data_nef_c30657_6u46 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 6U46 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 7 CYS SG 1 45 CYS SG 1 19 CYS SG 1 58 CYS SG 1 44 CYS SG 1 49 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 PHE start . . 2 A 2 VAL middle . . 3 A 3 ASN middle . . 4 A 4 GLN middle . . 5 A 5 HIS middle . . 6 A 6 LEU middle . . 7 A 7 CYS middle -HG . 8 A 8 GLY middle . false 9 A 9 SER middle . . 10 A 10 HIS middle . . 11 A 11 LEU middle . . 12 A 12 VAL middle . . 13 A 13 GLU middle . . 14 A 14 ALA middle . . 15 A 15 LEU middle . . 16 A 16 TYR middle . . 17 A 17 LEU middle . . 18 A 18 VAL middle . . 19 A 19 CYS middle -HG . 20 A 20 GLY middle . false 21 A 21 GLU middle . . 22 A 22 ARG middle . . 23 A 23 GLY middle . false 24 A 24 PHE middle . . 25 A 25 PHE middle . . 26 A 26 TYR middle . . 27 A 27 THR middle . . 28 A 28 PRO middle . false 29 A 29 ARG middle . . 30 A 30 THR middle . . 31 A 31 GLU middle . . 32 A 32 GLU middle . . 33 A 33 GLY middle . false 34 A 34 SER middle . . 35 A 35 ARG middle . . 36 A 36 ARG middle . . 37 A 37 SER middle . . 38 A 38 ARG middle . . 39 A 39 GLY middle . false 40 A 40 ILE middle . . 41 A 41 VAL middle . . 42 A 42 GLU middle . . 43 A 43 GLN middle . . 44 A 44 CYS middle -HG . 45 A 45 CYS middle -HG . 46 A 46 ARG middle . . 47 A 47 SER middle . . 48 A 48 ILE middle . . 49 A 49 CYS middle -HG . 50 A 50 SER middle . . 51 A 51 LEU middle . . 52 A 52 TYR middle . . 53 A 53 GLN middle . . 54 A 54 LEU middle . . 55 A 55 GLU middle . . 56 A 56 ASN middle . . 57 A 57 TYR middle . . 58 A 58 CYS middle -HG . 59 A 59 GLY end . false 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 PHE HA H 1 4.1600 . A 1 PHE HBx H 1 3.0700 . A 1 PHE HBy H 1 3.1400 . A 1 PHE HDx H 1 7.1800 . A 1 PHE HDy H 1 7.1800 . A 1 PHE HEx H 1 7.3100 . A 1 PHE HEy H 1 7.3100 . A 2 VAL H H 1 7.9900 . A 2 VAL HA H 1 4.0050 . A 2 VAL HB H 1 1.7780 . A 2 VAL HGx% H 1 0.7530 . A 2 VAL HGy% H 1 0.8200 . A 2 VAL N N 15 125.4600 . A 3 ASN H H 1 8.4600 . A 3 ASN HA H 1 4.6500 . A 3 ASN HBx H 1 2.6300 . A 3 ASN HBy H 1 2.6300 . A 3 ASN HD2y H 1 7.4800 . A 3 ASN HD2x H 1 6.8300 . A 3 ASN N N 15 124.200 . A 3 ASN ND2 N 15 111.4700 . A 4 GLN H H 1 8.4500 . A 4 GLN HA H 1 4.4600 . A 4 GLN HBy H 1 2.0000 . A 4 GLN HBx H 1 1.9000 . A 4 GLN HE2y H 1 7.3500 . A 4 GLN HE2x H 1 6.7700 . A 4 GLN HGx H 1 2.1600 . A 4 GLN HGy H 1 2.2500 . A 4 GLN N N 15 120.1500 . A 4 GLN NE2 N 15 112.0800 . A 5 HIS H H 1 8.7200 . A 5 HIS HA H 1 4.3400 . A 5 HIS HBx H 1 3.2000 . A 5 HIS HBy H 1 3.5000 . A 5 HIS HD2 H 1 8.5600 . A 5 HIS HE1 H 1 7.3000 . A 5 HIS N N 15 119.5000 . A 6 LEU H H 1 9.0600 . A 6 LEU HA H 1 4.4500 . A 6 LEU HBx H 1 0.6800 . A 6 LEU HBy H 1 1.7460 . A 6 LEU HDx% H 1 0.8400 . A 6 LEU HDy% H 1 0.6260 . A 6 LEU HG H 1 1.5500 . A 6 LEU N N 15 127.4300 . A 7 CYS H H 1 8.3800 . A 7 CYS HA H 1 4.9900 . A 7 CYS HBy H 1 3.2000 . A 7 CYS HBx H 1 2.8800 . A 7 CYS N N 15 118.9000 . A 8 GLY H H 1 9.6200 . A 8 GLY HAy H 1 3.8800 . A 8 GLY HAx H 1 3.8200 . A 8 GLY N N 15 113.3200 . A 9 SER H H 1 8.8800 . A 9 SER HA H 1 2.9900 . A 9 SER HBy H 1 3.5800 . A 9 SER HBx H 1 3.4800 . A 9 SER N N 15 122.3000 . A 10 HIS H H 1 7.6900 . A 10 HIS HA H 1 4.3000 . A 10 HIS HBx H 1 3.1600 . A 10 HIS HBy H 1 3.4400 . A 10 HIS HD2 H 1 8.5600 . A 10 HIS HE1 H 1 7.3800 . A 10 HIS N N 15 118.4000 . A 11 LEU H H 1 6.8100 . A 11 LEU HA H 1 3.8900 . A 11 LEU HBy H 1 1.8200 . A 11 LEU HBx H 1 1.1100 . A 11 LEU HDx% H 1 0.6900 . A 11 LEU HDy% H 1 0.7200 . A 11 LEU HG H 1 1.1700 . A 11 LEU N N 15 121.4400 . A 12 VAL H H 1 6.6800 . A 12 VAL HA H 1 3.2700 . A 12 VAL HB H 1 1.7600 . A 12 VAL HGx% H 1 0.4600 . A 12 VAL HGy% H 1 0.3600 . A 12 VAL N N 15 113.1000 . A 13 GLU H H 1 7.5700 . A 13 GLU HA H 1 3.8500 . A 13 GLU HBy H 1 1.9800 . A 13 GLU HBx H 1 1.9000 . A 13 GLU HGx H 1 2.3000 . A 13 GLU HGy H 1 2.4100 . A 13 GLU N N 15 118.5100 . A 14 ALA H H 1 7.4000 . A 14 ALA HA H 1 4.0700 . A 14 ALA HB% H 1 1.3960 . A 14 ALA N N 15 121.5400 . A 15 LEU H H 1 7.7200 . A 15 LEU HA H 1 3.5500 . A 15 LEU HBy H 1 0.7300 . A 15 LEU HBx H 1 -0.0470 . A 15 LEU HDx% H 1 0.4800 . A 15 LEU HDy% H 1 0.6400 . A 15 LEU HG H 1 1.2800 . A 15 LEU N N 15 117.8600 . A 16 TYR H H 1 7.7000 . A 16 TYR HA H 1 4.1100 . A 16 TYR HBx H 1 2.8900 . A 16 TYR HBy H 1 2.9500 . A 16 TYR HDx H 1 7.2200 . A 16 TYR HDy H 1 7.2200 . A 16 TYR HEx H 1 6.7800 . A 16 TYR HEy H 1 6.7800 . A 16 TYR N N 15 118.8200 . A 17 LEU H H 1 7.7300 . A 17 LEU HA H 1 3.8000 . A 17 LEU HBy H 1 1.8800 . A 17 LEU HBx H 1 1.8300 . A 17 LEU HDx% H 1 0.8800 . A 17 LEU HDy% H 1 0.9000 . A 17 LEU HG H 1 1.5400 . A 17 LEU N N 15 119.8500 . A 18 VAL H H 1 8.6600 . A 18 VAL HA H 1 3.7300 . A 18 VAL HB H 1 1.9900 . A 18 VAL HGx% H 1 0.9300 . A 18 VAL HGy% H 1 0.7900 . A 18 VAL N N 15 117.6200 . A 19 CYS H H 1 8.5800 . A 19 CYS HA H 1 4.7100 . A 19 CYS HBx H 1 2.8600 . A 19 CYS HBy H 1 3.2900 . A 19 CYS N N 15 116.3300 . A 20 GLY H H 1 7.3100 . A 20 GLY HAy H 1 3.8900 . A 20 GLY HAx H 1 3.7900 . A 20 GLY N N 15 107.5500 . A 21 GLU H H 1 9.1500 . A 21 GLU HA H 1 4.1000 . A 21 GLU HBy H 1 2.1800 . A 21 GLU HBx H 1 2.0100 . A 21 GLU HGy H 1 2.4500 . A 21 GLU HGx H 1 2.4000 . A 21 GLU N N 15 125.4300 . A 22 ARG H H 1 7.9400 . A 22 ARG HA H 1 4.0800 . A 22 ARG HBy H 1 2.1500 . A 22 ARG HBx H 1 2.0000 . A 22 ARG HDx H 1 3.3100 . A 22 ARG HDy H 1 3.3100 . A 22 ARG HGy H 1 1.9300 . A 22 ARG HGx H 1 1.7900 . A 22 ARG N N 15 116.6300 . A 23 GLY H H 1 7.5600 . A 23 GLY HAy H 1 4.6500 . A 23 GLY HAx H 1 3.7600 . A 23 GLY N N 15 102.5300 . A 24 PHE H H 1 8.7400 . A 24 PHE HA H 1 5.4600 . A 24 PHE HBy H 1 3.1700 . A 24 PHE HBx H 1 2.9800 . A 24 PHE HDx H 1 6.9400 . A 24 PHE HDy H 1 6.9400 . A 24 PHE HEx H 1 6.8200 . A 24 PHE HEy H 1 6.8200 . A 24 PHE HZ H 1 7.0240 . A 24 PHE N N 15 112.7600 . A 25 PHE H H 1 8.5900 . A 25 PHE HA H 1 4.9800 . A 25 PHE HBy H 1 2.9900 . A 25 PHE HBx H 1 2.9300 . A 25 PHE HDx H 1 6.9400 . A 25 PHE HDy H 1 6.9400 . A 25 PHE HEx H 1 7.0700 . A 25 PHE HEy H 1 7.0700 . A 25 PHE N N 15 118.1600 . A 26 TYR H H 1 8.4900 . A 26 TYR HA H 1 4.6400 . A 26 TYR HBx H 1 2.6300 . A 26 TYR HBy H 1 2.6300 . A 26 TYR HDx H 1 7.1300 . A 26 TYR HDy H 1 7.1300 . A 26 TYR HEx H 1 6.8400 . A 26 TYR HEy H 1 6.8400 . A 26 TYR N N 15 124.1900 . A 27 THR H H 1 8.1000 . A 27 THR HA H 1 4.4900 . A 27 THR HB H 1 4.0400 . A 27 THR HG2% H 1 1.0800 . A 27 THR N N 15 119.3300 . A 28 PRO HA H 1 4.1200 . A 28 PRO HBx H 1 2.0000 . A 28 PRO HBy H 1 2.0000 . A 28 PRO HDy H 1 3.4500 . A 28 PRO HDx H 1 2.3200 . A 28 PRO HGy H 1 1.8400 . A 28 PRO HGx H 1 1.7400 . A 29 ARG H H 1 8.3400 . A 29 ARG HA H 1 4.4000 . A 29 ARG HBx H 1 1.8800 . A 29 ARG HBy H 1 1.8800 . A 29 ARG HDy H 1 3.0900 . A 29 ARG HDx H 1 3.0100 . A 29 ARG HGx H 1 1.6000 . A 29 ARG HGy H 1 1.7600 . A 29 ARG N N 15 121.930 . A 30 THR H H 1 8.2000 . A 30 THR HA H 1 4.2900 . A 30 THR HB H 1 4.1700 . A 30 THR HG2% H 1 1.1600 . A 30 THR N N 15 116.1600 . A 31 GLU H H 1 8.4200 . A 31 GLU HA H 1 4.3000 . A 31 GLU HBx H 1 1.9800 . A 31 GLU HBy H 1 1.9800 . A 31 GLU HGx H 1 2.3800 . A 31 GLU HGy H 1 2.3800 . A 31 GLU N N 15 121.6300 . A 32 GLU H H 1 8.3200 . A 32 GLU HA H 1 4.3100 . A 32 GLU HBx H 1 1.9100 . A 32 GLU HBy H 1 2.0300 . A 32 GLU HGx H 1 2.3600 . A 32 GLU HGy H 1 2.3600 . A 32 GLU N N 15 122.1800 . A 33 GLY H H 1 8.5400 . A 33 GLY HAx H 1 3.8700 . A 33 GLY HAy H 1 4.0300 . A 33 GLY N N 15 110.4100 . A 34 SER H H 1 8.2700 . A 34 SER HA H 1 4.3800 . A 34 SER HBy H 1 3.9200 . A 34 SER HBx H 1 3.8500 . A 34 SER N N 15 116.2100 . A 35 ARG H H 1 8.3400 . A 35 ARG HA H 1 4.3000 . A 35 ARG HBy H 1 1.8800 . A 35 ARG HBx H 1 1.7500 . A 35 ARG HDx H 1 3.1300 . A 35 ARG HDy H 1 3.1300 . A 35 ARG HGx H 1 1.5700 . A 35 ARG HGy H 1 1.6300 . A 35 ARG N N 15 121.7700 . A 36 ARG H H 1 8.1400 . A 36 ARG HA H 1 4.2700 . A 36 ARG HBy H 1 1.8400 . A 36 ARG HBx H 1 1.7400 . A 36 ARG HDx H 1 3.1380 . A 36 ARG HDy H 1 3.1380 . A 36 ARG HGx H 1 1.5300 . A 36 ARG HGy H 1 1.5800 . A 36 ARG N N 15 120.2200 . A 37 SER H H 1 8.1000 . A 37 SER HA H 1 4.4200 . A 37 SER HBx H 1 3.8400 . A 37 SER HBy H 1 3.8600 . A 37 SER N N 15 115.7200 . A 38 ARG H H 1 8.1900 . A 38 ARG HA H 1 4.4000 . A 38 ARG HBy H 1 1.8400 . A 38 ARG HBx H 1 1.7800 . A 38 ARG HDx H 1 3.1800 . A 38 ARG HDy H 1 3.1800 . A 38 ARG HGx H 1 1.5500 . A 38 ARG HGy H 1 1.6400 . A 38 ARG N N 15 120.1100 . A 39 GLY H H 1 8.4000 . A 39 GLY HAx H 1 3.9500 . A 39 GLY HAy H 1 4.1000 . A 39 GLY N N 15 110.5500 . A 40 ILE HA H 1 3.7100 . A 40 ILE HB H 1 1.8200 . A 40 ILE HD1% H 1 0.4500 . A 40 ILE HG1x H 1 1.2300 . A 40 ILE HG1y H 1 1.8100 . A 40 ILE HG2% H 1 0.6700 . A 41 VAL H H 1 8.1100 . A 41 VAL HA H 1 3.5600 . A 41 VAL HB H 1 2.0100 . A 41 VAL HGx% H 1 0.9200 . A 41 VAL HGy% H 1 1.0070 . A 41 VAL N N 15 123.5600 . A 42 GLU H H 1 8.4600 . A 42 GLU HA H 1 4.3900 . A 42 GLU HBy H 1 2.0900 . A 42 GLU HBx H 1 1.9400 . A 42 GLU HGx H 1 2.3600 . A 42 GLU HGy H 1 2.3600 . A 42 GLU N N 15 123.1500 . A 43 GLN H H 1 8.3000 . A 43 GLN HA H 1 3.9600 . A 43 GLN HBy H 1 2.0900 . A 43 GLN HBx H 1 1.9400 . A 43 GLN HE2y H 1 7.4100 . A 43 GLN HE2x H 1 6.8900 . A 43 GLN HGx H 1 2.3000 . A 43 GLN HGy H 1 2.4300 . A 43 GLN N N 15 121.5400 . A 43 GLN NE2 N 15 111.9100 . A 44 CYS H H 1 8.3450 . A 44 CYS HA H 1 4.9300 . A 44 CYS HBy H 1 3.2700 . A 44 CYS HBx H 1 2.8500 . A 44 CYS N N 15 109.6200 . A 45 CYS H H 1 7.9800 . A 45 CYS HA H 1 4.8560 . A 45 CYS HBx H 1 3.4000 . A 45 CYS HBy H 1 3.8600 . A 45 CYS N N 15 118.0700 . A 46 ARG H H 1 8.2400 . A 46 ARG HA H 1 4.0500 . A 46 ARG HBx H 1 2.0000 . A 46 ARG HBy H 1 2.1500 . A 46 ARG HDx H 1 3.1500 . A 46 ARG HDy H 1 3.1500 . A 46 ARG HGx H 1 1.5600 . A 46 ARG HGy H 1 1.6800 . A 46 ARG N N 15 118.9700 . A 47 SER H H 1 7.0700 . A 47 SER HA H 1 4.7400 . A 47 SER HBy H 1 4.0650 . A 47 SER HBx H 1 3.8650 . A 47 SER N N 15 114.6300 . A 48 ILE H H 1 7.7800 . A 48 ILE HA H 1 4.3100 . A 48 ILE HB H 1 1.4750 . A 48 ILE HD1% H 1 0.4040 . A 48 ILE HG1x H 1 0.2100 . A 48 ILE HG1y H 1 0.9600 . A 48 ILE HG2% H 1 0.5700 . A 48 ILE N N 15 117.5800 . A 49 CYS HA H 1 4.9800 . A 49 CYS HBy H 1 3.2300 . A 49 CYS HBx H 1 2.3400 . A 50 SER H H 1 8.6600 . A 50 SER HA H 1 4.5400 . A 50 SER HBx H 1 3.9600 . A 50 SER HBy H 1 4.2400 . A 50 SER N N 15 117.2700 . A 51 LEU H H 1 8.6000 . A 51 LEU HA H 1 3.6500 . A 51 LEU HBy H 1 1.2700 . A 51 LEU HBx H 1 1.1200 . A 51 LEU HDx% H 1 0.7870 . A 51 LEU HDy% H 1 0.6750 . A 51 LEU HG H 1 1.2700 . A 51 LEU N N 15 122.1000 . A 52 TYR H H 1 7.5000 . A 52 TYR HA H 1 4.1100 . A 52 TYR HBx H 1 2.8900 . A 52 TYR HBy H 1 2.9400 . A 52 TYR HDx H 1 7.0100 . A 52 TYR HDy H 1 7.0100 . A 52 TYR HEx H 1 6.8200 . A 52 TYR HEy H 1 6.8200 . A 52 TYR N N 15 115.4400 . A 53 GLN H H 1 7.5100 . A 53 GLN HA H 1 3.9300 . A 53 GLN HBy H 1 2.1000 . A 53 GLN HBx H 1 1.9900 . A 53 GLN HE2y H 1 7.5400 . A 53 GLN HE2x H 1 7.0000 . A 53 GLN HGx H 1 2.3000 . A 53 GLN HGy H 1 2.4000 . A 53 GLN N N 15 118.1300 . A 53 GLN NE2 N 15 112.0800 . A 54 LEU H H 1 8.0300 . A 54 LEU HA H 1 4.1200 . A 54 LEU HBx H 1 1.4800 . A 54 LEU HBy H 1 1.8800 . A 54 LEU HDx% H 1 0.7900 . A 54 LEU HDy% H 1 0.7400 . A 54 LEU HG H 1 1.4800 . A 54 LEU N N 15 120.6000 . A 55 GLU H H 1 8.0100 . A 55 GLU HA H 1 4.3900 . A 55 GLU HBx H 1 2.0600 . A 55 GLU HBy H 1 2.3300 . A 55 GLU HGx H 1 2.2400 . A 55 GLU HGy H 1 2.5600 . A 55 GLU N N 15 113.3700 . A 56 ASN H H 1 7.3200 . A 56 ASN HA H 1 4.4400 . A 56 ASN HBx H 1 2.3800 . A 56 ASN HBy H 1 2.5600 . A 56 ASN HD2x H 1 6.6000 . A 56 ASN HD2y H 1 7.0800 . A 56 ASN N N 15 117.6500 . A 56 ASN ND2 N 15 111.9000 . A 57 TYR H H 1 7.8700 . A 57 TYR HA H 1 4.4500 . A 57 TYR HBy H 1 3.5600 . A 57 TYR HBx H 1 2.8700 . A 57 TYR HDx H 1 7.3200 . A 57 TYR HDy H 1 7.3200 . A 57 TYR HEx H 1 6.7600 . A 57 TYR HEy H 1 6.7600 . A 57 TYR N N 15 117.3400 . A 58 CYS H H 1 7.2600 . A 58 CYS HA H 1 5.4400 . A 58 CYS HBx H 1 2.8500 . A 58 CYS HBy H 1 3.2900 . A 58 CYS N N 15 115.1800 . A 59 GLY H H 1 8.2000 . A 59 GLY HAx H 1 3.9800 . A 59 GLY HAy H 1 3.9800 . A 59 GLY N N 15 112.6700 . 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 1 PHE HDy A 1 PHE HA 1.0 1.8 4.5 2 2 A 1 PHE HDx A 17 LEU HBy 1.0 1.8 4.3 3 3 A 1 PHE HA A 2 VAL H 1.0 1.8 3.5 4 4 A 1 PHE HDy A 4 GLN HGy 1.0 1.8 5.3 5 5 A 1 PHE HZ A 6 LEU HDy% 1.0 1.8 4.0 6 6 A 1 PHE HEy A 6 LEU HBx 1.0 1.8 5.0 7 7 A 1 PHE HEy A 6 LEU HG 1.0 1.8 4.5 8 8 A 1 PHE HEx A 17 LEU HBx 1.0 1.8 4.0 9 9 A 17 LEU HBy A 1 PHE HEx 1.0 1.8 5.0 10 10 A 1 PHE HDx A 17 LEU HDy% 1.0 1.8 5.5 11 11 A 1 PHE HZ A 18 VAL HGx% 1.0 1.8 5.0 12 12 A 1 PHE HDy A 51 LEU HDy% 1.0 1.8 4.3 13 13 A 1 PHE HEy A 54 LEU HDx% 1.0 1.8 4.0 14 14 A 2 VAL HA A 2 VAL HB 1.0 1.8 2.8 15 15 A 2 VAL H A 2 VAL HA 1.0 1.8 3.4 16 16 A 2 VAL H A 2 VAL HGx% 1.0 1.8 5.5 17 17 A 2 VAL H A 2 VAL HB 1.0 1.8 4.0 18 18 A 2 VAL HA A 2 VAL HGx% 1.0 1.8 4.0 19 19 A 2 VAL HA A 2 VAL HGy% 1.0 1.8 3.7 20 20 A 2 VAL HB A 3 ASN H 1.0 1.8 3.5 21 21 A 2 VAL HA A 3 ASN H 1.0 1.8 3.4 22 22 A 2 VAL HGx% A 3 ASN H 1.0 1.8 4.2 23 23 A 2 VAL HGy% A 3 ASN H 1.0 1.8 3.9 24 24 A 2 VAL HGx% A 4 GLN HE2y 1.0 1.8 5.5 25 25 A 2 VAL HGx% A 4 GLN HE2x 1.0 1.8 6.5 26 26 A 2 VAL HGy% A 4 GLN HE2y 1.0 1.8 4.7 27 27 A 2 VAL HGy% A 4 GLN HE2x 1.0 1.8 5.5 28 28 A 2 VAL HGy% A 4 GLN HGx 1.0 1.8 4.0 29 29 A 3 ASN HA A 3 ASN HBx 1.0 1.8 3.1 30 29 A 3 ASN HA A 3 ASN HBy 1.0 1.8 3.1 31 30 A 3 ASN H A 3 ASN HA 1.0 1.8 3.2 32 31 A 3 ASN H A 3 ASN HBx 1.0 1.8 3.9 33 31 A 3 ASN H A 3 ASN HBy 1.0 1.8 3.9 34 32 A 3 ASN HD2y A 3 ASN HBx 1.0 1.8 3.7 35 32 A 3 ASN HBy A 3 ASN HD2y 1.0 1.8 3.7 36 33 A 3 ASN HD2x A 3 ASN HBx 1.0 1.8 4.5 37 33 A 3 ASN HBy A 3 ASN HD2x 1.0 1.8 4.5 38 34 A 4 GLN HGx A 3 ASN HA 1.0 1.8 5.0 39 35 A 48 ILE HG2% A 3 ASN HBx 1.0 1.8 5.2 40 35 A 3 ASN HBy A 48 ILE HG2% 1.0 1.8 5.2 41 36 A 3 ASN HA A 48 ILE HG2% 1.0 1.8 5.5 42 37 A 4 GLN HA A 4 GLN HBy 1.0 1.8 3.5 43 38 A 4 GLN HA A 4 GLN HBx 1.0 1.8 2.8 44 39 A 4 GLN HA A 4 GLN H 1.0 1.8 3.2 45 40 A 4 GLN HE2y A 4 GLN HBy 1.0 1.8 5.0 46 41 A 4 GLN HE2y A 4 GLN HBx 1.0 1.8 5.0 47 42 A 4 GLN HE2x A 4 GLN HBx 1.0 1.8 5.0 48 43 A 4 GLN HE2x A 4 GLN HBy 1.0 1.8 5.0 49 44 A 4 GLN HGy A 4 GLN HE2x 1.0 1.8 5.0 50 45 A 4 GLN HE2y A 4 GLN HGx 1.0 1.8 5.0 51 46 A 4 GLN HGy A 4 GLN HA 1.0 1.8 6.0 52 47 A 4 GLN HE2x A 4 GLN HGx 1.0 1.8 3.8 53 48 A 4 GLN HGy A 4 GLN HE2y 1.0 1.8 4.0 54 49 A 4 GLN HA A 5 HIS H 1.0 1.8 2.9 55 50 A 4 GLN HBx A 5 HIS H 1.0 1.8 4.0 56 51 A 4 GLN HBy A 5 HIS H 1.0 1.8 3.5 57 52 A 4 GLN HGy A 5 HIS H 1.0 1.8 5.0 58 53 A 4 GLN HGx A 5 HIS H 1.0 1.8 6.0 59 54 A 48 ILE HG2% A 4 GLN HA 1.0 1.8 5.5 60 55 A 4 GLN HA A 48 ILE HD1% 1.0 1.8 4.0 61 56 A 5 HIS HA A 5 HIS HBy 1.0 1.8 3.0 62 57 A 5 HIS HA A 5 HIS HBx 1.0 1.8 3.3 63 58 A 5 HIS H A 5 HIS HA 1.0 1.8 3.2 64 59 A 5 HIS H A 5 HIS HBy 1.0 1.8 3.6 65 60 A 5 HIS H A 5 HIS HBx 1.0 1.8 3.5 66 61 A 5 HIS HBy A 5 HIS HE1 1.0 1.8 5.0 67 62 A 5 HIS HBx A 5 HIS HE1 1.0 1.8 5.0 68 63 A 5 HIS H A 5 HIS HE1 1.0 1.8 5.5 69 64 A 5 HIS H A 6 LEU H 1.0 1.8 4.5 70 65 A 5 HIS HBy A 6 LEU H 1.0 1.8 5.0 71 66 A 5 HIS HBx A 6 LEU H 1.0 1.8 4.2 72 67 A 5 HIS HA A 6 LEU H 1.0 1.8 3.4 73 68 A 5 HIS HA A 6 LEU HDx% 1.0 1.8 6.5 74 69 A 5 HIS HBx A 45 CYS HA 1.0 1.8 5.0 75 70 A 5 HIS HBy A 45 CYS HA 1.0 1.8 6.0 76 71 A 5 HIS HBx A 47 SER HA 1.0 1.8 6.0 77 72 A 5 HIS H A 48 ILE HD1% 1.0 1.8 5.5 78 73 A 48 ILE HG2% A 5 HIS H 1.0 1.8 5.8 79 74 A 5 HIS HD2 A 48 ILE HG1x 1.0 1.8 5.0 80 75 A 48 ILE HD1% A 5 HIS HD2 1.0 1.8 4.8 81 76 A 48 ILE HG2% A 5 HIS HD2 1.0 1.8 5.5 82 77 A 48 ILE HG2% A 5 HIS HA 1.0 1.8 5.0 83 78 A 48 ILE HD1% A 5 HIS HA 1.0 1.8 5.5 84 79 A 5 HIS HA A 48 ILE H 1.0 1.8 5.0 85 80 A 6 LEU HA A 6 LEU HBy 1.0 1.8 3.0 86 81 A 6 LEU HBx A 6 LEU HA 1.0 1.8 3.5 87 82 A 6 LEU HG A 6 LEU HA 1.0 1.8 5.0 88 83 A 6 LEU HDx% A 6 LEU HA 1.0 1.8 5.5 89 84 A 6 LEU H A 6 LEU HA 1.0 1.8 3.4 90 85 A 6 LEU HG A 6 LEU H 1.0 1.8 5.0 91 86 A 6 LEU HDy% A 6 LEU H 1.0 1.8 5.5 92 87 A 6 LEU HBx A 6 LEU H 1.0 1.8 4.0 93 88 A 6 LEU H A 6 LEU HBy 1.0 1.8 4.0 94 89 A 6 LEU H A 6 LEU HDx% 1.0 1.8 4.5 95 90 A 6 LEU HBx A 6 LEU HDx% 1.0 1.8 3.7 96 91 A 6 LEU HDx% A 6 LEU HBy 1.0 1.8 3.7 97 92 A 6 LEU H A 7 CYS H 1.0 1.8 4.5 98 93 A 6 LEU HA A 7 CYS H 1.0 1.8 2.9 99 94 A 6 LEU HBx A 7 CYS H 1.0 1.8 5.0 100 95 A 6 LEU HBy A 10 HIS H 1.0 1.8 5.6 101 96 A 6 LEU HBy A 10 HIS HBy 1.0 1.8 5.0 102 97 A 6 LEU HA A 10 HIS HBy 1.0 1.8 4.0 103 98 A 6 LEU HA A 10 HIS HBx 1.0 1.8 4.0 104 99 A 6 LEU HBy A 11 LEU H 1.0 1.8 4.0 105 100 A 6 LEU HG A 11 LEU HDx% 1.0 1.8 4.5 106 101 A 6 LEU HBx A 11 LEU HDx% 1.0 1.8 4.0 107 102 A 6 LEU HDy% A 11 LEU HA 1.0 1.8 3.5 108 103 A 6 LEU HDx% A 11 LEU HA 1.0 1.8 5.5 109 104 A 6 LEU HBy A 11 LEU HA 1.0 1.8 2.7 110 105 A 6 LEU HG A 11 LEU HA 1.0 1.8 3.5 111 106 A 6 LEU HBx A 11 LEU HA 1.0 1.8 4.0 112 107 A 6 LEU HBy A 11 LEU HBy 1.0 1.8 2.7 113 108 A 6 LEU HDy% A 11 LEU HDx% 1.0 1.8 3.8 114 109 A 6 LEU HG A 14 ALA H 1.0 1.8 4.6 115 110 A 6 LEU HDx% A 14 ALA H 1.0 1.8 6.5 116 111 A 6 LEU HDx% A 14 ALA HB% 1.0 1.8 4.5 117 112 A 6 LEU HDy% A 14 ALA HB% 1.0 1.8 3.0 118 113 A 6 LEU HBy A 14 ALA HB% 1.0 1.8 5.0 119 114 A 6 LEU HDy% A 14 ALA H 1.0 1.8 5.0 120 115 A 6 LEU HDy% A 15 LEU H 1.0 1.8 5.0 121 116 A 6 LEU H A 44 CYS HA 1.0 1.8 4.2 122 117 A 6 LEU HBx A 44 CYS H 1.0 1.8 5.5 123 118 A 6 LEU HBy A 44 CYS HBx 1.0 1.8 4.0 124 119 A 6 LEU HBy A 44 CYS HBy 1.0 1.8 4.0 125 120 A 6 LEU H A 45 CYS HA 1.0 1.8 3.5 126 121 A 6 LEU H A 45 CYS HBx 1.0 1.8 5.0 127 122 A 6 LEU HBy A 45 CYS HBx 1.0 1.8 4.7 128 123 A 6 LEU HBx A 45 CYS H 1.0 1.8 4.3 129 124 A 6 LEU H A 48 ILE HA 1.0 1.8 4.6 130 125 A 6 LEU HBx A 54 LEU HDx% 1.0 1.8 5.0 131 126 A 6 LEU HDy% A 54 LEU HDy% 1.0 1.8 5.0 132 127 A 6 LEU HDy% A 54 LEU HDx% 1.0 1.8 3.7 133 128 A 7 CYS HA A 7 CYS HBx 1.0 1.8 2.7 134 129 A 7 CYS H A 7 CYS HA 1.0 1.8 3.0 135 130 A 7 CYS H A 7 CYS HBx 1.0 1.8 3.8 136 131 A 7 CYS H A 7 CYS HBy 1.0 1.8 2.8 137 132 A 7 CYS HBx A 8 GLY H 1.0 1.8 3.5 138 133 A 7 CYS HBy A 8 GLY H 1.0 1.8 4.3 139 134 A 7 CYS HA A 8 GLY H 1.0 1.8 3.5 140 135 A 7 CYS HA A 8 GLY HAy 1.0 1.8 6.0 141 136 A 7 CYS H A 10 HIS HBy 1.0 1.8 3.5 142 137 A 7 CYS H A 10 HIS HBx 1.0 1.8 5.0 143 138 A 10 HIS HBy A 7 CYS HA 1.0 1.8 4.2 144 139 A 7 CYS H A 11 LEU H 1.0 1.8 5.0 145 140 A 45 CYS H A 7 CYS HA 1.0 1.8 5.0 146 141 A 7 CYS HA A 45 CYS HBy 1.0 1.8 4.0 147 142 A 45 CYS HBx A 7 CYS HA 1.0 1.8 2.7 148 143 A 45 CYS HBx A 7 CYS HBx 1.0 1.8 4.3 149 144 A 8 GLY H A 8 GLY HAy 1.0 1.8 3.0 150 145 A 8 GLY H A 8 GLY HAx 1.0 1.8 3.2 151 146 A 8 GLY H A 9 SER H 1.0 1.8 5.0 152 147 A 8 GLY HAx A 9 SER H 1.0 1.8 2.9 153 148 A 8 GLY HAy A 9 SER H 1.0 1.8 3.3 154 149 A 8 GLY HAy A 9 SER HA 1.0 1.8 5.0 155 150 A 10 HIS H A 8 GLY HAx 1.0 1.8 3.7 156 151 A 11 LEU HBy A 8 GLY HAy 1.0 1.8 4.5 157 152 A 8 GLY HAy A 12 VAL HGy% 1.0 1.8 5.5 158 153 A 8 GLY H A 41 VAL HGx% 1.0 1.8 4.0 159 154 A 8 GLY HAy A 41 VAL HGx% 1.0 1.8 5.0 160 155 A 45 CYS HBx A 8 GLY H 1.0 1.8 4.4 161 156 A 9 SER H A 9 SER HBx 1.0 1.8 4.0 162 157 A 9 SER H A 9 SER HBy 1.0 1.8 3.5 163 158 A 10 HIS H A 9 SER H 1.0 1.8 4.0 164 159 A 10 HIS H A 9 SER HBy 1.0 1.8 2.9 165 160 A 10 HIS H A 9 SER HA 1.0 1.8 3.6 166 161 A 11 LEU H A 9 SER H 1.0 1.8 5.0 167 162 A 9 SER HA A 12 VAL HGy% 1.0 1.8 4.0 168 163 A 10 HIS HBy A 10 HIS HA 1.0 1.8 2.9 169 164 A 10 HIS HBx A 10 HIS HA 1.0 1.8 3.3 170 165 A 10 HIS H A 10 HIS HA 1.0 1.8 3.0 171 166 A 10 HIS H A 10 HIS HBx 1.0 1.8 3.6 172 167 A 10 HIS H A 10 HIS HBy 1.0 1.8 2.9 173 168 A 10 HIS HBx A 10 HIS HE1 1.0 1.8 5.2 174 169 A 10 HIS HA A 10 HIS HE1 1.0 1.8 6.0 175 170 A 10 HIS HBx A 11 LEU H 1.0 1.8 4.0 176 171 A 10 HIS HBy A 11 LEU H 1.0 1.8 4.0 177 172 A 10 HIS H A 11 LEU H 1.0 1.8 3.3 178 173 A 10 HIS HA A 13 GLU H 1.0 1.8 4.0 179 174 A 10 HIS HA A 13 GLU HBy 1.0 1.8 3.4 180 175 A 11 LEU HA A 11 LEU HBx 1.0 1.8 3.7 181 176 A 11 LEU HA A 11 LEU HBy 1.0 1.8 2.9 182 177 A 11 LEU H A 11 LEU HA 1.0 1.8 3.0 183 178 A 11 LEU H A 11 LEU HBx 1.0 1.8 3.5 184 179 A 11 LEU H A 11 LEU HBy 1.0 1.8 3.5 185 180 A 11 LEU H A 11 LEU HG 1.0 1.8 4.5 186 181 A 11 LEU HDx% A 11 LEU HA 1.0 1.8 3.2 187 182 A 11 LEU H A 11 LEU HDy% 1.0 1.8 5.5 188 183 A 11 LEU H A 12 VAL HGy% 1.0 1.8 5.5 189 184 A 11 LEU HA A 12 VAL H 1.0 1.8 4.0 190 185 A 11 LEU HDx% A 12 VAL H 1.0 1.8 5.5 191 186 A 11 LEU HG A 12 VAL H 1.0 1.8 4.0 192 187 A 11 LEU HBy A 12 VAL H 1.0 1.8 4.0 193 188 A 11 LEU HBx A 12 VAL H 1.0 1.8 3.2 194 189 A 11 LEU HDy% A 12 VAL H 1.0 1.8 5.2 195 190 A 11 LEU HA A 14 ALA H 1.0 1.8 5.0 196 191 A 11 LEU HDx% A 14 ALA H 1.0 1.8 5.5 197 192 A 11 LEU HDx% A 14 ALA HB% 1.0 1.8 5.0 198 193 A 11 LEU HA A 14 ALA HB% 1.0 1.8 3.5 199 194 A 11 LEU HDx% A 15 LEU H 1.0 1.8 4.5 200 195 A 11 LEU HA A 15 LEU H 1.0 1.8 4.0 201 196 A 11 LEU HDx% A 15 LEU HDy% 1.0 1.8 5.0 202 197 A 11 LEU HDx% A 15 LEU HDx% 1.0 1.8 4.0 203 198 A 11 LEU HDy% A 15 LEU HDx% 1.0 1.8 4.2 204 199 A 11 LEU HBy A 15 LEU HDx% 1.0 1.8 5.2 205 200 A 11 LEU HBx A 24 PHE HEy 1.0 1.8 5.2 206 201 A 11 LEU HA A 26 TYR HEx 1.0 1.8 5.0 207 202 A 11 LEU HBy A 26 TYR HEx 1.0 1.8 4.0 208 203 A 11 LEU HDy% A 26 TYR HEx 1.0 1.8 3.8 209 204 A 11 LEU HG A 26 TYR HEx 1.0 1.8 3.5 210 205 A 11 LEU HBx A 26 TYR HEx 1.0 1.8 2.7 211 206 A 11 LEU HBx A 26 TYR HDx 1.0 1.8 5.0 212 207 A 11 LEU HDy% A 40 ILE HA 1.0 1.8 5.0 213 208 A 11 LEU HDy% A 40 ILE HD1% 1.0 1.8 3.5 214 209 A 11 LEU HDy% A 40 ILE HG2% 1.0 1.8 4.0 215 210 A 11 LEU HDx% A 40 ILE HD1% 1.0 1.8 4.0 216 211 A 11 LEU HDy% A 41 VAL HA 1.0 1.8 3.7 217 212 A 41 VAL HGx% A 11 LEU HDy% 1.0 1.8 5.5 218 213 A 44 CYS HBy A 11 LEU HDy% 1.0 1.8 3.8 219 214 A 11 LEU HDx% A 44 CYS HBx 1.0 1.8 3.8 220 215 A 11 LEU HDx% A 54 LEU HA 1.0 1.8 5.0 221 216 A 54 LEU HDx% A 11 LEU HDx% 1.0 1.8 4.5 222 217 A 11 LEU HDx% A 54 LEU HDy% 1.0 1.8 3.5 223 218 A 12 VAL HA A 12 VAL HB 1.0 1.8 3.2 224 219 A 12 VAL H A 12 VAL HA 1.0 1.8 2.9 225 220 A 12 VAL HGy% A 12 VAL H 1.0 1.8 3.3 226 221 A 12 VAL H A 12 VAL HGx% 1.0 1.8 4.5 227 222 A 12 VAL H A 12 VAL HB 1.0 1.8 3.2 228 223 A 12 VAL HGy% A 12 VAL HA 1.0 1.8 3.2 229 224 A 12 VAL HA A 12 VAL HGx% 1.0 1.8 3.3 230 225 A 13 GLU H A 12 VAL HA 1.0 1.8 4.0 231 226 A 13 GLU H A 12 VAL HGx% 1.0 1.8 4.0 232 227 A 12 VAL HGy% A 13 GLU H 1.0 1.8 4.3 233 228 A 13 GLU H A 12 VAL HB 1.0 1.8 3.5 234 229 A 13 GLU H A 12 VAL H 1.0 1.8 3.5 235 230 A 12 VAL HGx% A 13 GLU HA 1.0 1.8 5.0 236 231 A 14 ALA H A 12 VAL HGy% 1.0 1.8 6.0 237 232 A 14 ALA H A 12 VAL HGx% 1.0 1.8 5.5 238 233 A 15 LEU H A 12 VAL HA 1.0 1.8 3.5 239 234 A 15 LEU HDx% A 12 VAL HA 1.0 1.8 4.0 240 235 A 12 VAL HA A 15 LEU HBy 1.0 1.8 5.0 241 236 A 12 VAL HA A 15 LEU HBx 1.0 1.8 5.0 242 237 A 12 VAL HA A 16 TYR H 1.0 1.8 4.0 243 238 A 12 VAL HGx% A 16 TYR HBx 1.0 1.8 4.0 244 239 A 12 VAL HGy% A 24 PHE HEy 1.0 1.8 3.2 245 240 A 12 VAL HA A 24 PHE HZ 1.0 1.8 3.2 246 241 A 12 VAL HGx% A 24 PHE HZ 1.0 1.8 3.2 247 242 A 12 VAL HGy% A 24 PHE HZ 1.0 1.8 3.5 248 243 A 12 VAL HB A 24 PHE HZ 1.0 1.8 4.3 249 244 A 12 VAL HGy% A 26 TYR HEx 1.0 1.8 4.0 250 245 A 13 GLU HA A 13 GLU HBx 1.0 1.8 3.3 251 246 A 13 GLU HBy A 13 GLU HA 1.0 1.8 3.3 252 247 A 13 GLU H A 13 GLU HA 1.0 1.8 3.0 253 248 A 13 GLU H A 13 GLU HGy 1.0 1.8 2.9 254 249 A 13 GLU H A 13 GLU HBx 1.0 1.8 3.8 255 250 A 13 GLU H A 13 GLU HBy 1.0 1.8 2.9 256 251 A 13 GLU HA A 13 GLU HGy 1.0 1.8 2.7 257 252 A 14 ALA H A 13 GLU HGy 1.0 1.8 4.3 258 253 A 14 ALA H A 13 GLU HA 1.0 1.8 3.8 259 254 A 14 ALA H A 13 GLU HBy 1.0 1.8 3.0 260 255 A 14 ALA H A 13 GLU HBx 1.0 1.8 4.0 261 256 A 14 ALA H A 13 GLU H 1.0 1.8 3.2 262 257 A 13 GLU HA A 16 TYR H 1.0 1.8 4.0 263 258 A 13 GLU HA A 16 TYR HBx 1.0 1.8 4.0 264 259 A 14 ALA H A 14 ALA HA 1.0 1.8 3.0 265 260 A 14 ALA H A 14 ALA HB% 1.0 1.8 3.4 266 261 A 14 ALA H A 15 LEU H 1.0 1.8 3.0 267 262 A 14 ALA HB% A 15 LEU H 1.0 1.8 3.4 268 263 A 15 LEU H A 14 ALA HA 1.0 1.8 4.0 269 264 A 17 LEU HBy A 14 ALA HA 1.0 1.8 3.4 270 265 A 14 ALA HA A 17 LEU HDx% 1.0 1.8 3.3 271 266 A 17 LEU HDy% A 14 ALA HA 1.0 1.8 5.0 272 267 A 14 ALA H A 17 LEU HDx% 1.0 1.8 5.2 273 268 A 14 ALA HA A 17 LEU H 1.0 1.8 3.5 274 269 A 14 ALA HA A 18 VAL H 1.0 1.8 5.0 275 270 A 54 LEU HDx% A 14 ALA HB% 1.0 1.8 4.0 276 271 A 15 LEU HBy A 15 LEU HA 1.0 1.8 3.5 277 272 A 15 LEU H A 15 LEU HA 1.0 1.8 3.0 278 273 A 15 LEU H A 15 LEU HBx 1.0 1.8 4.0 279 274 A 15 LEU H A 15 LEU HBy 1.0 1.8 3.0 280 275 A 15 LEU H A 15 LEU HG 1.0 1.8 3.5 281 276 A 15 LEU H A 15 LEU HDx% 1.0 1.8 4.5 282 277 A 15 LEU H A 15 LEU HDy% 1.0 1.8 5.0 283 278 A 15 LEU HDy% A 15 LEU HBy 1.0 1.8 3.8 284 279 A 15 LEU HDx% A 15 LEU HBy 1.0 1.8 3.2 285 280 A 15 LEU HDx% A 15 LEU HA 1.0 1.8 5.0 286 281 A 15 LEU HDy% A 15 LEU HA 1.0 1.8 3.7 287 282 A 15 LEU HA A 15 LEU HG 1.0 1.8 3.0 288 283 A 16 TYR H A 15 LEU HG 1.0 1.8 5.0 289 284 A 15 LEU HBx A 16 TYR H 1.0 1.8 3.8 290 285 A 15 LEU HBy A 16 TYR H 1.0 1.8 3.0 291 286 A 16 TYR H A 15 LEU HA 1.0 1.8 3.5 292 287 A 15 LEU HBx A 17 LEU H 1.0 1.8 6.0 293 288 A 15 LEU H A 17 LEU HDx% 1.0 1.8 5.8 294 289 A 15 LEU HA A 18 VAL HB 1.0 1.8 2.7 295 290 A 18 VAL HGx% A 15 LEU HA 1.0 1.8 4.3 296 291 A 18 VAL H A 15 LEU HA 1.0 1.8 4.0 297 292 A 15 LEU HA A 18 VAL HGy% 1.0 1.8 3.5 298 293 A 18 VAL HGx% A 15 LEU HDy% 1.0 1.8 5.5 299 294 A 15 LEU HDy% A 18 VAL HB 1.0 1.8 4.5 300 295 A 18 VAL HGx% A 15 LEU HA 1.0 1.8 4.7 301 296 A 15 LEU HA A 19 CYS H 1.0 1.8 3.5 302 297 A 24 PHE HEy A 15 LEU HBy 1.0 1.8 4.0 303 298 A 15 LEU HBy A 24 PHE HEx 1.0 1.8 4.0 304 299 A 15 LEU HDx% A 24 PHE HEy 1.0 1.8 3.7 305 300 A 15 LEU HDy% A 24 PHE HEy 1.0 1.8 5.8 306 301 A 15 LEU HBx A 24 PHE HEx 1.0 1.8 4.0 307 302 A 15 LEU HBx A 24 PHE HDx 1.0 1.8 3.8 308 303 A 15 LEU HDy% A 24 PHE HDy 1.0 1.8 5.0 309 304 A 15 LEU HDx% A 24 PHE HDy 1.0 1.8 3.8 310 305 A 15 LEU HBx A 24 PHE HZ 1.0 1.8 4.3 311 306 A 24 PHE HZ A 15 LEU HG 1.0 1.8 5.8 312 307 A 15 LEU HBy A 24 PHE HZ 1.0 1.8 3.2 313 308 A 15 LEU HDx% A 26 TYR HEx 1.0 1.8 4.0 314 309 A 15 LEU HDy% A 40 ILE HD1% 1.0 1.8 5.2 315 310 A 54 LEU HDx% A 15 LEU H 1.0 1.8 5.0 316 311 A 15 LEU HDy% A 54 LEU HBy 1.0 1.8 3.2 317 312 A 15 LEU HDy% A 54 LEU HA 1.0 1.8 3.5 318 313 A 54 LEU HDy% A 15 LEU HDx% 1.0 1.8 4.3 319 314 A 15 LEU HDy% A 57 TYR HBy 1.0 1.8 3.3 320 315 A 15 LEU HDy% A 57 TYR H 1.0 1.8 4.5 321 316 A 15 LEU HDy% A 57 TYR HBx 1.0 1.8 4.8 322 317 A 15 LEU HDy% A 58 CYS H 1.0 1.8 5.0 323 318 A 16 TYR H A 16 TYR HA 1.0 1.8 3.0 324 319 A 16 TYR H A 16 TYR HBx 1.0 1.8 3.0 325 320 A 16 TYR HBx A 16 TYR HEx 1.0 1.8 5.5 326 321 A 16 TYR HA A 16 TYR HDy 1.0 1.8 2.7 327 322 A 16 TYR HBx A 17 LEU H 1.0 1.8 4.0 328 323 A 17 LEU H A 16 TYR HA 1.0 1.8 3.8 329 324 A 16 TYR H A 17 LEU HDx% 1.0 1.8 4.5 330 325 A 17 LEU HDx% A 16 TYR HDx 1.0 1.8 5.5 331 326 A 17 LEU HDx% A 16 TYR HEx 1.0 1.8 4.0 332 327 A 16 TYR HDx A 17 LEU HG 1.0 1.8 4.0 333 328 A 16 TYR H A 19 CYS H 1.0 1.8 5.0 334 329 A 16 TYR HA A 19 CYS HBx 1.0 1.8 3.5 335 330 A 16 TYR HA A 20 GLY H 1.0 1.8 6.0 336 331 A 16 TYR HBx A 20 GLY H 1.0 1.8 6.2 337 332 A 16 TYR H A 24 PHE HEx 1.0 1.8 3.5 338 333 A 24 PHE HEx A 16 TYR HA 1.0 1.8 2.7 339 334 A 24 PHE HEx A 16 TYR HBy 1.0 1.8 4.0 340 335 A 16 TYR HBx A 24 PHE HEx 1.0 1.8 3.2 341 336 A 16 TYR HBx A 24 PHE HZ 1.0 1.8 4.0 342 337 A 24 PHE HZ A 16 TYR HA 1.0 1.8 4.5 343 338 A 16 TYR H A 24 PHE HZ 1.0 1.8 4.0 344 339 A 24 PHE HZ A 16 TYR HBy 1.0 1.8 5.5 345 340 A 24 PHE HDx A 16 TYR HA 1.0 1.8 3.5 346 341 A 17 LEU HBx A 17 LEU HA 1.0 1.8 3.3 347 342 A 17 LEU HBy A 17 LEU HA 1.0 1.8 3.3 348 343 A 17 LEU H A 17 LEU HA 1.0 1.8 3.2 349 344 A 17 LEU H A 17 LEU HG 1.0 1.8 4.0 350 345 A 17 LEU HBx A 17 LEU H 1.0 1.8 3.5 351 346 A 17 LEU HBy A 17 LEU H 1.0 1.8 3.0 352 347 A 17 LEU HDy% A 17 LEU H 1.0 1.8 5.5 353 348 A 17 LEU HDx% A 17 LEU H 1.0 1.8 3.2 354 349 A 17 LEU HDx% A 17 LEU HA 1.0 1.8 4.0 355 350 A 17 LEU HDy% A 17 LEU HA 1.0 1.8 4.5 356 351 A 17 LEU HG A 17 LEU HA 1.0 1.8 2.7 357 352 A 17 LEU H A 18 VAL HGy% 1.0 1.8 5.5 358 353 A 17 LEU H A 18 VAL H 1.0 1.8 2.9 359 354 A 18 VAL H A 17 LEU HA 1.0 1.8 3.5 360 355 A 17 LEU HDx% A 18 VAL H 1.0 1.8 4.5 361 356 A 17 LEU HBy A 18 VAL H 1.0 1.8 3.3 362 357 A 17 LEU HBx A 18 VAL H 1.0 1.8 3.5 363 358 A 18 VAL H A 17 LEU HG 1.0 1.8 5.0 364 359 A 19 CYS H A 17 LEU HA 1.0 1.8 5.0 365 360 A 20 GLY H A 17 LEU HA 1.0 1.8 3.5 366 361 A 18 VAL HB A 18 VAL HA 1.0 1.8 3.3 367 362 A 18 VAL H A 18 VAL HA 1.0 1.8 3.0 368 363 A 18 VAL HGx% A 18 VAL H 1.0 1.8 4.5 369 364 A 18 VAL H A 18 VAL HGy% 1.0 1.8 3.4 370 365 A 18 VAL H A 18 VAL HB 1.0 1.8 2.9 371 366 A 18 VAL HGx% A 18 VAL HA 1.0 1.8 3.0 372 367 A 18 VAL HGy% A 18 VAL HA 1.0 1.8 3.2 373 368 A 19 CYS H A 18 VAL HA 1.0 1.8 3.6 374 369 A 18 VAL HB A 19 CYS H 1.0 1.8 2.9 375 370 A 18 VAL HGx% A 19 CYS H 1.0 1.8 4.0 376 371 A 18 VAL HGy% A 19 CYS H 1.0 1.8 4.5 377 372 A 18 VAL HB A 20 GLY H 1.0 1.8 4.5 378 373 A 18 VAL H A 20 GLY H 1.0 1.8 4.0 379 374 A 18 VAL HGy% A 51 LEU HA 1.0 1.8 4.3 380 375 A 18 VAL HGx% A 51 LEU HA 1.0 1.8 5.0 381 376 A 51 LEU HDy% A 18 VAL HGy% 1.0 1.8 4.0 382 377 A 18 VAL HGy% A 54 LEU HBy 1.0 1.8 3.7 383 378 A 18 VAL HGx% A 54 LEU HBy 1.0 1.8 4.0 384 379 A 18 VAL HGx% A 54 LEU HA 1.0 1.8 5.3 385 380 A 54 LEU HDx% A 18 VAL HGy% 1.0 1.8 4.0 386 381 A 18 VAL HGy% A 55 GLU H 1.0 1.8 5.5 387 382 A 18 VAL HGx% A 55 GLU H 1.0 1.8 3.5 388 383 A 19 CYS HA A 19 CYS HBy 1.0 1.8 2.8 389 384 A 19 CYS HBx A 19 CYS HA 1.0 1.8 3.1 390 385 A 19 CYS H A 19 CYS HA 1.0 1.8 3.3 391 386 A 19 CYS H A 19 CYS HBy 1.0 1.8 3.5 392 387 A 19 CYS H A 19 CYS HBx 1.0 1.8 2.7 393 388 A 20 GLY H A 19 CYS HA 1.0 1.8 4.0 394 389 A 19 CYS H A 20 GLY H 1.0 1.8 3.0 395 390 A 20 GLY H A 19 CYS HBy 1.0 1.8 4.5 396 391 A 19 CYS HBx A 20 GLY H 1.0 1.8 3.1 397 392 A 19 CYS HA A 22 ARG H 1.0 1.8 4.5 398 393 A 19 CYS HBx A 22 ARG H 1.0 1.8 5.0 399 394 A 19 CYS HBx A 23 GLY H 1.0 1.8 3.5 400 395 A 19 CYS HBy A 23 GLY H 1.0 1.8 3.5 401 396 A 24 PHE HDx A 19 CYS HBx 1.0 1.8 3.2 402 397 A 19 CYS H A 24 PHE HEx 1.0 1.8 5.4 403 398 A 19 CYS HBy A 24 PHE H 1.0 1.8 5.0 404 399 A 19 CYS H A 58 CYS HBy 1.0 1.8 4.8 405 400 A 19 CYS HA A 58 CYS HBy 1.0 1.8 2.7 406 401 A 19 CYS HA A 58 CYS HBx 1.0 1.8 3.5 407 402 A 19 CYS HBy A 58 CYS HA 1.0 1.8 2.8 408 403 A 19 CYS HBy A 58 CYS HBy 1.0 1.8 2.7 409 404 A 19 CYS HBy A 59 GLY H 1.0 1.8 4.0 410 405 A 20 GLY H A 20 GLY HAy 1.0 1.8 2.9 411 406 A 20 GLY H A 20 GLY HAx 1.0 1.8 2.9 412 407 A 20 GLY H A 21 GLU H 1.0 1.8 4.7 413 408 A 20 GLY HAx A 21 GLU H 1.0 1.8 2.9 414 409 A 20 GLY HAy A 21 GLU H 1.0 1.8 3.4 415 410 A 22 ARG H A 20 GLY HAy 1.0 1.8 5.0 416 411 A 21 GLU HA A 21 GLU HBx 1.0 1.8 2.8 417 412 A 21 GLU HA A 21 GLU HBy 1.0 1.8 3.2 418 413 A 21 GLU HA A 21 GLU HGx 1.0 1.8 3.0 419 414 A 21 GLU H A 21 GLU HA 1.0 1.8 3.0 420 415 A 21 GLU H A 21 GLU HGy 1.0 1.8 4.0 421 416 A 21 GLU H A 21 GLU HGx 1.0 1.8 3.0 422 417 A 21 GLU H A 21 GLU HBy 1.0 1.8 3.0 423 418 A 21 GLU H A 21 GLU HBx 1.0 1.8 3.8 424 419 A 22 ARG H A 21 GLU H 1.0 1.8 2.8 425 420 A 22 ARG H A 21 GLU HBy 1.0 1.8 3.5 426 421 A 22 ARG H A 21 GLU HGx 1.0 1.8 5.0 427 422 A 22 ARG H A 21 GLU HA 1.0 1.8 3.8 428 423 A 23 GLY H A 21 GLU HBy 1.0 1.8 5.3 429 424 A 23 GLY H A 21 GLU HA 1.0 1.8 3.8 430 425 A 22 ARG HA A 22 ARG HBx 1.0 1.8 2.8 431 426 A 22 ARG HA A 22 ARG HBy 1.0 1.8 3.3 432 427 A 22 ARG H A 22 ARG HA 1.0 1.8 2.9 433 428 A 22 ARG HA A 22 ARG HGy 1.0 1.8 2.9 434 429 A 22 ARG H A 22 ARG HBx 1.0 1.8 3.8 435 430 A 22 ARG H A 22 ARG HGx 1.0 1.8 3.4 436 431 A 22 ARG H A 22 ARG HGy 1.0 1.8 3.6 437 432 A 22 ARG H A 22 ARG HDx 1.0 1.8 5.0 438 432 A 22 ARG H A 22 ARG HDy 1.0 1.8 5.0 439 433 A 22 ARG H A 23 GLY H 1.0 1.8 3.3 440 434 A 23 GLY H A 22 ARG HGy 1.0 1.8 5.5 441 435 A 23 GLY H A 22 ARG HBy 1.0 1.8 3.3 442 436 A 23 GLY H A 22 ARG HA 1.0 1.8 4.2 443 437 A 59 GLY H A 22 ARG HBy 1.0 1.8 5.0 444 438 A 59 GLY H A 22 ARG HBx 1.0 1.8 5.5 445 439 A 23 GLY H A 23 GLY HAy 1.0 1.8 2.9 446 440 A 23 GLY H A 23 GLY HAx 1.0 1.8 3.4 447 441 A 24 PHE H A 23 GLY HAx 1.0 1.8 3.5 448 442 A 24 PHE H A 23 GLY HAy 1.0 1.8 3.5 449 443 A 23 GLY H A 24 PHE H 1.0 1.8 4.5 450 444 A 24 PHE HDx A 23 GLY H 1.0 1.8 4.3 451 445 A 24 PHE HDx A 23 GLY HAy 1.0 1.8 3.5 452 446 A 24 PHE HEx A 23 GLY HAy 1.0 1.8 5.0 453 447 A 23 GLY HAy A 24 PHE HA 1.0 1.8 4.8 454 448 A 23 GLY H A 58 CYS HBx 1.0 1.8 6.0 455 449 A 24 PHE HA A 24 PHE HBx 1.0 1.8 2.8 456 450 A 24 PHE HA A 24 PHE HBy 1.0 1.8 2.8 457 451 A 24 PHE H A 24 PHE HA 1.0 1.8 3.2 458 452 A 24 PHE H A 24 PHE HBx 1.0 1.8 3.5 459 453 A 24 PHE H A 24 PHE HBy 1.0 1.8 4.2 460 454 A 24 PHE HDx A 24 PHE H 1.0 1.8 3.5 461 455 A 24 PHE HEx A 24 PHE H 1.0 1.8 4.0 462 456 A 24 PHE HDx A 24 PHE HA 1.0 1.8 3.8 463 457 A 24 PHE HDx A 24 PHE HBx 1.0 1.8 2.7 464 458 A 24 PHE HDy A 24 PHE HBy 1.0 1.8 2.7 465 459 A 24 PHE HDx A 24 PHE HBy 1.0 1.8 3.8 466 460 A 24 PHE HDy A 24 PHE HBx 1.0 1.8 3.8 467 461 A 24 PHE HA A 25 PHE H 1.0 1.8 2.9 468 462 A 24 PHE H A 25 PHE HA 1.0 1.8 5.0 469 463 A 24 PHE H A 25 PHE H 1.0 1.8 4.5 470 464 A 24 PHE HA A 25 PHE HDy 1.0 1.8 4.2 471 465 A 24 PHE HA A 25 PHE HBx 1.0 1.8 4.2 472 466 A 24 PHE HDy A 26 TYR H 1.0 1.8 4.5 473 467 A 24 PHE HDy A 26 TYR HA 1.0 1.8 4.5 474 468 A 24 PHE HEy A 26 TYR HA 1.0 1.8 4.0 475 469 A 24 PHE HEy A 26 TYR HBx 1.0 1.8 3.8 476 469 A 24 PHE HEy A 26 TYR HBy 1.0 1.8 3.8 477 470 A 24 PHE HDy A 57 TYR HBx 1.0 1.8 4.3 478 471 A 24 PHE HBy A 57 TYR HDy 1.0 1.8 4.7 479 472 A 57 TYR H A 24 PHE HBy 1.0 1.8 5.2 480 473 A 57 TYR HBx A 24 PHE HBy 1.0 1.8 3.3 481 474 A 57 TYR HBy A 24 PHE HBx 1.0 1.8 3.5 482 475 A 58 CYS HBy A 24 PHE HBx 1.0 1.8 4.5 483 476 A 24 PHE H A 58 CYS HA 1.0 1.8 5.0 484 477 A 58 CYS H A 24 PHE HA 1.0 1.8 4.5 485 478 A 24 PHE HDx A 58 CYS HA 1.0 1.8 4.3 486 479 A 58 CYS H A 24 PHE HBy 1.0 1.8 5.0 487 480 A 58 CYS HA A 24 PHE HBx 1.0 1.8 3.3 488 481 A 58 CYS HA A 24 PHE HBy 1.0 1.8 3.6 489 482 A 59 GLY H A 24 PHE HBx 1.0 1.8 3.3 490 483 A 59 GLY H A 24 PHE HBy 1.0 1.8 4.0 491 484 A 59 GLY H A 24 PHE HA 1.0 1.8 3.5 492 485 A 25 PHE H A 25 PHE HA 1.0 1.8 3.2 493 486 A 25 PHE H A 25 PHE HBx 1.0 1.8 3.2 494 487 A 25 PHE H A 25 PHE HBy 1.0 1.8 4.0 495 488 A 25 PHE H A 25 PHE HDx 1.0 1.8 4.5 496 489 A 25 PHE H A 25 PHE HDy 1.0 1.8 3.2 497 490 A 25 PHE H A 25 PHE HEy 1.0 1.8 4.5 498 491 A 25 PHE HDy A 25 PHE HBy 1.0 1.8 3.8 499 492 A 25 PHE HDy A 25 PHE HBx 1.0 1.8 2.7 500 493 A 25 PHE HBx A 25 PHE HDx 1.0 1.8 3.5 501 494 A 25 PHE HBy A 25 PHE HDx 1.0 1.8 2.7 502 495 A 25 PHE HA A 26 TYR H 1.0 1.8 4.8 503 496 A 26 TYR H A 25 PHE HBy 1.0 1.8 3.5 504 497 A 25 PHE HBx A 26 TYR H 1.0 1.8 4.5 505 498 A 25 PHE H A 26 TYR HA 1.0 1.8 6.0 506 499 A 25 PHE HZ A 36 ARG HDx 1.0 1.8 4.5 507 499 A 25 PHE HZ A 36 ARG HDy 1.0 1.8 4.5 508 500 A 57 TYR HBx A 25 PHE H 1.0 1.8 5.0 509 501 A 57 TYR HBx A 25 PHE HDy 1.0 1.8 3.3 510 502 A 59 GLY H A 25 PHE HBx 1.0 1.8 5.0 511 503 A 25 PHE HEx A 40 ILE HB 1.0 1.8 5.5 512 504 A 25 PHE HEy A 40 ILE HB 1.0 1.8 6.0 513 505 A 25 PHE HEy A 40 ILE HG1x 1.0 1.8 4.8 514 506 A 26 TYR HA A 26 TYR HBx 1.0 1.8 2.7 515 506 A 26 TYR HA A 26 TYR HBy 1.0 1.8 2.7 516 507 A 26 TYR H A 26 TYR HA 1.0 1.8 3.5 517 508 A 26 TYR HDx A 26 TYR H 1.0 1.8 4.5 518 509 A 26 TYR H A 26 TYR HBx 1.0 1.8 3.0 519 509 A 26 TYR H A 26 TYR HBy 1.0 1.8 3.0 520 510 A 26 TYR HA A 27 THR H 1.0 1.8 3.7 521 511 A 26 TYR HDy A 27 THR HG2% 1.0 1.8 3.7 522 512 A 26 TYR HDx A 27 THR HG2% 1.0 1.8 6.0 523 513 A 41 VAL HGx% A 26 TYR HEy 1.0 1.8 5.5 524 514 A 27 THR HG2% A 27 THR HA 1.0 1.8 4.0 525 515 A 27 THR H A 27 THR HG2% 1.0 1.8 4.0 526 516 A 27 THR H A 27 THR HB 1.0 1.8 3.0 527 517 A 27 THR HG2% A 28 PRO HA 1.0 1.8 5.8 528 518 A 27 THR HG2% A 28 PRO HDx 1.0 1.8 5.5 529 519 A 27 THR HA A 28 PRO HDy 1.0 1.8 2.7 530 520 A 27 THR HA A 28 PRO HDx 1.0 1.8 2.7 531 521 A 27 THR HG2% A 29 ARG H 1.0 1.8 5.5 532 522 A 27 THR HG2% A 30 THR H 1.0 1.8 6.0 533 523 A 28 PRO HA A 28 PRO HGx 1.0 1.8 4.0 534 524 A 29 ARG H A 28 PRO HBx 1.0 1.8 4.2 535 525 A 28 PRO HDx A 29 ARG H 1.0 1.8 6.0 536 526 A 28 PRO HA A 29 ARG H 1.0 1.8 4.0 537 527 A 28 PRO HDy A 29 ARG H 1.0 1.8 6.0 538 528 A 29 ARG H A 28 PRO HBy 1.0 1.8 5.0 539 529 A 29 ARG H A 28 PRO HBx 1.0 1.8 5.3 540 530 A 28 PRO HA A 29 ARG HDx 1.0 1.8 5.8 541 531 A 28 PRO HA A 29 ARG HDy 1.0 1.8 4.5 542 532 A 28 PRO HDx A 29 ARG HDy 1.0 1.8 5.8 543 533 A 30 THR H A 28 PRO HGx 1.0 1.8 6.0 544 534 A 29 ARG H A 29 ARG HA 1.0 1.8 3.2 545 535 A 29 ARG H A 29 ARG HGx 1.0 1.8 4.0 546 536 A 29 ARG H A 29 ARG HBx 1.0 1.8 3.7 547 536 A 29 ARG H A 29 ARG HBy 1.0 1.8 3.7 548 537 A 29 ARG H A 29 ARG HGy 1.0 1.8 4.2 549 538 A 29 ARG HA A 29 ARG HGx 1.0 1.8 5.0 550 539 A 30 THR H A 29 ARG HA 1.0 1.8 4.0 551 540 A 30 THR H A 29 ARG HGy 1.0 1.8 5.0 552 541 A 30 THR H A 29 ARG HGx 1.0 1.8 5.0 553 542 A 30 THR H A 29 ARG HBx 1.0 1.8 4.3 554 542 A 30 THR H A 29 ARG HBy 1.0 1.8 4.3 555 543 A 30 THR H A 30 THR HA 1.0 1.8 2.9 556 544 A 30 THR H A 30 THR HB 1.0 1.8 4.0 557 545 A 30 THR H A 30 THR HG2% 1.0 1.8 3.5 558 546 A 30 THR HA A 30 THR HG2% 1.0 1.8 3.5 559 547 A 30 THR HG2% A 31 GLU H 1.0 1.8 5.3 560 548 A 30 THR HA A 31 GLU H 1.0 1.8 3.8 561 549 A 30 THR HB A 32 GLU H 1.0 1.8 4.0 562 550 A 30 THR HG2% A 32 GLU H 1.0 1.8 5.5 563 551 A 30 THR HA A 32 GLU H 1.0 1.8 4.0 564 552 A 30 THR HA A 32 GLU HGx 1.0 1.8 5.0 565 552 A 30 THR HA A 32 GLU HGy 1.0 1.8 5.0 566 553 A 31 GLU H A 31 GLU HBx 1.0 1.8 4.0 567 553 A 31 GLU H A 31 GLU HBy 1.0 1.8 4.0 568 554 A 31 GLU H A 31 GLU HGx 1.0 1.8 3.4 569 554 A 31 GLU H A 31 GLU HGy 1.0 1.8 3.4 570 555 A 32 GLU H A 31 GLU HA 1.0 1.8 4.0 571 556 A 31 GLU HA A 33 GLY H 1.0 1.8 4.0 572 557 A 32 GLU H A 32 GLU HBx 1.0 1.8 3.3 573 558 A 32 GLU H A 32 GLU HGx 1.0 1.8 4.0 574 558 A 32 GLU H A 32 GLU HGy 1.0 1.8 4.0 575 559 A 33 GLY H A 32 GLU HGx 1.0 1.8 5.5 576 559 A 32 GLU HGy A 33 GLY H 1.0 1.8 5.5 577 560 A 33 GLY H A 32 GLU HA 1.0 1.8 3.4 578 561 A 33 GLY H A 32 GLU HBy 1.0 1.8 4.0 579 562 A 33 GLY H A 32 GLU HBx 1.0 1.8 2.9 580 563 A 33 GLY HAx A 34 SER H 1.0 1.8 3.4 581 564 A 34 SER H A 33 GLY HAy 1.0 1.8 3.3 582 565 A 34 SER H A 34 SER HBx 1.0 1.8 3.3 583 566 A 34 SER H A 34 SER HBy 1.0 1.8 3.8 584 567 A 34 SER HBy A 35 ARG H 1.0 1.8 3.4 585 568 A 34 SER HBx A 35 ARG H 1.0 1.8 3.2 586 569 A 35 ARG H A 34 SER HA 1.0 1.8 3.4 587 570 A 34 SER HBx A 35 ARG HGx 1.0 1.8 5.0 588 571 A 35 ARG H A 35 ARG HDx 1.0 1.8 5.0 589 571 A 35 ARG H A 35 ARG HDy 1.0 1.8 5.0 590 572 A 35 ARG H A 35 ARG HBy 1.0 1.8 4.0 591 573 A 35 ARG H A 35 ARG HGx 1.0 1.8 2.9 592 574 A 35 ARG H A 35 ARG HBx 1.0 1.8 3.9 593 575 A 35 ARG H A 35 ARG HGy 1.0 1.8 2.9 594 576 A 35 ARG HGx A 35 ARG HA 1.0 1.8 5.0 595 577 A 35 ARG HGy A 36 ARG H 1.0 1.8 3.4 596 578 A 35 ARG HGx A 36 ARG H 1.0 1.8 3.2 597 579 A 35 ARG HBy A 36 ARG H 1.0 1.8 2.9 598 580 A 35 ARG HBx A 36 ARG H 1.0 1.8 4.0 599 581 A 36 ARG H A 35 ARG HDx 1.0 1.8 5.5 600 581 A 35 ARG HDy A 36 ARG H 1.0 1.8 5.5 601 582 A 35 ARG HGy A 36 ARG HA 1.0 1.8 4.0 602 583 A 35 ARG HBy A 36 ARG HA 1.0 1.8 4.5 603 584 A 35 ARG HA A 38 ARG HGx 1.0 1.8 5.0 604 585 A 36 ARG H A 36 ARG HGy 1.0 1.8 4.0 605 586 A 36 ARG H A 36 ARG HGx 1.0 1.8 2.9 606 587 A 36 ARG H A 36 ARG HBy 1.0 1.8 3.9 607 588 A 36 ARG H A 36 ARG HBx 1.0 1.8 4.0 608 589 A 36 ARG HA A 36 ARG HGy 1.0 1.8 5.0 609 590 A 36 ARG HA A 36 ARG HGx 1.0 1.8 3.8 610 591 A 37 SER H A 36 ARG HDx 1.0 1.8 5.5 611 591 A 36 ARG HDy A 37 SER H 1.0 1.8 5.5 612 592 A 36 ARG HGy A 37 SER H 1.0 1.8 4.5 613 593 A 36 ARG HGx A 37 SER H 1.0 1.8 4.2 614 594 A 36 ARG HA A 37 SER H 1.0 1.8 3.4 615 595 A 36 ARG HBy A 37 SER H 1.0 1.8 3.4 616 596 A 36 ARG HBx A 37 SER H 1.0 1.8 3.7 617 597 A 37 SER H A 37 SER HBx 1.0 1.8 3.5 618 598 A 37 SER H A 37 SER HBy 1.0 1.8 3.4 619 599 A 37 SER HA A 38 ARG H 1.0 1.8 4.0 620 600 A 37 SER HA A 39 GLY H 1.0 1.8 4.0 621 601 A 40 ILE HG2% A 37 SER HBx 1.0 1.8 5.2 622 602 A 38 ARG H A 38 ARG HBx 1.0 1.8 2.9 623 603 A 38 ARG HGx A 38 ARG H 1.0 1.8 2.9 624 604 A 38 ARG H A 38 ARG HDx 1.0 1.8 5.0 625 604 A 38 ARG H A 38 ARG HDy 1.0 1.8 5.0 626 605 A 38 ARG HGx A 38 ARG HA 1.0 1.8 4.0 627 606 A 38 ARG HA A 38 ARG HGy 1.0 1.8 3.8 628 607 A 39 GLY H A 38 ARG HBy 1.0 1.8 4.2 629 608 A 38 ARG HGx A 39 GLY H 1.0 1.8 4.0 630 609 A 39 GLY H A 38 ARG HDx 1.0 1.8 5.5 631 609 A 39 GLY H A 38 ARG HDy 1.0 1.8 5.5 632 610 A 39 GLY H A 38 ARG HA 1.0 1.8 3.4 633 611 A 38 ARG HGy A 39 GLY HAy 1.0 1.8 4.0 634 612 A 38 ARG HGy A 39 GLY HAx 1.0 1.8 3.8 635 613 A 38 ARG HA A 41 VAL H 1.0 1.8 4.5 636 614 A 38 ARG HA A 42 GLU H 1.0 1.8 3.1 637 615 A 38 ARG HA A 42 GLU HGx 1.0 1.8 3.2 638 615 A 38 ARG HA A 42 GLU HGy 1.0 1.8 3.2 639 616 A 38 ARG HA A 42 GLU HBy 1.0 1.8 2.7 640 617 A 39 GLY H A 39 GLY HAy 1.0 1.8 2.7 641 618 A 39 GLY H A 39 GLY HAx 1.0 1.8 3.0 642 619 A 39 GLY HAx A 43 GLN HBy 1.0 1.8 3.5 643 620 A 40 ILE HA A 40 ILE HG2% 1.0 1.8 4.0 644 621 A 40 ILE HG2% A 41 VAL H 1.0 1.8 3.2 645 622 A 40 ILE HD1% A 41 VAL HA 1.0 1.8 5.0 646 623 A 40 ILE HG2% A 41 VAL HA 1.0 1.8 4.0 647 624 A 40 ILE HG2% A 41 VAL HGy% 1.0 1.8 3.7 648 625 A 40 ILE HB A 41 VAL H 1.0 1.8 3.7 649 626 A 44 CYS HBx A 40 ILE HD1% 1.0 1.8 5.0 650 627 A 40 ILE HD1% A 54 LEU HA 1.0 1.8 4.0 651 628 A 54 LEU HDy% A 40 ILE HD1% 1.0 1.8 3.5 652 629 A 40 ILE HD1% A 54 LEU HG 1.0 1.8 5.0 653 630 A 57 TYR HBx A 40 ILE HG1x 1.0 1.8 4.0 654 631 A 40 ILE HD1% A 57 TYR HDy 1.0 1.8 4.0 655 632 A 40 ILE HD1% A 57 TYR HEy 1.0 1.8 3.7 656 633 A 40 ILE HG1x A 57 TYR HEx 1.0 1.8 4.0 657 634 A 40 ILE HG1x A 57 TYR HEy 1.0 1.8 4.0 658 635 A 40 ILE HB A 57 TYR HEx 1.0 1.8 3.5 659 636 A 41 VAL HA A 41 VAL H 1.0 1.8 2.9 660 637 A 41 VAL H A 41 VAL HB 1.0 1.8 3.5 661 638 A 41 VAL HGx% A 41 VAL H 1.0 1.8 4.5 662 639 A 41 VAL HGx% A 41 VAL HA 1.0 1.8 3.2 663 640 A 41 VAL H A 41 VAL HGy% 1.0 1.8 3.4 664 641 A 41 VAL HA A 41 VAL HGy% 1.0 1.8 3.8 665 642 A 41 VAL H A 42 GLU H 1.0 1.8 3.5 666 643 A 44 CYS HBy A 41 VAL HA 1.0 1.8 3.7 667 644 A 44 CYS H A 41 VAL HA 1.0 1.8 5.0 668 645 A 45 CYS H A 41 VAL HA 1.0 1.8 3.8 669 646 A 45 CYS H A 41 VAL HGx% 1.0 1.8 5.5 670 647 A 45 CYS H A 41 VAL HB 1.0 1.8 5.5 671 648 A 45 CYS HBx A 41 VAL HGx% 1.0 1.8 3.5 672 649 A 45 CYS HBx A 41 VAL HA 1.0 1.8 3.7 673 650 A 41 VAL HGx% A 46 ARG H 1.0 1.8 6.0 674 651 A 42 GLU HA A 42 GLU HBx 1.0 1.8 3.0 675 652 A 42 GLU HBy A 42 GLU HA 1.0 1.8 3.5 676 653 A 42 GLU H A 42 GLU HA 1.0 1.8 2.9 677 654 A 42 GLU HA A 42 GLU HGx 1.0 1.8 3.4 678 654 A 42 GLU HGy A 42 GLU HA 1.0 1.8 3.4 679 655 A 42 GLU HA A 43 GLN H 1.0 1.8 3.8 680 656 A 43 GLN H A 42 GLU HGx 1.0 1.8 5.0 681 656 A 42 GLU HGy A 43 GLN H 1.0 1.8 5.0 682 657 A 42 GLU HBy A 43 GLN H 1.0 1.8 2.9 683 658 A 44 CYS H A 42 GLU HA 1.0 1.8 5.0 684 659 A 45 CYS H A 42 GLU HA 1.0 1.8 4.0 685 660 A 46 ARG H A 42 GLU HBx 1.0 1.8 4.0 686 661 A 43 GLN HA A 43 GLN HBx 1.0 1.8 3.3 687 662 A 43 GLN HBy A 43 GLN HA 1.0 1.8 2.8 688 663 A 43 GLN H A 43 GLN HA 1.0 1.8 2.9 689 664 A 43 GLN HBy A 43 GLN H 1.0 1.8 2.9 690 665 A 43 GLN H A 43 GLN HBx 1.0 1.8 3.2 691 666 A 43 GLN HGy A 43 GLN HE2y 1.0 1.8 4.0 692 667 A 43 GLN HGy A 43 GLN HE2x 1.0 1.8 4.2 693 668 A 43 GLN HE2x A 43 GLN HGx 1.0 1.8 4.6 694 669 A 43 GLN HA A 43 GLN HGy 1.0 1.8 3.8 695 670 A 43 GLN HA A 43 GLN HGx 1.0 1.8 3.9 696 671 A 43 GLN HE2y A 43 GLN HGx 1.0 1.8 3.8 697 672 A 44 CYS H A 43 GLN HA 1.0 1.8 5.0 698 673 A 44 CYS H A 43 GLN HBx 1.0 1.8 2.9 699 674 A 44 CYS H A 43 GLN HBy 1.0 1.8 3.8 700 675 A 45 CYS H A 43 GLN HBx 1.0 1.8 5.3 701 676 A 43 GLN HA A 47 SER H 1.0 1.8 4.2 702 677 A 43 GLN HE2y A 49 CYS HBy 1.0 1.8 4.5 703 678 A 43 GLN HGy A 53 GLN HE2x 1.0 1.8 3.8 704 679 A 44 CYS HA A 44 CYS HBx 1.0 1.8 2.7 705 680 A 44 CYS HA A 44 CYS H 1.0 1.8 3.0 706 681 A 44 CYS H A 44 CYS HBy 1.0 1.8 2.7 707 682 A 44 CYS HA A 45 CYS H 1.0 1.8 4.0 708 683 A 44 CYS HBy A 45 CYS H 1.0 1.8 3.1 709 684 A 44 CYS H A 45 CYS H 1.0 1.8 2.9 710 685 A 44 CYS HBx A 45 CYS H 1.0 1.8 3.3 711 686 A 44 CYS HA A 47 SER H 1.0 1.8 3.8 712 687 A 44 CYS H A 49 CYS HBy 1.0 1.8 5.2 713 688 A 44 CYS H A 49 CYS HBx 1.0 1.8 4.0 714 689 A 44 CYS H A 54 LEU HDy% 1.0 1.8 5.8 715 690 A 44 CYS HBx A 54 LEU HDy% 1.0 1.8 4.5 716 691 A 45 CYS HA A 45 CYS HBy 1.0 1.8 3.1 717 692 A 45 CYS HA A 45 CYS HBx 1.0 1.8 3.6 718 693 A 45 CYS HA A 45 CYS H 1.0 1.8 3.2 719 694 A 45 CYS HBx A 45 CYS H 1.0 1.8 3.5 720 695 A 45 CYS H A 45 CYS HBy 1.0 1.8 3.5 721 696 A 45 CYS HA A 46 ARG H 1.0 1.8 4.0 722 697 A 45 CYS HBx A 46 ARG H 1.0 1.8 4.0 723 698 A 45 CYS H A 46 ARG H 1.0 1.8 3.2 724 699 A 45 CYS HBy A 46 ARG H 1.0 1.8 3.1 725 700 A 45 CYS H A 46 ARG HA 1.0 1.8 6.0 726 701 A 45 CYS H A 47 SER H 1.0 1.8 4.0 727 702 A 46 ARG H A 46 ARG HA 1.0 1.8 2.9 728 703 A 46 ARG H A 46 ARG HDx 1.0 1.8 5.5 729 703 A 46 ARG H A 46 ARG HDy 1.0 1.8 5.5 730 704 A 46 ARG H A 46 ARG HGy 1.0 1.8 4.5 731 705 A 46 ARG H A 46 ARG HBx 1.0 1.8 3.8 732 706 A 46 ARG H A 46 ARG HGx 1.0 1.8 4.8 733 707 A 46 ARG H A 46 ARG HBy 1.0 1.8 2.9 734 708 A 46 ARG HA A 46 ARG HGy 1.0 1.8 3.5 735 709 A 46 ARG HA A 46 ARG HGx 1.0 1.8 4.3 736 710 A 46 ARG HA A 46 ARG HDx 1.0 1.8 4.5 737 710 A 46 ARG HA A 46 ARG HDy 1.0 1.8 4.5 738 711 A 46 ARG HBy A 46 ARG HDx 1.0 1.8 4.0 739 711 A 46 ARG HDy A 46 ARG HBy 1.0 1.8 4.0 740 712 A 46 ARG H A 47 SER H 1.0 1.8 2.9 741 713 A 47 SER H A 46 ARG HDx 1.0 1.8 5.0 742 713 A 47 SER H A 46 ARG HDy 1.0 1.8 5.0 743 714 A 47 SER H A 46 ARG HGy 1.0 1.8 5.5 744 715 A 47 SER H A 46 ARG HA 1.0 1.8 4.0 745 716 A 47 SER H A 46 ARG HBy 1.0 1.8 4.2 746 717 A 47 SER H A 46 ARG HBx 1.0 1.8 4.0 747 718 A 47 SER HA A 46 ARG HDx 1.0 1.8 5.0 748 718 A 47 SER HA A 46 ARG HDy 1.0 1.8 5.0 749 719 A 47 SER HA A 47 SER HBx 1.0 1.8 2.8 750 720 A 47 SER HA A 47 SER HBy 1.0 1.8 3.6 751 721 A 47 SER HA A 47 SER H 1.0 1.8 3.5 752 722 A 47 SER H A 47 SER HBy 1.0 1.8 3.3 753 723 A 47 SER H A 47 SER HBx 1.0 1.8 4.3 754 724 A 48 ILE H A 47 SER HBx 1.0 1.8 3.2 755 725 A 47 SER HA A 48 ILE H 1.0 1.8 3.2 756 726 A 48 ILE H A 47 SER HBy 1.0 1.8 5.0 757 727 A 49 CYS HBx A 47 SER HBy 1.0 1.8 4.8 758 728 A 48 ILE H A 48 ILE HA 1.0 1.8 3.3 759 729 A 48 ILE H A 48 ILE HB 1.0 1.8 2.9 760 730 A 48 ILE HG2% A 48 ILE H 1.0 1.8 5.0 761 731 A 48 ILE HD1% A 48 ILE H 1.0 1.8 4.8 762 732 A 48 ILE H A 48 ILE HG1y 1.0 1.8 4.5 763 733 A 48 ILE HG1x A 48 ILE H 1.0 1.8 3.5 764 734 A 48 ILE H A 48 ILE HG1y 1.0 1.8 5.0 765 735 A 48 ILE HG2% A 48 ILE HA 1.0 1.8 3.4 766 736 A 48 ILE HD1% A 48 ILE HA 1.0 1.8 4.8 767 737 A 48 ILE HG1x A 48 ILE HA 1.0 1.8 4.0 768 738 A 48 ILE HD1% A 48 ILE HB 1.0 1.8 4.0 769 739 A 49 CYS HBy A 50 SER H 1.0 1.8 3.2 770 740 A 50 SER H A 49 CYS HA 1.0 1.8 3.2 771 741 A 49 CYS HBx A 50 SER H 1.0 1.8 4.3 772 742 A 49 CYS HBy A 53 GLN HE2x 1.0 1.8 4.0 773 743 A 49 CYS HBy A 53 GLN HE2y 1.0 1.8 3.6 774 744 A 50 SER HA A 50 SER HBx 1.0 1.8 3.1 775 745 A 50 SER H A 50 SER HA 1.0 1.8 3.1 776 746 A 50 SER H A 50 SER HBy 1.0 1.8 4.0 777 747 A 50 SER H A 50 SER HBx 1.0 1.8 3.3 778 748 A 50 SER HBy A 51 LEU H 1.0 1.8 3.2 779 749 A 50 SER HBx A 51 LEU H 1.0 1.8 3.5 780 750 A 50 SER HA A 51 LEU H 1.0 1.8 2.9 781 751 A 50 SER HA A 52 TYR H 1.0 1.8 5.0 782 752 A 50 SER HBy A 52 TYR H 1.0 1.8 3.5 783 753 A 50 SER H A 53 GLN H 1.0 1.8 4.0 784 754 A 50 SER H A 53 GLN HBy 1.0 1.8 4.0 785 755 A 50 SER HBx A 53 GLN H 1.0 1.8 3.7 786 756 A 50 SER HBy A 53 GLN HGy 1.0 1.8 5.0 787 757 A 51 LEU HA A 51 LEU H 1.0 1.8 2.9 788 758 A 51 LEU H A 51 LEU HDx% 1.0 1.8 4.5 789 759 A 51 LEU HDy% A 51 LEU H 1.0 1.8 3.5 790 760 A 51 LEU H A 51 LEU HG 1.0 1.8 3.3 791 761 A 51 LEU H A 51 LEU HBx 1.0 1.8 4.0 792 762 A 51 LEU H A 51 LEU HBy 1.0 1.8 2.9 793 763 A 51 LEU HA A 51 LEU HG 1.0 1.8 5.0 794 764 A 51 LEU HDy% A 51 LEU HA 1.0 1.8 3.2 795 765 A 51 LEU H A 52 TYR H 1.0 1.8 3.3 796 766 A 52 TYR H A 51 LEU HDx% 1.0 1.8 5.5 797 767 A 51 LEU HDy% A 52 TYR H 1.0 1.8 5.5 798 768 A 51 LEU HA A 52 TYR H 1.0 1.8 4.0 799 769 A 52 TYR H A 51 LEU HBx 1.0 1.8 4.0 800 770 A 52 TYR H A 51 LEU HG 1.0 1.8 4.2 801 771 A 52 TYR H A 51 LEU HBy 1.0 1.8 5.0 802 772 A 51 LEU HBy A 52 TYR HA 1.0 1.8 5.0 803 773 A 53 GLN H A 51 LEU HBx 1.0 1.8 6.0 804 774 A 51 LEU HA A 54 LEU H 1.0 1.8 4.0 805 775 A 54 LEU HDx% A 51 LEU HA 1.0 1.8 4.0 806 776 A 51 LEU HDy% A 54 LEU HDx% 1.0 1.8 4.0 807 777 A 52 TYR H A 52 TYR HA 1.0 1.8 3.2 808 778 A 52 TYR H A 52 TYR HDy 1.0 1.8 4.3 809 779 A 52 TYR H A 52 TYR HBx 1.0 1.8 2.9 810 780 A 52 TYR H A 52 TYR HBy 1.0 1.8 3.4 811 781 A 52 TYR HA A 52 TYR HDy 1.0 1.8 3.3 812 782 A 52 TYR HBx A 52 TYR HDx 1.0 1.8 3.6 813 783 A 52 TYR HDy A 52 TYR HBx 1.0 1.8 3.2 814 784 A 52 TYR HA A 52 TYR HDx 1.0 1.8 3.7 815 785 A 53 GLN H A 52 TYR HBx 1.0 1.8 3.5 816 786 A 53 GLN H A 52 TYR HA 1.0 1.8 4.0 817 787 A 53 GLN H A 52 TYR HBy 1.0 1.8 3.2 818 788 A 53 GLN H A 52 TYR HDx 1.0 1.8 5.0 819 789 A 52 TYR HDx A 53 GLN HGx 1.0 1.8 5.0 820 790 A 52 TYR H A 54 LEU H 1.0 1.8 4.5 821 791 A 55 GLU H A 52 TYR HA 1.0 1.8 4.0 822 792 A 52 TYR HA A 55 GLU HBy 1.0 1.8 3.0 823 793 A 52 TYR HDx A 56 ASN H 1.0 1.8 6.5 824 794 A 53 GLN HBx A 53 GLN HA 1.0 1.8 3.0 825 795 A 53 GLN HBy A 53 GLN HA 1.0 1.8 3.3 826 796 A 53 GLN H A 53 GLN HA 1.0 1.8 3.1 827 797 A 53 GLN H A 53 GLN HGx 1.0 1.8 3.4 828 798 A 53 GLN H A 53 GLN HGy 1.0 1.8 2.7 829 799 A 53 GLN H A 53 GLN HBy 1.0 1.8 3.5 830 800 A 53 GLN HGx A 53 GLN HA 1.0 1.8 2.7 831 801 A 53 GLN HGy A 53 GLN HA 1.0 1.8 3.2 832 802 A 53 GLN HA A 56 ASN HBy 1.0 1.8 3.3 833 803 A 53 GLN HE2y A 53 GLN HBy 1.0 1.8 4.0 834 804 A 53 GLN HE2x A 53 GLN HGx 1.0 1.8 4.0 835 805 A 53 GLN HE2y A 53 GLN HGx 1.0 1.8 3.3 836 806 A 53 GLN HGx A 53 GLN HA 1.0 1.8 2.7 837 807 A 53 GLN HGy A 53 GLN HA 1.0 1.8 3.3 838 808 A 54 LEU H A 53 GLN HA 1.0 1.8 4.0 839 809 A 53 GLN H A 54 LEU H 1.0 1.8 3.2 840 810 A 53 GLN HGy A 54 LEU H 1.0 1.8 4.2 841 811 A 54 LEU H A 53 GLN HBx 1.0 1.8 4.0 842 812 A 53 GLN HBy A 54 LEU H 1.0 1.8 5.0 843 813 A 55 GLU H A 53 GLN HBy 1.0 1.8 5.0 844 814 A 53 GLN HA A 56 ASN HBy 1.0 1.8 4.0 845 815 A 56 ASN H A 53 GLN HA 1.0 1.8 4.0 846 816 A 53 GLN HA A 56 ASN HD2y 1.0 1.8 5.0 847 817 A 53 GLN HA A 56 ASN HD2x 1.0 1.8 4.0 848 818 A 57 TYR HEy A 53 GLN HBy 1.0 1.8 3.8 849 819 A 57 TYR HDy A 53 GLN HA 1.0 1.8 5.3 850 820 A 54 LEU HA A 54 LEU HBy 1.0 1.8 2.9 851 821 A 54 LEU HA A 54 LEU HBx 1.0 1.8 2.8 852 822 A 54 LEU HA A 54 LEU H 1.0 1.8 3.2 853 823 A 54 LEU HDx% A 54 LEU H 1.0 1.8 4.5 854 824 A 54 LEU HDy% A 54 LEU H 1.0 1.8 4.2 855 825 A 54 LEU H A 54 LEU HBx 1.0 1.8 3.0 856 826 A 54 LEU HG A 54 LEU H 1.0 1.8 3.2 857 827 A 54 LEU HBy A 54 LEU H 1.0 1.8 4.0 858 828 A 54 LEU HDy% A 54 LEU HA 1.0 1.8 3.2 859 829 A 54 LEU HDx% A 54 LEU HA 1.0 1.8 4.5 860 830 A 54 LEU HA A 54 LEU HG 1.0 1.8 5.0 861 831 A 55 GLU H A 54 LEU HBx 1.0 1.8 3.2 862 832 A 54 LEU HA A 55 GLU H 1.0 1.8 5.0 863 833 A 54 LEU HDy% A 55 GLU H 1.0 1.8 5.5 864 834 A 55 GLU H A 54 LEU HG 1.0 1.8 4.0 865 835 A 54 LEU HBy A 55 GLU H 1.0 1.8 4.0 866 836 A 54 LEU HDy% A 56 ASN H 1.0 1.8 6.2 867 837 A 54 LEU HA A 56 ASN H 1.0 1.8 3.7 868 838 A 54 LEU HDy% A 57 TYR HDy 1.0 1.8 4.0 869 839 A 54 LEU HDy% A 57 TYR HEy 1.0 1.8 3.8 870 840 A 54 LEU HA A 57 TYR H 1.0 1.8 4.0 871 841 A 54 LEU HA A 57 TYR HDy 1.0 1.8 2.7 872 842 A 54 LEU HA A 57 TYR HEy 1.0 1.8 3.0 873 843 A 55 GLU HBy A 55 GLU HA 1.0 1.8 2.9 874 844 A 55 GLU HA A 55 GLU HBx 1.0 1.8 3.1 875 845 A 55 GLU H A 55 GLU HA 1.0 1.8 3.5 876 846 A 55 GLU H A 55 GLU HBy 1.0 1.8 3.5 877 847 A 55 GLU H A 55 GLU HBx 1.0 1.8 3.3 878 848 A 55 GLU H A 55 GLU HGx 1.0 1.8 4.5 879 849 A 55 GLU H A 55 GLU HGy 1.0 1.8 4.7 880 850 A 55 GLU HA A 55 GLU HGx 1.0 1.8 2.7 881 851 A 55 GLU HA A 55 GLU HGy 1.0 1.8 3.5 882 852 A 55 GLU H A 56 ASN H 1.0 1.8 3.0 883 853 A 55 GLU HBy A 56 ASN H 1.0 1.8 3.7 884 854 A 56 ASN H A 55 GLU HA 1.0 1.8 3.4 885 855 A 57 TYR H A 55 GLU HA 1.0 1.8 3.8 886 856 A 58 CYS H A 55 GLU HGx 1.0 1.8 5.0 887 857 A 58 CYS H A 55 GLU HBy 1.0 1.8 5.3 888 858 A 58 CYS H A 55 GLU HA 1.0 1.8 3.5 889 859 A 56 ASN HBy A 56 ASN HA 1.0 1.8 3.2 890 860 A 56 ASN HA A 56 ASN HBx 1.0 1.8 2.8 891 861 A 56 ASN H A 56 ASN HA 1.0 1.8 3.1 892 862 A 56 ASN H A 56 ASN HBy 1.0 1.8 2.9 893 863 A 56 ASN H A 56 ASN HBx 1.0 1.8 2.9 894 864 A 56 ASN HD2y A 56 ASN HBx 1.0 1.8 3.8 895 865 A 56 ASN HD2x A 56 ASN HBx 1.0 1.8 3.3 896 866 A 56 ASN HBy A 56 ASN HD2y 1.0 1.8 4.0 897 867 A 56 ASN HBy A 56 ASN HD2x 1.0 1.8 3.3 898 868 A 57 TYR HBy A 56 ASN H 1.0 1.8 5.3 899 869 A 57 TYR HEy A 56 ASN H 1.0 1.8 4.3 900 870 A 57 TYR H A 56 ASN H 1.0 1.8 3.0 901 871 A 57 TYR H A 56 ASN HBy 1.0 1.8 3.0 902 872 A 57 TYR H A 56 ASN HBx 1.0 1.8 4.0 903 873 A 57 TYR H A 56 ASN HA 1.0 1.8 3.5 904 874 A 58 CYS H A 56 ASN HA 1.0 1.8 4.0 905 875 A 57 TYR HBy A 57 TYR HA 1.0 1.8 3.1 906 876 A 57 TYR HBx A 57 TYR HA 1.0 1.8 2.8 907 877 A 57 TYR H A 57 TYR HA 1.0 1.8 3.0 908 878 A 57 TYR H A 57 TYR HBx 1.0 1.8 3.5 909 879 A 57 TYR HBy A 57 TYR H 1.0 1.8 3.0 910 880 A 57 TYR H A 57 TYR HDy 1.0 1.8 2.9 911 881 A 57 TYR H A 57 TYR HEy 1.0 1.8 4.2 912 882 A 57 TYR HA A 57 TYR HDx 1.0 1.8 3.5 913 883 A 57 TYR HBx A 57 TYR HDx 1.0 1.8 2.7 914 884 A 57 TYR HBx A 57 TYR HDy 1.0 1.8 3.8 915 885 A 57 TYR HBy A 57 TYR HDx 1.0 1.8 3.8 916 886 A 57 TYR HBx A 57 TYR HEx 1.0 1.8 4.7 917 887 A 57 TYR H A 58 CYS H 1.0 1.8 2.9 918 888 A 57 TYR HBx A 58 CYS H 1.0 1.8 4.7 919 889 A 57 TYR HBy A 58 CYS H 1.0 1.8 3.8 920 890 A 58 CYS H A 57 TYR HA 1.0 1.8 3.3 921 891 A 58 CYS HBy A 58 CYS HA 1.0 1.8 2.7 922 892 A 58 CYS HBx A 58 CYS HA 1.0 1.8 3.3 923 893 A 58 CYS H A 58 CYS HA 1.0 1.8 3.1 924 894 A 58 CYS H A 58 CYS HBy 1.0 1.8 3.5 925 895 A 58 CYS H A 58 CYS HBx 1.0 1.8 2.7 926 896 A 58 CYS H A 59 GLY H 1.0 1.8 4.6 927 897 A 58 CYS HBx A 59 GLY H 1.0 1.8 5.0 928 898 A 58 CYS HBy A 59 GLY H 1.0 1.8 5.0 929 899 A 58 CYS HA A 59 GLY H 1.0 1.8 2.9 930 900 A 59 GLY H A 59 GLY HAx 1.0 1.8 2.7 931 900 A 59 GLY H A 59 GLY HAy 1.0 1.8 2.7 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 3 ASN C A 4 GLN N A 4 GLN CA A 4 GLN C 1.0 -181.0 -97.0 PHI 2 2 A 4 GLN N A 4 GLN CA A 4 GLN C A 5 HIS N 1.0 134.0 178.0 PSI 3 3 A 4 GLN C A 5 HIS N A 5 HIS CA A 5 HIS C 1.0 -126.0 -46.0 PHI 4 4 A 5 HIS N A 5 HIS CA A 5 HIS C A 6 LEU N 1.0 92.0 160.0 PSI 5 5 A 5 HIS C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 -144.0 -72.0 PHI 6 6 A 6 LEU N A 6 LEU CA A 6 LEU C A 7 CYS N 1.0 118.0 166.0 PSI 7 7 A 6 LEU C A 7 CYS N A 7 CYS CA A 7 CYS C 1.0 -171.0 -83.0 PHI 8 8 A 7 CYS N A 7 CYS CA A 7 CYS C A 8 GLY N 1.0 126.0 178.0 PSI 9 9 A 7 CYS C A 8 GLY N A 8 GLY CA A 8 GLY C 1.0 31.0 71.0 PHI 10 10 A 8 GLY N A 8 GLY CA A 8 GLY C A 9 SER N 1.0 -160.0 -108.0 PSI 11 11 A 8 GLY C A 9 SER N A 9 SER CA A 9 SER C 1.0 -83.0 -39.0 PHI 12 12 A 9 SER N A 9 SER CA A 9 SER C A 10 HIS N 1.0 -69.0 3.0 PSI 13 13 A 9 SER C A 10 HIS N A 10 HIS CA A 10 HIS C 1.0 -85.0 -45.0 PHI 14 14 A 10 HIS N A 10 HIS CA A 10 HIS C A 11 LEU N 1.0 -63.0 -23.0 PSI 15 15 A 10 HIS C A 11 LEU N A 11 LEU CA A 11 LEU C 1.0 -82.0 -42.0 PHI 16 16 A 11 LEU N A 11 LEU CA A 11 LEU C A 12 VAL N 1.0 -63.0 -23.0 PSI 17 17 A 11 LEU C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -80.0 -40.0 PHI 18 18 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 GLU N 1.0 -65.0 -25.0 PSI 19 19 A 12 VAL C A 13 GLU N A 13 GLU CA A 13 GLU C 1.0 -81.0 -41.0 PHI 20 20 A 13 GLU N A 13 GLU CA A 13 GLU C A 14 ALA N 1.0 -57.0 -17.0 PSI 21 21 A 13 GLU C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -87.0 -47.0 PHI 22 22 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 LEU N 1.0 -61.0 -21.0 PSI 23 23 A 14 ALA C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -83.0 -43.0 PHI 24 24 A 15 LEU N A 15 LEU CA A 15 LEU C A 16 TYR N 1.0 -60.0 -20.0 PSI 25 25 A 15 LEU C A 16 TYR N A 16 TYR CA A 16 TYR C 1.0 -82.0 -42.0 PHI 26 26 A 16 TYR N A 16 TYR CA A 16 TYR C A 17 LEU N 1.0 -57.0 -17.0 PSI 27 27 A 16 TYR C A 17 LEU N A 17 LEU CA A 17 LEU C 1.0 -83.0 -43.0 PHI 28 28 A 17 LEU N A 17 LEU CA A 17 LEU C A 18 VAL N 1.0 -62.0 -18.0 PSI 29 29 A 17 LEU C A 18 VAL N A 18 VAL CA A 18 VAL C 1.0 -91.0 -51.0 PHI 30 30 A 18 VAL N A 18 VAL CA A 18 VAL C A 19 CYS N 1.0 -61.0 -17.0 PSI 31 31 A 18 VAL C A 19 CYS N A 19 CYS CA A 19 CYS C 1.0 -114.0 -74.0 PHI 32 32 A 19 CYS N A 19 CYS CA A 19 CYS C A 20 GLY N 1.0 -22.0 34.0 PSI 33 33 A 19 CYS C A 20 GLY N A 20 GLY CA A 20 GLY C 1.0 17.0 73.0 PHI 34 34 A 20 GLY N A 20 GLY CA A 20 GLY C A 21 GLU N 1.0 -138.0 -98.0 PSI 35 35 A 20 GLY C A 21 GLU N A 21 GLU CA A 21 GLU C 1.0 -84.0 -44.0 PHI 36 36 A 21 GLU N A 21 GLU CA A 21 GLU C A 22 ARG N 1.0 -43.0 -3.0 PSI 37 37 A 21 GLU C A 22 ARG N A 22 ARG CA A 22 ARG C 1.0 -95.0 -55.0 PHI 38 38 A 22 ARG N A 22 ARG CA A 22 ARG C A 23 GLY N 1.0 -48.0 -8.0 PSI 39 39 A 22 ARG C A 23 GLY N A 23 GLY CA A 23 GLY C 1.0 76.0 156.0 PHI 40 40 A 23 GLY N A 23 GLY CA A 23 GLY C A 24 PHE N 1.0 148.0 188.0 PSI 41 41 A 23 GLY C A 24 PHE N A 24 PHE CA A 24 PHE C 1.0 -156.0 -104.0 PHI 42 42 A 24 PHE N A 24 PHE CA A 24 PHE C A 25 PHE N 1.0 132.0 172.0 PSI 43 43 A 24 PHE C A 25 PHE N A 25 PHE CA A 25 PHE C 1.0 -158.0 -70.0 PHI 44 44 A 25 PHE N A 25 PHE CA A 25 PHE C A 26 TYR N 1.0 106.0 170.0 PSI 45 45 A 25 PHE C A 26 TYR N A 26 TYR CA A 26 TYR C 1.0 -116.0 -68.0 PHI 46 46 A 26 TYR N A 26 TYR CA A 26 TYR C A 27 THR N 1.0 109.0 169.0 PSI 47 47 A 37 SER C A 38 ARG N A 38 ARG CA A 38 ARG C 1.0 -120.0 -60.0 PHI 48 48 A 38 ARG N A 38 ARG CA A 38 ARG C A 39 GLY N 1.0 -42.0 18.0 PSI 49 49 A 38 ARG C A 39 GLY N A 39 GLY CA A 39 GLY C 1.0 -82.0 -42.0 PHI 50 50 A 39 GLY N A 39 GLY CA A 39 GLY C A 40 ILE N 1.0 -62.0 -22.0 PSI 51 51 A 39 GLY C A 40 ILE N A 40 ILE CA A 40 ILE C 1.0 -99.0 -29.0 PHI 52 52 A 40 ILE N A 40 ILE CA A 40 ILE C A 41 VAL N 1.0 -62.0 -10.0 PSI 53 53 A 40 ILE C A 41 VAL N A 41 VAL CA A 41 VAL C 1.0 -81.0 -41.0 PHI 54 54 A 41 VAL N A 41 VAL CA A 41 VAL C A 42 GLU N 1.0 -63.0 -23.0 PSI 55 55 A 41 VAL C A 42 GLU N A 42 GLU CA A 42 GLU C 1.0 -84.0 -44.0 PHI 56 56 A 42 GLU N A 42 GLU CA A 42 GLU C A 43 GLN N 1.0 -61.0 -21.0 PSI 57 57 A 42 GLU C A 43 GLN N A 43 GLN CA A 43 GLN C 1.0 -86.0 -46.0 PHI 58 58 A 43 GLN N A 43 GLN CA A 43 GLN C A 44 CYS N 1.0 -63.0 -23.0 PSI 59 59 A 43 GLN C A 44 CYS N A 44 CYS CA A 44 CYS C 1.0 -84.0 -44.0 PHI 60 60 A 44 CYS N A 44 CYS CA A 44 CYS C A 45 CYS N 1.0 -63.0 -15.0 PSI 61 61 A 44 CYS C A 45 CYS N A 45 CYS CA A 45 CYS C 1.0 -82.0 -42.0 PHI 62 62 A 45 CYS N A 45 CYS CA A 45 CYS C A 46 ARG N 1.0 -52.0 -4.0 PSI 63 63 A 45 CYS C A 46 ARG N A 46 ARG CA A 46 ARG C 1.0 -104.0 -60.0 PHI 64 64 A 46 ARG N A 46 ARG CA A 46 ARG C A 47 SER N 1.0 -38.0 6.0 PSI 65 65 A 46 ARG C A 47 SER N A 47 SER CA A 47 SER C 1.0 -136.0 -76.0 PHI 66 66 A 47 SER N A 47 SER CA A 47 SER C A 48 ILE N 1.0 113.0 173.0 PSI 67 67 A 47 SER C A 48 ILE N A 48 ILE CA A 48 ILE C 1.0 -118.0 -70.0 PHI 68 68 A 48 ILE N A 48 ILE CA A 48 ILE C A 49 CYS N 1.0 100.0 176.0 PSI 69 69 A 48 ILE C A 49 CYS N A 49 CYS CA A 49 CYS C 1.0 -144.0 -80.0 PHI 70 70 A 49 CYS N A 49 CYS CA A 49 CYS C A 50 SER N 1.0 138.0 186.0 PSI 71 71 A 49 CYS C A 50 SER N A 50 SER CA A 50 SER C 1.0 -184.0 -44.0 PHI 72 72 A 50 SER N A 50 SER CA A 50 SER C A 51 LEU N 1.0 126.0 166.0 PSI 73 73 A 50 SER C A 51 LEU N A 51 LEU CA A 51 LEU C 1.0 -77.0 -37.0 PHI 74 74 A 51 LEU N A 51 LEU CA A 51 LEU C A 52 TYR N 1.0 -61.0 -21.0 PSI 75 75 A 51 LEU C A 52 TYR N A 52 TYR CA A 52 TYR C 1.0 -83.0 -43.0 PHI 76 76 A 52 TYR N A 52 TYR CA A 52 TYR C A 53 GLN N 1.0 -65.0 -1.0 PSI 77 77 A 52 TYR C A 53 GLN N A 53 GLN CA A 53 GLN C 1.0 -86.0 -46.0 PHI 78 78 A 53 GLN N A 53 GLN CA A 53 GLN C A 54 LEU N 1.0 -61.0 -21.0 PSI 79 79 A 53 GLN C A 54 LEU N A 54 LEU CA A 54 LEU C 1.0 -83.0 -43.0 PHI 80 80 A 54 LEU N A 54 LEU CA A 54 LEU C A 55 GLU N 1.0 -61.0 -21.0 PSI 81 81 A 54 LEU C A 55 GLU N A 55 GLU CA A 55 GLU C 1.0 -85.0 -45.0 PHI 82 82 A 55 GLU N A 55 GLU CA A 55 GLU C A 56 ASN N 1.0 -51.0 -11.0 PSI 83 83 A 55 GLU C A 56 ASN N A 56 ASN CA A 56 ASN C 1.0 -90.0 -50.0 PHI 84 84 A 56 ASN N A 56 ASN CA A 56 ASN C A 57 TYR N 1.0 -62.0 -10.0 PSI 85 85 A 56 ASN C A 57 TYR N A 57 TYR CA A 57 TYR C 1.0 -109.0 -53.0 PHI 86 86 A 57 TYR N A 57 TYR CA A 57 TYR C A 58 CYS N 1.0 -65.0 7.0 PSI 87 87 A 57 TYR C A 58 CYS N A 58 CYS CA A 58 CYS C 1.0 -118.0 -46.0 PHI 88 88 A 58 CYS N A 58 CYS CA A 58 CYS C A 59 GLY N 1.0 47.0 111.0 PSI stop_ save_