data_nef_c30267_5v2g 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 5V2G 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 11 CYS SG 4 1 ZBR C8 2 11 CYS SG 4 1 ZBR C7 3 11 CYS SG 4 1 ZBR C9 1 20 SER C 2 1 LYS N 2 20 SER C 3 1 LYS N 1 1 LYS N 3 20 SER C 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 LYS start . . 2 A 2 ASN middle . . 3 A 3 PRO middle . false 4 A 4 GLU middle . . 5 A 5 ALA middle . . 6 A 6 GLU middle . . 7 A 7 GLU middle . . 8 A 8 ILE middle . . 9 A 9 THR middle . . 10 A 10 ARG middle . . 11 A 11 CYS middle . . 12 A 12 LYS middle . . 13 A 13 LYS middle . . 14 A 14 LEU middle . . 15 A 15 LEU middle . . 16 A 16 ASP middle . . 17 A 17 ASP middle . . 18 A 18 SER middle . . 19 A 19 SER middle . . 20 A 20 SER end . . 21 B 1 LYS start . . 22 B 2 ASN middle . . 23 B 3 PRO middle . false 24 B 4 GLU middle . . 25 B 5 ALA middle . . 26 B 6 GLU middle . . 27 B 7 GLU middle . . 28 B 8 ILE middle . . 29 B 9 THR middle . . 30 B 10 ARG middle . . 31 B 11 CYS middle . . 32 B 12 LYS middle . . 33 B 13 LYS middle . . 34 B 14 LEU middle . . 35 B 15 LEU middle . . 36 B 16 ASP middle . . 37 B 17 ASP middle . . 38 B 18 SER middle . . 39 B 19 SER middle . . 40 B 20 SER end . . 41 C 1 LYS start . . 42 C 2 ASN middle . . 43 C 3 PRO middle . false 44 C 4 GLU middle . . 45 C 5 ALA middle . . 46 C 6 GLU middle . . 47 C 7 GLU middle . . 48 C 8 ILE middle . . 49 C 9 THR middle . . 50 C 10 ARG middle . . 51 C 11 CYS middle . . 52 C 12 LYS middle . . 53 C 13 LYS middle . . 54 C 14 LEU middle . . 55 C 15 LEU middle . . 56 C 16 ASP middle . . 57 C 17 ASP middle . . 58 C 18 SER middle . . 59 C 19 SER middle . . 60 C 20 SER end . . 61 D 1 ZBR . -BR1,-BR2,-BR3 . 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 LYS H1 H 1 8.24 0.05 A 1 LYS HA H 1 4.34 0.05 A 1 LYS HB2 H 1 1.92 0.05 A 1 LYS HB3 H 1 1.78 0.05 A 1 LYS HG2 H 1 1.44 0.05 A 1 LYS HG3 H 1 1.50 0.05 A 1 LYS CA C 13 56.84 0.20 A 1 LYS CB C 13 32.52 0.20 A 1 LYS CD C 13 29.01 0.20 A 1 LYS CG C 13 24.85 0.20 A 2 ASN H H 1 8.08 0.05 A 2 ASN HA H 1 5.01 0.05 A 2 ASN HB2 H 1 2.74 0.05 A 2 ASN HB3 H 1 2.86 0.05 A 2 ASN CA C 13 51.51 0.20 A 2 ASN CB C 13 39.01 0.20 A 3 PRO HA H 1 4.46 0.05 A 3 PRO HB2 H 1 2.00 0.05 A 3 PRO HB3 H 1 2.38 0.05 A 3 PRO HG2 H 1 2.08 0.05 A 3 PRO HG3 H 1 2.08 0.05 A 3 PRO CA C 13 64.14 0.20 A 3 PRO CB C 13 32.09 0.20 A 3 PRO CG C 13 27.50 0.20 A 4 GLU H H 1 8.43 0.05 A 4 GLU HA H 1 4.34 0.05 A 4 GLU HB2 H 1 2.06 0.05 A 4 GLU HB3 H 1 2.21 0.05 A 4 GLU CA C 13 56.48 0.20 A 4 GLU CB C 13 28.65 0.20 A 5 ALA H H 1 8.13 0.05 A 5 ALA HA H 1 4.17 0.05 A 5 ALA CA C 13 54.58 0.20 A 5 ALA CB C 13 18.79 0.20 A 6 GLU H H 1 8.27 0.05 A 6 GLU HA H 1 4.22 0.05 A 6 GLU CA C 13 58.28 0.20 A 6 GLU CB C 13 28.62 0.20 A 7 GLU H H 1 8.15 0.05 A 7 GLU HA H 1 4.17 0.05 A 7 GLU HB2 H 1 2.13 0.05 A 7 GLU HB3 H 1 2.19 0.05 A 7 GLU HG2 H 1 2.46 0.05 A 7 GLU HG3 H 1 2.49 0.05 A 7 GLU CA C 13 58.55 0.20 A 7 GLU CB C 13 28.59 0.20 A 7 GLU CG C 13 34.12 0.20 A 8 ILE H H 1 8.02 0.05 A 8 ILE HA H 1 3.81 0.05 A 8 ILE HB H 1 2.01 0.05 A 8 ILE HD11 H 1 0.86 0.05 A 8 ILE HD12 H 1 0.86 0.05 A 8 ILE HD13 H 1 0.86 0.05 A 8 ILE HG12 H 1 1.22 0.05 A 8 ILE HG13 H 1 1.61 0.05 A 8 ILE HG21 H 1 0.92 0.05 A 8 ILE HG22 H 1 0.92 0.05 A 8 ILE HG23 H 1 0.92 0.05 A 8 ILE CA C 13 64.04 0.20 A 8 ILE CB C 13 37.72 0.20 A 8 ILE CD1 C 13 13.07 0.20 A 8 ILE CG1 C 13 28.84 0.20 A 8 ILE CG2 C 13 17.77 0.20 A 9 THR H H 1 7.98 0.05 A 9 THR HA H 1 3.95 0.05 A 9 THR HB H 1 4.28 0.05 A 9 THR HG21 H 1 1.29 0.05 A 9 THR HG22 H 1 1.29 0.05 A 9 THR HG23 H 1 1.29 0.05 A 9 THR CA C 13 66.16 0.20 A 9 THR CB C 13 68.75 0.20 A 9 THR CG2 C 13 22.11 0.20 A 10 ARG H H 1 8.00 0.05 A 10 ARG HA H 1 4.14 0.05 A 10 ARG CA C 13 58.99 0.20 A 10 ARG CB C 13 30.20 0.20 A 11 CYS H H 1 8.14 0.05 A 11 CYS HA H 1 4.28 0.05 A 11 CYS HB2 H 1 2.89 0.05 A 11 CYS HB3 H 1 2.96 0.05 A 11 CYS CA C 13 57.43 0.20 A 11 CYS CB C 13 28.50 0.20 A 12 LYS H H 1 8.28 0.05 A 12 LYS HA H 1 3.93 0.05 A 12 LYS HB2 H 1 1.92 0.05 A 12 LYS HB3 H 1 1.95 0.05 A 12 LYS HD2 H 1 1.69 0.05 A 12 LYS HD3 H 1 1.73 0.05 A 12 LYS HG2 H 1 1.45 0.05 A 12 LYS HG3 H 1 1.60 0.05 A 12 LYS CA C 13 59.89 0.20 A 12 LYS CB C 13 32.41 0.20 A 12 LYS CD C 13 29.48 0.20 A 12 LYS CG C 13 25.68 0.20 A 13 LYS H H 1 7.81 0.05 A 13 LYS HA H 1 4.16 0.05 A 13 LYS HB2 H 1 1.90 0.05 A 13 LYS HB3 H 1 1.94 0.05 A 13 LYS HD2 H 1 1.71 0.05 A 13 LYS HD3 H 1 1.73 0.05 A 13 LYS HG2 H 1 1.50 0.05 A 13 LYS HG3 H 1 1.58 0.05 A 13 LYS CA C 13 58.60 0.20 A 13 LYS CB C 13 32.40 0.20 A 13 LYS CD C 13 29.47 0.20 A 13 LYS CG C 13 25.09 0.20 A 14 LEU H H 1 7.71 0.05 A 14 LEU HA H 1 4.25 0.05 A 14 LEU HB2 H 1 1.70 0.05 A 14 LEU HB3 H 1 1.89 0.05 A 14 LEU HDx% H 1 0.92 0.05 A 14 LEU HDy% H 1 0.96 0.05 A 14 LEU HG H 1 1.78 0.05 A 14 LEU CA C 13 56.94 0.20 A 14 LEU CB C 13 42.31 0.20 A 14 LEU CD1 C 13 23.81 0.20 A 14 LEU CD2 C 13 25.46 0.20 A 14 LEU CG C 13 27.12 0.20 A 15 LEU H H 1 7.87 0.05 A 15 LEU HA H 1 4.19 0.05 A 15 LEU HB2 H 1 1.76 0.05 A 15 LEU HB3 H 1 1.56 0.05 A 15 LEU HDx% H 1 0.76 0.05 A 15 LEU HDy% H 1 0.76 0.05 A 15 LEU HG H 1 1.72 0.05 A 15 LEU CA C 13 56.26 0.20 A 15 LEU CB C 13 42.13 0.20 A 15 LEU CD1 C 13 25.64 0.20 A 15 LEU CD2 C 13 23.42 0.20 A 15 LEU CG C 13 26.85 0.20 A 16 ASP H H 1 8.10 0.05 A 16 ASP HA H 1 4.63 0.05 A 16 ASP HB2 H 1 2.85 0.05 A 16 ASP HB3 H 1 2.89 0.05 A 16 ASP CA C 13 54.52 0.20 A 16 ASP CB C 13 39.58 0.20 A 17 ASP H H 1 8.12 0.05 A 17 ASP HA H 1 4.77 0.05 A 17 ASP HB2 H 1 2.87 0.05 A 17 ASP HB3 H 1 2.91 0.05 A 17 ASP CA C 13 54.52 0.20 A 17 ASP CB C 13 39.78 0.20 A 18 SER H H 1 8.25 0.05 A 18 SER HA H 1 4.49 0.05 A 18 SER HB2 H 1 3.95 0.05 A 18 SER HB3 H 1 4.03 0.05 A 18 SER CA C 13 59.24 0.20 A 18 SER CB C 13 63.87 0.20 A 19 SER H H 1 8.33 0.05 A 19 SER HA H 1 4.52 0.05 A 19 SER HB2 H 1 3.94 0.05 A 19 SER HB3 H 1 4.03 0.05 A 19 SER CA C 13 58.85 0.20 A 19 SER CB C 13 63.80 0.20 A 20 SER H H 1 8.19 0.05 A 20 SER HA H 1 4.43 0.05 A 20 SER HB2 H 1 3.89 0.05 A 20 SER HB3 H 1 3.97 0.05 A 20 SER CA C 13 58.96 0.20 A 20 SER CB C 13 63.80 0.20 B 1 LYS H1 H 1 8.24 0.05 B 1 LYS HA H 1 4.34 0.05 B 1 LYS HB2 H 1 1.92 0.05 B 1 LYS HB3 H 1 1.78 0.05 B 1 LYS HG2 H 1 1.44 0.05 B 1 LYS HG3 H 1 1.50 0.05 B 1 LYS CA C 13 56.84 0.20 B 1 LYS CB C 13 32.52 0.20 B 1 LYS CD C 13 29.01 0.20 B 1 LYS CG C 13 24.85 0.20 B 2 ASN H H 1 8.08 0.05 B 2 ASN HA H 1 5.01 0.05 B 2 ASN HB2 H 1 2.74 0.05 B 2 ASN HB3 H 1 2.86 0.05 B 2 ASN CA C 13 51.51 0.20 B 2 ASN CB C 13 39.01 0.20 B 3 PRO HA H 1 4.46 0.05 B 3 PRO HB2 H 1 2.00 0.05 B 3 PRO HB3 H 1 2.38 0.05 B 3 PRO HG2 H 1 2.08 0.05 B 3 PRO HG3 H 1 2.08 0.05 B 3 PRO CA C 13 64.14 0.20 B 3 PRO CB C 13 32.09 0.20 B 3 PRO CG C 13 27.50 0.20 B 4 GLU H H 1 8.43 0.05 B 4 GLU HA H 1 4.34 0.05 B 4 GLU HB2 H 1 2.06 0.05 B 4 GLU HB3 H 1 2.21 0.05 B 4 GLU CA C 13 56.48 0.20 B 4 GLU CB C 13 28.65 0.20 B 5 ALA H H 1 8.13 0.05 B 5 ALA HA H 1 4.17 0.05 B 5 ALA CA C 13 54.58 0.20 B 5 ALA CB C 13 18.79 0.20 B 6 GLU H H 1 8.27 0.05 B 6 GLU HA H 1 4.22 0.05 B 6 GLU CA C 13 58.28 0.20 B 6 GLU CB C 13 28.62 0.20 B 7 GLU H H 1 8.15 0.05 B 7 GLU HA H 1 4.17 0.05 B 7 GLU HB2 H 1 2.13 0.05 B 7 GLU HB3 H 1 2.19 0.05 B 7 GLU HG2 H 1 2.46 0.05 B 7 GLU HG3 H 1 2.49 0.05 B 7 GLU CA C 13 58.55 0.20 B 7 GLU CB C 13 28.59 0.20 B 7 GLU CG C 13 34.12 0.20 B 8 ILE H H 1 8.02 0.05 B 8 ILE HA H 1 3.81 0.05 B 8 ILE HB H 1 2.01 0.05 B 8 ILE HD11 H 1 0.86 0.05 B 8 ILE HD12 H 1 0.86 0.05 B 8 ILE HD13 H 1 0.86 0.05 B 8 ILE HG12 H 1 1.22 0.05 B 8 ILE HG13 H 1 1.61 0.05 B 8 ILE HG21 H 1 0.92 0.05 B 8 ILE HG22 H 1 0.92 0.05 B 8 ILE HG23 H 1 0.92 0.05 B 8 ILE CA C 13 64.04 0.20 B 8 ILE CB C 13 37.72 0.20 B 8 ILE CD1 C 13 13.07 0.20 B 8 ILE CG1 C 13 28.84 0.20 B 8 ILE CG2 C 13 17.77 0.20 B 9 THR H H 1 7.98 0.05 B 9 THR HA H 1 3.95 0.05 B 9 THR HB H 1 4.28 0.05 B 9 THR HG21 H 1 1.29 0.05 B 9 THR HG22 H 1 1.29 0.05 B 9 THR HG23 H 1 1.29 0.05 B 9 THR CA C 13 66.16 0.20 B 9 THR CB C 13 68.75 0.20 B 9 THR CG2 C 13 22.11 0.20 B 10 ARG H H 1 8.00 0.05 B 10 ARG HA H 1 4.14 0.05 B 10 ARG CA C 13 58.99 0.20 B 10 ARG CB C 13 30.20 0.20 B 11 CYS H H 1 8.14 0.05 B 11 CYS HA H 1 4.28 0.05 B 11 CYS HB2 H 1 2.89 0.05 B 11 CYS HB3 H 1 2.96 0.05 B 11 CYS CA C 13 57.43 0.20 B 11 CYS CB C 13 28.50 0.20 B 12 LYS H H 1 8.28 0.05 B 12 LYS HA H 1 3.93 0.05 B 12 LYS HB2 H 1 1.92 0.05 B 12 LYS HB3 H 1 1.95 0.05 B 12 LYS HD2 H 1 1.69 0.05 B 12 LYS HD3 H 1 1.73 0.05 B 12 LYS HG2 H 1 1.45 0.05 B 12 LYS HG3 H 1 1.60 0.05 B 12 LYS CA C 13 59.89 0.20 B 12 LYS CB C 13 32.41 0.20 B 12 LYS CD C 13 29.48 0.20 B 12 LYS CG C 13 25.68 0.20 B 13 LYS H H 1 7.81 0.05 B 13 LYS HA H 1 4.16 0.05 B 13 LYS HB2 H 1 1.90 0.05 B 13 LYS HB3 H 1 1.94 0.05 B 13 LYS HD2 H 1 1.71 0.05 B 13 LYS HD3 H 1 1.73 0.05 B 13 LYS HG2 H 1 1.50 0.05 B 13 LYS HG3 H 1 1.58 0.05 B 13 LYS CA C 13 58.60 0.20 B 13 LYS CB C 13 32.40 0.20 B 13 LYS CD C 13 29.47 0.20 B 13 LYS CG C 13 25.09 0.20 B 14 LEU H H 1 7.71 0.05 B 14 LEU HA H 1 4.25 0.05 B 14 LEU HB2 H 1 1.70 0.05 B 14 LEU HB3 H 1 1.89 0.05 B 14 LEU HDx% H 1 0.92 0.05 B 14 LEU HDy% H 1 0.96 0.05 B 14 LEU HG H 1 1.78 0.05 B 14 LEU CA C 13 56.94 0.20 B 14 LEU CB C 13 42.31 0.20 B 14 LEU CD1 C 13 23.81 0.20 B 14 LEU CD2 C 13 25.46 0.20 B 14 LEU CG C 13 27.12 0.20 B 15 LEU H H 1 7.87 0.05 B 15 LEU HA H 1 4.19 0.05 B 15 LEU HB2 H 1 1.76 0.05 B 15 LEU HB3 H 1 1.56 0.05 B 15 LEU HDx% H 1 0.76 0.05 B 15 LEU HDy% H 1 0.76 0.05 B 15 LEU HG H 1 1.72 0.05 B 15 LEU CA C 13 56.26 0.20 B 15 LEU CB C 13 42.13 0.20 B 15 LEU CD1 C 13 25.64 0.20 B 15 LEU CD2 C 13 23.42 0.20 B 15 LEU CG C 13 26.85 0.20 B 16 ASP H H 1 8.10 0.05 B 16 ASP HA H 1 4.63 0.05 B 16 ASP HB2 H 1 2.85 0.05 B 16 ASP HB3 H 1 2.89 0.05 B 16 ASP CA C 13 54.52 0.20 B 16 ASP CB C 13 39.58 0.20 B 17 ASP H H 1 8.12 0.05 B 17 ASP HA H 1 4.77 0.05 B 17 ASP HB2 H 1 2.87 0.05 B 17 ASP HB3 H 1 2.91 0.05 B 17 ASP CA C 13 54.52 0.20 B 17 ASP CB C 13 39.78 0.20 B 18 SER H H 1 8.25 0.05 B 18 SER HA H 1 4.49 0.05 B 18 SER HB2 H 1 3.95 0.05 B 18 SER HB3 H 1 4.03 0.05 B 18 SER CA C 13 59.24 0.20 B 18 SER CB C 13 63.87 0.20 B 19 SER H H 1 8.33 0.05 B 19 SER HA H 1 4.52 0.05 B 19 SER HB2 H 1 3.94 0.05 B 19 SER HB3 H 1 4.03 0.05 B 19 SER CA C 13 58.85 0.20 B 19 SER CB C 13 63.80 0.20 B 20 SER H H 1 8.19 0.05 B 20 SER HA H 1 4.43 0.05 B 20 SER HB2 H 1 3.89 0.05 B 20 SER CA C 13 58.96 0.20 B 20 SER CB C 13 63.80 0.20 C 1 LYS H1 H 1 8.24 0.05 C 1 LYS HA H 1 4.34 0.05 C 1 LYS HB2 H 1 1.92 0.05 C 1 LYS HB3 H 1 1.78 0.05 C 1 LYS HG2 H 1 1.44 0.05 C 1 LYS HG3 H 1 1.50 0.05 C 1 LYS CA C 13 56.84 0.20 C 1 LYS CB C 13 32.52 0.20 C 1 LYS CD C 13 29.01 0.20 C 1 LYS CG C 13 24.85 0.20 C 2 ASN H H 1 8.08 0.05 C 2 ASN HA H 1 5.01 0.05 C 2 ASN HB2 H 1 2.74 0.05 C 2 ASN HB3 H 1 2.86 0.05 C 2 ASN CA C 13 51.51 0.20 C 2 ASN CB C 13 39.01 0.20 C 3 PRO HA H 1 4.46 0.05 C 3 PRO HB2 H 1 2.00 0.05 C 3 PRO HB3 H 1 2.38 0.05 C 3 PRO HG2 H 1 2.08 0.05 C 3 PRO HG3 H 1 2.08 0.05 C 3 PRO CA C 13 64.14 0.20 C 3 PRO CB C 13 32.09 0.20 C 3 PRO CG C 13 27.50 0.20 C 4 GLU H H 1 8.43 0.05 C 4 GLU HA H 1 4.34 0.05 C 4 GLU HB2 H 1 2.06 0.05 C 4 GLU HB3 H 1 2.21 0.05 C 4 GLU CA C 13 56.48 0.20 C 4 GLU CB C 13 28.65 0.20 C 5 ALA H H 1 8.13 0.05 C 5 ALA HA H 1 4.17 0.05 C 5 ALA CA C 13 54.58 0.20 C 5 ALA CB C 13 18.79 0.20 C 6 GLU H H 1 8.27 0.05 C 6 GLU HA H 1 4.22 0.05 C 6 GLU CA C 13 58.28 0.20 C 6 GLU CB C 13 28.62 0.20 C 7 GLU H H 1 8.15 0.05 C 7 GLU HA H 1 4.17 0.05 C 7 GLU HB2 H 1 2.13 0.05 C 7 GLU HB3 H 1 2.19 0.05 C 7 GLU HG2 H 1 2.46 0.05 C 7 GLU HG3 H 1 2.49 0.05 C 7 GLU CA C 13 58.55 0.20 C 7 GLU CB C 13 28.59 0.20 C 7 GLU CG C 13 34.12 0.20 C 8 ILE H H 1 8.02 0.05 C 8 ILE HA H 1 3.81 0.05 C 8 ILE HB H 1 2.01 0.05 C 8 ILE HD11 H 1 0.86 0.05 C 8 ILE HD12 H 1 0.86 0.05 C 8 ILE HD13 H 1 0.86 0.05 C 8 ILE HG12 H 1 1.22 0.05 C 8 ILE HG13 H 1 1.61 0.05 C 8 ILE HG21 H 1 0.92 0.05 C 8 ILE HG22 H 1 0.92 0.05 C 8 ILE HG23 H 1 0.92 0.05 C 8 ILE CA C 13 64.04 0.20 C 8 ILE CB C 13 37.72 0.20 C 8 ILE CD1 C 13 13.07 0.20 C 8 ILE CG1 C 13 28.84 0.20 C 8 ILE CG2 C 13 17.77 0.20 C 9 THR H H 1 7.98 0.05 C 9 THR HA H 1 3.95 0.05 C 9 THR HB H 1 4.28 0.05 C 9 THR HG21 H 1 1.29 0.05 C 9 THR HG22 H 1 1.29 0.05 C 9 THR HG23 H 1 1.29 0.05 C 9 THR CA C 13 66.16 0.20 C 9 THR CB C 13 68.75 0.20 C 9 THR CG2 C 13 22.11 0.20 C 10 ARG H H 1 8.00 0.05 C 10 ARG HA H 1 4.14 0.05 C 10 ARG CA C 13 58.99 0.20 C 10 ARG CB C 13 30.20 0.20 C 11 CYS H H 1 8.14 0.05 C 11 CYS HA H 1 4.28 0.05 C 11 CYS HB2 H 1 2.89 0.05 C 11 CYS HB3 H 1 2.96 0.05 C 11 CYS CA C 13 57.43 0.20 C 11 CYS CB C 13 28.50 0.20 C 12 LYS H H 1 8.28 0.05 C 12 LYS HA H 1 3.93 0.05 C 12 LYS HB2 H 1 1.92 0.05 C 12 LYS HB3 H 1 1.95 0.05 C 12 LYS HD2 H 1 1.69 0.05 C 12 LYS HD3 H 1 1.73 0.05 C 12 LYS HG2 H 1 1.45 0.05 C 12 LYS HG3 H 1 1.60 0.05 C 12 LYS CA C 13 59.89 0.20 C 12 LYS CB C 13 32.41 0.20 C 12 LYS CD C 13 29.48 0.20 C 12 LYS CG C 13 25.68 0.20 C 13 LYS H H 1 7.81 0.05 C 13 LYS HA H 1 4.16 0.05 C 13 LYS HB2 H 1 1.90 0.05 C 13 LYS HB3 H 1 1.94 0.05 C 13 LYS HD2 H 1 1.71 0.05 C 13 LYS HD3 H 1 1.73 0.05 C 13 LYS HG2 H 1 1.50 0.05 C 13 LYS HG3 H 1 1.58 0.05 C 13 LYS CA C 13 58.60 0.20 C 13 LYS CB C 13 32.40 0.20 C 13 LYS CD C 13 29.47 0.20 C 13 LYS CG C 13 25.09 0.20 C 14 LEU H H 1 7.71 0.05 C 14 LEU HA H 1 4.25 0.05 C 14 LEU HB2 H 1 1.70 0.05 C 14 LEU HB3 H 1 1.89 0.05 C 14 LEU HDx% H 1 0.92 0.05 C 14 LEU HDy% H 1 0.96 0.05 C 14 LEU HG H 1 1.78 0.05 C 14 LEU CA C 13 56.94 0.20 C 14 LEU CB C 13 42.31 0.20 C 14 LEU CD1 C 13 23.81 0.20 C 14 LEU CD2 C 13 25.46 0.20 C 14 LEU CG C 13 27.12 0.20 C 15 LEU H H 1 7.87 0.05 C 15 LEU HA H 1 4.19 0.05 C 15 LEU HB2 H 1 1.76 0.05 C 15 LEU HB3 H 1 1.56 0.05 C 15 LEU HDx% H 1 0.76 0.05 C 15 LEU HDy% H 1 0.76 0.05 C 15 LEU HG H 1 1.72 0.05 C 15 LEU CA C 13 56.26 0.20 C 15 LEU CB C 13 42.13 0.20 C 15 LEU CD1 C 13 25.64 0.20 C 15 LEU CD2 C 13 23.42 0.20 C 15 LEU CG C 13 26.85 0.20 C 16 ASP H H 1 8.10 0.05 C 16 ASP HA H 1 4.63 0.05 C 16 ASP HB2 H 1 2.85 0.05 C 16 ASP HB3 H 1 2.89 0.05 C 16 ASP CA C 13 54.52 0.20 C 16 ASP CB C 13 39.58 0.20 C 17 ASP H H 1 8.12 0.05 C 17 ASP HA H 1 4.77 0.05 C 17 ASP HB2 H 1 2.87 0.05 C 17 ASP HB3 H 1 2.91 0.05 C 17 ASP CA C 13 54.52 0.20 C 17 ASP CB C 13 39.78 0.20 C 18 SER H H 1 8.25 0.05 C 18 SER HA H 1 4.49 0.05 C 18 SER HB2 H 1 3.95 0.05 C 18 SER HB3 H 1 4.03 0.05 C 18 SER CA C 13 59.24 0.20 C 18 SER CB C 13 63.87 0.20 C 19 SER H H 1 8.33 0.05 C 19 SER HA H 1 4.52 0.05 C 19 SER HB2 H 1 3.94 0.05 C 19 SER HB3 H 1 4.03 0.05 C 19 SER CA C 13 58.85 0.20 C 19 SER CB C 13 63.80 0.20 C 20 SER H H 1 8.19 0.05 C 20 SER HA H 1 4.43 0.05 C 20 SER HB2 H 1 3.89 0.05 C 20 SER HB3 H 1 3.97 0.05 C 20 SER CA C 13 58.96 0.20 C 20 SER CB C 13 63.80 0.20 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 8 ILE HD11 A 2 ASN HD2x 1.0 1.8 5.5 2 2 B 8 ILE HD11 B 2 ASN HD2x 1.0 1.8 5.5 3 3 C 8 ILE HD11 C 2 ASN HD2x 1.0 1.8 5.5 4 4 A 2 ASN HD2x A 5 ALA HB1 1.0 1.8 5.5 5 5 B 2 ASN HD2x B 5 ALA HB1 1.0 1.8 5.5 6 6 C 2 ASN HD2x C 5 ALA HB1 1.0 1.8 5.5 7 7 A 5 ALA HB1 A 2 ASN HB2 1.0 1.8 5.5 8 7 A 5 ALA HB1 A 2 ASN HB3 1.0 1.8 5.5 9 8 B 5 ALA HB1 B 2 ASN HB2 1.0 1.8 5.5 10 8 B 5 ALA HB1 B 2 ASN HB3 1.0 1.8 5.5 11 9 C 5 ALA HB1 C 2 ASN HB2 1.0 1.8 5.5 12 9 C 5 ALA HB1 C 2 ASN HB3 1.0 1.8 5.5 13 10 A 5 ALA HA A 8 ILE HB 1.0 1.8 3.5 14 11 B 5 ALA HA B 8 ILE HB 1.0 1.8 3.5 15 12 C 5 ALA HA C 8 ILE HB 1.0 1.8 3.5 16 13 A 8 ILE HD11 A 5 ALA HA 1.0 1.8 4.0 17 14 B 8 ILE HD11 B 5 ALA HA 1.0 1.8 4.0 18 15 C 8 ILE HD11 C 5 ALA HA 1.0 1.8 4.0 19 16 A 5 ALA HA A 8 ILE HG21 1.0 1.8 5.0 20 17 B 5 ALA HA B 8 ILE HG21 1.0 1.8 5.0 21 18 C 5 ALA HA C 8 ILE HG21 1.0 1.8 5.0 22 19 A 18 SER HA A 19 SER H 1.0 1.8 3.0 23 20 B 18 SER HA B 19 SER H 1.0 1.8 3.0 24 21 C 18 SER HA C 19 SER H 1.0 1.8 3.0 25 22 A 19 SER HA A 20 SER H 1.0 1.8 3.0 26 23 B 19 SER HA B 20 SER H 1.0 1.8 3.0 27 24 C 19 SER HA C 20 SER H 1.0 1.8 3.0 28 25 A 1 LYS HA A 2 ASN H 1.0 1.8 3.0 29 26 B 1 LYS HA B 2 ASN H 1.0 1.8 3.0 30 27 C 1 LYS HA C 2 ASN H 1.0 1.8 3.0 31 28 A 2 ASN HA A 3 PRO HDx 1.0 1.8 3.0 32 28 A 2 ASN HA A 3 PRO HDy 1.0 1.8 3.0 33 29 B 2 ASN HA B 3 PRO HDx 1.0 1.8 3.0 34 29 B 2 ASN HA B 3 PRO HDy 1.0 1.8 3.0 35 30 C 2 ASN HA C 3 PRO HDx 1.0 1.8 3.0 36 30 C 2 ASN HA C 3 PRO HDy 1.0 1.8 3.0 37 31 A 14 LEU HDx% A 7 GLU HG2 1.0 1.8 5.5 38 31 A 14 LEU HDx% A 7 GLU HG3 1.0 1.8 5.5 39 32 A 14 LEU HDy% A 7 GLU HG2 1.0 1.8 5.5 40 32 A 14 LEU HDy% A 7 GLU HG3 1.0 1.8 5.5 41 33 B 14 LEU HDy% B 7 GLU HG2 1.0 1.8 5.5 42 33 B 14 LEU HDy% B 7 GLU HG3 1.0 1.8 5.5 43 34 A 4 GLU H A 5 ALA H 1.0 1.8 3.0 44 35 B 4 GLU H B 5 ALA H 1.0 1.8 3.0 45 36 C 4 GLU H C 5 ALA H 1.0 1.8 3.0 46 37 A 5 ALA H A 6 GLU H 1.0 1.8 3.0 47 38 B 5 ALA H B 6 GLU H 1.0 1.8 3.0 48 39 C 5 ALA H C 6 GLU H 1.0 1.8 3.0 49 40 A 6 GLU H A 7 GLU H 1.0 1.8 3.0 50 41 B 6 GLU H B 7 GLU H 1.0 1.8 3.0 51 42 C 6 GLU H C 7 GLU H 1.0 1.8 3.0 52 43 A 7 GLU H A 8 ILE H 1.0 1.8 3.0 53 44 B 7 GLU H B 8 ILE H 1.0 1.8 3.0 54 45 C 7 GLU H C 8 ILE H 1.0 1.8 3.0 55 46 A 8 ILE H A 9 THR H 1.0 1.8 3.0 56 47 B 8 ILE H B 9 THR H 1.0 1.8 3.0 57 48 C 8 ILE H C 9 THR H 1.0 1.8 3.0 58 49 A 9 THR H A 10 ARG H 1.0 1.8 3.0 59 50 B 9 THR H B 10 ARG H 1.0 1.8 3.0 60 51 C 9 THR H C 10 ARG H 1.0 1.8 3.0 61 52 A 10 ARG H A 11 CYS H 1.0 1.8 3.0 62 53 B 10 ARG H B 11 CYS H 1.0 1.8 3.0 63 54 C 10 ARG H C 11 CYS H 1.0 1.8 3.0 64 55 A 11 CYS H A 12 LYS H 1.0 1.8 3.0 65 56 B 11 CYS H B 12 LYS H 1.0 1.8 3.0 66 57 C 11 CYS H C 12 LYS H 1.0 1.8 3.0 67 58 A 12 LYS H A 13 LYS H 1.0 1.8 3.0 68 59 B 12 LYS H B 13 LYS H 1.0 1.8 3.0 69 60 C 12 LYS H C 13 LYS H 1.0 1.8 3.0 70 61 A 13 LYS H A 14 LEU H 1.0 1.8 3.0 71 62 B 13 LYS H B 14 LEU H 1.0 1.8 3.0 72 63 C 13 LYS H C 14 LEU H 1.0 1.8 3.0 73 64 A 14 LEU H A 15 LEU H 1.0 1.8 3.0 74 65 B 14 LEU H B 15 LEU H 1.0 1.8 3.0 75 66 C 14 LEU H C 15 LEU H 1.0 1.8 3.0 76 67 A 15 LEU H A 16 ASP H 1.0 1.8 3.0 77 68 B 15 LEU H B 16 ASP H 1.0 1.8 3.0 78 69 C 15 LEU H C 16 ASP H 1.0 1.8 3.0 79 70 A 16 ASP H A 17 ASP H 1.0 1.8 3.0 80 71 B 16 ASP H B 17 ASP H 1.0 1.8 3.0 81 72 C 16 ASP H C 17 ASP H 1.0 1.8 3.0 82 73 A 5 ALA HB1 A 2 ASN HA 1.0 1.8 5.0 83 74 B 5 ALA HB1 B 2 ASN HA 1.0 1.8 5.0 84 75 C 5 ALA HB1 C 2 ASN HA 1.0 1.8 5.0 85 76 A 3 PRO HA A 6 GLU HBx 1.0 1.8 5.0 86 76 A 3 PRO HA A 6 GLU HBy 1.0 1.8 5.0 87 77 B 3 PRO HA B 6 GLU HBx 1.0 1.8 5.0 88 77 B 3 PRO HA B 6 GLU HBy 1.0 1.8 5.0 89 78 C 3 PRO HA C 6 GLU HBx 1.0 1.8 5.0 90 78 C 3 PRO HA C 6 GLU HBy 1.0 1.8 5.0 91 79 A 4 GLU HA A 7 GLU HB2 1.0 1.8 5.0 92 79 A 4 GLU HA A 7 GLU HB3 1.0 1.8 5.0 93 80 B 4 GLU HA B 7 GLU HB2 1.0 1.8 5.0 94 80 B 4 GLU HA B 7 GLU HB3 1.0 1.8 5.0 95 81 C 4 GLU HA C 7 GLU HB2 1.0 1.8 5.0 96 81 C 4 GLU HA C 7 GLU HB3 1.0 1.8 5.0 97 82 A 5 ALA HA A 8 ILE HB 1.0 1.8 4.0 98 83 B 5 ALA HA B 8 ILE HB 1.0 1.8 4.0 99 84 C 5 ALA HA C 8 ILE HB 1.0 1.8 4.0 100 85 A 9 THR H A 6 GLU HA 1.0 1.8 5.0 101 86 B 9 THR H B 6 GLU HA 1.0 1.8 5.0 102 87 C 9 THR H C 6 GLU HA 1.0 1.8 5.0 103 88 A 6 GLU HA A 9 THR HB 1.0 1.8 5.0 104 89 B 6 GLU HA B 9 THR HB 1.0 1.8 5.0 105 90 C 6 GLU HA C 9 THR HB 1.0 1.8 5.0 106 91 A 6 GLU HA A 9 THR HG21 1.0 1.8 5.0 107 92 B 6 GLU HA B 9 THR HG21 1.0 1.8 5.0 108 93 C 6 GLU HA C 9 THR HG21 1.0 1.8 5.0 109 94 A 7 GLU HA A 10 ARG HE 1.0 1.8 5.0 110 95 B 7 GLU HA B 10 ARG HE 1.0 1.8 5.0 111 96 C 7 GLU HA C 10 ARG HE 1.0 1.8 5.0 112 97 A 10 ARG HE A 7 GLU HG2 1.0 1.8 5.0 113 97 A 7 GLU HG3 A 10 ARG HE 1.0 1.8 5.0 114 98 B 10 ARG HE B 7 GLU HG2 1.0 1.8 5.0 115 98 B 7 GLU HG3 B 10 ARG HE 1.0 1.8 5.0 116 99 C 10 ARG HE C 7 GLU HG2 1.0 1.8 5.0 117 99 C 10 ARG HE C 7 GLU HG3 1.0 1.8 5.0 118 100 A 14 LEU HDx% A 10 ARG HE 1.0 1.8 5.5 119 101 B 14 LEU HDx% B 10 ARG HE 1.0 1.8 5.5 120 102 C 14 LEU HDx% C 10 ARG HE 1.0 1.8 5.5 121 103 A 14 LEU HDy% A 10 ARG HE 1.0 1.8 5.5 122 104 B 14 LEU HDy% B 10 ARG HE 1.0 1.8 5.5 123 105 C 14 LEU HDy% C 10 ARG HE 1.0 1.8 5.5 124 106 A 7 GLU HA A 10 ARG HBx 1.0 1.8 4.0 125 106 A 7 GLU HA A 10 ARG HBy 1.0 1.8 4.0 126 107 B 7 GLU HA B 10 ARG HBx 1.0 1.8 4.0 127 107 B 7 GLU HA B 10 ARG HBy 1.0 1.8 4.0 128 108 C 7 GLU HA C 10 ARG HBx 1.0 1.8 4.0 129 108 C 7 GLU HA C 10 ARG HBy 1.0 1.8 4.0 130 109 A 8 ILE HA A 11 CYS HB2 1.0 1.8 3.5 131 109 A 8 ILE HA A 11 CYS HB3 1.0 1.8 3.5 132 110 B 8 ILE HA B 11 CYS HB2 1.0 1.8 3.5 133 110 B 8 ILE HA B 11 CYS HB3 1.0 1.8 3.5 134 111 C 8 ILE HA C 11 CYS HB2 1.0 1.8 3.5 135 111 C 8 ILE HA C 11 CYS HB3 1.0 1.8 3.5 136 112 A 12 LYS HA A 15 LEU HB2 1.0 1.8 4.0 137 112 A 12 LYS HA A 15 LEU HB3 1.0 1.8 4.0 138 113 B 12 LYS HA B 15 LEU HB2 1.0 1.8 4.0 139 113 B 12 LYS HA B 15 LEU HB3 1.0 1.8 4.0 140 114 C 12 LYS HA C 15 LEU HB2 1.0 1.8 4.0 141 114 C 12 LYS HA C 15 LEU HB3 1.0 1.8 4.0 142 115 A 15 LEU HDx% A 12 LYS HA 1.0 1.8 5.0 143 116 B 15 LEU HDx% B 12 LYS HA 1.0 1.8 5.0 144 117 C 15 LEU HDx% C 12 LYS HA 1.0 1.8 5.0 145 118 A 15 LEU HDy% A 12 LYS HA 1.0 1.8 5.0 146 119 B 15 LEU HDy% B 12 LYS HA 1.0 1.8 5.0 147 120 C 15 LEU HDy% C 12 LYS HA 1.0 1.8 5.0 148 121 A 13 LYS HA A 16 ASP HB2 1.0 1.8 4.0 149 121 A 13 LYS HA A 16 ASP HB3 1.0 1.8 4.0 150 122 B 13 LYS HA B 16 ASP HB2 1.0 1.8 4.0 151 122 B 13 LYS HA B 16 ASP HB3 1.0 1.8 4.0 152 123 C 13 LYS HA C 16 ASP HB2 1.0 1.8 4.0 153 123 C 13 LYS HA C 16 ASP HB3 1.0 1.8 4.0 154 124 A 14 LEU HA A 17 ASP HB2 1.0 1.8 5.0 155 124 A 14 LEU HA A 17 ASP HB3 1.0 1.8 5.0 156 125 B 14 LEU HA B 17 ASP HB2 1.0 1.8 5.0 157 125 B 14 LEU HA B 17 ASP HB3 1.0 1.8 5.0 158 126 C 14 LEU HA C 17 ASP HB2 1.0 1.8 5.0 159 126 C 14 LEU HA C 17 ASP HB3 1.0 1.8 5.0 160 127 A 10 ARG HE A 7 GLU OE1 1.0 1.8 2.2 161 128 A 7 GLU OE1 A 10 ARG NE 1.0 2.8 3.2 162 129 B 10 ARG HE B 7 GLU OE1 1.0 1.8 2.2 163 130 B 7 GLU OE1 B 10 ARG NE 1.0 2.8 3.2 164 131 C 10 ARG HE C 7 GLU OE1 1.0 1.8 2.2 165 132 C 7 GLU OE1 C 10 ARG NE 1.0 2.8 3.2 166 133 A 1 LYS HA A 1 LYS HB2 1.0 1.8 4.0 167 133 A 1 LYS HA A 1 LYS HB3 1.0 1.8 4.0 168 134 B 1 LYS HA B 1 LYS HB2 1.0 1.8 4.0 169 134 B 1 LYS HA B 1 LYS HB3 1.0 1.8 4.0 170 135 C 1 LYS HA C 1 LYS HB2 1.0 1.8 4.0 171 135 C 1 LYS HA C 1 LYS HB3 1.0 1.8 4.0 172 136 A 1 LYS HA A 1 LYS HG2 1.0 1.8 4.0 173 136 A 1 LYS HA A 1 LYS HG3 1.0 1.8 4.0 174 137 B 1 LYS HA B 1 LYS HG2 1.0 1.8 4.0 175 137 B 1 LYS HA B 1 LYS HG3 1.0 1.8 4.0 176 138 C 1 LYS HA C 1 LYS HG2 1.0 1.8 4.0 177 138 C 1 LYS HA C 1 LYS HG3 1.0 1.8 4.0 178 139 A 2 ASN H A 2 ASN HA 1.0 1.8 4.0 179 140 B 2 ASN H B 2 ASN HA 1.0 1.8 4.0 180 141 C 2 ASN H C 2 ASN HA 1.0 1.8 4.0 181 142 A 2 ASN HB3 A 2 ASN H 1.0 1.8 4.0 182 142 A 2 ASN H A 2 ASN HB2 1.0 1.8 4.0 183 143 B 2 ASN HB3 B 2 ASN H 1.0 1.8 4.0 184 143 B 2 ASN H B 2 ASN HB2 1.0 1.8 4.0 185 144 C 2 ASN HB3 C 2 ASN H 1.0 1.8 4.0 186 144 C 2 ASN H C 2 ASN HB2 1.0 1.8 4.0 187 145 A 2 ASN HB3 A 2 ASN HA 1.0 1.8 3.0 188 145 A 2 ASN HA A 2 ASN HB2 1.0 1.8 3.0 189 146 B 2 ASN HB3 B 2 ASN HA 1.0 1.8 3.0 190 146 B 2 ASN HA B 2 ASN HB2 1.0 1.8 3.0 191 147 C 2 ASN HB3 C 2 ASN HA 1.0 1.8 3.0 192 147 C 2 ASN HA C 2 ASN HB2 1.0 1.8 3.0 193 148 A 3 PRO HA A 3 PRO HB2 1.0 1.8 3.0 194 148 A 3 PRO HA A 3 PRO HB3 1.0 1.8 3.0 195 149 B 3 PRO HA B 3 PRO HB2 1.0 1.8 3.0 196 149 B 3 PRO HA B 3 PRO HB3 1.0 1.8 3.0 197 150 C 3 PRO HA C 3 PRO HB2 1.0 1.8 3.0 198 150 C 3 PRO HA C 3 PRO HB3 1.0 1.8 3.0 199 151 A 3 PRO HA A 3 PRO HG2 1.0 1.8 4.0 200 151 A 3 PRO HA A 3 PRO HG3 1.0 1.8 4.0 201 152 B 3 PRO HA B 3 PRO HG2 1.0 1.8 4.0 202 152 B 3 PRO HA B 3 PRO HG3 1.0 1.8 4.0 203 153 C 3 PRO HA C 3 PRO HG2 1.0 1.8 4.0 204 153 C 3 PRO HA C 3 PRO HG3 1.0 1.8 4.0 205 154 A 3 PRO HDy A 3 PRO HA 1.0 1.8 5.0 206 154 A 3 PRO HA A 3 PRO HDx 1.0 1.8 5.0 207 155 B 3 PRO HDy B 3 PRO HA 1.0 1.8 5.0 208 155 B 3 PRO HA B 3 PRO HDx 1.0 1.8 5.0 209 156 C 3 PRO HDy C 3 PRO HA 1.0 1.8 5.0 210 156 C 3 PRO HA C 3 PRO HDx 1.0 1.8 5.0 211 157 A 4 GLU H A 4 GLU HA 1.0 1.8 4.0 212 158 B 4 GLU H B 4 GLU HA 1.0 1.8 4.0 213 159 C 4 GLU H C 4 GLU HA 1.0 1.8 4.0 214 160 A 4 GLU H A 4 GLU HB2 1.0 1.8 5.0 215 160 A 4 GLU H A 4 GLU HB3 1.0 1.8 5.0 216 161 B 4 GLU H B 4 GLU HB2 1.0 1.8 5.0 217 161 B 4 GLU H B 4 GLU HB3 1.0 1.8 5.0 218 162 C 4 GLU H C 4 GLU HB2 1.0 1.8 5.0 219 162 C 4 GLU H C 4 GLU HB3 1.0 1.8 5.0 220 163 A 4 GLU H A 4 GLU HGx 1.0 1.8 3.0 221 163 A 4 GLU H A 4 GLU HGy 1.0 1.8 3.0 222 164 B 4 GLU H B 4 GLU HGx 1.0 1.8 3.0 223 164 B 4 GLU H B 4 GLU HGy 1.0 1.8 3.0 224 165 C 4 GLU H C 4 GLU HGx 1.0 1.8 3.0 225 165 C 4 GLU H C 4 GLU HGy 1.0 1.8 3.0 226 166 A 4 GLU HA A 4 GLU HB2 1.0 1.8 4.0 227 166 A 4 GLU HA A 4 GLU HB3 1.0 1.8 4.0 228 167 B 4 GLU HA B 4 GLU HB2 1.0 1.8 4.0 229 167 B 4 GLU HA B 4 GLU HB3 1.0 1.8 4.0 230 168 C 4 GLU HA C 4 GLU HB2 1.0 1.8 4.0 231 168 C 4 GLU HA C 4 GLU HB3 1.0 1.8 4.0 232 169 A 5 ALA HA A 5 ALA H 1.0 1.8 4.0 233 170 B 5 ALA HA B 5 ALA H 1.0 1.8 4.0 234 171 C 5 ALA HA C 5 ALA H 1.0 1.8 4.0 235 172 A 5 ALA HB1 A 5 ALA H 1.0 1.8 4.0 236 173 B 5 ALA HB1 B 5 ALA H 1.0 1.8 4.0 237 174 C 5 ALA HB1 C 5 ALA H 1.0 1.8 4.0 238 175 A 5 ALA HB1 A 5 ALA HA 1.0 1.8 3.0 239 176 B 5 ALA HB1 B 5 ALA HA 1.0 1.8 3.0 240 177 C 5 ALA HB1 C 5 ALA HA 1.0 1.8 3.0 241 178 A 6 GLU H A 6 GLU HA 1.0 1.8 4.0 242 179 B 6 GLU H B 6 GLU HA 1.0 1.8 4.0 243 180 C 6 GLU H C 6 GLU HA 1.0 1.8 4.0 244 181 A 6 GLU H A 6 GLU HBy 1.0 1.8 5.0 245 181 A 6 GLU H A 6 GLU HBx 1.0 1.8 5.0 246 182 B 6 GLU H B 6 GLU HBy 1.0 1.8 5.0 247 182 B 6 GLU H B 6 GLU HBx 1.0 1.8 5.0 248 183 C 6 GLU H C 6 GLU HBy 1.0 1.8 5.0 249 183 C 6 GLU H C 6 GLU HBx 1.0 1.8 5.0 250 184 A 6 GLU H A 6 GLU HGx 1.0 1.8 3.0 251 184 A 6 GLU H A 6 GLU HGy 1.0 1.8 3.0 252 185 B 6 GLU H B 6 GLU HGx 1.0 1.8 3.0 253 185 B 6 GLU H B 6 GLU HGy 1.0 1.8 3.0 254 186 C 6 GLU H C 6 GLU HGx 1.0 1.8 3.0 255 186 C 6 GLU H C 6 GLU HGy 1.0 1.8 3.0 256 187 A 6 GLU HBy A 6 GLU HA 1.0 1.8 4.0 257 187 A 6 GLU HA A 6 GLU HBx 1.0 1.8 4.0 258 188 B 6 GLU HBy B 6 GLU HA 1.0 1.8 4.0 259 188 B 6 GLU HA B 6 GLU HBx 1.0 1.8 4.0 260 189 C 6 GLU HBy C 6 GLU HA 1.0 1.8 4.0 261 189 C 6 GLU HA C 6 GLU HBx 1.0 1.8 4.0 262 190 A 7 GLU H A 7 GLU HA 1.0 1.8 4.0 263 191 B 7 GLU H B 7 GLU HA 1.0 1.8 4.0 264 192 C 7 GLU H C 7 GLU HA 1.0 1.8 4.0 265 193 A 7 GLU H A 7 GLU HB3 1.0 1.8 4.0 266 193 A 7 GLU H A 7 GLU HB2 1.0 1.8 4.0 267 194 B 7 GLU H B 7 GLU HB3 1.0 1.8 4.0 268 194 B 7 GLU H B 7 GLU HB2 1.0 1.8 4.0 269 195 C 7 GLU H C 7 GLU HB3 1.0 1.8 4.0 270 195 C 7 GLU H C 7 GLU HB2 1.0 1.8 4.0 271 196 A 7 GLU HG3 A 7 GLU H 1.0 1.8 5.5 272 196 A 7 GLU H A 7 GLU HG2 1.0 1.8 5.5 273 197 B 7 GLU HG3 B 7 GLU H 1.0 1.8 5.5 274 197 B 7 GLU H B 7 GLU HG2 1.0 1.8 5.5 275 198 C 7 GLU H C 7 GLU HG3 1.0 1.8 5.5 276 198 C 7 GLU H C 7 GLU HG2 1.0 1.8 5.5 277 199 A 7 GLU HB3 A 7 GLU HA 1.0 1.8 5.0 278 199 A 7 GLU HA A 7 GLU HB2 1.0 1.8 5.0 279 200 B 7 GLU HB3 B 7 GLU HA 1.0 1.8 5.0 280 200 B 7 GLU HA B 7 GLU HB2 1.0 1.8 5.0 281 201 C 7 GLU HB3 C 7 GLU HA 1.0 1.8 5.0 282 201 C 7 GLU HA C 7 GLU HB2 1.0 1.8 5.0 283 202 A 8 ILE H A 8 ILE HA 1.0 1.8 4.0 284 203 B 8 ILE H B 8 ILE HA 1.0 1.8 4.0 285 204 C 8 ILE H C 8 ILE HA 1.0 1.8 4.0 286 205 A 8 ILE HB A 8 ILE H 1.0 1.8 4.0 287 206 B 8 ILE HB B 8 ILE H 1.0 1.8 4.0 288 207 C 8 ILE HB C 8 ILE H 1.0 1.8 4.0 289 208 A 8 ILE HG21 A 8 ILE H 1.0 1.8 5.5 290 209 B 8 ILE HG21 B 8 ILE H 1.0 1.8 5.5 291 210 C 8 ILE HG21 C 8 ILE H 1.0 1.8 5.5 292 211 A 8 ILE HD11 A 8 ILE H 1.0 1.8 5.0 293 212 B 8 ILE HD11 B 8 ILE H 1.0 1.8 5.0 294 213 C 8 ILE HD11 C 8 ILE H 1.0 1.8 5.0 295 214 A 8 ILE HG21 A 8 ILE HA 1.0 1.8 4.0 296 215 B 8 ILE HG21 B 8 ILE HA 1.0 1.8 4.0 297 216 C 8 ILE HG21 C 8 ILE HA 1.0 1.8 4.0 298 217 A 8 ILE HD11 A 8 ILE HA 1.0 1.8 4.0 299 218 B 8 ILE HD11 B 8 ILE HA 1.0 1.8 4.0 300 219 C 8 ILE HD11 C 8 ILE HA 1.0 1.8 4.0 301 220 A 9 THR H A 9 THR HA 1.0 1.8 4.0 302 221 B 9 THR H B 9 THR HA 1.0 1.8 4.0 303 222 C 9 THR H C 9 THR HA 1.0 1.8 4.0 304 223 A 9 THR H A 9 THR HB 1.0 1.8 4.0 305 224 B 9 THR H B 9 THR HB 1.0 1.8 4.0 306 225 C 9 THR H C 9 THR HB 1.0 1.8 4.0 307 226 A 9 THR H A 9 THR HG21 1.0 1.8 5.5 308 227 B 9 THR H B 9 THR HG21 1.0 1.8 5.5 309 228 C 9 THR H C 9 THR HG21 1.0 1.8 5.5 310 229 A 9 THR HG21 A 9 THR HA 1.0 1.8 4.0 311 230 B 9 THR HG21 B 9 THR HA 1.0 1.8 4.0 312 231 C 9 THR HG21 C 9 THR HA 1.0 1.8 4.0 313 232 A 10 ARG H A 10 ARG HA 1.0 1.8 4.0 314 233 B 10 ARG H B 10 ARG HA 1.0 1.8 4.0 315 234 C 10 ARG H C 10 ARG HA 1.0 1.8 4.0 316 235 A 10 ARG H A 10 ARG HBy 1.0 1.8 4.0 317 235 A 10 ARG H A 10 ARG HBx 1.0 1.8 4.0 318 236 B 10 ARG H B 10 ARG HBy 1.0 1.8 4.0 319 236 B 10 ARG H B 10 ARG HBx 1.0 1.8 4.0 320 237 C 10 ARG H C 10 ARG HBy 1.0 1.8 4.0 321 237 C 10 ARG H C 10 ARG HBx 1.0 1.8 4.0 322 238 A 10 ARG HBy A 10 ARG HA 1.0 1.8 5.0 323 238 A 10 ARG HA A 10 ARG HBx 1.0 1.8 5.0 324 239 B 10 ARG HBy B 10 ARG HA 1.0 1.8 5.0 325 239 B 10 ARG HA B 10 ARG HBx 1.0 1.8 5.0 326 240 C 10 ARG HBy C 10 ARG HA 1.0 1.8 5.0 327 240 C 10 ARG HA C 10 ARG HBx 1.0 1.8 5.0 328 241 A 10 ARG HA A 10 ARG HGx 1.0 1.8 3.0 329 241 A 10 ARG HA A 10 ARG HGy 1.0 1.8 3.0 330 242 B 10 ARG HA B 10 ARG HGx 1.0 1.8 3.0 331 242 B 10 ARG HA B 10 ARG HGy 1.0 1.8 3.0 332 243 C 10 ARG HA C 10 ARG HGx 1.0 1.8 3.0 333 243 C 10 ARG HA C 10 ARG HGy 1.0 1.8 3.0 334 244 A 12 LYS H A 12 LYS HA 1.0 1.8 4.0 335 245 B 12 LYS H B 12 LYS HA 1.0 1.8 4.0 336 246 C 12 LYS H C 12 LYS HA 1.0 1.8 4.0 337 247 A 12 LYS H A 12 LYS HB2 1.0 1.8 5.0 338 247 A 12 LYS H A 12 LYS HB3 1.0 1.8 5.0 339 248 B 12 LYS H B 12 LYS HB2 1.0 1.8 5.0 340 248 B 12 LYS H B 12 LYS HB3 1.0 1.8 5.0 341 249 C 12 LYS H C 12 LYS HB2 1.0 1.8 5.0 342 249 C 12 LYS H C 12 LYS HB3 1.0 1.8 5.0 343 250 A 12 LYS HA A 12 LYS HB2 1.0 1.8 4.0 344 250 A 12 LYS HA A 12 LYS HB3 1.0 1.8 4.0 345 251 B 12 LYS HA B 12 LYS HB2 1.0 1.8 4.0 346 251 B 12 LYS HA B 12 LYS HB3 1.0 1.8 4.0 347 252 C 12 LYS HA C 12 LYS HB2 1.0 1.8 4.0 348 252 C 12 LYS HA C 12 LYS HB3 1.0 1.8 4.0 349 253 A 13 LYS H A 13 LYS HA 1.0 1.8 4.0 350 254 B 13 LYS H B 13 LYS HA 1.0 1.8 4.0 351 255 C 13 LYS H C 13 LYS HA 1.0 1.8 4.0 352 256 A 13 LYS H A 13 LYS HB2 1.0 1.8 4.0 353 256 A 13 LYS H A 13 LYS HB3 1.0 1.8 4.0 354 257 B 13 LYS H B 13 LYS HB2 1.0 1.8 4.0 355 257 B 13 LYS H B 13 LYS HB3 1.0 1.8 4.0 356 258 C 13 LYS H C 13 LYS HB2 1.0 1.8 4.0 357 258 C 13 LYS H C 13 LYS HB3 1.0 1.8 4.0 358 259 A 13 LYS HA A 13 LYS HB2 1.0 1.8 5.0 359 259 A 13 LYS HA A 13 LYS HB3 1.0 1.8 5.0 360 260 B 13 LYS HA B 13 LYS HB2 1.0 1.8 5.0 361 260 B 13 LYS HA B 13 LYS HB3 1.0 1.8 5.0 362 261 C 13 LYS HA C 13 LYS HB2 1.0 1.8 5.0 363 261 C 13 LYS HA C 13 LYS HB3 1.0 1.8 5.0 364 262 A 14 LEU H A 14 LEU HA 1.0 1.8 4.0 365 263 B 14 LEU H B 14 LEU HA 1.0 1.8 4.0 366 264 C 14 LEU H C 14 LEU HA 1.0 1.8 4.0 367 265 A 14 LEU H A 14 LEU HB2 1.0 1.8 5.0 368 265 A 14 LEU H A 14 LEU HB3 1.0 1.8 5.0 369 266 B 14 LEU H B 14 LEU HB2 1.0 1.8 5.0 370 266 B 14 LEU H B 14 LEU HB3 1.0 1.8 5.0 371 267 C 14 LEU H C 14 LEU HB2 1.0 1.8 5.0 372 267 C 14 LEU H C 14 LEU HB3 1.0 1.8 5.0 373 268 A 14 LEU HDx% A 14 LEU H 1.0 1.8 5.5 374 269 B 14 LEU HDx% B 14 LEU H 1.0 1.8 5.5 375 270 C 14 LEU HDx% C 14 LEU H 1.0 1.8 5.5 376 271 A 14 LEU HDy% A 14 LEU H 1.0 1.8 5.5 377 272 B 14 LEU HDy% B 14 LEU H 1.0 1.8 5.5 378 273 C 14 LEU HDy% C 14 LEU H 1.0 1.8 5.5 379 274 A 14 LEU HA A 14 LEU HB2 1.0 1.8 4.0 380 274 A 14 LEU HA A 14 LEU HB3 1.0 1.8 4.0 381 275 B 14 LEU HA B 14 LEU HB2 1.0 1.8 4.0 382 275 B 14 LEU HA B 14 LEU HB3 1.0 1.8 4.0 383 276 C 14 LEU HA C 14 LEU HB2 1.0 1.8 4.0 384 276 C 14 LEU HA C 14 LEU HB3 1.0 1.8 4.0 385 277 A 14 LEU HDy% A 14 LEU HA 1.0 1.8 4.0 386 278 B 14 LEU HDy% B 14 LEU HA 1.0 1.8 4.0 387 279 C 14 LEU HDy% C 14 LEU HA 1.0 1.8 4.0 388 280 A 15 LEU H A 15 LEU HA 1.0 1.8 4.0 389 281 B 15 LEU H B 15 LEU HA 1.0 1.8 4.0 390 282 C 15 LEU H C 15 LEU HA 1.0 1.8 4.0 391 283 A 15 LEU H A 15 LEU HB3 1.0 1.8 5.0 392 283 A 15 LEU H A 15 LEU HB2 1.0 1.8 5.0 393 284 B 15 LEU H B 15 LEU HB3 1.0 1.8 5.0 394 284 B 15 LEU H B 15 LEU HB2 1.0 1.8 5.0 395 285 C 15 LEU H C 15 LEU HB3 1.0 1.8 5.0 396 285 C 15 LEU H C 15 LEU HB2 1.0 1.8 5.0 397 286 A 15 LEU HDx% A 15 LEU H 1.0 1.8 5.5 398 287 B 15 LEU HDx% B 15 LEU H 1.0 1.8 5.5 399 288 C 15 LEU HDx% C 15 LEU H 1.0 1.8 5.5 400 289 A 15 LEU HDy% A 15 LEU H 1.0 1.8 4.0 401 290 B 15 LEU HDy% B 15 LEU H 1.0 1.8 4.0 402 291 C 15 LEU HDy% C 15 LEU H 1.0 1.8 4.0 403 292 A 15 LEU HB3 A 15 LEU HA 1.0 1.8 4.0 404 292 A 15 LEU HA A 15 LEU HB2 1.0 1.8 4.0 405 293 B 15 LEU HB3 B 15 LEU HA 1.0 1.8 4.0 406 293 B 15 LEU HA B 15 LEU HB2 1.0 1.8 4.0 407 294 C 15 LEU HB3 C 15 LEU HA 1.0 1.8 4.0 408 294 C 15 LEU HA C 15 LEU HB2 1.0 1.8 4.0 409 295 A 15 LEU HDx% A 15 LEU HA 1.0 1.8 4.0 410 296 B 15 LEU HDx% B 15 LEU HA 1.0 1.8 4.0 411 297 C 15 LEU HDx% C 15 LEU HA 1.0 1.8 4.0 412 298 A 15 LEU HDy% A 15 LEU HA 1.0 1.8 5.0 413 299 B 15 LEU HDy% B 15 LEU HA 1.0 1.8 5.0 414 300 C 15 LEU HDy% C 15 LEU HA 1.0 1.8 5.0 415 301 A 16 ASP H A 16 ASP HA 1.0 1.8 4.0 416 302 B 16 ASP H B 16 ASP HA 1.0 1.8 4.0 417 303 C 16 ASP H C 16 ASP HA 1.0 1.8 4.0 418 304 A 16 ASP H A 16 ASP HB3 1.0 1.8 5.0 419 304 A 16 ASP H A 16 ASP HB2 1.0 1.8 5.0 420 305 B 16 ASP H B 16 ASP HB3 1.0 1.8 5.0 421 305 B 16 ASP H B 16 ASP HB2 1.0 1.8 5.0 422 306 C 16 ASP H C 16 ASP HB3 1.0 1.8 5.0 423 306 C 16 ASP H C 16 ASP HB2 1.0 1.8 5.0 424 307 A 17 ASP H A 17 ASP HA 1.0 1.8 4.0 425 308 B 17 ASP H B 17 ASP HA 1.0 1.8 4.0 426 309 C 17 ASP H C 17 ASP HA 1.0 1.8 4.0 427 310 A 17 ASP H A 17 ASP HB3 1.0 1.8 5.0 428 310 A 17 ASP H A 17 ASP HB2 1.0 1.8 5.0 429 311 B 17 ASP H B 17 ASP HB3 1.0 1.8 5.0 430 311 B 17 ASP H B 17 ASP HB2 1.0 1.8 5.0 431 312 C 17 ASP H C 17 ASP HB3 1.0 1.8 5.0 432 312 C 17 ASP H C 17 ASP HB2 1.0 1.8 5.0 433 313 A 18 SER HA A 18 SER H 1.0 1.8 4.0 434 314 B 18 SER HA B 18 SER H 1.0 1.8 4.0 435 315 C 18 SER HA C 18 SER H 1.0 1.8 4.0 436 316 A 18 SER H A 18 SER HB2 1.0 1.8 4.0 437 316 A 18 SER H A 18 SER HB3 1.0 1.8 4.0 438 317 B 18 SER H B 18 SER HB2 1.0 1.8 4.0 439 317 B 18 SER H B 18 SER HB3 1.0 1.8 4.0 440 318 C 18 SER H C 18 SER HB2 1.0 1.8 4.0 441 318 C 18 SER H C 18 SER HB3 1.0 1.8 4.0 442 319 A 19 SER H A 19 SER HA 1.0 1.8 4.0 443 320 B 19 SER H B 19 SER HA 1.0 1.8 4.0 444 321 C 19 SER H C 19 SER HA 1.0 1.8 4.0 445 322 A 19 SER H A 19 SER HB2 1.0 1.8 4.0 446 322 A 19 SER H A 19 SER HB3 1.0 1.8 4.0 447 323 B 19 SER H B 19 SER HB2 1.0 1.8 4.0 448 323 B 19 SER H B 19 SER HB3 1.0 1.8 4.0 449 324 C 19 SER H C 19 SER HB2 1.0 1.8 4.0 450 324 C 19 SER H C 19 SER HB3 1.0 1.8 4.0 451 325 A 20 SER H A 20 SER HA 1.0 1.8 4.0 452 326 B 20 SER H B 20 SER HA 1.0 1.8 4.0 453 327 C 20 SER H C 20 SER HA 1.0 1.8 4.0 454 328 A 20 SER H A 20 SER HB2 1.0 1.8 5.0 455 328 A 20 SER H A 20 SER HB3 1.0 1.8 5.0 456 329 B 20 SER H B 20 SER HB2 1.0 1.8 5.0 457 329 B 20 SER H B 20 SER HBy 1.0 1.8 5.0 458 330 C 20 SER H C 20 SER HB2 1.0 1.8 5.0 459 330 C 20 SER H C 20 SER HB3 1.0 1.8 5.0 stop_ save_