data_nef_c17979_2lk5 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 BMRB 5249 BMRB 5271 BMRB 5260 BMRB 17997 PDB 1cfw PDB 1dhg PDB 1dcd PDB 1dxg 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 2 29 CYS SG 3 2 ZN ZN 1 9 CYS SG 3 1 ZN ZN 2 9 CYS SG 3 2 ZN ZN 1 29 CYS SG 3 1 ZN ZN 2 12 CYS SG 3 2 ZN ZN 1 12 CYS SG 3 1 ZN ZN 1 28 CYS SG 3 1 ZN ZN 2 28 CYS SG 3 2 ZN ZN 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 ALA start . . 2 A 2 ASN middle . . 3 A 3 GLU middle . . 4 A 4 GLY middle . false 5 A 5 ASP middle . . 6 A 6 VAL middle . . 7 A 7 TYR middle . . 8 A 8 LYS middle . . 9 A 9 CYS middle -HG . 10 A 10 GLU middle . . 11 A 11 LEU middle . . 12 A 12 CYS middle -HG . 13 A 13 GLY middle . false 14 A 14 GLN middle . . 15 A 15 VAL middle . . 16 A 16 VAL middle . . 17 A 17 LYS middle . . 18 A 18 VAL middle . . 19 A 19 LEU middle . . 20 A 20 GLU middle . . 21 A 21 GLU middle . . 22 A 22 GLY middle . false 23 A 23 GLY middle . false 24 A 24 GLY middle . false 25 A 25 THR middle . . 26 A 26 LEU middle . . 27 A 27 VAL middle . . 28 A 28 CYS middle -HG . 29 A 29 CYS middle -HG . 30 A 30 GLY middle . false 31 A 31 GLU middle . . 32 A 32 ASP middle . . 33 A 33 MET middle . . 34 A 34 VAL middle . . 35 A 35 LYS middle . . 36 A 36 GLN end . . 37 B 1 ALA start . . 38 B 2 ASN middle . . 39 B 3 GLU middle . . 40 B 4 GLY middle . false 41 B 5 ASP middle . . 42 B 6 VAL middle . . 43 B 7 TYR middle . . 44 B 8 LYS middle . . 45 B 9 CYS middle -HG . 46 B 10 GLU middle . . 47 B 11 LEU middle . . 48 B 12 CYS middle -HG . 49 B 13 GLY middle . false 50 B 14 GLN middle . . 51 B 15 VAL middle . . 52 B 16 VAL middle . . 53 B 17 LYS middle . . 54 B 18 VAL middle . . 55 B 19 LEU middle . . 56 B 20 GLU middle . . 57 B 21 GLU middle . . 58 B 22 GLY middle . false 59 B 23 GLY middle . false 60 B 24 GLY middle . false 61 B 25 THR middle . . 62 B 26 LEU middle . . 63 B 27 VAL middle . . 64 B 28 CYS middle -HG . 65 B 29 CYS middle -HG . 66 B 30 GLY middle . false 67 B 31 GLU middle . . 68 B 32 ASP middle . . 69 B 33 MET middle . . 70 B 34 VAL middle . . 71 B 35 LYS middle . . 72 B 36 GLN end . . 73 C 1 ZN . . . 74 C 2 ZN . . . 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 1 ALA HA H 1 3.98 0.013 A 1 ALA HB% H 1 1.56 0.013 A 2 ASN H H 1 8.33 0.013 A 2 ASN HA H 1 4.73 0.013 A 2 ASN HBx H 1 2.68 0.013 A 2 ASN HBy H 1 2.68 0.013 A 3 GLU H H 1 9.02 0.013 A 3 GLU HA H 1 3.35 0.013 A 3 GLU HBx H 1 1.83 0.013 A 3 GLU HBy H 1 1.83 0.013 A 3 GLU HGx H 1 1.96 0.013 A 3 GLU HGy H 1 2.20 0.013 A 4 GLY H H 1 8.97 0.013 A 4 GLY HAy H 1 4.32 0.013 A 4 GLY HAx H 1 3.35 0.013 A 5 ASP H H 1 7.98 0.013 A 5 ASP HA H 1 4.37 0.013 A 5 ASP HBx H 1 2.49 0.013 A 5 ASP HBy H 1 2.94 0.013 A 6 VAL H H 1 8.70 0.013 A 6 VAL HA H 1 4.86 0.013 A 6 VAL HB H 1 1.62 0.013 A 6 VAL HGx% H 1 0.77 0.013 A 6 VAL HGy% H 1 0.60 0.013 A 7 TYR H H 1 8.98 0.013 A 7 TYR HA H 1 4.81 0.013 A 7 TYR HBx H 1 2.27 0.013 A 7 TYR HBy H 1 2.62 0.013 A 7 TYR HDy H 1 6.45 0.013 A 7 TYR HEy H 1 6.64 0.013 A 8 LYS H H 1 8.83 0.013 A 8 LYS HA H 1 5.32 0.013 A 8 LYS HBx H 1 1.65 0.013 A 8 LYS HBy H 1 1.65 0.013 A 8 LYS HDx H 1 1.21 0.013 A 8 LYS HDy H 1 1.21 0.013 A 8 LYS HEx H 1 2.62 0.013 A 8 LYS HEy H 1 2.62 0.013 A 8 LYS HGx H 1 0.94 0.013 A 8 LYS HGy H 1 0.94 0.013 A 9 CYS H H 1 9.22 0.013 A 9 CYS HA H 1 4.66 0.013 A 9 CYS HBx H 1 2.31 0.013 A 9 CYS HBy H 1 3.13 0.013 A 10 GLU H H 1 9.35 0.013 A 10 GLU HA H 1 4.04 0.013 A 10 GLU HBx H 1 1.76 0.013 A 10 GLU HBy H 1 1.76 0.013 A 10 GLU HGx H 1 1.98 0.013 A 10 GLU HGy H 1 2.28 0.013 A 11 LEU H H 1 8.90 0.013 A 11 LEU HA H 1 4.33 0.013 A 11 LEU HBx H 1 1.77 0.013 A 11 LEU HBy H 1 1.77 0.013 A 11 LEU HDx% H 1 0.78 0.013 A 11 LEU HDy% H 1 0.78 0.013 A 11 LEU HG H 1 1.45 0.013 A 12 CYS H H 1 9.11 0.013 A 12 CYS HA H 1 4.82 0.013 A 12 CYS HBx H 1 2.74 0.013 A 12 CYS HBy H 1 3.03 0.013 A 13 GLY H H 1 7.57 0.013 A 13 GLY HAx H 1 3.53 0.013 A 13 GLY HAy H 1 4.07 0.013 A 14 GLN H H 1 8.45 0.013 A 14 GLN HA H 1 3.85 0.013 A 14 GLN HBy H 1 1.94 0.013 A 14 GLN HBx H 1 1.83 0.013 A 14 GLN HE2x H 1 5.97 0.013 A 14 GLN HE2y H 1 6.90 0.013 A 14 GLN HGx H 1 2.28 0.013 A 14 GLN HGy H 1 2.28 0.013 A 15 VAL H H 1 8.44 0.013 A 15 VAL HA H 1 5.01 0.013 A 15 VAL HB H 1 1.56 0.013 A 15 VAL HGx% H 1 0.78 0.013 A 15 VAL HGy% H 1 0.78 0.013 A 16 VAL H H 1 9.35 0.013 A 16 VAL HA H 1 5.39 0.013 A 16 VAL HB H 1 1.82 0.013 A 16 VAL HGx% H 1 0.57 0.013 A 16 VAL HGy% H 1 0.57 0.013 A 17 LYS H H 1 9.04 0.013 A 17 LYS HA H 1 5.33 0.013 A 17 LYS HBx H 1 1.53 0.013 A 17 LYS HBy H 1 1.53 0.013 A 17 LYS HDx H 1 0.65 0.013 A 17 LYS HDy H 1 0.65 0.013 A 17 LYS HEx H 1 2.80 0.013 A 17 LYS HEy H 1 2.80 0.013 A 17 LYS HGx H 1 1.12 0.013 A 17 LYS HGy H 1 1.12 0.013 A 18 VAL H H 1 9.03 0.013 A 18 VAL HA H 1 3.92 0.013 A 18 VAL HB H 1 2.28 0.013 A 18 VAL HGx% H 1 0.77 0.013 A 18 VAL HGy% H 1 0.56 0.013 A 19 LEU H H 1 9.38 0.013 A 19 LEU HA H 1 4.37 0.013 A 19 LEU HBx H 1 1.40 0.013 A 19 LEU HBy H 1 1.40 0.013 A 19 LEU HDx% H 1 0.76 0.013 A 19 LEU HDy% H 1 0.76 0.013 A 19 LEU HG H 1 1.54 0.013 A 20 GLU H H 1 7.57 0.013 A 20 GLU HA H 1 4.55 0.013 A 20 GLU HBx H 1 1.68 0.013 A 20 GLU HBy H 1 1.68 0.013 A 20 GLU HGy H 1 2.15 0.013 A 20 GLU HGx H 1 1.95 0.013 A 21 GLU H H 1 8.70 0.013 A 21 GLU HA H 1 4.06 0.013 A 21 GLU HBx H 1 2.20 0.013 A 21 GLU HBy H 1 2.20 0.013 A 21 GLU HGx H 1 1.89 0.013 A 21 GLU HGy H 1 1.89 0.013 A 22 GLY H H 1 7.20 0.013 A 22 GLY HAy H 1 4.16 0.013 A 22 GLY HAx H 1 3.86 0.013 A 23 GLY H H 1 7.91 0.013 A 23 GLY HAx H 1 3.53 0.013 A 23 GLY HAy H 1 3.90 0.013 A 24 GLY H H 1 8.51 0.013 A 24 GLY HAx H 1 3.76 0.013 A 24 GLY HAy H 1 4.69 0.013 A 25 THR H H 1 8.84 0.013 A 25 THR HA H 1 4.00 0.013 A 25 THR HB H 1 3.80 0.013 A 25 THR HG2% H 1 0.94 0.013 A 26 LEU H H 1 8.05 0.013 A 26 LEU HA H 1 4.30 0.013 A 26 LEU HBx H 1 1.17 0.013 A 26 LEU HBy H 1 1.17 0.013 A 26 LEU HDx% H 1 0.48 0.013 A 26 LEU HDy% H 1 -0.04 0.013 A 26 LEU HG H 1 0.94 0.013 A 27 VAL H H 1 9.25 0.013 A 27 VAL HA H 1 4.23 0.013 A 27 VAL HB H 1 1.40 0.013 A 27 VAL HGx% H 1 0.66 0.013 A 27 VAL HGy% H 1 0.46 0.013 A 28 CYS H H 1 8.25 0.013 A 28 CYS HA H 1 4.44 0.013 A 28 CYS HBx H 1 2.34 0.013 A 28 CYS HBy H 1 2.81 0.013 A 29 CYS H H 1 7.14 0.013 A 29 CYS HA H 1 3.84 0.013 A 29 CYS HBx H 1 2.89 0.013 A 29 CYS HBy H 1 2.89 0.013 A 30 GLY H H 1 8.15 0.013 A 30 GLY HAx H 1 3.25 0.013 A 30 GLY HAy H 1 3.88 0.013 A 31 GLU H H 1 7.98 0.013 A 31 GLU HA H 1 4.62 0.013 A 31 GLU HBx H 1 1.64 0.013 A 31 GLU HBy H 1 1.64 0.013 A 31 GLU HGy H 1 2.19 0.013 A 31 GLU HGx H 1 1.94 0.013 A 32 ASP H H 1 8.77 0.013 A 32 ASP HA H 1 4.41 0.013 A 32 ASP HBx H 1 2.41 0.013 A 32 ASP HBy H 1 2.41 0.013 A 33 MET H H 1 8.33 0.013 A 33 MET HA H 1 4.41 0.013 A 33 MET HBy H 1 2.12 0.013 A 33 MET HBx H 1 1.92 0.013 A 33 MET HE% H 1 1.65 0.013 A 33 MET HGx H 1 1.46 0.013 A 33 MET HGy H 1 1.46 0.013 A 34 VAL H H 1 9.23 0.013 A 34 VAL HA H 1 4.06 0.013 A 34 VAL HB H 1 1.86 0.013 A 34 VAL HGx% H 1 0.97 0.013 A 34 VAL HGy% H 1 0.79 0.013 A 35 LYS H H 1 8.82 0.013 A 35 LYS HA H 1 3.18 0.013 A 35 LYS HBx H 1 1.43 0.013 A 35 LYS HBy H 1 1.43 0.013 A 35 LYS HDy H 1 0.71 0.013 A 35 LYS HEx H 1 2.78 0.013 A 35 LYS HGx H 1 1.23 0.013 A 36 GLN H H 1 8.70 0.013 A 36 GLN HA H 1 3.89 0.013 A 36 GLN HBx H 1 1.50 0.013 A 36 GLN HBy H 1 1.50 0.013 A 36 GLN HE2x H 1 6.63 0.013 A 36 GLN HE2y H 1 7.42 0.013 A 36 GLN HGx H 1 1.91 0.013 A 36 GLN HGy H 1 2.01 0.013 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-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 1 ALA HB% A 5 ASP HBx 1.0 . 6.00 2 2 A 1 ALA HB% A 7 TYR HEy 1.0 . 3.40 3 3 A 1 ALA HB% A 7 TYR HDy 1.0 . 6.00 4 4 A 1 ALA HB% A 21 GLU HA 1.0 . 6.00 5 5 A 1 ALA HB% A 26 LEU HDx% 1.0 . 7.00 6 6 A 1 ALA HB% B 14 GLN HE2y 1.0 . 6.00 7 7 A 2 ASN HA A 3 GLU HBx 1.0 . 4.90 8 7 A 2 ASN HA A 3 GLU HBy 1.0 . 4.90 9 8 A 3 GLU H A 2 ASN HBx 1.0 . 4.50 10 8 A 2 ASN HBy A 3 GLU H 1.0 . 4.50 11 9 A 3 GLU H A 3 GLU HBx 1.0 . 3.00 12 9 A 3 GLU HBy A 3 GLU H 1.0 . 3.00 13 10 A 3 GLU H A 3 GLU HGy 1.0 . 4.50 14 11 A 3 GLU HGy A 3 GLU HA 1.0 . 4.00 15 12 A 3 GLU HA A 4 GLY H 1.0 . 2.50 16 13 A 3 GLU HA A 18 VAL HB 1.0 . 4.10 17 14 A 3 GLU HA A 18 VAL HGx% 1.0 . 3.50 18 15 A 4 GLY H A 3 GLU HBx 1.0 . 4.40 19 15 A 3 GLU HBy A 4 GLY H 1.0 . 4.40 20 16 A 4 GLY H A 5 ASP H 1.0 . 3.20 21 17 A 5 ASP H A 4 GLY HAy 1.0 . 3.40 22 18 A 4 GLY HAy A 6 VAL HGy% 1.0 . 6.00 23 19 A 4 GLY HAy A 17 LYS HBx 1.0 . 6.00 24 19 A 4 GLY HAy A 17 LYS HBy 1.0 . 6.00 25 20 A 4 GLY HAy A 17 LYS HGx 1.0 . 6.00 26 20 A 4 GLY HAy A 17 LYS HGy 1.0 . 6.00 27 21 A 4 GLY HAy A 17 LYS HEx 1.0 . 6.00 28 21 A 4 GLY HAy A 17 LYS HEy 1.0 . 6.00 29 22 A 4 GLY HAx A 17 LYS HEx 1.0 . 6.00 30 22 A 17 LYS HEy A 4 GLY HAx 1.0 . 6.00 31 23 A 5 ASP HBx A 5 ASP H 1.0 . 2.80 32 24 A 5 ASP H A 5 ASP HBy 1.0 . 3.50 33 25 A 5 ASP H A 18 VAL H 1.0 . 3.40 34 26 A 18 VAL HB A 5 ASP H 1.0 . 3.70 35 27 A 18 VAL HGx% A 5 ASP H 1.0 . 6.00 36 28 A 5 ASP H A 18 VAL HGy% 1.0 . 6.00 37 29 A 5 ASP HA A 6 VAL H 1.0 . 3.20 38 30 A 5 ASP HBx A 6 VAL H 1.0 . 4.10 39 31 A 5 ASP HBx A 7 TYR HEy 1.0 . 3.90 40 32 A 5 ASP HBx A 7 TYR HDy 1.0 . 4.90 41 33 A 5 ASP HBx A 18 VAL HGy% 1.0 . 4.60 42 34 A 5 ASP HBy A 6 VAL H 1.0 . 3.50 43 35 A 7 TYR HEy A 5 ASP HBy 1.0 . 3.80 44 36 A 7 TYR HDy A 5 ASP HBy 1.0 . 4.90 45 37 A 5 ASP O A 18 VAL N 1.0 . 3.00 46 38 A 18 VAL H A 5 ASP O 1.0 . 2.00 47 39 A 6 VAL H A 6 VAL HB 1.0 . 2.40 48 40 A 6 VAL H A 7 TYR HA 1.0 . 5.00 49 41 A 7 TYR HEy A 6 VAL H 1.0 . 5.00 50 42 A 7 TYR HDy A 6 VAL H 1.0 . 5.00 51 43 A 6 VAL HA A 7 TYR H 1.0 . 2.80 52 44 A 6 VAL HA A 17 LYS HA 1.0 . 2.40 53 45 A 6 VAL HA A 17 LYS HGx 1.0 . 6.00 54 45 A 17 LYS HGy A 6 VAL HA 1.0 . 6.00 55 46 A 7 TYR HDy A 6 VAL HB 1.0 . 5.00 56 47 A 7 TYR H A 6 VAL HGx% 1.0 . 3.40 57 48 A 17 LYS HA A 6 VAL HGx% 1.0 . 5.20 58 49 A 6 VAL HGx% A 36 GLN HGx 1.0 . 6.00 59 50 A 6 VAL HGx% A 36 GLN HGy 1.0 . 3.40 60 51 A 6 VAL HGx% A 36 GLN HE2y 1.0 . 6.00 61 52 A 6 VAL HGy% A 17 LYS HA 1.0 . 3.40 62 53 A 6 VAL HGy% A 17 LYS HEx 1.0 . 7.00 63 53 A 6 VAL HGy% A 17 LYS HEy 1.0 . 7.00 64 54 A 6 VAL O A 36 GLN N 1.0 . 3.00 65 55 A 6 VAL O A 36 GLN H 1.0 . 2.00 66 56 A 7 TYR N A 16 VAL O 1.0 . 3.00 67 57 A 7 TYR H A 7 TYR HBx 1.0 . 2.50 68 58 A 7 TYR H A 7 TYR HBy 1.0 . 3.30 69 59 A 7 TYR HDy A 7 TYR H 1.0 . 5.00 70 60 A 7 TYR H A 15 VAL HGy% 1.0 . 7.40 71 60 A 7 TYR H A 15 VAL HGx% 1.0 . 7.40 72 61 A 7 TYR H A 16 VAL H 1.0 . 2.80 73 62 A 7 TYR H A 16 VAL O 1.0 . 2.00 74 63 A 7 TYR H A 17 LYS HA 1.0 . 3.20 75 64 A 7 TYR H A 17 LYS HBx 1.0 . 6.00 76 64 A 17 LYS HBy A 7 TYR H 1.0 . 6.00 77 65 A 7 TYR HA A 8 LYS H 1.0 . 3.30 78 66 A 7 TYR HA A 8 LYS HBx 1.0 . 5.40 79 66 A 7 TYR HA A 8 LYS HBy 1.0 . 5.40 80 67 A 7 TYR HA A 35 LYS HA 1.0 . 2.40 81 68 A 7 TYR HA A 35 LYS HGx 1.0 . 6.00 82 68 A 7 TYR HA A 35 LYS HGy 1.0 . 6.00 83 69 A 7 TYR HA A 36 GLN HGx 1.0 . 4.60 84 70 A 7 TYR HEy A 7 TYR HBx 1.0 . 5.00 85 71 A 7 TYR HDy A 7 TYR HBx 1.0 . 3.60 86 72 A 7 TYR HBx A 8 LYS H 1.0 . 4.70 87 73 A 26 LEU HDx% A 7 TYR HBx 1.0 . 5.60 88 74 A 7 TYR HBy A 7 TYR HDx 1.0 . 3.50 89 75 A 7 TYR HBy A 8 LYS H 1.0 . 4.10 90 76 A 7 TYR HBy A 16 VAL HGy% 1.0 . 4.80 91 77 A 26 LEU HDx% A 7 TYR HBy 1.0 . 6.00 92 78 A 7 TYR HBy A 33 MET HBx 1.0 . 3.50 93 79 A 7 TYR HBy A 33 MET HE% 1.0 . 6.00 94 80 A 8 LYS H A 7 TYR HDx 1.0 . 4.60 95 81 A 7 TYR HDx A 26 LEU HG 1.0 . 5.00 96 82 A 7 TYR HDx A 33 MET HBx 1.0 . 4.00 97 83 A 7 TYR HDx A 33 MET HE% 1.0 . 5.40 98 84 A 7 TYR HDx A 34 VAL H 1.0 . 5.00 99 85 A 7 TYR HDx A 34 VAL HA 1.0 . 5.00 100 86 A 7 TYR HEx A 35 LYS H 1.0 . 4.30 101 87 A 7 TYR HEx A 35 LYS HBx 1.0 . 6.00 102 87 A 7 TYR HEx A 35 LYS HBy 1.0 . 6.00 103 88 A 7 TYR HEx A 35 LYS HGx 1.0 . 5.00 104 88 A 35 LYS HGy A 7 TYR HEx 1.0 . 5.00 105 89 A 7 TYR HEy A 26 LEU HDx% 1.0 . 6.00 106 90 A 7 TYR HEy A 35 LYS HA 1.0 . 5.00 107 91 A 7 TYR HEy A 35 LYS HEx 1.0 . 6.00 108 91 A 7 TYR HEy A 35 LYS HEy 1.0 . 6.00 109 92 A 7 TYR HDy A 16 VAL HGy% 1.0 . 6.00 110 93 A 7 TYR HDy A 18 VAL HGy% 1.0 . 4.20 111 94 A 7 TYR HDy A 26 LEU HDx% 1.0 . 5.70 112 95 A 7 TYR HDy A 35 LYS HA 1.0 . 5.00 113 96 A 7 TYR HDy A 35 LYS HGx 1.0 . 6.00 114 96 A 7 TYR HDy A 35 LYS HGy 1.0 . 6.00 115 97 A 7 TYR O A 16 VAL N 1.0 . 3.00 116 98 A 16 VAL H A 7 TYR O 1.0 . 2.00 117 99 A 8 LYS N A 34 VAL O 1.0 . 3.00 118 100 A 8 LYS H A 9 CYS H 1.0 . 4.80 119 101 A 8 LYS H A 34 VAL O 1.0 . 2.00 120 102 A 36 GLN HGx A 8 LYS H 1.0 . 5.00 121 103 A 8 LYS HA A 8 LYS HDx 1.0 . 5.60 122 103 A 8 LYS HA A 8 LYS HDy 1.0 . 5.60 123 104 A 9 CYS H A 8 LYS HA 1.0 . 3.00 124 105 A 8 LYS HA A 15 VAL HA 1.0 . 2.40 125 106 A 16 VAL H A 8 LYS HA 1.0 . 4.50 126 107 A 33 MET HBx A 8 LYS HA 1.0 . 5.00 127 108 A 8 LYS HBy A 8 LYS HEx 1.0 . 7.00 128 108 A 8 LYS HBx A 8 LYS HEx 1.0 . 7.00 129 108 A 8 LYS HEy A 8 LYS HBx 1.0 . 7.00 130 108 A 8 LYS HBy A 8 LYS HEy 1.0 . 7.00 131 109 A 9 CYS H A 8 LYS HBx 1.0 . 4.40 132 109 A 8 LYS HBy A 9 CYS H 1.0 . 4.40 133 110 A 15 VAL HA A 8 LYS HBx 1.0 . 6.00 134 110 A 8 LYS HBy A 15 VAL HA 1.0 . 6.00 135 111 A 8 LYS HBx A 15 VAL HGy% 1.0 . 6.10 136 111 A 8 LYS HBy A 15 VAL HGy% 1.0 . 6.10 137 111 A 15 VAL HGx% A 8 LYS HBx 1.0 . 6.10 138 111 A 15 VAL HGx% A 8 LYS HBy 1.0 . 6.10 139 112 A 16 VAL H A 8 LYS HBx 1.0 . 6.00 140 112 A 16 VAL H A 8 LYS HBy 1.0 . 6.00 141 113 A 36 GLN HE2x A 8 LYS HBx 1.0 . 6.00 142 113 A 8 LYS HBy A 36 GLN HE2x 1.0 . 6.00 143 114 A 36 GLN HE2y A 8 LYS HBx 1.0 . 6.00 144 114 A 36 GLN HE2y A 8 LYS HBy 1.0 . 6.00 145 115 A 9 CYS H A 8 LYS HDx 1.0 . 6.00 146 115 A 9 CYS H A 8 LYS HDy 1.0 . 6.00 147 116 A 15 VAL HA A 8 LYS HDx 1.0 . 6.00 148 116 A 8 LYS HDy A 15 VAL HA 1.0 . 6.00 149 117 A 36 GLN HGy A 8 LYS HDx 1.0 . 5.90 150 117 A 36 GLN HGy A 8 LYS HDy 1.0 . 5.90 151 118 A 36 GLN HE2x A 8 LYS HDx 1.0 . 6.00 152 118 A 8 LYS HDy A 36 GLN HE2x 1.0 . 6.00 153 119 A 9 CYS H A 8 LYS HEx 1.0 . 6.00 154 119 A 9 CYS H A 8 LYS HEy 1.0 . 6.00 155 120 A 9 CYS HBy A 8 LYS HEx 1.0 . 6.00 156 120 A 8 LYS HEy A 9 CYS HBy 1.0 . 6.00 157 121 A 10 GLU HA A 8 LYS HEx 1.0 . 6.00 158 121 A 8 LYS HEy A 10 GLU HA 1.0 . 6.00 159 122 A 13 GLY HAx A 8 LYS HEx 1.0 . 6.00 160 122 A 8 LYS HEy A 13 GLY HAx 1.0 . 6.00 161 123 A 8 LYS HEx A 15 VAL HGy% 1.0 . 8.40 162 123 A 8 LYS HEy A 15 VAL HGy% 1.0 . 8.40 163 123 A 15 VAL HGx% A 8 LYS HEx 1.0 . 8.40 164 123 A 15 VAL HGx% A 8 LYS HEy 1.0 . 8.40 165 124 A 36 GLN HE2y A 8 LYS HEx 1.0 . 6.00 166 124 A 36 GLN HE2y A 8 LYS HEy 1.0 . 6.00 167 125 A 8 LYS O A 34 VAL N 1.0 . 3.00 168 126 A 34 VAL H A 8 LYS O 1.0 . 2.00 169 127 A 9 CYS N A 14 GLN O 1.0 . 3.00 170 128 A 9 CYS H A 9 CYS HBx 1.0 . 3.30 171 129 A 9 CYS H A 9 CYS HBy 1.0 . 3.20 172 130 A 9 CYS H A 14 GLN H 1.0 . 3.80 173 131 A 9 CYS H A 14 GLN O 1.0 . 2.00 174 132 A 9 CYS HBx A 9 CYS HA 1.0 . 2.90 175 133 A 9 CYS HBx A 13 GLY H 1.0 . 3.90 176 134 A 9 CYS HBx A 33 MET HGx 1.0 . 3.50 177 134 A 9 CYS HBx A 33 MET HGy 1.0 . 3.50 178 135 A 9 CYS HBy A 13 GLY H 1.0 . 3.30 179 136 A 9 CYS HBy A 14 GLN H 1.0 . 4.40 180 137 A 9 CYS HBy A 33 MET HGx 1.0 . 6.00 181 137 A 9 CYS HBy A 33 MET HGy 1.0 . 6.00 182 138 A 9 CYS SG A 12 CYS N 1.0 . 3.80 183 139 A 9 CYS SG A 12 CYS H 1.0 . 2.90 184 140 A 9 CYS SG A 12 CYS SG 1.0 . 3.78 185 141 A 9 CYS SG A 28 CYS SG 1.0 . 3.76 186 142 A 9 CYS SG A 29 CYS SG 1.0 . 3.79 187 143 A 10 GLU H A 10 GLU HBx 1.0 . 3.60 188 143 A 10 GLU H A 10 GLU HBy 1.0 . 3.60 189 144 A 10 GLU H A 10 GLU HGx 1.0 . 3.70 190 145 A 10 GLU H A 10 GLU HGy 1.0 . 4.20 191 146 A 10 GLU H A 11 LEU H 1.0 . 3.10 192 147 A 10 GLU H A 34 VAL HGy% 1.0 . 6.00 193 148 A 10 GLU HA A 10 GLU HGx 1.0 . 2.90 194 149 A 10 GLU HGx A 11 LEU H 1.0 . 5.00 195 150 A 10 GLU HGx A 34 VAL HGx% 1.0 . 4.60 196 151 A 10 GLU HGx A 34 VAL HGy% 1.0 . 5.70 197 152 A 10 GLU HGy A 34 VAL HGy% 1.0 . 4.60 198 153 A 11 LEU H A 11 LEU HBx 1.0 . 3.80 199 153 A 11 LEU H A 11 LEU HBy 1.0 . 3.80 200 154 A 11 LEU H A 11 LEU HG 1.0 . 3.90 201 155 A 11 LEU H A 11 LEU HDx% 1.0 . 8.40 202 155 A 11 LEU H A 11 LEU HDy% 1.0 . 8.40 203 156 A 12 CYS H A 11 LEU H 1.0 . 2.80 204 157 A 13 GLY H A 11 LEU H 1.0 . 3.90 205 158 A 11 LEU HG A 11 LEU HA 1.0 . 3.30 206 159 A 12 CYS H A 11 LEU HBx 1.0 . 4.60 207 159 A 12 CYS H A 11 LEU HBy 1.0 . 4.60 208 160 A 13 GLY H A 11 LEU HBx 1.0 . 4.80 209 160 A 13 GLY H A 11 LEU HBy 1.0 . 4.80 210 161 A 11 LEU HBx A 29 CYS HBx 1.0 . 6.90 211 161 A 11 LEU HBy A 29 CYS HBx 1.0 . 6.90 212 161 A 29 CYS HBy A 11 LEU HBx 1.0 . 6.90 213 161 A 11 LEU HBy A 29 CYS HBy 1.0 . 6.90 214 162 A 12 CYS H A 11 LEU HG 1.0 . 4.40 215 163 A 11 LEU HG A 29 CYS HBx 1.0 . 5.60 216 163 A 11 LEU HG A 29 CYS HBy 1.0 . 5.60 217 164 A 29 CYS HA A 11 LEU HDx% 1.0 . 7.40 218 164 A 11 LEU HDy% A 29 CYS HA 1.0 . 7.40 219 165 A 11 LEU HDy% A 29 CYS HBx 1.0 . 8.40 220 165 A 11 LEU HDx% A 29 CYS HBx 1.0 . 8.40 221 165 A 29 CYS HBy A 11 LEU HDx% 1.0 . 8.40 222 165 A 11 LEU HDy% A 29 CYS HBy 1.0 . 8.40 223 166 A 12 CYS H A 12 CYS HBx 1.0 . 4.00 224 167 A 13 GLY H A 12 CYS H 1.0 . 2.70 225 168 A 14 GLN H A 12 CYS H 1.0 . 4.20 226 169 A 12 CYS HBx A 12 CYS HA 1.0 . 2.70 227 170 A 12 CYS HA A 12 CYS HBy 1.0 . 2.70 228 171 A 12 CYS HBx B 23 GLY H 1.0 . 5.00 229 172 A 12 CYS HBx B 24 GLY H 1.0 . 5.00 230 173 A 12 CYS HBy B 23 GLY H 1.0 . 4.30 231 174 A 12 CYS HBy B 24 GLY H 1.0 . 5.00 232 175 A 12 CYS SG A 14 GLN N 1.0 . 3.80 233 176 A 14 GLN H A 12 CYS SG 1.0 . 2.90 234 177 A 12 CYS SG A 28 CYS SG 1.0 . 3.60 235 178 A 12 CYS SG A 29 CYS SG 1.0 . 3.70 236 179 A 14 GLN H A 13 GLY H 1.0 . 2.90 237 180 A 14 GLN H A 14 GLN HA 1.0 . 2.70 238 181 A 14 GLN H A 14 GLN HBy 1.0 . 2.90 239 182 A 14 GLN H A 14 GLN HBx 1.0 . 2.40 240 183 A 14 GLN H A 14 GLN HE2x 1.0 . 5.00 241 184 A 14 GLN HBy A 14 GLN HE2x 1.0 . 5.00 242 185 A 14 GLN HBy A 14 GLN HE2y 1.0 . 5.00 243 186 A 14 GLN HBx A 14 GLN HE2x 1.0 . 3.70 244 187 A 14 GLN HBx A 14 GLN HE2y 1.0 . 4.10 245 188 A 15 VAL H A 14 GLN HGx 1.0 . 6.00 246 188 A 14 GLN HGy A 15 VAL H 1.0 . 6.00 247 189 B 22 GLY HAx A 14 GLN HGx 1.0 . 6.00 248 189 A 14 GLN HGy B 22 GLY HAx 1.0 . 6.00 249 190 A 14 GLN HE2x A 33 MET HGx 1.0 . 6.00 250 190 A 33 MET HGy A 14 GLN HE2x 1.0 . 6.00 251 191 B 24 GLY H A 14 GLN HE2x 1.0 . 5.00 252 192 A 14 GLN HE2x B 26 LEU HBx 1.0 . 6.00 253 192 A 14 GLN HE2x B 26 LEU HBy 1.0 . 6.00 254 193 A 14 GLN HE2x B 26 LEU HD11 1.0 . 6.00 255 194 A 14 GLN HE2x B 26 LEU HD21 1.0 . 6.00 256 195 A 14 GLN HE2y B 1 ALA HB1 1.0 . 6.00 257 196 A 14 GLN HE2y B 26 LEU HBx 1.0 . 6.00 258 196 A 14 GLN HE2y B 26 LEU HBy 1.0 . 6.00 259 197 A 14 GLN HE2y B 26 LEU HD11 1.0 . 6.00 260 198 A 14 GLN HE2y B 26 LEU HD21 1.0 . 6.00 261 199 A 15 VAL N B 20 GLU O 1.0 . 3.00 262 200 A 15 VAL H A 15 VAL HB 1.0 . 2.50 263 201 A 16 VAL H A 15 VAL H 1.0 . 4.70 264 202 A 16 VAL HGy% A 15 VAL H 1.0 . 6.00 265 203 A 15 VAL H B 20 GLU H 1.0 . 2.40 266 204 A 15 VAL H B 20 GLU O 1.0 . 2.00 267 205 A 15 VAL HGx% A 15 VAL HA 1.0 . 3.40 268 206 A 16 VAL H A 15 VAL HA 1.0 . 2.80 269 207 A 15 VAL HB B 20 GLU H 1.0 . 3.10 270 208 A 16 VAL HA A 15 VAL HGy% 1.0 . 7.40 271 208 A 15 VAL HGx% A 16 VAL HA 1.0 . 7.40 272 209 B 20 GLU H A 15 VAL HGy% 1.0 . 7.40 273 209 A 15 VAL HGx% B 20 GLU H 1.0 . 7.40 274 210 A 15 VAL O B 19 LEU N 1.0 . 3.00 275 211 A 15 VAL O B 19 LEU H 1.0 . 2.00 276 212 A 15 VAL O B 20 GLU N 1.0 . 3.00 277 213 B 20 GLU H A 15 VAL O 1.0 . 2.00 278 214 A 16 VAL HA A 16 VAL HB 1.0 . 2.40 279 215 A 16 VAL HA A 17 LYS H 1.0 . 2.40 280 216 A 16 VAL HA A 17 LYS HBx 1.0 . 4.50 281 216 A 17 LYS HBy A 16 VAL HA 1.0 . 4.50 282 217 A 16 VAL HA B 18 VAL HA 1.0 . 2.70 283 218 A 16 VAL HA B 19 LEU H 1.0 . 2.40 284 219 A 16 VAL HB A 17 LYS H 1.0 . 2.40 285 220 A 26 LEU HDx% A 16 VAL HB 1.0 . 6.00 286 221 A 26 LEU HDx% A 16 VAL HGy% 1.0 . 4.40 287 222 A 17 LYS N B 17 LYS O 1.0 . 3.00 288 223 A 17 LYS H A 17 LYS HBx 1.0 . 3.10 289 223 A 17 LYS HBy A 17 LYS H 1.0 . 3.10 290 224 A 17 LYS H A 17 LYS HDx 1.0 . 5.50 291 224 A 17 LYS H A 17 LYS HDy 1.0 . 5.50 292 225 A 17 LYS H B 17 LYS O 1.0 . 2.00 293 226 A 17 LYS HA A 17 LYS HDx 1.0 . 6.00 294 226 A 17 LYS HA A 17 LYS HDy 1.0 . 6.00 295 227 A 18 VAL H A 17 LYS HA 1.0 . 2.40 296 228 A 17 LYS HBx A 17 LYS HEx 1.0 . 6.90 297 228 A 17 LYS HBy A 17 LYS HEx 1.0 . 6.90 298 228 A 17 LYS HEy A 17 LYS HBx 1.0 . 6.90 299 228 A 17 LYS HBy A 17 LYS HEy 1.0 . 6.90 300 229 A 18 VAL H A 17 LYS HGx 1.0 . 5.20 301 229 A 17 LYS HGy A 18 VAL H 1.0 . 5.20 302 230 A 19 LEU HA A 17 LYS HDx 1.0 . 4.50 303 230 A 17 LYS HDy A 19 LEU HA 1.0 . 4.50 304 231 A 17 LYS O B 17 LYS N 1.0 . 3.00 305 232 A 17 LYS O B 17 LYS H 1.0 . 2.00 306 233 A 18 VAL HB A 18 VAL H 1.0 . 2.60 307 234 A 18 VAL H A 18 VAL HGy% 1.0 . 4.00 308 235 A 18 VAL H A 19 LEU H 1.0 . 3.70 309 236 A 19 LEU H A 18 VAL HA 1.0 . 2.60 310 237 A 18 VAL HA A 20 GLU H 1.0 . 3.40 311 238 A 18 VAL HA B 16 VAL HA 1.0 . 2.70 312 239 A 18 VAL HGx% A 19 LEU H 1.0 . 4.50 313 240 A 18 VAL HGx% A 20 GLU H 1.0 . 4.60 314 241 A 18 VAL HGx% A 20 GLU HA 1.0 . 6.00 315 242 A 21 GLU HA A 18 VAL HGx% 1.0 . 5.90 316 243 A 18 VAL HGx% A 22 GLY H 1.0 . 6.00 317 244 A 26 LEU HDx% A 18 VAL HGy% 1.0 . 4.40 318 245 A 19 LEU N B 15 VAL O 1.0 . 3.00 319 246 A 19 LEU H A 19 LEU HDy% 1.0 . 8.40 320 246 A 19 LEU H A 19 LEU HDx% 1.0 . 8.40 321 247 A 19 LEU H A 20 GLU H 1.0 . 2.70 322 248 A 19 LEU H B 15 VAL O 1.0 . 2.00 323 249 A 19 LEU HA A 19 LEU HDx% 1.0 . 4.10 324 250 A 20 GLU H A 19 LEU HBx 1.0 . 4.70 325 250 A 20 GLU H A 19 LEU HBy 1.0 . 4.70 326 251 B 15 VAL O A 20 GLU N 1.0 . 3.00 327 252 A 20 GLU H A 20 GLU HGx 1.0 . 4.00 328 253 A 20 GLU H A 21 GLU H 1.0 . 5.00 329 254 A 20 GLU H B 15 VAL H 1.0 . 2.40 330 255 A 20 GLU H B 15 VAL HB 1.0 . 3.10 331 256 A 20 GLU H B 15 VAL HG21 1.0 . 7.40 332 256 A 20 GLU H B 15 VAL HG11 1.0 . 7.40 333 257 A 20 GLU H B 15 VAL O 1.0 . 2.00 334 258 A 20 GLU HA A 20 GLU HGy 1.0 . 4.10 335 259 A 20 GLU HA A 20 GLU HGx 1.0 . 3.90 336 260 A 20 GLU HA A 21 GLU H 1.0 . 3.30 337 261 A 20 GLU O B 15 VAL N 1.0 . 3.00 338 262 B 15 VAL H A 20 GLU O 1.0 . 2.00 339 263 A 21 GLU H A 21 GLU HBx 1.0 . 3.50 340 263 A 21 GLU H A 21 GLU HBy 1.0 . 3.50 341 264 A 22 GLY H A 21 GLU H 1.0 . 5.00 342 265 A 21 GLU HA A 22 GLY H 1.0 . 2.40 343 266 A 22 GLY H A 21 GLU HBx 1.0 . 4.20 344 266 A 22 GLY H A 21 GLU HBy 1.0 . 4.20 345 267 A 22 GLY H A 21 GLU HGx 1.0 . 5.90 346 267 A 22 GLY H A 21 GLU HGy 1.0 . 5.90 347 268 A 22 GLY HAy B 14 GLN HGx 1.0 . 6.00 348 268 A 22 GLY HAy B 14 GLN HGy 1.0 . 6.00 349 269 A 23 GLY H A 24 GLY H 1.0 . 3.90 350 270 A 23 GLY H B 12 CYS HBx 1.0 . 5.00 351 271 A 23 GLY H B 12 CYS HBy 1.0 . 4.30 352 272 A 24 GLY H A 25 THR H 1.0 . 5.00 353 273 A 24 GLY H B 12 CYS HBx 1.0 . 5.00 354 274 A 24 GLY H B 12 CYS HBy 1.0 . 5.00 355 275 A 24 GLY H B 14 GLN HE2x 1.0 . 5.00 356 276 A 25 THR H A 25 THR HB 1.0 . 2.60 357 277 A 25 THR H A 26 LEU H 1.0 . 5.00 358 278 A 25 THR H B 29 CYS H 1.0 . 3.50 359 279 A 26 LEU H A 25 THR HA 1.0 . 2.40 360 280 A 25 THR HA A 26 LEU HBx 1.0 . 6.00 361 280 A 25 THR HA A 26 LEU HBy 1.0 . 6.00 362 281 A 25 THR HB A 26 LEU H 1.0 . 4.30 363 282 A 25 THR HB A 27 VAL HGy% 1.0 . 6.00 364 283 A 27 VAL HGy% A 25 THR HG2% 1.0 . 4.40 365 284 A 26 LEU H A 26 LEU HBx 1.0 . 3.60 366 284 A 26 LEU H A 26 LEU HBy 1.0 . 3.60 367 285 A 26 LEU HG A 26 LEU H 1.0 . 3.00 368 286 A 26 LEU HDx% A 26 LEU H 1.0 . 6.00 369 287 A 26 LEU H A 26 LEU HDy% 1.0 . 6.00 370 288 A 26 LEU H A 27 VAL H 1.0 . 5.00 371 289 A 26 LEU HG A 26 LEU HA 1.0 . 3.20 372 290 A 26 LEU HDx% A 26 LEU HA 1.0 . 6.00 373 291 A 26 LEU HDy% A 26 LEU HA 1.0 . 4.30 374 292 A 27 VAL H A 26 LEU HA 1.0 . 2.40 375 293 B 14 GLN HE2x A 26 LEU HBx 1.0 . 6.00 376 293 B 14 GLN HE2x A 26 LEU HBy 1.0 . 6.00 377 294 B 14 GLN HE2y A 26 LEU HBx 1.0 . 6.00 378 294 B 14 GLN HE2y A 26 LEU HBy 1.0 . 6.00 379 295 A 26 LEU HDx% A 33 MET HBx 1.0 . 6.00 380 296 A 26 LEU HDx% A 33 MET HGx 1.0 . 7.00 381 296 A 26 LEU HDx% A 33 MET HGy 1.0 . 7.00 382 297 A 26 LEU HDx% A 33 MET HE% 1.0 . 7.00 383 298 A 26 LEU HDx% B 14 GLN HE2x 1.0 . 6.00 384 299 A 26 LEU HDx% B 14 GLN HE2y 1.0 . 6.00 385 300 B 14 GLN HE2x A 26 LEU HDy% 1.0 . 6.00 386 301 B 14 GLN HE2y A 26 LEU HDy% 1.0 . 6.00 387 302 A 26 LEU O A 33 MET N 1.0 . 3.00 388 303 A 26 LEU O A 33 MET H 1.0 . 2.00 389 304 A 27 VAL N B 27 VAL O 1.0 . 3.00 390 305 A 27 VAL H A 27 VAL HB 1.0 . 2.40 391 306 A 27 VAL H A 28 CYS H 1.0 . 5.00 392 307 A 27 VAL H B 27 VAL O 1.0 . 2.00 393 308 A 28 CYS H A 27 VAL HA 1.0 . 3.00 394 309 A 33 MET H A 27 VAL HA 1.0 . 2.70 395 310 A 27 VAL HA A 33 MET HBy 1.0 . 5.00 396 311 A 27 VAL HB A 28 CYS H 1.0 . 4.00 397 312 A 28 CYS H A 27 VAL HGx% 1.0 . 3.80 398 313 A 27 VAL HGx% A 29 CYS H 1.0 . 6.00 399 314 A 29 CYS HA A 27 VAL HGx% 1.0 . 6.00 400 315 A 27 VAL HGx% A 30 GLY H 1.0 . 4.80 401 316 A 27 VAL HGx% A 30 GLY HAx 1.0 . 3.90 402 317 A 27 VAL HGx% A 31 GLU H 1.0 . 4.40 403 318 A 27 VAL HGx% A 31 GLU HA 1.0 . 6.00 404 319 A 33 MET H A 27 VAL HGx% 1.0 . 6.00 405 320 A 27 VAL HGy% A 28 CYS H 1.0 . 6.00 406 321 A 27 VAL HGy% A 32 ASP H 1.0 . 6.00 407 322 A 27 VAL HGy% A 33 MET H 1.0 . 6.00 408 323 A 27 VAL O B 27 VAL N 1.0 . 3.00 409 324 A 27 VAL O B 27 VAL H 1.0 . 2.00 410 325 A 28 CYS N A 31 GLU O 1.0 . 3.00 411 326 A 28 CYS H A 28 CYS HBx 1.0 . 4.10 412 327 A 28 CYS H A 31 GLU H 1.0 . 3.30 413 328 A 28 CYS H A 31 GLU O 1.0 . 2.00 414 329 A 28 CYS H A 33 MET HBy 1.0 . 4.90 415 330 A 28 CYS HBx A 28 CYS HA 1.0 . 2.70 416 331 A 28 CYS HA A 28 CYS HBy 1.0 . 2.60 417 332 A 33 MET HBy A 28 CYS HBx 1.0 . 4.60 418 333 A 28 CYS HBx A 33 MET HGx 1.0 . 6.00 419 333 A 33 MET HGy A 28 CYS HBx 1.0 . 6.00 420 334 A 28 CYS SG A 29 CYS SG 1.0 . 4.04 421 335 A 28 CYS O A 31 GLU N 1.0 . 3.00 422 336 A 31 GLU H A 28 CYS O 1.0 . 2.00 423 337 A 29 CYS HA A 29 CYS H 1.0 . 2.50 424 338 A 29 CYS H A 30 GLY H 1.0 . 3.50 425 339 A 29 CYS H B 25 THR H 1.0 . 3.50 426 340 A 29 CYS HA A 30 GLY H 1.0 . 3.10 427 341 A 30 GLY H A 30 GLY HAx 1.0 . 2.90 428 342 A 30 GLY H A 31 GLU H 1.0 . 3.70 429 343 A 31 GLU H A 31 GLU HGy 1.0 . 4.20 430 344 A 31 GLU H A 31 GLU HGx 1.0 . 5.00 431 345 A 31 GLU H A 32 ASP H 1.0 . 4.60 432 346 A 31 GLU HA A 31 GLU HGy 1.0 . 3.80 433 347 A 32 ASP H A 31 GLU HGy 1.0 . 3.80 434 348 A 32 ASP H A 31 GLU HGx 1.0 . 5.00 435 349 A 32 ASP H A 32 ASP HBx 1.0 . 3.60 436 349 A 32 ASP H A 32 ASP HBy 1.0 . 3.60 437 350 A 34 VAL HGy% A 32 ASP H 1.0 . 6.00 438 351 A 33 MET H A 32 ASP HA 1.0 . 3.30 439 352 A 33 MET H A 33 MET HBy 1.0 . 3.10 440 353 A 33 MET HBx A 33 MET H 1.0 . 3.70 441 354 A 33 MET HE% A 33 MET H 1.0 . 6.00 442 355 A 34 VAL H A 33 MET H 1.0 . 5.00 443 356 A 34 VAL HGy% A 33 MET H 1.0 . 6.00 444 357 A 33 MET HBy A 33 MET HA 1.0 . 2.60 445 358 A 33 MET HBx A 33 MET HA 1.0 . 2.60 446 359 A 34 VAL HGy% A 33 MET HGx 1.0 . 7.00 447 359 A 33 MET HGy A 34 VAL HGy% 1.0 . 7.00 448 360 A 34 VAL H A 34 VAL HB 1.0 . 2.50 449 361 A 34 VAL H A 34 VAL HGy% 1.0 . 4.30 450 362 A 34 VAL HA A 35 LYS H 1.0 . 2.40 451 363 A 35 LYS H A 34 VAL HB 1.0 . 3.40 452 364 A 36 GLN HE2x A 34 VAL HB 1.0 . 4.30 453 365 A 35 LYS H A 34 VAL HGx% 1.0 . 4.40 454 366 A 36 GLN HE2x A 34 VAL HGx% 1.0 . 6.00 455 367 A 36 GLN HE2y A 34 VAL HGx% 1.0 . 5.30 456 368 A 35 LYS H A 34 VAL HGy% 1.0 . 4.70 457 369 A 36 GLN HE2x A 34 VAL HGy% 1.0 . 6.00 458 370 A 36 GLN HE2y A 34 VAL HGy% 1.0 . 6.00 459 371 A 35 LYS H A 35 LYS HBx 1.0 . 3.60 460 371 A 35 LYS H A 35 LYS HBy 1.0 . 3.60 461 372 A 35 LYS H A 35 LYS HGx 1.0 . 4.70 462 372 A 35 LYS HGy A 35 LYS H 1.0 . 4.70 463 373 A 35 LYS H A 36 GLN HE2x 1.0 . 5.00 464 374 A 35 LYS HA A 35 LYS HDy 1.0 . 3.80 465 375 A 36 GLN H A 35 LYS HA 1.0 . 2.40 466 376 A 36 GLN HGx A 35 LYS HA 1.0 . 5.00 467 377 A 35 LYS HBy A 35 LYS HEx 1.0 . 7.00 468 377 A 35 LYS HBx A 35 LYS HEx 1.0 . 7.00 469 377 A 35 LYS HEy A 35 LYS HBx 1.0 . 7.00 470 377 A 35 LYS HBy A 35 LYS HEy 1.0 . 7.00 471 378 A 36 GLN H A 35 LYS HGx 1.0 . 5.30 472 378 A 36 GLN H A 35 LYS HGy 1.0 . 5.30 473 379 A 36 GLN H A 35 LYS HEx 1.0 . 6.00 474 379 A 36 GLN H A 35 LYS HEy 1.0 . 6.00 475 380 A 36 GLN H A 36 GLN HBx 1.0 . 3.30 476 380 A 36 GLN H A 36 GLN HBy 1.0 . 3.30 477 381 A 36 GLN HGx A 36 GLN H 1.0 . 3.30 478 382 A 36 GLN HGy A 36 GLN H 1.0 . 3.10 479 383 A 36 GLN H A 36 GLN HE2x 1.0 . 5.00 480 384 A 36 GLN HE2y A 36 GLN H 1.0 . 5.00 481 385 A 36 GLN HE2y A 36 GLN HA 1.0 . 5.00 482 386 A 36 GLN HGx A 36 GLN HE2y 1.0 . 3.70 483 387 A 36 GLN HGy A 36 GLN HE2y 1.0 . 4.00 484 388 B 1 ALA HB1 B 5 ASP HBx 1.0 . 6.00 485 389 B 1 ALA HB1 B 7 TYR HEy 1.0 . 3.40 486 390 B 1 ALA HB1 B 7 TYR HDy 1.0 . 6.00 487 391 B 1 ALA HB1 B 21 GLU HA 1.0 . 6.00 488 392 B 26 LEU HD11 B 1 ALA HB1 1.0 . 7.00 489 393 B 2 ASN HA B 3 GLU HBx 1.0 . 4.90 490 393 B 2 ASN HA B 3 GLU HBy 1.0 . 4.90 491 394 B 3 GLU H B 2 ASN HBx 1.0 . 4.50 492 394 B 2 ASN HBy B 3 GLU H 1.0 . 4.50 493 395 B 3 GLU H B 3 GLU HBx 1.0 . 3.00 494 395 B 3 GLU HBy B 3 GLU H 1.0 . 3.00 495 396 B 3 GLU H B 3 GLU HGy 1.0 . 4.50 496 397 B 3 GLU HGy B 3 GLU HA 1.0 . 4.00 497 398 B 3 GLU HA B 4 GLY H 1.0 . 2.50 498 399 B 3 GLU HA B 18 VAL HB 1.0 . 4.10 499 400 B 3 GLU HA B 18 VAL HG11 1.0 . 3.50 500 401 B 4 GLY H B 3 GLU HBx 1.0 . 4.40 501 401 B 3 GLU HBy B 4 GLY H 1.0 . 4.40 502 402 B 4 GLY H B 5 ASP H 1.0 . 3.20 503 403 B 5 ASP H B 4 GLY HAx 1.0 . 3.40 504 404 B 4 GLY HAx B 6 VAL HG21 1.0 . 6.00 505 405 B 4 GLY HAx B 17 LYS HBx 1.0 . 6.00 506 405 B 4 GLY HAx B 17 LYS HBy 1.0 . 6.00 507 406 B 4 GLY HAx B 17 LYS HGx 1.0 . 6.00 508 406 B 4 GLY HAx B 17 LYS HGy 1.0 . 6.00 509 407 B 4 GLY HAx B 17 LYS HEx 1.0 . 6.00 510 407 B 4 GLY HAx B 17 LYS HEy 1.0 . 6.00 511 408 B 4 GLY HAy B 17 LYS HEx 1.0 . 6.00 512 408 B 17 LYS HEy B 4 GLY HAy 1.0 . 6.00 513 409 B 5 ASP HBx B 5 ASP H 1.0 . 2.80 514 410 B 5 ASP H B 5 ASP HBy 1.0 . 3.50 515 411 B 5 ASP H B 18 VAL H 1.0 . 3.40 516 412 B 18 VAL HB B 5 ASP H 1.0 . 3.70 517 413 B 18 VAL HG11 B 5 ASP H 1.0 . 6.00 518 414 B 5 ASP H B 18 VAL HG21 1.0 . 6.00 519 415 B 5 ASP HA B 6 VAL H 1.0 . 3.20 520 416 B 5 ASP HBx B 6 VAL H 1.0 . 4.10 521 417 B 5 ASP HBx B 7 TYR HEy 1.0 . 3.90 522 418 B 5 ASP HBx B 7 TYR HDy 1.0 . 4.90 523 419 B 5 ASP HBx B 18 VAL HG21 1.0 . 4.60 524 420 B 5 ASP HBy B 6 VAL H 1.0 . 3.50 525 421 B 7 TYR HEy B 5 ASP HBy 1.0 . 3.80 526 422 B 7 TYR HDy B 5 ASP HBy 1.0 . 4.90 527 423 B 5 ASP O B 18 VAL N 1.0 . 3.00 528 424 B 18 VAL H B 5 ASP O 1.0 . 2.00 529 425 B 6 VAL H B 6 VAL HB 1.0 . 2.40 530 426 B 6 VAL H B 7 TYR HA 1.0 . 5.00 531 427 B 7 TYR HEy B 6 VAL H 1.0 . 5.00 532 428 B 7 TYR HDy B 6 VAL H 1.0 . 5.00 533 429 B 6 VAL HA B 7 TYR H 1.0 . 2.80 534 430 B 6 VAL HA B 17 LYS HA 1.0 . 2.40 535 431 B 6 VAL HA B 17 LYS HGx 1.0 . 6.00 536 431 B 17 LYS HGy B 6 VAL HA 1.0 . 6.00 537 432 B 7 TYR HDy B 6 VAL HB 1.0 . 5.00 538 433 B 7 TYR H B 6 VAL HG11 1.0 . 3.40 539 434 B 17 LYS HA B 6 VAL HG11 1.0 . 5.20 540 435 B 6 VAL HG11 B 36 GLN HGx 1.0 . 6.00 541 436 B 6 VAL HG11 B 36 GLN HGy 1.0 . 3.40 542 437 B 6 VAL HG11 B 36 GLN HE2y 1.0 . 6.00 543 438 B 6 VAL HG21 B 17 LYS HA 1.0 . 3.40 544 439 B 6 VAL HG21 B 17 LYS HEx 1.0 . 7.00 545 439 B 6 VAL HG21 B 17 LYS HEy 1.0 . 7.00 546 440 B 6 VAL O B 36 GLN N 1.0 . 3.00 547 441 B 6 VAL O B 36 GLN H 1.0 . 2.00 548 442 B 7 TYR N B 16 VAL O 1.0 . 3.00 549 443 B 7 TYR H B 7 TYR HBx 1.0 . 2.50 550 444 B 7 TYR H B 7 TYR HBy 1.0 . 3.30 551 445 B 7 TYR HDy B 7 TYR H 1.0 . 5.00 552 446 B 7 TYR H B 15 VAL HG21 1.0 . 7.40 553 446 B 15 VAL HG11 B 7 TYR H 1.0 . 7.40 554 447 B 7 TYR H B 16 VAL H 1.0 . 2.80 555 448 B 7 TYR H B 16 VAL O 1.0 . 2.00 556 449 B 7 TYR H B 17 LYS HA 1.0 . 3.20 557 450 B 7 TYR H B 17 LYS HBx 1.0 . 6.00 558 450 B 17 LYS HBy B 7 TYR H 1.0 . 6.00 559 451 B 7 TYR HA B 8 LYS H 1.0 . 3.30 560 452 B 7 TYR HA B 8 LYS HBx 1.0 . 5.40 561 452 B 7 TYR HA B 8 LYS HBy 1.0 . 5.40 562 453 B 7 TYR HA B 35 LYS HA 1.0 . 2.40 563 454 B 7 TYR HA B 35 LYS HGx 1.0 . 6.00 564 454 B 7 TYR HA B 35 LYS HGy 1.0 . 6.00 565 455 B 7 TYR HA B 36 GLN HGx 1.0 . 4.60 566 456 B 7 TYR HEy B 7 TYR HBx 1.0 . 5.00 567 457 B 7 TYR HDy B 7 TYR HBx 1.0 . 3.60 568 458 B 7 TYR HBx B 8 LYS H 1.0 . 4.70 569 459 B 26 LEU HD11 B 7 TYR HBx 1.0 . 5.60 570 460 B 7 TYR HBy B 7 TYR HDx 1.0 . 3.50 571 461 B 7 TYR HBy B 8 LYS H 1.0 . 4.10 572 462 B 7 TYR HBy B 16 VAL HG21 1.0 . 4.80 573 463 B 26 LEU HD11 B 7 TYR HBy 1.0 . 6.00 574 464 B 7 TYR HBy B 33 MET HBy 1.0 . 3.50 575 465 B 7 TYR HBy B 33 MET HE1 1.0 . 6.00 576 466 B 8 LYS H B 7 TYR HDx 1.0 . 4.60 577 467 B 7 TYR HDx B 26 LEU HG 1.0 . 5.00 578 468 B 7 TYR HDx B 33 MET HBy 1.0 . 4.00 579 469 B 7 TYR HDx B 33 MET HE1 1.0 . 5.40 580 470 B 7 TYR HDx B 34 VAL H 1.0 . 5.00 581 471 B 7 TYR HDx B 34 VAL HA 1.0 . 5.00 582 472 B 7 TYR HEx B 35 LYS H 1.0 . 4.30 583 473 B 7 TYR HEx B 35 LYS HBx 1.0 . 6.00 584 473 B 7 TYR HEx B 35 LYS HBy 1.0 . 6.00 585 474 B 7 TYR HEx B 35 LYS HGx 1.0 . 5.00 586 474 B 35 LYS HGy B 7 TYR HEx 1.0 . 5.00 587 475 B 26 LEU HD11 B 7 TYR HEy 1.0 . 6.00 588 476 B 7 TYR HEy B 35 LYS HA 1.0 . 5.00 589 477 B 7 TYR HEy B 35 LYS HEx 1.0 . 6.00 590 477 B 7 TYR HEy B 35 LYS HEy 1.0 . 6.00 591 478 B 7 TYR HDy B 16 VAL HG21 1.0 . 6.00 592 479 B 7 TYR HDy B 18 VAL HG21 1.0 . 4.20 593 480 B 26 LEU HD11 B 7 TYR HDy 1.0 . 5.70 594 481 B 7 TYR HDy B 35 LYS HA 1.0 . 5.00 595 482 B 7 TYR HDy B 35 LYS HGx 1.0 . 6.00 596 482 B 7 TYR HDy B 35 LYS HGy 1.0 . 6.00 597 483 B 7 TYR O B 16 VAL N 1.0 . 3.00 598 484 B 16 VAL H B 7 TYR O 1.0 . 2.00 599 485 B 8 LYS N B 34 VAL O 1.0 . 3.00 600 486 B 8 LYS H B 9 CYS H 1.0 . 4.80 601 487 B 8 LYS H B 34 VAL O 1.0 . 2.00 602 488 B 36 GLN HGx B 8 LYS H 1.0 . 5.00 603 489 B 8 LYS HA B 8 LYS HDx 1.0 . 5.60 604 489 B 8 LYS HA B 8 LYS HDy 1.0 . 5.60 605 490 B 9 CYS H B 8 LYS HA 1.0 . 3.00 606 491 B 8 LYS HA B 15 VAL HA 1.0 . 2.40 607 492 B 16 VAL H B 8 LYS HA 1.0 . 4.50 608 493 B 33 MET HBy B 8 LYS HA 1.0 . 5.00 609 494 B 8 LYS HBy B 8 LYS HEx 1.0 . 7.00 610 494 B 8 LYS HBx B 8 LYS HEx 1.0 . 7.00 611 494 B 8 LYS HEy B 8 LYS HBx 1.0 . 7.00 612 494 B 8 LYS HBy B 8 LYS HEy 1.0 . 7.00 613 495 B 9 CYS H B 8 LYS HBx 1.0 . 4.40 614 495 B 8 LYS HBy B 9 CYS H 1.0 . 4.40 615 496 B 15 VAL HA B 8 LYS HBx 1.0 . 6.00 616 496 B 8 LYS HBy B 15 VAL HA 1.0 . 6.00 617 497 B 8 LYS HBx B 15 VAL HG21 1.0 . 6.10 618 497 B 8 LYS HBy B 15 VAL HG21 1.0 . 6.10 619 497 B 15 VAL HG11 B 8 LYS HBx 1.0 . 6.10 620 497 B 15 VAL HG11 B 8 LYS HBy 1.0 . 6.10 621 498 B 16 VAL H B 8 LYS HBx 1.0 . 6.00 622 498 B 16 VAL H B 8 LYS HBy 1.0 . 6.00 623 499 B 36 GLN HE2x B 8 LYS HBx 1.0 . 6.00 624 499 B 8 LYS HBy B 36 GLN HE2x 1.0 . 6.00 625 500 B 36 GLN HE2y B 8 LYS HBx 1.0 . 6.00 626 500 B 36 GLN HE2y B 8 LYS HBy 1.0 . 6.00 627 501 B 9 CYS H B 8 LYS HDx 1.0 . 6.00 628 501 B 9 CYS H B 8 LYS HDy 1.0 . 6.00 629 502 B 15 VAL HA B 8 LYS HDx 1.0 . 6.00 630 502 B 8 LYS HDy B 15 VAL HA 1.0 . 6.00 631 503 B 36 GLN HGy B 8 LYS HDx 1.0 . 5.90 632 503 B 36 GLN HGy B 8 LYS HDy 1.0 . 5.90 633 504 B 36 GLN HE2x B 8 LYS HDx 1.0 . 6.00 634 504 B 8 LYS HDy B 36 GLN HE2x 1.0 . 6.00 635 505 B 9 CYS H B 8 LYS HEx 1.0 . 6.00 636 505 B 9 CYS H B 8 LYS HEy 1.0 . 6.00 637 506 B 9 CYS HBy B 8 LYS HEx 1.0 . 6.00 638 506 B 8 LYS HEy B 9 CYS HBy 1.0 . 6.00 639 507 B 10 GLU HA B 8 LYS HEx 1.0 . 6.00 640 507 B 8 LYS HEy B 10 GLU HA 1.0 . 6.00 641 508 B 13 GLY HAx B 8 LYS HEx 1.0 . 6.00 642 508 B 8 LYS HEy B 13 GLY HAx 1.0 . 6.00 643 509 B 8 LYS HEy B 15 VAL HG21 1.0 . 8.40 644 509 B 8 LYS HEx B 15 VAL HG21 1.0 . 8.40 645 509 B 15 VAL HG11 B 8 LYS HEx 1.0 . 8.40 646 509 B 15 VAL HG11 B 8 LYS HEy 1.0 . 8.40 647 510 B 36 GLN HE2y B 8 LYS HEx 1.0 . 6.00 648 510 B 36 GLN HE2y B 8 LYS HEy 1.0 . 6.00 649 511 B 8 LYS O B 34 VAL N 1.0 . 3.00 650 512 B 34 VAL H B 8 LYS O 1.0 . 2.00 651 513 B 9 CYS N B 14 GLN O 1.0 . 3.00 652 514 B 9 CYS H B 9 CYS HBx 1.0 . 3.30 653 515 B 9 CYS H B 9 CYS HBy 1.0 . 3.20 654 516 B 9 CYS H B 14 GLN H 1.0 . 3.80 655 517 B 9 CYS H B 14 GLN O 1.0 . 2.00 656 518 B 9 CYS HBx B 9 CYS HA 1.0 . 2.90 657 519 B 9 CYS HBx B 13 GLY H 1.0 . 3.90 658 520 B 9 CYS HBx B 33 MET HGx 1.0 . 3.50 659 520 B 9 CYS HBx B 33 MET HGy 1.0 . 3.50 660 521 B 9 CYS HBy B 13 GLY H 1.0 . 3.30 661 522 B 9 CYS HBy B 14 GLN H 1.0 . 4.40 662 523 B 9 CYS HBy B 33 MET HGx 1.0 . 6.00 663 523 B 9 CYS HBy B 33 MET HGy 1.0 . 6.00 664 524 B 9 CYS SG B 12 CYS N 1.0 . 3.80 665 525 B 9 CYS SG B 12 CYS H 1.0 . 2.90 666 526 B 9 CYS SG B 12 CYS SG 1.0 . 3.78 667 527 B 9 CYS SG B 28 CYS SG 1.0 . 3.76 668 528 B 9 CYS SG B 29 CYS SG 1.0 . 3.79 669 529 B 10 GLU H B 10 GLU HBx 1.0 . 3.60 670 529 B 10 GLU H B 10 GLU HBy 1.0 . 3.60 671 530 B 10 GLU H B 10 GLU HGx 1.0 . 3.70 672 531 B 10 GLU H B 10 GLU HGy 1.0 . 4.20 673 532 B 10 GLU H B 11 LEU H 1.0 . 3.10 674 533 B 10 GLU H B 34 VAL HG21 1.0 . 6.00 675 534 B 10 GLU HA B 10 GLU HGx 1.0 . 2.90 676 535 B 10 GLU HGx B 11 LEU H 1.0 . 5.00 677 536 B 10 GLU HGx B 34 VAL HG11 1.0 . 4.60 678 537 B 10 GLU HGx B 34 VAL HG21 1.0 . 5.70 679 538 B 10 GLU HGy B 34 VAL HG21 1.0 . 4.60 680 539 B 11 LEU H B 11 LEU HBx 1.0 . 3.80 681 539 B 11 LEU H B 11 LEU HBy 1.0 . 3.80 682 540 B 11 LEU H B 11 LEU HG 1.0 . 3.90 683 541 B 11 LEU H B 11 LEU HD11 1.0 . 8.40 684 541 B 11 LEU H B 11 LEU HD21 1.0 . 8.40 685 542 B 12 CYS H B 11 LEU H 1.0 . 2.80 686 543 B 13 GLY H B 11 LEU H 1.0 . 3.90 687 544 B 11 LEU HG B 11 LEU HA 1.0 . 3.30 688 545 B 12 CYS H B 11 LEU HBx 1.0 . 4.60 689 545 B 12 CYS H B 11 LEU HBy 1.0 . 4.60 690 546 B 13 GLY H B 11 LEU HBx 1.0 . 4.80 691 546 B 13 GLY H B 11 LEU HBy 1.0 . 4.80 692 547 B 11 LEU HBx B 29 CYS HBx 1.0 . 6.90 693 547 B 11 LEU HBy B 29 CYS HBx 1.0 . 6.90 694 547 B 29 CYS HBy B 11 LEU HBx 1.0 . 6.90 695 547 B 11 LEU HBy B 29 CYS HBy 1.0 . 6.90 696 548 B 12 CYS H B 11 LEU HG 1.0 . 4.40 697 549 B 11 LEU HG B 29 CYS HBx 1.0 . 5.60 698 549 B 11 LEU HG B 29 CYS HBy 1.0 . 5.60 699 550 B 29 CYS HA B 11 LEU HD11 1.0 . 7.40 700 550 B 11 LEU HD21 B 29 CYS HA 1.0 . 7.40 701 551 B 11 LEU HD11 B 29 CYS HBx 1.0 . 8.40 702 551 B 11 LEU HD21 B 29 CYS HBx 1.0 . 8.40 703 551 B 29 CYS HBy B 11 LEU HD11 1.0 . 8.40 704 551 B 11 LEU HD21 B 29 CYS HBy 1.0 . 8.40 705 552 B 12 CYS HBx B 12 CYS H 1.0 . 4.00 706 553 B 13 GLY H B 12 CYS H 1.0 . 2.70 707 554 B 14 GLN H B 12 CYS H 1.0 . 4.20 708 555 B 12 CYS HBx B 12 CYS HA 1.0 . 2.70 709 556 B 12 CYS HBy B 12 CYS HA 1.0 . 2.70 710 557 B 12 CYS SG B 14 GLN N 1.0 . 3.80 711 558 B 14 GLN H B 12 CYS SG 1.0 . 2.90 712 559 B 12 CYS SG B 28 CYS SG 1.0 . 3.60 713 560 B 12 CYS SG B 29 CYS SG 1.0 . 3.70 714 561 B 14 GLN H B 13 GLY H 1.0 . 2.90 715 562 B 14 GLN H B 14 GLN HA 1.0 . 2.70 716 563 B 14 GLN H B 14 GLN HBx 1.0 . 2.90 717 564 B 14 GLN H B 14 GLN HBy 1.0 . 2.40 718 565 B 14 GLN HE2x B 14 GLN H 1.0 . 5.00 719 566 B 14 GLN HE2x B 14 GLN HBx 1.0 . 5.00 720 567 B 14 GLN HE2y B 14 GLN HBx 1.0 . 5.00 721 568 B 14 GLN HE2x B 14 GLN HBy 1.0 . 3.70 722 569 B 14 GLN HE2y B 14 GLN HBy 1.0 . 4.10 723 570 B 15 VAL H B 14 GLN HGx 1.0 . 6.00 724 570 B 15 VAL H B 14 GLN HGy 1.0 . 6.00 725 571 B 14 GLN HE2x B 33 MET HGx 1.0 . 6.00 726 571 B 14 GLN HE2x B 33 MET HGy 1.0 . 6.00 727 572 B 15 VAL H B 15 VAL HB 1.0 . 2.50 728 573 B 15 VAL H B 16 VAL H 1.0 . 4.70 729 574 B 15 VAL H B 16 VAL HG21 1.0 . 6.00 730 575 B 15 VAL HG11 B 15 VAL HA 1.0 . 3.40 731 576 B 16 VAL H B 15 VAL HA 1.0 . 2.80 732 577 B 16 VAL HA B 15 VAL HG21 1.0 . 7.40 733 577 B 16 VAL HA B 15 VAL HG11 1.0 . 7.40 734 578 B 16 VAL HA B 16 VAL HB 1.0 . 2.40 735 579 B 17 LYS H B 16 VAL HA 1.0 . 2.40 736 580 B 16 VAL HA B 17 LYS HBx 1.0 . 4.50 737 580 B 16 VAL HA B 17 LYS HBy 1.0 . 4.50 738 581 B 17 LYS H B 16 VAL HB 1.0 . 2.40 739 582 B 26 LEU HD11 B 16 VAL HB 1.0 . 6.00 740 583 B 26 LEU HD11 B 16 VAL HG21 1.0 . 4.40 741 584 B 17 LYS H B 17 LYS HBx 1.0 . 3.10 742 584 B 17 LYS H B 17 LYS HBy 1.0 . 3.10 743 585 B 17 LYS H B 17 LYS HDx 1.0 . 5.50 744 585 B 17 LYS H B 17 LYS HDy 1.0 . 5.50 745 586 B 17 LYS HA B 17 LYS HDx 1.0 . 6.00 746 586 B 17 LYS HA B 17 LYS HDy 1.0 . 6.00 747 587 B 18 VAL H B 17 LYS HA 1.0 . 2.40 748 588 B 17 LYS HBx B 17 LYS HEx 1.0 . 6.90 749 588 B 17 LYS HBy B 17 LYS HEx 1.0 . 6.90 750 588 B 17 LYS HEy B 17 LYS HBx 1.0 . 6.90 751 588 B 17 LYS HBy B 17 LYS HEy 1.0 . 6.90 752 589 B 18 VAL H B 17 LYS HGx 1.0 . 5.20 753 589 B 17 LYS HGy B 18 VAL H 1.0 . 5.20 754 590 B 19 LEU HA B 17 LYS HDx 1.0 . 4.50 755 590 B 17 LYS HDy B 19 LEU HA 1.0 . 4.50 756 591 B 18 VAL HB B 18 VAL H 1.0 . 2.60 757 592 B 18 VAL H B 18 VAL HG21 1.0 . 4.00 758 593 B 19 LEU H B 18 VAL H 1.0 . 3.70 759 594 B 19 LEU H B 18 VAL HA 1.0 . 2.60 760 595 B 20 GLU H B 18 VAL HA 1.0 . 3.40 761 596 B 19 LEU H B 18 VAL HG11 1.0 . 4.50 762 597 B 20 GLU H B 18 VAL HG11 1.0 . 4.60 763 598 B 18 VAL HG11 B 20 GLU HA 1.0 . 6.00 764 599 B 21 GLU HA B 18 VAL HG11 1.0 . 5.90 765 600 B 18 VAL HG11 B 22 GLY H 1.0 . 6.00 766 601 B 26 LEU HD11 B 18 VAL HG21 1.0 . 4.40 767 602 B 19 LEU H B 19 LEU HD21 1.0 . 8.40 768 602 B 19 LEU H B 19 LEU HD11 1.0 . 8.40 769 603 B 20 GLU H B 19 LEU H 1.0 . 2.70 770 604 B 19 LEU HA B 19 LEU HD11 1.0 . 4.10 771 605 B 20 GLU H B 19 LEU HBx 1.0 . 4.70 772 605 B 20 GLU H B 19 LEU HBy 1.0 . 4.70 773 606 B 20 GLU H B 20 GLU HGy 1.0 . 4.00 774 607 B 20 GLU H B 21 GLU H 1.0 . 5.00 775 608 B 20 GLU HA B 20 GLU HGx 1.0 . 4.10 776 609 B 20 GLU HA B 20 GLU HGy 1.0 . 3.90 777 610 B 20 GLU HA B 21 GLU H 1.0 . 3.30 778 611 B 21 GLU H B 21 GLU HBx 1.0 . 3.50 779 611 B 21 GLU H B 21 GLU HBy 1.0 . 3.50 780 612 B 22 GLY H B 21 GLU H 1.0 . 5.00 781 613 B 21 GLU HA B 22 GLY H 1.0 . 2.40 782 614 B 22 GLY H B 21 GLU HBx 1.0 . 4.20 783 614 B 22 GLY H B 21 GLU HBy 1.0 . 4.20 784 615 B 22 GLY H B 21 GLU HGx 1.0 . 5.90 785 615 B 22 GLY H B 21 GLU HGy 1.0 . 5.90 786 616 B 23 GLY H B 24 GLY H 1.0 . 3.90 787 617 B 24 GLY H B 25 THR H 1.0 . 5.00 788 618 B 25 THR H B 25 THR HB 1.0 . 2.60 789 619 B 25 THR H B 26 LEU H 1.0 . 5.00 790 620 B 26 LEU H B 25 THR HA 1.0 . 2.40 791 621 B 25 THR HA B 26 LEU HBx 1.0 . 6.00 792 621 B 26 LEU HBy B 25 THR HA 1.0 . 6.00 793 622 B 25 THR HB B 26 LEU H 1.0 . 4.30 794 623 B 25 THR HB B 27 VAL HG21 1.0 . 6.00 795 624 B 27 VAL HG21 B 25 THR HG21 1.0 . 4.40 796 625 B 26 LEU H B 26 LEU HBx 1.0 . 3.60 797 625 B 26 LEU HBy B 26 LEU H 1.0 . 3.60 798 626 B 26 LEU HG B 26 LEU H 1.0 . 3.00 799 627 B 26 LEU HD11 B 26 LEU H 1.0 . 6.00 800 628 B 26 LEU HD21 B 26 LEU H 1.0 . 6.00 801 629 B 27 VAL H B 26 LEU H 1.0 . 5.00 802 630 B 26 LEU HG B 26 LEU HA 1.0 . 3.20 803 631 B 26 LEU HD11 B 26 LEU HA 1.0 . 6.00 804 632 B 26 LEU HD21 B 26 LEU HA 1.0 . 4.30 805 633 B 27 VAL H B 26 LEU HA 1.0 . 2.40 806 634 B 26 LEU HD11 B 33 MET HBy 1.0 . 6.00 807 635 B 26 LEU HD11 B 33 MET HGx 1.0 . 7.00 808 635 B 26 LEU HD11 B 33 MET HGy 1.0 . 7.00 809 636 B 26 LEU HD11 B 33 MET HE1 1.0 . 7.00 810 637 B 26 LEU O B 33 MET N 1.0 . 3.00 811 638 B 26 LEU O B 33 MET H 1.0 . 2.00 812 639 B 27 VAL H B 27 VAL HB 1.0 . 2.40 813 640 B 27 VAL H B 28 CYS H 1.0 . 5.00 814 641 B 28 CYS H B 27 VAL HA 1.0 . 3.00 815 642 B 33 MET H B 27 VAL HA 1.0 . 2.70 816 643 B 27 VAL HA B 33 MET HBx 1.0 . 5.00 817 644 B 27 VAL HB B 28 CYS H 1.0 . 4.00 818 645 B 28 CYS H B 27 VAL HG11 1.0 . 3.80 819 646 B 29 CYS H B 27 VAL HG11 1.0 . 6.00 820 647 B 29 CYS HA B 27 VAL HG11 1.0 . 6.00 821 648 B 27 VAL HG11 B 30 GLY H 1.0 . 4.80 822 649 B 27 VAL HG11 B 30 GLY HAx 1.0 . 3.90 823 650 B 27 VAL HG11 B 31 GLU H 1.0 . 4.40 824 651 B 27 VAL HG11 B 31 GLU HA 1.0 . 6.00 825 652 B 33 MET H B 27 VAL HG11 1.0 . 6.00 826 653 B 27 VAL HG21 B 28 CYS H 1.0 . 6.00 827 654 B 27 VAL HG21 B 32 ASP H 1.0 . 6.00 828 655 B 27 VAL HG21 B 33 MET H 1.0 . 6.00 829 656 B 28 CYS N B 31 GLU O 1.0 . 3.00 830 657 B 28 CYS H B 28 CYS HBx 1.0 . 4.10 831 658 B 28 CYS H B 31 GLU H 1.0 . 3.30 832 659 B 28 CYS H B 31 GLU O 1.0 . 2.00 833 660 B 28 CYS H B 33 MET HBx 1.0 . 4.90 834 661 B 28 CYS HBx B 28 CYS HA 1.0 . 2.70 835 662 B 28 CYS HA B 28 CYS HBy 1.0 . 2.60 836 663 B 33 MET HBx B 28 CYS HBx 1.0 . 4.60 837 664 B 28 CYS HBx B 33 MET HGx 1.0 . 6.00 838 664 B 33 MET HGy B 28 CYS HBx 1.0 . 6.00 839 665 B 28 CYS SG B 29 CYS SG 1.0 . 4.04 840 666 B 28 CYS O B 31 GLU N 1.0 . 3.00 841 667 B 31 GLU H B 28 CYS O 1.0 . 2.00 842 668 B 29 CYS H B 29 CYS HA 1.0 . 2.50 843 669 B 29 CYS H B 30 GLY H 1.0 . 3.50 844 670 B 29 CYS HA B 30 GLY H 1.0 . 3.10 845 671 B 30 GLY H B 30 GLY HAx 1.0 . 2.90 846 672 B 30 GLY H B 31 GLU H 1.0 . 3.70 847 673 B 31 GLU H B 31 GLU HGx 1.0 . 4.20 848 674 B 31 GLU H B 31 GLU HGy 1.0 . 5.00 849 675 B 31 GLU H B 32 ASP H 1.0 . 4.60 850 676 B 31 GLU HA B 31 GLU HGx 1.0 . 3.80 851 677 B 32 ASP H B 31 GLU HGx 1.0 . 3.80 852 678 B 32 ASP H B 31 GLU HGy 1.0 . 5.00 853 679 B 32 ASP H B 32 ASP HBx 1.0 . 3.60 854 679 B 32 ASP H B 32 ASP HBy 1.0 . 3.60 855 680 B 34 VAL HG21 B 32 ASP H 1.0 . 6.00 856 681 B 33 MET H B 32 ASP HA 1.0 . 3.30 857 682 B 33 MET H B 33 MET HBx 1.0 . 3.10 858 683 B 33 MET HBy B 33 MET H 1.0 . 3.70 859 684 B 33 MET HE1 B 33 MET H 1.0 . 6.00 860 685 B 34 VAL H B 33 MET H 1.0 . 5.00 861 686 B 34 VAL HG21 B 33 MET H 1.0 . 6.00 862 687 B 33 MET HBx B 33 MET HA 1.0 . 2.60 863 688 B 33 MET HBy B 33 MET HA 1.0 . 2.60 864 689 B 34 VAL HG21 B 33 MET HGx 1.0 . 7.00 865 689 B 33 MET HGy B 34 VAL HG21 1.0 . 7.00 866 690 B 34 VAL H B 34 VAL HB 1.0 . 2.50 867 691 B 34 VAL H B 34 VAL HG21 1.0 . 4.30 868 692 B 34 VAL HA B 35 LYS H 1.0 . 2.40 869 693 B 35 LYS H B 34 VAL HB 1.0 . 3.40 870 694 B 36 GLN HE2x B 34 VAL HB 1.0 . 4.30 871 695 B 35 LYS H B 34 VAL HG11 1.0 . 4.40 872 696 B 36 GLN HE2x B 34 VAL HG11 1.0 . 6.00 873 697 B 36 GLN HE2y B 34 VAL HG11 1.0 . 5.30 874 698 B 35 LYS H B 34 VAL HG21 1.0 . 4.70 875 699 B 36 GLN HE2x B 34 VAL HG21 1.0 . 6.00 876 700 B 36 GLN HE2y B 34 VAL HG21 1.0 . 6.00 877 701 B 35 LYS H B 35 LYS HBx 1.0 . 3.60 878 701 B 35 LYS H B 35 LYS HBy 1.0 . 3.60 879 702 B 35 LYS H B 35 LYS HGx 1.0 . 4.70 880 702 B 35 LYS HGy B 35 LYS H 1.0 . 4.70 881 703 B 35 LYS H B 36 GLN HE2x 1.0 . 5.00 882 704 B 35 LYS HA B 35 LYS HDy 1.0 . 3.80 883 705 B 36 GLN H B 35 LYS HA 1.0 . 2.40 884 706 B 36 GLN HGx B 35 LYS HA 1.0 . 5.00 885 707 B 35 LYS HBx B 35 LYS HEx 1.0 . 7.00 886 707 B 35 LYS HBy B 35 LYS HEx 1.0 . 7.00 887 707 B 35 LYS HEy B 35 LYS HBx 1.0 . 7.00 888 707 B 35 LYS HBy B 35 LYS HEy 1.0 . 7.00 889 708 B 36 GLN H B 35 LYS HGx 1.0 . 5.30 890 708 B 36 GLN H B 35 LYS HGy 1.0 . 5.30 891 709 B 36 GLN H B 35 LYS HEx 1.0 . 6.00 892 709 B 36 GLN H B 35 LYS HEy 1.0 . 6.00 893 710 B 36 GLN H B 36 GLN HBx 1.0 . 3.30 894 710 B 36 GLN H B 36 GLN HBy 1.0 . 3.30 895 711 B 36 GLN HGx B 36 GLN H 1.0 . 3.30 896 712 B 36 GLN HGy B 36 GLN H 1.0 . 3.10 897 713 B 36 GLN H B 36 GLN HE2x 1.0 . 5.00 898 714 B 36 GLN HE2y B 36 GLN H 1.0 . 5.00 899 715 B 36 GLN HE2y B 36 GLN HA 1.0 . 5.00 900 716 B 36 GLN HGx B 36 GLN HE2y 1.0 . 3.70 901 717 B 36 GLN HGy B 36 GLN HE2y 1.0 . 4.00 stop_ save_