HAy 1.0 0.0 2.77 207 137 A 2 GLY H A 2 GLY HAx 1.0 0.0 2.77 208 138 A 3 GLY H A 3 GLY HAy 1.0 0.0 2.85 209 138 A 3 GLY H A 3 GLY HAx 1.0 0.0 2.85 210 139 A 4 GLY H A 3 GLY HAy 1.0 0.0 2.78 211 139 A 4 GLY H A 3 GLY HAx 1.0 0.0 2.78 212 140 A 4 GLY H A 4 GLY HAy 1.0 0.0 2.69 213 140 A 4 GLY H A 4 GLY HAx 1.0 0.0 2.69 214 141 A 5 ARG H A 4 GLY HAy 1.0 0.0 2.59 215 141 A 5 ARG H A 4 GLY HAx 1.0 0.0 2.59 216 142 A 5 ARG H A 5 ARG HBx 1.0 0.0 2.85 217 142 A 5 ARG H A 5 ARG HBy 1.0 0.0 2.85 218 143 A 6 GLY H A 5 ARG HBx 1.0 0.0 3.33 219 143 A 6 GLY H A 5 ARG HBy 1.0 0.0 3.33 220 144 A 7 TYR HA A 7 TYR HBy 1.0 0.0 2.91 221 144 A 7 TYR HA A 7 TYR HBx 1.0 0.0 2.91 222 145 A 7 TYR HD2 A 7 TYR HBy 1.0 0.0 3.23 223 145 A 7 TYR HD2 A 7 TYR HBx 1.0 0.0 3.23 224 146 A 9 TYR H A 9 TYR HBy 1.0 0.0 3.19 225 146 A 9 TYR H A 9 TYR HBx 1.0 0.0 3.19 226 147 A 9 TYR HA A 9 TYR HBy 1.0 0.0 2.93 227 147 A 9 TYR HA A 9 TYR HBx 1.0 0.0 2.93 228 148 A 10 ASN H A 10 ASN HBy 1.0 0.0 3.19 229 148 A 10 ASN H A 10 ASN HBx 1.0 0.0 3.19 230 149 A 10 ASN HA A 10 ASN HBy 1.0 0.0 2.64 231 149 A 10 ASN HBx A 10 ASN HA 1.0 0.0 2.64 232 150 A 11 LYS HA A 11 LYS HBx 1.0 0.0 2.65 233 150 A 11 LYS HA A 11 LYS HBy 1.0 0.0 2.65 234 151 A 11 LYS HBx A 11 LYS HDx 1.0 0.0 2.90 235 151 A 11 LYS HBy A 11 LYS HDx 1.0 0.0 2.90 236 151 A 11 LYS HDy A 11 LYS HBx 1.0 0.0 2.90 237 151 A 11 LYS HBy A 11 LYS HDy 1.0 0.0 2.90 238 152 A 12 GLN HA A 12 GLN HGx 1.0 0.0 2.84 239 152 A 12 GLN HA A 12 GLN HGy 1.0 0.0 2.84 240 153 A 13 CYS H A 12 GLN HGx 1.0 0.0 3.29 241 153 A 13 CYS H A 12 GLN HGy 1.0 0.0 3.29 242 154 A 14 LEU H A 14 LEU HD2% 1.0 0.0 4.01 243 154 A 14 LEU H A 14 LEU HD1% 1.0 0.0 4.01 244 155 A 14 LEU HA A 14 LEU HD2% 1.0 0.0 2.45 245 155 A 14 LEU HA A 14 LEU HD1% 1.0 0.0 2.45 246 156 A 14 LEU HG A 14 LEU HBx 1.0 0.0 2.74 247 156 A 14 LEU HG A 14 LEU HBy 1.0 0.0 2.74 248 157 A 15 ILE HG2% A 15 ILE HG1x 1.0 0.0 2.93 249 157 A 15 ILE HG2% A 15 ILE HG1y 1.0 0.0 2.93 250 158 A 16 PHE HA A 16 PHE HB2 1.0 0.0 2.81 251 158 A 16 PHE HA A 16 PHE HBy 1.0 0.0 2.81 252 159 A 17 CYS H A 17 CYS HBx 1.0 0.0 3.01 253 159 A 17 CYS H A 17 CYS HBy 1.0 0.0 3.01 254 160 A 17 CYS HA A 17 CYS HBx 1.0 0.0 2.81 255 160 A 17 CYS HA A 17 CYS HBy 1.0 0.0 2.81 256 161 A 5 ARG HA A 5 ARG HBx 1.0 0.0 2.87 257 161 A 5 ARG HA A 5 ARG HBy 1.0 0.0 2.87 258 162 A 7 TYR HE2 A 7 TYR HBy 1.0 0.0 4.80 259 162 A 7 TYR HE2 A 7 TYR HBx 1.0 0.0 4.80 260 163 A 8 GLU H A 8 GLU HG2 1.0 0.0 4.67 261 163 A 8 GLU H A 8 GLU HGy 1.0 0.0 4.67 262 164 A 9 TYR HD1 A 9 TYR HBy 1.0 0.0 3.40 263 164 A 9 TYR HBx A 9 TYR HD1 1.0 0.0 3.40 264 165 A 9 TYR HE1 A 9 TYR HBy 1.0 0.0 4.82 265 165 A 9 TYR HE1 A 9 TYR HBx 1.0 0.0 4.82 266 166 A 11 LYS HDy A 11 LYS HBx 1.0 0.0 3.71 267 166 A 11 LYS HBx A 11 LYS HDx 1.0 0.0 3.71 268 167 A 12 GLN H A 12 GLN HGx 1.0 0.0 3.74 269 167 A 12 GLN H A 12 GLN HGy 1.0 0.0 3.74 270 168 A 13 CYS H A 13 CYS HBx 1.0 0.0 2.71 271 168 A 13 CYS H A 13 CYS HBy 1.0 0.0 2.71 272 169 A 14 LEU HBy A 14 LEU HD2% 1.0 0.0 2.44 273 169 A 14 LEU HBx A 14 LEU HD2% 1.0 0.0 2.44 274 169 A 14 LEU HD1% A 14 LEU HBx 1.0 0.0 2.44 275 169 A 14 LEU HBy A 14 LEU HD1% 1.0 0.0 2.44 276 170 A 16 PHE HE2 A 16 PHE HB2 1.0 0.0 4.76 277 170 A 16 PHE HE2 A 16 PHE HBy 1.0 0.0 4.76 278 171 A 11 LYS HBy A 11 LYS HDy 1.0 0.0 3.71 279 171 A 11 LYS HBy A 11 LYS HDx 1.0 0.0 3.71 280 172 A 17 CYS HA A 13 CYS HBx 1.0 0.0 2.95 281 172 A 17 CYS HA A 13 CYS HBy 1.0 0.0 2.95 282 173 A 11 LYS HA A 11 LYS HDx 1.0 0.0 3.51 283 173 A 11 LYS HA A 11 LYS HDy 1.0 0.0 3.51 284 174 A 13 CYS SG A 17 CYS CB 1.0 0.0 3.10 285 175 A 13 CYS CB A 17 CYS SG 1.0 0.0 3.10 286 176 A 1 GLY CA A 8 GLU CD 1.0 0.0 2.40 287 177 A 11 LYS H A 11 LYS HBx 1.0 0.0 3.46 288 177 A 11 LYS H A 11 LYS HBy 1.0 0.0 3.46 289 178 A 8 GLU CD A 1 GLY N 1.0 0.0 1.60 290 179 A 1 GLY N A 8 GLU CG 1.0 0.0 2.40 291 180 A 13 CYS SG A 17 CYS SG 1.0 0.0 2.10 stop_ save_