data_nef_c36053_5x37 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 36050 BMRB 36051 BMRB 36052 BMRB 36054 BMRB 36055 BMRB 36056 PDB 5X37 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 8 CYS SG 1 25 CYS SG 1 19 CYS SG 1 35 CYS SG 1 14 SER OG 2 1 MAN C1 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 THR start . . 2 A 2 GLN middle . . 3 A 3 SER middle . . 4 A 4 HIS middle . . 5 A 5 TYR middle . . 6 A 6 GLY middle . false 7 A 7 GLN middle . . 8 A 8 CYS middle -HG . 9 A 9 GLY middle . false 10 A 10 GLY middle . false 11 A 11 ILE middle . . 12 A 12 GLY middle . false 13 A 13 TYR middle . . 14 A 14 SER middle . . 15 A 15 GLY middle . false 16 A 16 PRO middle . false 17 A 17 THR middle . . 18 A 18 VAL middle . . 19 A 19 CYS middle -HG . 20 A 20 ALA middle . . 21 A 21 SER middle . . 22 A 22 GLY middle . false 23 A 23 THR middle . . 24 A 24 THR middle . . 25 A 25 CYS middle -HG . 26 A 26 GLN middle . . 27 A 27 VAL middle . . 28 A 28 LEU middle . . 29 A 29 ASN middle . . 30 A 30 PRO middle . false 31 A 31 TYR middle . . 32 A 32 TYR middle . . 33 A 33 SER middle . . 34 A 34 GLN middle . . 35 A 35 CYS middle -HG . 36 A 36 LEU end . . 37 B 1 MAN . -O1 . 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 THR HA H 1 3.9060 0.02 A 1 THR HB H 1 4.1140 0.02 A 1 THR HG2% H 1 1.2220 0.02 A 1 THR CA C 13 60.8900 0.3 A 1 THR CB C 13 69.4800 0.3 A 1 THR CG2 C 13 21.8000 0.3 A 2 GLN H H 1 9.1800 0.02 A 2 GLN HA H 1 4.7110 0.02 A 2 GLN HBx H 1 1.8280 0.02 A 2 GLN HBy H 1 1.8880 0.02 A 2 GLN HE21 H 1 8.6210 0.02 A 2 GLN HE22 H 1 7.0360 0.02 A 2 GLN HGx H 1 2.2220 0.02 A 2 GLN HGy H 1 2.5950 0.02 A 2 GLN CA C 13 54.3300 0.3 A 2 GLN CB C 13 30.8200 0.3 A 2 GLN CG C 13 33.1200 0.3 A 2 GLN N N 15 123.2600 0.2 A 2 GLN NE2 N 15 114.8500 0.2 A 3 SER H H 1 8.7690 0.02 A 3 SER HA H 1 4.3940 0.02 A 3 SER HBy H 1 3.9240 0.02 A 3 SER HBx H 1 3.8730 0.02 A 3 SER CA C 13 58.2900 0.3 A 3 SER CB C 13 64.8800 0.3 A 3 SER N N 15 120.2700 0.2 A 4 HIS H H 1 8.7320 0.02 A 4 HIS HA H 1 4.1250 0.02 A 4 HIS HB2 H 1 2.9540 0.02 A 4 HIS HB3 H 1 3.1060 0.02 A 4 HIS HD2 H 1 6.8120 0.02 A 4 HIS HE1 H 1 8.5030 0.02 A 4 HIS CA C 13 55.8800 0.3 A 4 HIS CB C 13 28.9800 0.3 A 4 HIS CD2 C 13 118.2100 0.3 A 4 HIS CE1 C 13 136.4700 0.3 A 4 HIS N N 15 120.4700 0.2 A 5 TYR H H 1 9.2900 0.02 A 5 TYR HA H 1 4.1390 0.02 A 5 TYR HBy H 1 3.2660 0.02 A 5 TYR HBx H 1 3.1080 0.02 A 5 TYR HDx H 1 6.8570 0.02 A 5 TYR HDy H 1 6.8570 0.02 A 5 TYR HEx H 1 6.5090 0.02 A 5 TYR HEy H 1 6.5090 0.02 A 5 TYR CA C 13 61.6680 0.3 A 5 TYR CB C 13 36.3400 0.3 A 5 TYR CDx C 13 132.8600 0.3 A 5 TYR CDy C 13 132.8600 0.3 A 5 TYR CEx C 13 117.7800 0.3 A 5 TYR CEy C 13 117.7800 0.3 A 5 TYR N N 15 121.1700 0.2 A 6 GLY H H 1 8.7980 0.02 A 6 GLY HA2 H 1 4.1780 0.02 A 6 GLY HA3 H 1 3.5440 0.02 A 6 GLY CA C 13 44.7600 0.3 A 6 GLY N N 15 110.4700 0.2 A 7 GLN H H 1 8.6380 0.02 A 7 GLN HA H 1 4.2720 0.02 A 7 GLN HB2 H 1 2.0630 0.02 A 7 GLN HB3 H 1 1.6690 0.02 A 7 GLN HE21 H 1 7.1650 0.02 A 7 GLN HE22 H 1 6.9840 0.02 A 7 GLN HGx H 1 1.0290 0.02 A 7 GLN HGy H 1 2.2760 0.02 A 7 GLN CA C 13 56.0900 0.3 A 7 GLN CB C 13 27.5300 0.3 A 7 GLN CG C 13 33.3600 0.3 A 7 GLN N N 15 123.0300 0.2 A 7 GLN NE2 N 15 109.3900 0.2 A 8 CYS H H 1 7.9450 0.02 A 8 CYS HA H 1 5.1710 0.02 A 8 CYS HB2 H 1 3.4650 0.02 A 8 CYS HB3 H 1 2.8230 0.02 A 8 CYS CA C 13 55.3730 0.3 A 8 CYS CB C 13 46.8800 0.3 A 8 CYS N N 15 115.6800 0.2 A 9 GLY H H 1 6.6690 0.02 A 9 GLY HAy H 1 4.2490 0.02 A 9 GLY HAx H 1 3.8170 0.02 A 9 GLY CA C 13 45.4000 0.3 A 9 GLY N N 15 108.2200 0.2 A 10 GLY H H 1 8.6260 0.02 A 10 GLY HAy H 1 4.3160 0.02 A 10 GLY HAx H 1 3.8360 0.02 A 10 GLY CA C 13 43.4700 0.3 A 10 GLY N N 15 112.1100 0.2 A 11 ILE H H 1 8.4060 0.02 A 11 ILE HA H 1 3.7950 0.02 A 11 ILE HB H 1 1.2770 0.02 A 11 ILE HD1% H 1 0.4880 0.02 A 11 ILE HG12 H 1 0.9710 0.02 A 11 ILE HG13 H 1 1.5150 0.02 A 11 ILE HG2% H 1 0.9070 0.02 A 11 ILE CA C 13 64.4200 0.3 A 11 ILE CB C 13 38.3100 0.3 A 11 ILE CD1 C 13 13.3900 0.3 A 11 ILE CG1 C 13 28.8000 0.3 A 11 ILE CG2 C 13 17.1300 0.3 A 11 ILE N N 15 124.8500 0.2 A 12 GLY H H 1 9.0760 0.02 A 12 GLY HA2 H 1 3.7540 0.02 A 12 GLY HA3 H 1 4.3150 0.02 A 12 GLY CA C 13 45.3400 0.3 A 12 GLY N N 15 117.1500 0.2 A 13 TYR H H 1 7.9540 0.02 A 13 TYR HA H 1 4.5970 0.02 A 13 TYR HB2 H 1 2.8040 0.02 A 13 TYR HB3 H 1 2.8950 0.02 A 13 TYR HDx H 1 6.9070 0.02 A 13 TYR HDy H 1 6.9070 0.02 A 13 TYR HEx H 1 6.4690 0.02 A 13 TYR HEy H 1 6.4690 0.02 A 13 TYR CA C 13 58.1380 0.3 A 13 TYR CB C 13 38.9200 0.3 A 13 TYR CDx C 13 132.7000 0.3 A 13 TYR CDy C 13 132.7000 0.3 A 13 TYR CEx C 13 117.8600 0.3 A 13 TYR CEy C 13 117.8600 0.3 A 13 TYR N N 15 121.2870 0.2 A 14 SER H H 1 8.4880 0.02 A 14 SER HA H 1 4.6990 0.02 A 14 SER HBy H 1 3.8370 0.02 A 14 SER HBx H 1 3.6040 0.02 A 14 SER CA C 13 55.2600 0.3 A 14 SER CB C 13 69.2800 0.3 A 14 SER N N 15 123.8100 0.2 A 15 GLY H H 1 5.0780 0.02 A 15 GLY HA2 H 1 4.0730 0.02 A 15 GLY HA3 H 1 3.5910 0.02 A 15 GLY CA C 13 44.9400 0.3 A 15 GLY N N 15 107.8600 0.2 A 16 PRO HA H 1 4.4950 0.02 A 16 PRO HB2 H 1 1.7800 0.02 A 16 PRO HB3 H 1 2.3630 0.02 A 16 PRO HDx H 1 3.5120 0.02 A 16 PRO HDy H 1 3.6410 0.02 A 16 PRO HGx H 1 2.0170 0.02 A 16 PRO HGy H 1 2.0570 0.02 A 16 PRO CA C 13 63.3300 0.3 A 16 PRO CB C 13 32.5800 0.3 A 16 PRO CD C 13 49.8300 0.3 A 16 PRO CG C 13 27.6200 0.3 A 17 THR H H 1 8.4500 0.02 A 17 THR HA H 1 4.7170 0.02 A 17 THR HB H 1 4.6130 0.02 A 17 THR HG2% H 1 1.3100 0.02 A 17 THR CA C 13 61.5200 0.3 A 17 THR CB C 13 70.5340 0.3 A 17 THR CG2 C 13 21.6980 0.3 A 17 THR N N 15 110.9800 0.2 A 18 VAL H H 1 7.1870 0.02 A 18 VAL HA H 1 4.0990 0.02 A 18 VAL HB H 1 2.0050 0.02 A 18 VAL HG1% H 1 0.9620 0.02 A 18 VAL HG2% H 1 0.9620 0.02 A 18 VAL CA C 13 61.9600 0.3 A 18 VAL CB C 13 32.6900 0.3 A 18 VAL CG1 C 13 21.1600 0.3 A 18 VAL CG2 C 13 21.1600 0.3 A 18 VAL N N 15 120.8900 0.2 A 19 CYS H H 1 8.6700 0.02 A 19 CYS HA H 1 4.6490 0.02 A 19 CYS HB2 H 1 2.2470 0.02 A 19 CYS HB3 H 1 3.6380 0.02 A 19 CYS CA C 13 54.8200 0.3 A 19 CYS CB C 13 39.6200 0.3 A 19 CYS N N 15 126.3200 0.2 A 20 ALA H H 1 8.1090 0.02 A 20 ALA HA H 1 4.0530 0.02 A 20 ALA HB% H 1 1.3100 0.02 A 20 ALA CA C 13 52.1900 0.3 A 20 ALA CB C 13 19.4400 0.3 A 20 ALA N N 15 124.2300 0.2 A 21 SER H H 1 8.4560 0.02 A 21 SER HA H 1 4.1820 0.02 A 21 SER HB2 H 1 3.8490 0.02 A 21 SER HB3 H 1 3.8490 0.02 A 21 SER CA C 13 60.2000 0.3 A 21 SER CB C 13 62.9500 0.3 A 21 SER N N 15 115.4100 0.2 A 22 GLY H H 1 8.8800 0.02 A 22 GLY HA2 H 1 3.6100 0.02 A 22 GLY HA3 H 1 4.3130 0.02 A 22 GLY CA C 13 44.9000 0.3 A 22 GLY N N 15 114.1200 0.2 A 23 THR H H 1 8.1260 0.02 A 23 THR HA H 1 4.7160 0.02 A 23 THR HB H 1 3.7770 0.02 A 23 THR HG2% H 1 0.5000 0.02 A 23 THR CA C 13 59.5500 0.3 A 23 THR CB C 13 72.5700 0.3 A 23 THR CG2 C 13 22.1800 0.3 A 23 THR N N 15 110.6700 0.2 A 24 THR H H 1 9.3660 0.02 A 24 THR HA H 1 4.5000 0.02 A 24 THR HB H 1 4.0130 0.02 A 24 THR HG2% H 1 1.1250 0.02 A 24 THR CA C 13 60.4000 0.3 A 24 THR CB C 13 72.4470 0.3 A 24 THR CG2 C 13 21.8900 0.3 A 24 THR N N 15 112.1900 0.2 A 25 CYS H H 1 8.8450 0.02 A 25 CYS HA H 1 4.5690 0.02 A 25 CYS HB2 H 1 3.1490 0.02 A 25 CYS HB3 H 1 2.9150 0.02 A 25 CYS CA C 13 56.1800 0.3 A 25 CYS CB C 13 38.8600 0.3 A 25 CYS N N 15 122.0900 0.2 A 26 GLN H H 1 9.0410 0.02 A 26 GLN HA H 1 4.6020 0.02 A 26 GLN HB2 H 1 1.9290 0.02 A 26 GLN HB3 H 1 2.0670 0.02 A 26 GLN HE21 H 1 7.0300 0.02 A 26 GLN HE22 H 1 6.7340 0.02 A 26 GLN HGx H 1 2.2460 0.02 A 26 GLN HGy H 1 2.4250 0.02 A 26 GLN CA C 13 55.0300 0.3 A 26 GLN CB C 13 30.3300 0.3 A 26 GLN CG C 13 33.6300 0.3 A 26 GLN N N 15 133.5700 0.2 A 26 GLN NE2 N 15 112.3400 0.2 A 27 VAL H H 1 8.6420 0.02 A 27 VAL HA H 1 4.0560 0.02 A 27 VAL HB H 1 1.9200 0.02 A 27 VAL HG1% H 1 0.6740 0.02 A 27 VAL HG2% H 1 0.9110 0.02 A 27 VAL CA C 13 63.4500 0.3 A 27 VAL CB C 13 32.7100 0.3 A 27 VAL CG1 C 13 20.7800 0.3 A 27 VAL CG2 C 13 20.9000 0.3 A 27 VAL N N 15 125.5800 0.2 A 28 LEU H H 1 8.6430 0.02 A 28 LEU HA H 1 4.7050 0.02 A 28 LEU HBy H 1 1.9190 0.02 A 28 LEU HBx H 1 1.8000 0.02 A 28 LEU HDx% H 1 1.0200 0.02 A 28 LEU HDy% H 1 0.9160 0.02 A 28 LEU HG H 1 1.7960 0.02 A 28 LEU CA C 13 56.7000 0.3 A 28 LEU CB C 13 42.3400 0.3 A 28 LEU CDy C 13 25.1800 0.3 A 28 LEU CDx C 13 23.8000 0.3 A 28 LEU CG C 13 28.4800 0.3 A 28 LEU N N 15 130.4000 0.2 A 29 ASN H H 1 8.6130 0.02 A 29 ASN HA H 1 4.8930 0.02 A 29 ASN HB2 H 1 3.1980 0.02 A 29 ASN HB3 H 1 3.1980 0.02 A 29 ASN HD21 H 1 7.8160 0.02 A 29 ASN HD22 H 1 7.0360 0.02 A 29 ASN CA C 13 53.0000 0.3 A 29 ASN CB C 13 37.6000 0.3 A 29 ASN N N 15 115.5500 0.2 A 29 ASN ND2 N 15 115.4700 0.2 A 30 PRO HA H 1 4.1970 0.02 A 30 PRO HB2 H 1 1.2170 0.02 A 30 PRO HB3 H 1 2.2450 0.02 A 30 PRO HD2 H 1 3.6930 0.02 A 30 PRO HD3 H 1 3.9130 0.02 A 30 PRO HG2 H 1 2.0900 0.02 A 30 PRO HG3 H 1 1.8990 0.02 A 30 PRO CA C 13 65.9000 0.3 A 30 PRO CB C 13 31.9900 0.3 A 30 PRO CD C 13 51.1780 0.3 A 30 PRO CG C 13 28.2500 0.3 A 31 TYR H H 1 8.6500 0.02 A 31 TYR HA H 1 4.3960 0.02 A 31 TYR HB2 H 1 2.8890 0.02 A 31 TYR HB3 H 1 3.3840 0.02 A 31 TYR HDx H 1 7.0810 0.02 A 31 TYR HDy H 1 7.0810 0.02 A 31 TYR HEx H 1 6.7680 0.02 A 31 TYR HEy H 1 6.7680 0.02 A 31 TYR CA C 13 58.4100 0.3 A 31 TYR CB C 13 39.2500 0.3 A 31 TYR CDx C 13 133.5300 0.3 A 31 TYR CDy C 13 133.5300 0.3 A 31 TYR CEx C 13 118.1800 0.3 A 31 TYR CEy C 13 118.1800 0.3 A 31 TYR N N 15 112.7300 0.2 A 32 TYR H H 1 7.9210 0.02 A 32 TYR HA H 1 4.6010 0.02 A 32 TYR HB2 H 1 2.8350 0.02 A 32 TYR HB3 H 1 2.7380 0.02 A 32 TYR HDx H 1 6.9070 0.02 A 32 TYR HDy H 1 6.9070 0.02 A 32 TYR HEx H 1 6.5370 0.02 A 32 TYR HEy H 1 6.5370 0.02 A 32 TYR CA C 13 61.3300 0.3 A 32 TYR CB C 13 42.7100 0.3 A 32 TYR CDx C 13 132.6800 0.3 A 32 TYR CDy C 13 132.6800 0.3 A 32 TYR CEx C 13 117.9100 0.3 A 32 TYR CEy C 13 117.9100 0.3 A 32 TYR N N 15 124.7600 0.2 A 33 SER H H 1 6.7160 0.02 A 33 SER HA H 1 5.1910 0.02 A 33 SER HB2 H 1 2.8340 0.02 A 33 SER HB3 H 1 3.5360 0.02 A 33 SER CA C 13 56.1760 0.3 A 33 SER CB C 13 65.8800 0.3 A 33 SER N N 15 124.5200 0.2 A 34 GLN H H 1 9.0810 0.02 A 34 GLN HA H 1 4.8170 0.02 A 34 GLN HBx H 1 1.6040 0.02 A 34 GLN HBy H 1 1.8610 0.02 A 34 GLN HE21 H 1 7.7010 0.02 A 34 GLN HE22 H 1 6.7200 0.02 A 34 GLN HGx H 1 2.0990 0.02 A 34 GLN HGy H 1 2.0990 0.02 A 34 GLN CA C 13 54.4800 0.3 A 34 GLN CB C 13 34.5200 0.3 A 34 GLN CG C 13 33.9700 0.3 A 34 GLN N N 15 127.1400 0.2 A 34 GLN NE2 N 15 109.1800 0.2 A 35 CYS H H 1 8.5130 0.02 A 35 CYS HA H 1 5.0380 0.02 A 35 CYS HB2 H 1 3.0400 0.02 A 35 CYS HB3 H 1 2.8790 0.02 A 35 CYS CA C 13 53.7300 0.3 A 35 CYS CB C 13 37.7400 0.3 A 35 CYS N N 15 123.7500 0.2 A 36 LEU H H 1 9.0660 0.02 A 36 LEU HA H 1 4.4890 0.02 A 36 LEU HB2 H 1 1.5710 0.02 A 36 LEU HB3 H 1 1.5710 0.02 A 36 LEU HDx% H 1 0.9200 0.02 A 36 LEU HDy% H 1 0.9730 0.02 A 36 LEU HG H 1 1.3600 0.02 A 36 LEU CA C 13 56.1000 0.3 A 36 LEU CB C 13 47.7000 0.3 A 36 LEU CDy C 13 25.7300 0.3 A 36 LEU CDx C 13 23.4200 0.3 A 36 LEU CG C 13 27.1900 0.3 A 36 LEU N N 15 135.2500 0.2 B 1 MAN H1 H 1 4.7530 0.02 B 1 MAN H2 H 1 3.8050 0.02 B 1 MAN H3 H 1 3.7110 0.02 B 1 MAN H4 H 1 3.6070 0.02 B 1 MAN H5 H 1 3.5230 0.02 B 1 MAN H6x H 1 3.7260 0.02 B 1 MAN H6y H 1 3.8470 0.02 B 1 MAN C1 C 13 103.1000 0.3 B 1 MAN C2 C 13 72.7600 0.3 B 1 MAN C3 C 13 73.2000 0.3 B 1 MAN C4 C 13 69.5700 0.3 B 1 MAN C5 C 13 75.7920 0.3 B 1 MAN C6 C 13 63.7600 0.3 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 24 THR H A 36 LEU H 1.0 1.8 3.5 2 2 A 13 TYR H A 12 GLY H 1.0 1.8 3.5 3 3 A 5 TYR HD% A 5 TYR H 1.0 1.8 4.5 4 4 A 5 TYR H A 4 HIS HD2 1.0 1.8 3.5 5 5 A 5 TYR H A 6 GLY H 1.0 1.8 4.5 6 6 A 23 THR H A 22 GLY H 1.0 1.8 3.5 7 7 A 32 TYR H A 31 TYR H 1.0 1.8 2.8 8 8 A 31 TYR H A 31 TYR HD% 1.0 1.8 3.5 9 9 A 18 VAL H A 17 THR H 1.0 1.8 3.5 10 10 A 32 TYR HE% A 7 GLN H 1.0 1.8 5.5 11 11 A 13 TYR H A 12 GLY H 1.0 1.8 3.5 12 12 A 23 THR H A 22 GLY H 1.0 1.8 3.5 13 13 A 32 TYR H A 31 TYR H 1.0 1.8 2.8 14 14 A 9 GLY H A 8 CYS H 1.0 1.8 2.8 15 15 A 36 LEU H A 26 GLN HE21 1.0 1.8 5.5 16 16 A 24 THR H A 26 GLN HE21 1.0 1.8 5.5 17 17 A 18 VAL H A 17 THR H 1.0 1.8 2.8 18 18 A 13 TYR H A 13 TYR HDx 1.0 1.8 4.5 19 18 A 13 TYR H A 13 TYR HDy 1.0 1.8 4.5 20 18 A 8 CYS H A 13 TYR HDx 1.0 1.8 4.5 21 18 A 8 CYS H A 13 TYR HDy 1.0 1.8 4.5 22 19 A 31 TYR HD% A 31 TYR HE% 1.0 1.8 2.8 23 20 A 32 TYR HE% A 32 TYR HDx 1.0 1.8 2.8 24 20 A 32 TYR HE% A 32 TYR HDy 1.0 1.8 2.8 25 21 A 13 TYR HE% A 13 TYR HDx 1.0 1.8 2.8 26 21 A 13 TYR HE% A 13 TYR HDy 1.0 1.8 2.8 27 22 A 5 TYR H A 4 HIS HD2 1.0 1.8 3.5 28 23 A 36 LEU H A 26 GLN HE22 1.0 1.8 5.5 29 23 A 34 GLN H A 33 SER H 1.0 1.8 5.5 30 24 A 4 HIS HE1 A 5 TYR HE% 1.0 1.8 5.5 31 25 A 9 GLY H A 8 CYS H 1.0 1.8 2.8 32 26 A 32 TYR H A 33 SER H 1.0 1.8 4.5 33 27 A 31 TYR HD% A 31 TYR HE% 1.0 1.8 2.8 34 28 A 32 TYR HE% A 32 TYR HDx 1.0 1.8 2.8 35 28 A 32 TYR HE% A 32 TYR HDy 1.0 1.8 2.8 36 29 A 5 TYR HD% A 5 TYR HE% 1.0 1.8 2.8 37 30 A 5 TYR HD% A 5 TYR HE% 1.0 1.8 2.8 38 31 A 24 THR H A 35 CYS HA 1.0 1.8 4.5 39 32 A 34 GLN H A 33 SER HA 1.0 1.8 2.8 40 33 A 36 LEU H A 35 CYS HA 1.0 1.8 2.8 41 34 A 35 CYS HA A 26 GLN H 1.0 1.8 3.5 42 35 A 36 LEU H A 34 GLN HA 1.0 1.8 5.5 43 35 A 26 GLN H A 34 GLN HA 1.0 1.8 5.5 44 36 A 33 SER HA A 28 LEU H 1.0 1.8 3.5 45 37 A 35 CYS HA A 25 CYS H 1.0 1.8 5.5 46 38 A 29 ASN HD21 A 30 PRO HD3 1.0 1.8 6.5 47 39 A 14 SER H A 15 GLY H 1.0 1.8 4.5 48 40 A 35 CYS HA A 35 CYS H 1.0 1.8 3.5 49 41 A 29 ASN H A 29 ASN HA 1.0 1.8 3.5 50 42 A 8 CYS H A 8 CYS HA 1.0 1.8 4.5 51 43 A 29 ASN HD21 A 29 ASN HA 1.0 1.8 5.5 52 44 A 33 SER H A 33 SER HA 1.0 1.8 4.5 53 45 A 9 GLY H A 8 CYS HA 1.0 1.8 4.5 54 46 A 13 TYR HE% A 8 CYS HA 1.0 1.8 4.5 55 47 A 24 THR H A 23 THR HA 1.0 1.8 3.5 56 48 A 24 THR H A 24 THR HA 1.0 1.8 3.5 57 49 A 34 GLN H A 28 LEU HA 1.0 1.8 4.5 58 49 A 36 LEU H A 23 THR HA 1.0 1.8 4.5 59 50 A 34 GLN H A 26 GLN HA 1.0 1.8 3.5 60 50 A 34 GLN H A 25 CYS HA 1.0 1.8 3.5 61 50 A 36 LEU H A 25 CYS HA 1.0 1.8 3.5 62 51 A 26 GLN H A 25 CYS HA 1.0 1.8 2.8 63 52 A 12 GLY H A 12 GLY HA3 1.0 1.8 3.5 64 53 A 5 TYR H A 5 TYR HA 1.0 1.8 2.8 65 53 A 5 TYR H A 4 HIS HA 1.0 1.8 2.8 66 54 A 2 GLN H A 1 THR HB 1.0 1.8 4.5 67 55 A 3 SER H A 2 GLN HA 1.0 1.8 3.5 68 56 A 28 LEU H A 28 LEU HA 1.0 1.8 4.5 69 57 A 26 GLN HA A 27 VAL H 1.0 1.8 2.8 70 58 A 25 CYS H A 25 CYS HA 1.0 1.8 3.5 71 59 A 3 SER H A 3 SER HA 1.0 1.8 4.5 72 60 A 3 SER HA A 4 HIS H 1.0 1.8 3.5 73 61 A 31 TYR H A 31 TYR HA 1.0 1.8 4.5 74 62 A 22 GLY H A 22 GLY HA3 1.0 1.8 3.5 75 63 A 10 GLY H A 9 GLY HAy 1.0 1.8 2.8 76 64 A 22 GLY H A 21 SER HA 1.0 1.8 2.8 77 65 A 7 GLN H A 6 GLY HA2 1.0 1.8 2.8 78 66 A 6 GLY H A 6 GLY HA2 1.0 1.8 2.8 79 66 A 6 GLY H A 5 TYR HA 1.0 1.8 2.8 80 67 A 4 HIS HA A 4 HIS H 1.0 1.8 3.5 81 68 A 14 SER H A 14 SER HA 1.0 1.8 4.5 82 68 A 14 SER H B 1 MAN H1 1.0 1.8 4.5 83 69 A 17 THR H A 17 THR HA 1.0 1.8 3.5 84 70 A 2 GLN HA A 2 GLN HE21 1.0 1.8 4.5 85 70 A 29 ASN H A 28 LEU HA 1.0 1.8 4.5 86 71 A 4 HIS HD2 A 4 HIS HE1 1.0 1.8 5.5 87 71 A 5 TYR HD% A 4 HIS HE1 1.0 1.8 5.5 88 72 A 14 SER H A 13 TYR HA 1.0 1.8 2.8 89 73 A 17 THR H A 16 PRO HA 1.0 1.8 2.8 90 74 A 17 THR H A 17 THR HB 1.0 1.8 4.5 91 75 A 31 TYR HA A 11 ILE H 1.0 1.8 2.8 92 76 A 35 CYS H A 7 GLN HA 1.0 1.8 4.5 93 77 A 21 SER HA A 21 SER H 1.0 1.8 3.5 94 78 A 35 CYS H A 6 GLY HA2 1.0 1.8 4.5 95 78 A 35 CYS H A 4 HIS HA 1.0 1.8 4.5 96 78 A 35 CYS H A 5 TYR HA 1.0 1.8 4.5 97 79 A 8 CYS H A 17 THR HA 1.0 1.8 5.5 98 79 A 13 TYR H A 14 SER HA 1.0 1.8 5.5 99 80 A 20 ALA H A 19 CYS HA 1.0 1.8 2.8 100 81 A 13 TYR H A 13 TYR HA 1.0 1.8 3.5 101 82 A 23 THR H A 22 GLY HA3 1.0 1.8 3.5 102 83 A 23 THR H A 21 SER HA 1.0 1.8 4.5 103 84 A 32 TYR H A 32 TYR HA 1.0 1.8 4.5 104 85 A 32 TYR H A 31 TYR HA 1.0 1.8 4.5 105 86 A 8 CYS H A 7 GLN HA 1.0 1.8 2.8 106 87 A 6 GLY HA2 A 34 GLN HE21 1.0 1.8 4.5 107 87 A 5 TYR HA A 34 GLN HE21 1.0 1.8 4.5 108 88 A 32 TYR HA A 7 GLN HE21 1.0 1.8 4.5 109 89 A 32 TYR HA A 7 GLN HE22 1.0 1.8 4.5 110 90 A 18 VAL H A 16 PRO HA 1.0 1.8 4.5 111 91 A 31 TYR HD% A 31 TYR HA 1.0 1.8 3.5 112 92 A 7 GLN HA A 7 GLN HE21 1.0 1.8 4.5 113 92 A 7 GLN HE21 A 10 GLY HAy 1.0 1.8 4.5 114 93 A 13 TYR HA A 13 TYR HDy 1.0 1.8 2.8 115 93 A 32 TYR HA A 32 TYR HDx 1.0 1.8 2.8 116 93 A 13 TYR HA A 13 TYR HDx 1.0 1.8 2.8 117 93 A 32 TYR HA A 32 TYR HDy 1.0 1.8 2.8 118 94 A 9 GLY H A 25 CYS HA 1.0 1.8 5.5 119 94 A 9 GLY H A 17 THR HB 1.0 1.8 5.5 120 94 A 9 GLY H A 32 TYR HA 1.0 1.8 5.5 121 95 A 33 SER H A 32 TYR HA 1.0 1.8 2.8 122 96 A 4 HIS HD2 A 36 LEU HA 1.0 1.8 3.5 123 97 A 33 SER H A 10 GLY HAy 1.0 1.8 4.5 124 97 A 33 SER H A 7 GLN HA 1.0 1.8 4.5 125 98 A 9 GLY H A 9 GLY HAy 1.0 1.8 3.5 126 99 A 9 GLY HAy A 13 TYR HDx 1.0 1.8 3.5 127 99 A 9 GLY HAy A 13 TYR HDy 1.0 1.8 3.5 128 100 A 5 TYR HD% A 5 TYR HA 1.0 1.8 3.5 129 101 A 4 HIS HD2 A 4 HIS HA 1.0 1.8 3.5 130 102 A 5 TYR HA A 34 GLN HE22 1.0 1.8 4.5 131 103 A 32 TYR HE% A 7 GLN HA 1.0 1.8 4.5 132 104 A 5 TYR HE% A 5 TYR HA 1.0 1.8 5.5 133 105 A 24 THR H A 24 THR HB 1.0 1.8 4.5 134 106 A 24 THR H A 23 THR HB 1.0 1.8 3.5 135 107 A 34 GLN H A 27 VAL HA 1.0 1.8 4.5 136 108 A 2 GLN H A 1 THR HA 1.0 1.8 4.5 137 109 A 12 GLY H A 12 GLY HA2 1.0 1.8 2.8 138 109 A 12 GLY H A 11 ILE HA 1.0 1.8 2.8 139 110 A 12 GLY H B 1 MAN H5 1.0 1.8 3.5 140 110 A 34 GLN H A 33 SER HB3 1.0 1.8 3.5 141 111 A 19 CYS H A 18 VAL HA 1.0 1.8 2.8 142 112 A 28 LEU H A 27 VAL HA 1.0 1.8 2.8 143 113 A 25 CYS H A 24 THR HB 1.0 1.8 3.5 144 114 A 4 HIS H A 3 SER HBx 1.0 1.8 3.5 145 114 A 4 HIS H A 3 SER HBy 1.0 1.8 3.5 146 115 A 3 SER H A 3 SER HBx 1.0 1.8 3.5 147 115 A 3 SER H A 3 SER HBy 1.0 1.8 3.5 148 116 A 22 GLY H A 21 SER HB2 1.0 1.8 4.5 149 116 A 22 GLY H A 21 SER HB3 1.0 1.8 4.5 150 117 A 10 GLY H A 10 GLY HAx 1.0 1.8 2.8 151 118 A 31 TYR H A 30 PRO HD2 1.0 1.8 4.5 152 119 A 19 CYS H A 19 CYS HB3 1.0 1.8 4.5 153 120 A 22 GLY H A 22 GLY HA2 1.0 1.8 3.5 154 121 A 6 GLY H A 6 GLY HA3 1.0 1.8 2.8 155 122 A 2 GLN HE21 A 6 GLY HA3 1.0 1.8 3.5 156 122 A 7 GLN H A 6 GLY HA3 1.0 1.8 3.5 157 123 A 21 SER H A 20 ALA HA 1.0 1.8 2.8 158 124 A 21 SER H A 21 SER HB2 1.0 1.8 2.8 159 124 A 21 SER H A 21 SER HB3 1.0 1.8 2.8 160 125 A 14 SER H A 14 SER HBy 1.0 1.8 4.5 161 126 A 11 ILE H A 11 ILE HA 1.0 1.8 2.8 162 126 A 11 ILE H A 10 GLY HAx 1.0 1.8 2.8 163 127 A 14 SER H B 1 MAN H4 1.0 1.8 4.5 164 127 A 14 SER H A 14 SER HBx 1.0 1.8 4.5 165 128 A 14 SER H B 1 MAN H5 1.0 1.8 5.5 166 129 A 20 ALA H A 20 ALA HA 1.0 1.8 3.5 167 130 A 13 TYR H A 11 ILE HA 1.0 1.8 3.5 168 130 A 13 TYR H A 12 GLY HA2 1.0 1.8 3.5 169 131 A 20 ALA H A 23 THR HB 1.0 1.8 5.5 170 131 A 23 THR H A 23 THR HB 1.0 1.8 5.5 171 132 A 20 ALA H A 19 CYS HB3 1.0 1.8 3.5 172 133 A 23 THR H A 22 GLY HA2 1.0 1.8 4.5 173 134 A 8 CYS H A 33 SER HB3 1.0 1.8 5.5 174 134 A 13 TYR H B 1 MAN H5 1.0 1.8 5.5 175 135 A 32 TYR H A 10 GLY HAx 1.0 1.8 5.5 176 136 A 29 ASN HD21 A 30 PRO HD2 1.0 1.8 5.5 177 137 A 8 CYS H A 8 CYS HB2 1.0 1.8 5.5 178 138 A 18 VAL H A 18 VAL HA 1.0 1.8 4.5 179 139 A 31 TYR HD% A 30 PRO HD2 1.0 1.8 4.5 180 140 A 9 GLY HAx A 13 TYR HDx 1.0 1.8 4.5 181 140 A 9 GLY HAx A 13 TYR HDy 1.0 1.8 4.5 182 141 A 33 SER H A 10 GLY HAx 1.0 1.8 4.5 183 142 A 9 GLY H A 9 GLY HAx 1.0 1.8 3.5 184 143 A 33 SER H A 33 SER HB3 1.0 1.8 4.5 185 144 A 9 GLY H A 33 SER HB3 1.0 1.8 5.5 186 145 A 13 TYR HE% A 15 GLY HA3 1.0 1.8 4.5 187 146 A 24 THR H A 35 CYS HB2 1.0 1.8 5.5 188 147 A 24 THR H A 35 CYS HB3 1.0 1.8 5.5 189 148 A 5 TYR H A 5 TYR HBy 1.0 1.8 5.5 190 149 A 26 GLN H A 25 CYS HB2 1.0 1.8 5.5 191 150 A 5 TYR H A 5 TYR HBx 1.0 1.8 4.5 192 150 A 5 TYR H A 4 HIS HB3 1.0 1.8 4.5 193 151 A 5 TYR H A 35 CYS HB2 1.0 1.8 4.5 194 152 A 36 LEU H A 35 CYS HB2 1.0 1.8 4.5 195 153 A 26 GLN H A 35 CYS HB3 1.0 1.8 5.5 196 153 A 26 GLN H A 25 CYS HB3 1.0 1.8 5.5 197 154 A 5 TYR H A 35 CYS HB3 1.0 1.8 4.5 198 155 A 34 GLN H A 33 SER HB2 1.0 1.8 4.5 199 155 A 36 LEU H A 35 CYS HB3 1.0 1.8 4.5 200 156 A 31 TYR H A 31 TYR HB3 1.0 1.8 4.5 201 157 A 6 GLY H A 5 TYR HBy 1.0 1.8 5.5 202 158 A 31 TYR H A 29 ASN HB2 1.0 1.8 4.5 203 158 A 31 TYR H A 29 ASN HB3 1.0 1.8 4.5 204 159 A 25 CYS H A 25 CYS HB2 1.0 1.8 3.5 205 160 A 6 GLY H A 35 CYS HB2 1.0 1.8 4.5 206 161 A 4 HIS H A 4 HIS HB3 1.0 1.8 3.5 207 162 A 4 HIS H A 4 HIS HB2 1.0 1.8 3.5 208 163 A 25 CYS H A 25 CYS HB3 1.0 1.8 3.5 209 164 A 31 TYR H A 31 TYR HB2 1.0 1.8 3.5 210 165 A 6 GLY H A 35 CYS HB3 1.0 1.8 5.5 211 166 A 11 ILE H A 31 TYR HB3 1.0 1.8 5.5 212 167 A 29 ASN H A 29 ASN HB2 1.0 1.8 4.5 213 167 A 29 ASN H A 29 ASN HB3 1.0 1.8 4.5 214 168 A 35 CYS H A 25 CYS HB2 1.0 1.8 5.5 215 168 A 4 HIS HE1 A 4 HIS HB3 1.0 1.8 5.5 216 169 A 35 CYS H A 35 CYS HB2 1.0 1.8 3.5 217 170 A 11 ILE H A 13 TYR HB3 1.0 1.8 5.5 218 170 A 11 ILE H A 31 TYR HB2 1.0 1.8 5.5 219 171 A 35 CYS H A 35 CYS HB3 1.0 1.8 3.5 220 172 A 2 GLN HE21 A 8 CYS HB3 1.0 1.8 4.5 221 172 A 10 GLY H A 13 TYR HB2 1.0 1.8 4.5 222 173 A 14 SER H A 13 TYR HB2 1.0 1.8 5.5 223 174 A 31 TYR H A 32 TYR HB3 1.0 1.8 5.5 224 174 A 28 LEU H A 32 TYR HB3 1.0 1.8 5.5 225 175 A 20 ALA H A 35 CYS HB2 1.0 1.8 5.5 226 176 A 13 TYR H A 13 TYR HB3 1.0 1.8 2.8 227 177 A 8 CYS H A 33 SER HB2 1.0 1.8 2.8 228 177 A 8 CYS H A 8 CYS HB3 1.0 1.8 2.8 229 177 A 13 TYR H A 13 TYR HB2 1.0 1.8 2.8 230 178 A 32 TYR H A 31 TYR HB3 1.0 1.8 5.5 231 179 A 34 GLN HE21 A 5 TYR HBy 1.0 1.8 5.5 232 180 A 32 TYR H A 29 ASN HB2 1.0 1.8 5.5 233 180 A 32 TYR H A 29 ASN HB3 1.0 1.8 5.5 234 181 A 29 ASN HD21 A 29 ASN HB2 1.0 1.8 2.8 235 181 A 29 ASN HD21 A 29 ASN HB3 1.0 1.8 2.8 236 182 A 34 GLN HE21 A 5 TYR HBx 1.0 1.8 4.5 237 183 A 29 ASN HD21 A 32 TYR HB2 1.0 1.8 5.5 238 184 A 32 TYR H A 31 TYR HB2 1.0 1.8 3.5 239 184 A 32 TYR H A 32 TYR HB2 1.0 1.8 3.5 240 185 A 29 ASN HD21 A 32 TYR HB3 1.0 1.8 5.5 241 186 A 31 TYR HD% A 31 TYR HB3 1.0 1.8 3.5 242 187 A 31 TYR HD% A 29 ASN HB2 1.0 1.8 4.5 243 187 A 31 TYR HD% A 29 ASN HB3 1.0 1.8 4.5 244 188 A 29 ASN HD22 A 29 ASN HB2 1.0 1.8 4.5 245 188 A 29 ASN HB3 A 29 ASN HD22 1.0 1.8 4.5 246 189 A 7 GLN HE21 A 13 TYR HB3 1.0 1.8 5.5 247 190 A 31 TYR HD% A 31 TYR HB2 1.0 1.8 2.8 248 191 A 7 GLN HE22 A 13 TYR HB3 1.0 1.8 4.5 249 192 A 32 TYR HB2 A 29 ASN HD22 1.0 1.8 4.5 250 193 A 7 GLN HE21 A 32 TYR HB2 1.0 1.8 4.5 251 193 A 7 GLN HE21 A 13 TYR HB2 1.0 1.8 4.5 252 194 A 7 GLN HE22 A 13 TYR HB2 1.0 1.8 3.5 253 195 A 32 TYR HB3 A 29 ASN HD22 1.0 1.8 4.5 254 196 A 31 TYR HE% A 31 TYR HB3 1.0 1.8 5.5 255 197 A 5 TYR HD% A 5 TYR HBy 1.0 1.8 2.8 256 198 A 34 GLN HE22 A 5 TYR HBy 1.0 1.8 5.5 257 199 A 5 TYR HD% A 5 TYR HBx 1.0 1.8 2.8 258 200 A 4 HIS HD2 A 4 HIS HB3 1.0 1.8 4.5 259 201 A 34 GLN HE22 A 5 TYR HBx 1.0 1.8 4.5 260 202 A 4 HIS HD2 A 4 HIS HB2 1.0 1.8 4.5 261 203 A 31 TYR HE% A 31 TYR HB2 1.0 1.8 4.5 262 204 A 33 SER H A 33 SER HB2 1.0 1.8 3.5 263 205 A 13 TYR HB2 A 13 TYR HDx 1.0 1.8 2.8 264 205 A 32 TYR HB2 A 32 TYR HDx 1.0 1.8 2.8 265 205 A 13 TYR HB2 A 13 TYR HDy 1.0 1.8 2.8 266 205 A 32 TYR HB2 A 32 TYR HDy 1.0 1.8 2.8 267 206 A 13 TYR HB3 A 13 TYR HDx 1.0 1.8 2.8 268 206 A 13 TYR HB3 A 13 TYR HDy 1.0 1.8 2.8 269 207 A 9 GLY H A 33 SER HB2 1.0 1.8 3.5 270 208 A 32 TYR HB3 A 32 TYR HDy 1.0 1.8 2.8 271 208 A 32 TYR HB3 A 32 TYR HDx 1.0 1.8 2.8 272 209 A 33 SER H A 32 TYR HB3 1.0 1.8 5.5 273 210 A 5 TYR HE% A 5 TYR HBy 1.0 1.8 5.5 274 211 A 5 TYR HE% A 5 TYR HBx 1.0 1.8 5.5 275 211 A 5 TYR HE% A 4 HIS HB3 1.0 1.8 5.5 276 212 A 32 TYR HE% A 32 TYR HB2 1.0 1.8 5.5 277 213 A 32 TYR HE% A 32 TYR HB3 1.0 1.8 5.5 278 214 A 24 THR H A 19 CYS HB2 1.0 1.8 5.5 279 214 A 24 THR H A 26 GLN HGx 1.0 1.8 5.5 280 215 A 36 LEU H A 26 GLN HGy 1.0 1.8 4.5 281 215 A 26 GLN H A 26 GLN HGy 1.0 1.8 4.5 282 216 A 36 LEU H A 26 GLN HGx 1.0 1.8 4.5 283 216 A 26 GLN H A 26 GLN HGx 1.0 1.8 4.5 284 217 A 5 TYR H A 34 GLN HGx 1.0 1.8 5.5 285 217 A 5 TYR H A 34 GLN HGy 1.0 1.8 5.5 286 218 A 36 LEU H A 34 GLN HGx 1.0 1.8 4.5 287 218 A 34 GLN H A 26 GLN HB3 1.0 1.8 4.5 288 218 A 34 GLN H A 34 GLN HGy 1.0 1.8 4.5 289 218 A 36 LEU H A 34 GLN HGy 1.0 1.8 4.5 290 218 A 34 GLN H A 34 GLN HGx 1.0 1.8 4.5 291 219 A 26 GLN H A 26 GLN HB3 1.0 1.8 4.5 292 220 A 3 SER H A 2 GLN HGy 1.0 1.8 4.5 293 221 A 27 VAL H A 26 GLN HGy 1.0 1.8 5.5 294 222 A 25 CYS H A 19 CYS HB2 1.0 1.8 5.5 295 223 A 19 CYS H A 19 CYS HB2 1.0 1.8 3.5 296 224 A 27 VAL H A 26 GLN HGx 1.0 1.8 3.5 297 224 A 2 GLN HE21 A 2 GLN HGx 1.0 1.8 3.5 298 225 A 3 SER H A 2 GLN HGx 1.0 1.8 5.5 299 226 A 27 VAL H A 26 GLN HB3 1.0 1.8 2.8 300 226 A 31 TYR H A 30 PRO HG2 1.0 1.8 2.8 301 226 A 7 GLN H A 7 GLN HB2 1.0 1.8 2.8 302 227 A 2 GLN HE21 A 2 GLN HGy 1.0 1.8 4.5 303 228 A 17 THR H A 16 PRO HB3 1.0 1.8 4.5 304 229 A 35 CYS H A 34 GLN HGx 1.0 1.8 3.5 305 229 A 35 CYS H A 34 GLN HGy 1.0 1.8 3.5 306 230 A 23 THR H A 19 CYS HB2 1.0 1.8 4.5 307 230 A 20 ALA H A 19 CYS HB2 1.0 1.8 4.5 308 231 A 8 CYS H A 7 GLN HGy 1.0 1.8 4.5 309 232 A 34 GLN HE21 A 34 GLN HGx 1.0 1.8 3.5 310 232 A 34 GLN HE21 A 34 GLN HGy 1.0 1.8 3.5 311 233 A 8 CYS H A 34 GLN HGx 1.0 1.8 5.5 312 233 A 8 CYS H A 34 GLN HGy 1.0 1.8 5.5 313 233 A 8 CYS H A 7 GLN HB2 1.0 1.8 5.5 314 234 A 2 GLN HGy A 2 GLN HE22 1.0 1.8 5.5 315 235 A 26 GLN HE21 A 26 GLN HGy 1.0 1.8 4.5 316 236 A 18 VAL H A 16 PRO HB3 1.0 1.8 5.5 317 237 A 7 GLN HE21 A 7 GLN HGy 1.0 1.8 3.5 318 238 A 7 GLN HE22 A 7 GLN HGy 1.0 1.8 4.5 319 239 A 31 TYR HD% A 30 PRO HB3 1.0 1.8 5.5 320 240 A 26 GLN HE21 A 26 GLN HGx 1.0 1.8 4.5 321 241 A 7 GLN HB2 A 2 GLN HE22 1.0 1.8 5.5 322 241 A 26 GLN HE21 A 26 GLN HB3 1.0 1.8 5.5 323 242 A 7 GLN HB2 A 32 TYR HDx 1.0 1.8 4.5 324 242 A 7 GLN HB2 A 32 TYR HDy 1.0 1.8 4.5 325 243 A 26 GLN HE22 A 26 GLN HGy 1.0 1.8 5.5 326 244 A 7 GLN HGy A 32 TYR HDx 1.0 1.8 4.5 327 244 A 7 GLN HGy A 32 TYR HDy 1.0 1.8 4.5 328 245 A 33 SER H A 7 GLN HGy 1.0 1.8 4.5 329 246 A 9 GLY H A 7 GLN HGy 1.0 1.8 3.5 330 247 A 31 TYR HE% A 30 PRO HB3 1.0 1.8 5.5 331 248 A 34 GLN HE22 A 34 GLN HGx 1.0 1.8 3.5 332 248 A 34 GLN HE22 A 34 GLN HGy 1.0 1.8 3.5 333 249 A 5 TYR HD% A 34 GLN HGx 1.0 1.8 5.5 334 249 A 5 TYR HD% A 34 GLN HGy 1.0 1.8 5.5 335 250 A 31 TYR HE% A 30 PRO HG2 1.0 1.8 5.5 336 251 A 9 GLY H A 7 GLN HB2 1.0 1.8 6.5 337 252 A 32 TYR HE% A 7 GLN HGy 1.0 1.8 4.5 338 253 A 32 TYR HE% A 7 GLN HB2 1.0 1.8 3.5 339 254 A 24 THR H A 36 LEU HB2 1.0 1.8 5.5 340 254 A 24 THR H A 36 LEU HB3 1.0 1.8 5.5 341 255 A 26 GLN H A 26 GLN HB2 1.0 1.8 3.5 342 256 A 2 GLN H A 2 GLN HBx 1.0 1.8 4.5 343 257 A 34 GLN H A 34 GLN HBy 1.0 1.8 3.5 344 258 A 34 GLN H A 34 GLN HBx 1.0 1.8 3.5 345 259 A 36 LEU H A 36 LEU HB2 1.0 1.8 2.8 346 259 A 36 LEU H A 36 LEU HB3 1.0 1.8 2.8 347 260 A 28 LEU H A 28 LEU HBy 1.0 1.8 2.8 348 260 A 2 GLN HE21 A 2 GLN HBy 1.0 1.8 2.8 349 261 A 3 SER H A 2 GLN HBy 1.0 1.8 4.5 350 262 A 28 LEU H A 28 LEU HBx 1.0 1.8 3.5 351 262 A 28 LEU H A 28 LEU HG 1.0 1.8 3.5 352 263 A 7 GLN H A 7 GLN HB3 1.0 1.8 3.5 353 264 A 17 THR H A 18 VAL HB 1.0 1.8 5.5 354 265 A 29 ASN H A 28 LEU HBy 1.0 1.8 3.5 355 265 A 2 GLN HE21 A 2 GLN HBy 1.0 1.8 3.5 356 266 A 35 CYS H A 2 GLN HBy 1.0 1.8 4.5 357 266 A 35 CYS H A 34 GLN HBy 1.0 1.8 4.5 358 267 A 2 GLN HE21 A 2 GLN HBx 1.0 1.8 3.5 359 267 A 29 ASN H A 28 LEU HBx 1.0 1.8 3.5 360 268 A 17 THR H A 16 PRO HB2 1.0 1.8 5.5 361 269 A 35 CYS H A 34 GLN HBx 1.0 1.8 4.5 362 270 A 11 ILE H A 11 ILE HG13 1.0 1.8 3.5 363 271 A 20 ALA H A 2 GLN HBx 1.0 1.8 5.5 364 271 A 20 ALA H A 2 GLN HBy 1.0 1.8 5.5 365 272 A 8 CYS H A 7 GLN HB3 1.0 1.8 5.5 366 273 A 29 ASN HD21 A 28 LEU HBy 1.0 1.8 6.5 367 274 A 29 ASN HD21 A 28 LEU HBx 1.0 1.8 6.5 368 275 A 18 VAL H A 18 VAL HB 1.0 1.8 3.5 369 276 A 2 GLN HE22 A 2 GLN HBy 1.0 1.8 5.5 370 276 A 26 GLN HE21 A 26 GLN HB2 1.0 1.8 5.5 371 277 A 29 ASN HD22 A 28 LEU HBx 1.0 1.8 5.5 372 277 A 2 GLN HE22 A 2 GLN HBx 1.0 1.8 5.5 373 278 A 18 VAL H A 16 PRO HB2 1.0 1.8 5.5 374 279 A 2 GLN HE22 A 7 GLN HB3 1.0 1.8 6.5 375 280 A 34 GLN HBx A 32 TYR HDx 1.0 1.8 4.5 376 280 A 34 GLN HBx A 32 TYR HDy 1.0 1.8 4.5 377 281 A 26 GLN HE21 A 36 LEU HB2 1.0 1.8 5.5 378 281 A 26 GLN HE21 A 36 LEU HB3 1.0 1.8 5.5 379 282 A 28 LEU HBy A 32 TYR HDx 1.0 1.8 3.5 380 282 A 28 LEU HBy A 32 TYR HDy 1.0 1.8 3.5 381 283 A 33 SER H A 34 GLN HBy 1.0 1.8 5.5 382 283 A 34 GLN HE22 A 34 GLN HBy 1.0 1.8 5.5 383 284 A 28 LEU HG A 32 TYR HDx 1.0 1.8 3.5 384 284 A 28 LEU HG A 32 TYR HDy 1.0 1.8 3.5 385 284 A 28 LEU HBx A 32 TYR HDx 1.0 1.8 3.5 386 284 A 28 LEU HBx A 32 TYR HDy 1.0 1.8 3.5 387 285 A 9 GLY H A 7 GLN HB3 1.0 1.8 5.5 388 286 A 4 HIS HD2 A 36 LEU HB2 1.0 1.8 5.5 389 286 A 4 HIS HD2 A 36 LEU HB3 1.0 1.8 5.5 390 287 A 26 GLN HE22 A 36 LEU HB2 1.0 1.8 4.5 391 287 A 26 GLN HE22 A 36 LEU HB3 1.0 1.8 4.5 392 288 A 32 TYR HE% A 34 GLN HBy 1.0 1.8 3.5 393 289 A 13 TYR HE% A 7 GLN HB3 1.0 1.8 4.5 394 290 A 32 TYR HE% A 34 GLN HBx 1.0 1.8 3.5 395 291 A 24 THR H A 36 LEU HG 1.0 1.8 6.5 396 292 A 24 THR H A 24 THR HG2% 1.0 1.8 4.5 397 293 A 36 LEU H A 36 LEU HG 1.0 1.8 3.5 398 294 A 34 GLN H A 28 LEU HDx% 1.0 1.8 4.5 399 295 A 2 GLN H A 1 THR HG2% 1.0 1.8 5.5 400 296 A 5 TYR H A 36 LEU HDy% 1.0 1.8 5.5 401 297 A 34 GLN H A 28 LEU HDy% 1.0 1.8 3.5 402 297 A 12 GLY H A 11 ILE HG2% 1.0 1.8 3.5 403 298 A 4 HIS H A 20 ALA HB% 1.0 1.8 5.5 404 299 A 31 TYR H A 30 PRO HB2 1.0 1.8 4.5 405 300 A 25 CYS H A 24 THR HG2% 1.0 1.8 4.5 406 301 A 28 LEU H A 28 LEU HDx% 1.0 1.8 4.5 407 302 A 19 CYS H A 18 VAL HG1% 1.0 1.8 3.5 408 303 A 27 VAL H A 27 VAL HG1% 1.0 1.8 3.5 409 303 A 28 LEU H A 27 VAL HG1% 1.0 1.8 3.5 410 304 A 35 CYS H A 36 LEU HG 1.0 1.8 5.5 411 305 A 17 THR H A 17 THR HG2% 1.0 1.8 2.8 412 305 A 21 SER H A 20 ALA HB% 1.0 1.8 2.8 413 306 A 11 ILE H A 11 ILE HB 1.0 1.8 3.5 414 307 A 21 SER H A 1 THR HG2% 1.0 1.8 5.5 415 308 A 11 ILE H A 11 ILE HG12 1.0 1.8 4.5 416 309 A 4 HIS HE1 A 36 LEU HDy% 1.0 1.8 5.5 417 309 A 35 CYS H A 36 LEU HDy% 1.0 1.8 5.5 418 310 A 11 ILE H A 11 ILE HG2% 1.0 1.8 4.5 419 311 A 17 THR H A 18 VAL HG2% 1.0 1.8 5.5 420 312 A 29 ASN H A 27 VAL HG1% 1.0 1.8 3.5 421 313 A 20 ALA H A 20 ALA HB% 1.0 1.8 2.8 422 314 A 20 ALA H A 1 THR HG2% 1.0 1.8 5.5 423 315 A 8 CYS H A 7 GLN HGx 1.0 1.8 4.5 424 316 A 34 GLN HE21 A 36 LEU HDy% 1.0 1.8 5.5 425 316 A 34 GLN HE21 A 28 LEU HDx% 1.0 1.8 5.5 426 317 A 18 VAL H A 17 THR HG2% 1.0 1.8 5.5 427 318 A 31 TYR HD% A 11 ILE HB 1.0 1.8 3.5 428 319 A 26 GLN HE21 A 24 THR HG2% 1.0 1.8 5.5 429 320 A 7 GLN HE21 A 7 GLN HGx 1.0 1.8 3.5 430 321 A 7 GLN HE22 A 7 GLN HGx 1.0 1.8 4.5 431 322 A 2 GLN HE22 A 7 GLN HGx 1.0 1.8 5.5 432 322 A 29 ASN HD22 A 28 LEU HDx% 1.0 1.8 5.5 433 323 A 18 VAL H A 18 VAL HG2% 1.0 1.8 3.5 434 324 A 29 ASN HD22 A 28 LEU HDy% 1.0 1.8 5.5 435 324 A 26 GLN HE21 A 36 LEU HDx% 1.0 1.8 5.5 436 325 A 31 TYR HD% A 11 ILE HG2% 1.0 1.8 4.5 437 326 A 4 HIS HD2 A 20 ALA HB% 1.0 1.8 5.5 438 326 A 4 HIS HD2 A 36 LEU HG 1.0 1.8 5.5 439 327 A 17 THR HG2% A 13 TYR HDx 1.0 1.8 4.5 440 327 A 17 THR HG2% A 13 TYR HDy 1.0 1.8 4.5 441 328 A 31 TYR HE% A 11 ILE HB 1.0 1.8 4.5 442 329 A 26 GLN HE22 A 24 THR HG2% 1.0 1.8 5.5 443 330 A 9 GLY H A 7 GLN HGx 1.0 1.8 3.5 444 331 A 28 LEU HDx% A 32 TYR HDx 1.0 1.8 3.5 445 331 A 28 LEU HDx% A 32 TYR HDy 1.0 1.8 3.5 446 332 A 33 SER H A 28 LEU HDx% 1.0 1.8 4.5 447 332 A 34 GLN HE22 A 28 LEU HDx% 1.0 1.8 4.5 448 332 A 33 SER H A 7 GLN HGx 1.0 1.8 4.5 449 333 A 5 TYR HD% A 36 LEU HDy% 1.0 1.8 3.5 450 334 A 4 HIS HD2 A 36 LEU HDy% 1.0 1.8 4.5 451 335 A 28 LEU HDy% A 32 TYR HDx 1.0 1.8 4.5 452 335 A 28 LEU HDy% A 32 TYR HDy 1.0 1.8 4.5 453 336 A 31 TYR HE% A 11 ILE HG2% 1.0 1.8 3.5 454 337 A 13 TYR HE% A 17 THR HG2% 1.0 1.8 3.5 455 338 A 32 TYR HE% A 28 LEU HDx% 1.0 1.8 3.5 456 339 A 5 TYR HE% A 36 LEU HDy% 1.0 1.8 4.5 457 340 A 32 TYR HE% A 28 LEU HDy% 1.0 1.8 5.5 458 341 A 24 THR H A 23 THR HG2% 1.0 1.8 4.5 459 342 A 5 TYR H A 23 THR HG2% 1.0 1.8 5.5 460 343 A 12 GLY H A 11 ILE HD1% 1.0 1.8 4.5 461 343 A 36 LEU H A 23 THR HG2% 1.0 1.8 4.5 462 344 A 4 HIS H A 23 THR HG2% 1.0 1.8 5.5 463 345 A 4 HIS HE1 A 23 THR HG2% 1.0 1.8 5.5 464 346 A 11 ILE H A 11 ILE HD1% 1.0 1.8 4.5 465 347 A 23 THR H A 23 THR HG2% 1.0 1.8 4.5 466 348 A 31 TYR HD% A 11 ILE HD1% 1.0 1.8 5.5 467 349 A 4 HIS HD2 A 23 THR HG2% 1.0 1.8 4.5 468 350 A 31 TYR HE% A 11 ILE HD1% 1.0 1.8 4.5 469 351 A 34 GLN H A 33 SER HA 1.0 1.8 4.5 470 352 A 33 SER HA A 28 LEU H 1.0 1.8 4.5 471 353 A 33 SER HA A 27 VAL HA 1.0 1.8 5.5 472 354 A 8 CYS HA A 8 CYS HB2 1.0 1.8 4.5 473 355 A 8 CYS HA A 8 CYS HB3 1.0 1.8 4.5 474 356 A 24 THR H A 24 THR HB 1.0 1.8 5.5 475 357 A 5 TYR H A 5 TYR HA 1.0 1.8 3.5 476 357 A 5 TYR H A 4 HIS HA 1.0 1.8 3.5 477 358 A 2 GLN H A 1 THR HA 1.0 1.8 5.5 478 359 A 24 THR H A 23 THR HB 1.0 1.8 3.5 479 360 A 12 GLY H A 11 ILE HA 1.0 1.8 2.8 480 361 A 36 LEU H A 19 CYS HB3 1.0 1.8 5.5 481 362 A 12 GLY H A 12 GLY HA2 1.0 1.8 3.5 482 363 A 12 GLY H B 1 MAN H5 1.0 1.8 3.5 483 363 A 34 GLN H A 33 SER HB3 1.0 1.8 3.5 484 364 A 5 TYR H A 5 TYR HBy 1.0 1.8 5.5 485 365 A 36 LEU H A 25 CYS HB2 1.0 1.8 4.5 486 365 A 26 GLN H A 25 CYS HB2 1.0 1.8 4.5 487 366 A 5 TYR H A 5 TYR HBx 1.0 1.8 4.5 488 366 A 5 TYR H A 4 HIS HB3 1.0 1.8 4.5 489 367 A 5 TYR H A 35 CYS HB2 1.0 1.8 4.5 490 368 A 5 TYR H A 4 HIS HB2 1.0 1.8 5.5 491 369 A 5 TYR H A 35 CYS HB3 1.0 1.8 4.5 492 370 A 26 GLN H A 33 SER HB2 1.0 1.8 4.5 493 370 A 26 GLN H A 8 CYS HB3 1.0 1.8 4.5 494 370 A 34 GLN H A 33 SER HB2 1.0 1.8 4.5 495 371 A 36 LEU H A 35 CYS HB2 1.0 1.8 4.5 496 372 A 12 GLY H A 13 TYR HB3 1.0 1.8 5.5 497 372 A 26 GLN H A 25 CYS HB3 1.0 1.8 5.5 498 373 A 12 GLY H A 13 TYR HB3 1.0 1.8 5.5 499 373 A 36 LEU H A 35 CYS HB3 1.0 1.8 5.5 500 374 A 36 LEU H A 26 GLN HGy 1.0 1.8 4.5 501 374 A 26 GLN H A 26 GLN HGy 1.0 1.8 4.5 502 375 A 36 LEU H A 26 GLN HGx 1.0 1.8 4.5 503 375 A 26 GLN H A 26 GLN HGx 1.0 1.8 4.5 504 376 A 2 GLN H A 2 GLN HBy 1.0 1.8 5.5 505 377 A 34 GLN H A 34 GLN HBy 1.0 1.8 4.5 506 378 A 34 GLN H A 26 GLN HB3 1.0 1.8 4.5 507 378 A 26 GLN H A 26 GLN HB3 1.0 1.8 4.5 508 379 A 34 GLN H A 28 LEU HBy 1.0 1.8 3.5 509 379 A 26 GLN H A 26 GLN HB2 1.0 1.8 3.5 510 380 A 36 LEU H A 36 LEU HB2 1.0 1.8 3.5 511 380 A 36 LEU H A 36 LEU HB3 1.0 1.8 3.5 512 381 A 24 THR H A 24 THR HG2% 1.0 1.8 4.5 513 382 A 26 GLN H A 36 LEU HG 1.0 1.8 4.5 514 382 A 36 LEU H A 36 LEU HG 1.0 1.8 4.5 515 383 A 21 SER H A 1 THR HG2% 1.0 1.8 5.5 516 384 A 34 GLN H A 28 LEU HDx% 1.0 1.8 5.5 517 385 A 12 GLY H A 11 ILE HG12 1.0 1.8 4.5 518 385 A 36 LEU H A 36 LEU HDy% 1.0 1.8 4.5 519 386 A 36 LEU H A 36 LEU HDx% 1.0 1.8 3.5 520 386 A 34 GLN H A 28 LEU HDy% 1.0 1.8 3.5 521 386 A 12 GLY H A 11 ILE HG2% 1.0 1.8 3.5 522 387 A 24 THR H A 23 THR HG2% 1.0 1.8 4.5 523 388 A 12 GLY H A 11 ILE HD1% 1.0 1.8 5.5 524 388 A 36 LEU H A 23 THR HG2% 1.0 1.8 5.5 525 389 A 22 GLY H A 21 SER HA 1.0 1.8 3.5 526 390 A 25 CYS H A 24 THR HA 1.0 1.8 5.5 527 391 A 6 GLY H A 6 GLY HA2 1.0 1.8 5.5 528 392 A 6 GLY H A 5 TYR HA 1.0 1.8 4.5 529 393 A 3 SER H A 3 SER HA 1.0 1.8 5.5 530 393 A 3 SER HA A 4 HIS H 1.0 1.8 5.5 531 394 A 10 GLY H A 9 GLY HAy 1.0 1.8 4.5 532 395 A 7 GLN H A 6 GLY HA2 1.0 1.8 4.5 533 396 A 21 SER HA A 21 SER H 1.0 1.8 4.5 534 397 A 17 THR H A 16 PRO HA 1.0 1.8 5.5 535 398 A 31 TYR HA A 11 ILE H 1.0 1.8 4.5 536 399 A 22 GLY H A 21 SER HB2 1.0 1.8 4.5 537 399 A 22 GLY H A 21 SER HB3 1.0 1.8 4.5 538 400 A 25 CYS H A 24 THR HB 1.0 1.8 4.5 539 401 A 3 SER H A 3 SER HBy 1.0 1.8 4.5 540 401 A 4 HIS H A 3 SER HBy 1.0 1.8 4.5 541 402 A 3 SER H A 3 SER HBx 1.0 1.8 4.5 542 402 A 4 HIS H A 3 SER HBx 1.0 1.8 4.5 543 403 A 19 CYS H A 18 VAL HA 1.0 1.8 3.5 544 404 A 28 LEU H A 27 VAL HA 1.0 1.8 2.8 545 405 A 30 PRO HD3 A 29 ASN H 1.0 1.8 5.5 546 405 A 1 THR HA A 19 CYS H 1.0 1.8 5.5 547 405 A 2 GLN HE21 A 3 SER HBy 1.0 1.8 5.5 548 405 A 31 TYR H A 30 PRO HD3 1.0 1.8 5.5 549 406 A 10 GLY H A 10 GLY HAx 1.0 1.8 3.5 550 407 A 35 CYS H A 4 HIS HA 1.0 1.8 4.5 551 407 A 35 CYS H A 5 TYR HA 1.0 1.8 4.5 552 408 A 21 SER H A 1 THR HA 1.0 1.8 6.5 553 408 A 17 THR H A 1 THR HA 1.0 1.8 6.5 554 409 A 21 SER H A 20 ALA HA 1.0 1.8 3.5 555 410 A 21 SER H A 21 SER HB2 1.0 1.8 3.5 556 410 A 14 SER H A 14 SER HBy 1.0 1.8 3.5 557 410 A 21 SER H A 21 SER HB3 1.0 1.8 3.5 558 411 A 11 ILE H A 10 GLY HAx 1.0 1.8 2.8 559 412 A 22 GLY H A 22 GLY HA2 1.0 1.8 3.5 560 413 A 6 GLY H A 6 GLY HA3 1.0 1.8 3.5 561 414 A 2 GLN HE21 A 19 CYS HB3 1.0 1.8 4.5 562 414 A 19 CYS H A 19 CYS HB3 1.0 1.8 4.5 563 415 A 10 GLY H A 9 GLY HAx 1.0 1.8 3.5 564 416 A 31 TYR H A 30 PRO HD2 1.0 1.8 4.5 565 417 A 2 GLN HE21 A 6 GLY HA3 1.0 1.8 3.5 566 417 A 7 GLN H A 6 GLY HA3 1.0 1.8 3.5 567 418 A 14 SER H B 1 MAN H4 1.0 1.8 4.5 568 418 A 14 SER H A 14 SER HBx 1.0 1.8 4.5 569 419 A 11 ILE H A 11 ILE HA 1.0 1.8 4.5 570 420 A 25 CYS H A 25 CYS HB2 1.0 1.8 3.5 571 421 A 31 TYR H A 31 TYR HB3 1.0 1.8 4.5 572 422 A 31 TYR H A 29 ASN HB2 1.0 1.8 4.5 573 422 A 29 ASN H A 29 ASN HB2 1.0 1.8 4.5 574 422 A 31 TYR H A 29 ASN HB3 1.0 1.8 4.5 575 422 A 29 ASN H A 29 ASN HB3 1.0 1.8 4.5 576 423 A 25 CYS H A 25 CYS HB3 1.0 1.8 2.8 577 424 A 6 GLY H A 35 CYS HB2 1.0 1.8 4.5 578 425 A 6 GLY H A 35 CYS HB3 1.0 1.8 5.5 579 426 A 4 HIS H A 4 HIS HB3 1.0 1.8 3.5 580 427 A 4 HIS H A 4 HIS HB2 1.0 1.8 3.5 581 428 A 10 GLY H A 13 TYR HB3 1.0 1.8 3.5 582 429 A 10 GLY H A 33 SER HB2 1.0 1.8 4.5 583 429 A 2 GLN HE21 A 8 CYS HB3 1.0 1.8 4.5 584 430 A 35 CYS H A 35 CYS HB2 1.0 1.8 3.5 585 431 A 14 SER H A 13 TYR HB3 1.0 1.8 3.5 586 431 A 35 CYS H A 35 CYS HB3 1.0 1.8 3.5 587 432 A 35 CYS H A 8 CYS HB3 1.0 1.8 5.5 588 433 A 3 SER H A 2 GLN HGy 1.0 1.8 4.5 589 434 A 2 GLN HE21 A 2 GLN HGy 1.0 1.8 4.5 590 435 A 28 LEU H A 32 TYR HB3 1.0 1.8 5.5 591 435 A 29 ASN H A 32 TYR HB3 1.0 1.8 5.5 592 436 A 25 CYS H A 19 CYS HB2 1.0 1.8 5.5 593 437 A 3 SER H A 2 GLN HGx 1.0 1.8 5.5 594 438 A 19 CYS H A 19 CYS HB2 1.0 1.8 2.8 595 439 A 35 CYS H A 34 GLN HGx 1.0 1.8 3.5 596 439 A 35 CYS H A 34 GLN HGy 1.0 1.8 3.5 597 440 A 17 THR H A 16 PRO HB3 1.0 1.8 5.5 598 441 A 27 VAL H A 26 GLN HB3 1.0 1.8 2.8 599 441 A 7 GLN H A 7 GLN HB2 1.0 1.8 2.8 600 442 A 27 VAL H A 27 VAL HB 1.0 1.8 2.8 601 442 A 29 ASN H A 28 LEU HBy 1.0 1.8 2.8 602 442 A 28 LEU H A 28 LEU HBy 1.0 1.8 2.8 603 443 A 29 ASN H A 28 LEU HBx 1.0 1.8 3.5 604 443 A 28 LEU H A 28 LEU HG 1.0 1.8 3.5 605 444 A 7 GLN H A 7 GLN HB3 1.0 1.8 3.5 606 445 A 11 ILE H A 11 ILE HG13 1.0 1.8 3.5 607 446 A 22 GLY H A 24 THR HG2% 1.0 1.8 4.5 608 446 A 25 CYS H A 24 THR HG2% 1.0 1.8 4.5 609 447 A 4 HIS H A 20 ALA HB% 1.0 1.8 4.5 610 448 A 17 THR H A 17 THR HG2% 1.0 1.8 2.8 611 448 A 21 SER H A 20 ALA HB% 1.0 1.8 2.8 612 449 A 11 ILE H A 11 ILE HB 1.0 1.8 3.5 613 450 A 19 CYS H A 18 VAL HG1% 1.0 1.8 3.5 614 451 A 28 LEU H A 28 LEU HDx% 1.0 1.8 4.5 615 452 A 27 VAL H A 27 VAL HG2% 1.0 1.8 2.8 616 453 A 17 THR H A 18 VAL HG2% 1.0 1.8 3.5 617 453 A 11 ILE H A 11 ILE HG12 1.0 1.8 3.5 618 454 A 11 ILE H A 11 ILE HG2% 1.0 1.8 4.5 619 455 A 28 LEU H A 27 VAL HG1% 1.0 1.8 3.5 620 455 A 29 ASN H A 27 VAL HG1% 1.0 1.8 3.5 621 456 A 11 ILE H A 11 ILE HD1% 1.0 1.8 4.5 622 457 A 23 THR H A 21 SER HA 1.0 1.8 5.5 623 458 A 8 CYS H A 7 GLN HA 1.0 1.8 4.5 624 459 A 20 ALA H A 20 ALA HA 1.0 1.8 4.5 625 460 A 5 TYR HA A 34 GLN HE21 1.0 1.8 5.5 626 461 A 20 ALA H A 23 THR HB 1.0 1.8 5.5 627 461 A 23 THR H A 23 THR HB 1.0 1.8 5.5 628 462 A 20 ALA H A 19 CYS HB3 1.0 1.8 4.5 629 463 A 23 THR H A 22 GLY HA2 1.0 1.8 4.5 630 464 A 13 TYR H B 1 MAN H2 1.0 1.8 4.5 631 464 A 13 TYR H A 11 ILE HA 1.0 1.8 4.5 632 465 A 13 TYR H A 12 GLY HA2 1.0 1.8 4.5 633 466 A 8 CYS H A 9 GLY HAx 1.0 1.8 5.5 634 466 A 13 TYR H A 10 GLY HAx 1.0 1.8 5.5 635 466 A 13 TYR H B 1 MAN H6y 1.0 1.8 5.5 636 466 A 32 TYR H A 10 GLY HAx 1.0 1.8 5.5 637 467 A 8 CYS H A 8 CYS HB2 1.0 1.8 5.5 638 468 A 29 ASN HD21 A 29 ASN HB2 1.0 1.8 2.8 639 468 A 29 ASN HD21 A 29 ASN HB3 1.0 1.8 2.8 640 469 A 34 GLN HE21 A 5 TYR HBy 1.0 1.8 5.5 641 470 A 29 ASN HD21 A 32 TYR HB2 1.0 1.8 5.5 642 471 A 32 TYR H A 31 TYR HB2 1.0 1.8 2.8 643 471 A 13 TYR H A 13 TYR HB3 1.0 1.8 2.8 644 472 A 2 GLN HGy A 2 GLN HE22 1.0 1.8 5.5 645 473 A 8 CYS H A 8 CYS HB3 1.0 1.8 3.5 646 473 A 13 TYR H A 13 TYR HB2 1.0 1.8 3.5 647 474 A 8 CYS H A 33 SER HB2 1.0 1.8 3.5 648 474 A 8 CYS H A 8 CYS HB3 1.0 1.8 3.5 649 474 A 32 TYR H A 32 TYR HB2 1.0 1.8 3.5 650 475 A 34 GLN HE21 A 5 TYR HBx 1.0 1.8 4.5 651 476 A 32 TYR H A 32 TYR HB3 1.0 1.8 4.5 652 477 A 29 ASN HD21 A 32 TYR HB3 1.0 1.8 5.5 653 478 A 23 THR H A 19 CYS HB2 1.0 1.8 4.5 654 478 A 20 ALA H A 19 CYS HB2 1.0 1.8 4.5 655 479 A 8 CYS H A 7 GLN HGy 1.0 1.8 4.5 656 480 A 34 GLN HE21 A 34 GLN HGx 1.0 1.8 3.5 657 480 A 34 GLN HE21 A 34 GLN HGy 1.0 1.8 3.5 658 481 A 29 ASN HD21 A 28 LEU HBx 1.0 1.8 6.5 659 482 A 20 ALA H A 20 ALA HB% 1.0 1.8 2.8 660 483 A 8 CYS H A 7 GLN HGx 1.0 1.8 4.5 661 484 A 23 THR H A 23 THR HG2% 1.0 1.8 4.5 662 485 A 31 TYR HD% A 31 TYR HA 1.0 1.8 5.5 663 486 A 9 GLY HAy A 13 TYR HDx 1.0 1.8 4.5 664 486 A 9 GLY HAy A 13 TYR HDy 1.0 1.8 4.5 665 487 A 18 VAL H A 18 VAL HA 1.0 1.8 4.5 666 488 A 9 GLY HAx A 13 TYR HDx 1.0 1.8 4.5 667 488 A 9 GLY HAx A 13 TYR HDy 1.0 1.8 4.5 668 489 A 31 TYR HD% A 30 PRO HD2 1.0 1.8 5.5 669 490 A 31 TYR HD% A 31 TYR HB3 1.0 1.8 3.5 670 491 A 29 ASN HD22 A 29 ASN HB2 1.0 1.8 3.5 671 491 A 29 ASN HB3 A 29 ASN HD22 1.0 1.8 3.5 672 492 A 7 GLN HE21 A 13 TYR HB2 1.0 1.8 4.5 673 493 A 31 TYR HD% A 31 TYR HB2 1.0 1.8 2.8 674 494 A 7 GLN HE21 A 13 TYR HB3 1.0 1.8 4.5 675 495 A 32 TYR HB2 A 29 ASN HD22 1.0 1.8 4.5 676 496 A 13 TYR HB3 A 13 TYR HDx 1.0 1.8 2.8 677 496 A 13 TYR HB3 A 13 TYR HDy 1.0 1.8 2.8 678 497 A 32 TYR HB2 A 32 TYR HDx 1.0 1.8 2.8 679 497 A 32 TYR HB2 A 32 TYR HDy 1.0 1.8 2.8 680 498 A 13 TYR HB2 A 13 TYR HDx 1.0 1.8 3.5 681 498 A 13 TYR HB2 A 13 TYR HDy 1.0 1.8 3.5 682 499 A 32 TYR HB3 A 29 ASN HD22 1.0 1.8 4.5 683 500 A 33 SER H A 32 TYR HB3 1.0 1.8 5.5 684 501 A 32 TYR HB3 A 32 TYR HDy 1.0 1.8 3.5 685 501 A 32 TYR HB3 A 32 TYR HDx 1.0 1.8 3.5 686 502 A 26 GLN HE22 A 26 GLN HGy 1.0 1.8 5.5 687 503 A 7 GLN HE21 A 7 GLN HGy 1.0 1.8 3.5 688 504 A 26 GLN HE21 A 26 GLN HB2 1.0 1.8 5.5 689 505 A 26 GLN HE21 A 26 GLN HGx 1.0 1.8 4.5 690 506 A 26 GLN HE21 A 26 GLN HGy 1.0 1.8 4.5 691 507 A 7 GLN HE22 A 7 GLN HGy 1.0 1.8 4.5 692 508 A 7 GLN HGy A 32 TYR HDx 1.0 1.8 4.5 693 508 A 7 GLN HGy A 32 TYR HDy 1.0 1.8 4.5 694 509 A 18 VAL H A 18 VAL HB 1.0 1.8 3.5 695 510 A 29 ASN HD22 A 28 LEU HBx 1.0 1.8 6.5 696 511 A 28 LEU HBy A 32 TYR HDx 1.0 1.8 4.5 697 511 A 28 LEU HBy A 32 TYR HDy 1.0 1.8 4.5 698 512 A 28 LEU HG A 32 TYR HDx 1.0 1.8 4.5 699 512 A 28 LEU HG A 32 TYR HDy 1.0 1.8 4.5 700 512 A 28 LEU HBx A 32 TYR HDx 1.0 1.8 4.5 701 512 A 28 LEU HBx A 32 TYR HDy 1.0 1.8 4.5 702 513 A 31 TYR HD% A 11 ILE HB 1.0 1.8 4.5 703 514 A 17 THR HG2% A 13 TYR HDx 1.0 1.8 4.5 704 514 A 17 THR HG2% A 13 TYR HDy 1.0 1.8 4.5 705 515 A 18 VAL H A 18 VAL HG2% 1.0 1.8 3.5 706 516 A 7 GLN HE21 A 7 GLN HGx 1.0 1.8 3.5 707 517 A 28 LEU HDx% A 32 TYR HDx 1.0 1.8 3.5 708 517 A 28 LEU HDx% A 32 TYR HDy 1.0 1.8 3.5 709 518 A 31 TYR HD% A 11 ILE HD1% 1.0 1.8 5.5 710 519 A 4 HIS HD2 A 36 LEU HA 1.0 1.8 5.5 711 520 A 9 GLY H A 9 GLY HAy 1.0 1.8 5.5 712 521 A 4 HIS HD2 A 4 HIS HA 1.0 1.8 3.5 713 521 A 5 TYR HD% A 5 TYR HA 1.0 1.8 3.5 714 522 A 9 GLY H A 9 GLY HAx 1.0 1.8 4.5 715 523 A 33 SER H A 33 SER HB3 1.0 1.8 4.5 716 523 A 9 GLY H A 33 SER HB3 1.0 1.8 4.5 717 524 A 13 TYR HE% A 15 GLY HA3 1.0 1.8 4.5 718 525 A 5 TYR HE% A 5 TYR HBy 1.0 1.8 5.5 719 526 A 5 TYR HD% A 5 TYR HBy 1.0 1.8 2.8 720 527 A 34 GLN HE22 A 5 TYR HBy 1.0 1.8 5.5 721 528 A 31 TYR HE% A 31 TYR HB3 1.0 1.8 5.5 722 529 A 5 TYR HD% A 5 TYR HBx 1.0 1.8 2.8 723 530 A 4 HIS HD2 A 4 HIS HB2 1.0 1.8 4.5 724 531 A 34 GLN HE22 A 5 TYR HBx 1.0 1.8 4.5 725 532 A 9 GLY H A 33 SER HB2 1.0 1.8 2.8 726 533 A 34 GLN HE22 A 34 GLN HGx 1.0 1.8 4.5 727 533 A 34 GLN HE22 A 34 GLN HGy 1.0 1.8 4.5 728 534 A 9 GLY H A 7 GLN HGy 1.0 1.8 3.5 729 535 A 32 TYR HE% A 7 GLN HGy 1.0 1.8 5.5 730 536 A 7 GLN HB2 A 32 TYR HDx 1.0 1.8 5.5 731 536 A 7 GLN HB2 A 32 TYR HDy 1.0 1.8 5.5 732 537 A 32 TYR HE% A 7 GLN HB2 1.0 1.8 3.5 733 538 A 32 TYR HE% A 34 GLN HBy 1.0 1.8 4.5 734 539 A 32 TYR HE% A 7 GLN HB3 1.0 1.8 5.5 735 540 A 32 TYR HE% A 34 GLN HBx 1.0 1.8 3.5 736 541 A 13 TYR HE% A 17 THR HG2% 1.0 1.8 3.5 737 542 A 4 HIS HD2 A 36 LEU HDy% 1.0 1.8 3.5 738 542 A 5 TYR HD% A 36 LEU HDy% 1.0 1.8 3.5 739 543 A 26 GLN HE22 A 36 LEU HDx% 1.0 1.8 4.5 740 543 A 31 TYR HE% A 11 ILE HG2% 1.0 1.8 4.5 741 544 A 26 GLN HE22 A 36 LEU HDy% 1.0 1.8 5.5 742 544 A 34 GLN HE22 A 36 LEU HDy% 1.0 1.8 5.5 743 545 A 9 GLY H A 7 GLN HGx 1.0 1.8 3.5 744 546 A 32 TYR HE% A 28 LEU HDx% 1.0 1.8 4.5 745 547 A 5 TYR HE% A 36 LEU HDy% 1.0 1.8 4.5 746 548 A 31 TYR HE% A 11 ILE HD1% 1.0 1.8 4.5 747 549 A 33 SER HA A 27 VAL HA 1.0 1.8 4.5 748 550 A 15 GLY H A 15 GLY HA2 1.0 1.8 4.5 749 551 A 30 PRO HD3 A 29 ASN HA 1.0 1.8 3.5 750 552 A 33 SER HA A 33 SER HB3 1.0 1.8 3.5 751 553 A 35 CYS HA A 8 CYS HB2 1.0 1.8 5.5 752 554 A 14 SER HA B 1 MAN H6y 1.0 1.8 3.5 753 554 A 14 SER HA A 14 SER HBy 1.0 1.8 3.5 754 555 A 15 GLY H A 15 GLY HA3 1.0 1.8 3.5 755 556 A 29 ASN HA A 30 PRO HD2 1.0 1.8 3.5 756 557 A 8 CYS HA A 8 CYS HB2 1.0 1.8 3.5 757 558 A 29 ASN HA A 29 ASN HB2 1.0 1.8 2.8 758 558 A 29 ASN HA A 29 ASN HB3 1.0 1.8 2.8 759 559 A 14 SER HA A 13 TYR HB2 1.0 1.8 4.5 760 559 B 1 MAN H1 A 13 TYR HB2 1.0 1.8 4.5 761 559 A 17 THR HA A 8 CYS HB3 1.0 1.8 4.5 762 560 A 8 CYS HA A 8 CYS HB3 1.0 1.8 2.8 763 561 A 35 CYS HA A 35 CYS HB2 1.0 1.8 3.5 764 562 A 35 CYS HA A 35 CYS HB3 1.0 1.8 3.5 765 563 A 33 SER HA A 28 LEU HBx 1.0 1.8 5.5 766 563 A 33 SER HA A 28 LEU HG 1.0 1.8 5.5 767 564 A 29 ASN HA A 30 PRO HG3 1.0 1.8 4.5 768 564 A 29 ASN HA A 28 LEU HBy 1.0 1.8 4.5 769 565 A 33 SER HA A 27 VAL HG1% 1.0 1.8 5.5 770 566 A 29 ASN HA A 27 VAL HG1% 1.0 1.8 4.5 771 567 A 24 THR HA A 24 THR HB 1.0 1.8 3.5 772 568 A 21 SER HA A 21 SER HB2 1.0 1.8 2.8 773 568 A 21 SER HA A 21 SER HB3 1.0 1.8 2.8 774 569 A 23 THR HA A 23 THR HB 1.0 1.8 3.5 775 570 B 1 MAN H1 A 14 SER HBx 1.0 1.8 3.5 776 570 A 14 SER HA A 14 SER HBx 1.0 1.8 3.5 777 570 B 1 MAN H1 B 1 MAN H4 1.0 1.8 3.5 778 571 A 17 THR HA A 8 CYS HB2 1.0 1.8 4.5 779 572 A 19 CYS HA A 19 CYS HB3 1.0 1.8 3.5 780 573 A 25 CYS HA A 8 CYS HB2 1.0 1.8 5.5 781 573 A 17 THR HB A 8 CYS HB2 1.0 1.8 5.5 782 574 A 24 THR HA A 19 CYS HB3 1.0 1.8 4.5 783 574 A 16 PRO HA A 16 PRO HDy 1.0 1.8 4.5 784 575 A 3 SER HA A 3 SER HBy 1.0 1.8 3.5 785 576 A 12 GLY HA3 B 1 MAN H3 1.0 1.8 5.5 786 576 A 12 GLY HA3 B 1 MAN H6x 1.0 1.8 5.5 787 577 A 16 PRO HA A 16 PRO HDx 1.0 1.8 5.5 788 578 A 19 CYS HA A 25 CYS HB2 1.0 1.8 5.5 789 578 A 17 THR HA A 25 CYS HB2 1.0 1.8 5.5 790 579 A 4 HIS HA A 35 CYS HB2 1.0 1.8 3.5 791 580 A 25 CYS HA A 25 CYS HB2 1.0 1.8 3.5 792 581 A 23 THR HB A 35 CYS HB2 1.0 1.8 3.5 793 582 A 31 TYR HA A 31 TYR HB3 1.0 1.8 3.5 794 583 A 19 CYS HB3 A 35 CYS HB2 1.0 1.8 3.5 795 584 A 36 LEU HA A 35 CYS HB2 1.0 1.8 6.5 796 585 A 4 HIS HA A 35 CYS HB3 1.0 1.8 3.5 797 586 A 7 GLN HA A 8 CYS HB3 1.0 1.8 4.5 798 586 A 7 GLN HA A 33 SER HB2 1.0 1.8 4.5 799 586 A 9 GLY HAy A 33 SER HB2 1.0 1.8 4.5 800 587 A 5 TYR HA A 5 TYR HBy 1.0 1.8 3.5 801 588 A 32 TYR HA A 32 TYR HB2 1.0 1.8 3.5 802 589 A 13 TYR HA A 13 TYR HB2 1.0 1.8 3.5 803 590 A 25 CYS HA A 35 CYS HB3 1.0 1.8 3.5 804 590 A 13 TYR HA A 13 TYR HB3 1.0 1.8 3.5 805 591 A 17 THR HB A 25 CYS HB3 1.0 1.8 3.5 806 591 A 25 CYS HA A 25 CYS HB3 1.0 1.8 3.5 807 592 A 31 TYR HA A 31 TYR HB2 1.0 1.8 3.5 808 593 A 4 HIS HA A 4 HIS HB3 1.0 1.8 2.8 809 593 A 5 TYR HA A 5 TYR HBx 1.0 1.8 2.8 810 594 A 4 HIS HA A 4 HIS HB2 1.0 1.8 3.5 811 595 A 32 TYR HA A 32 TYR HB3 1.0 1.8 4.5 812 596 A 26 GLN HA A 26 GLN HGx 1.0 1.8 3.5 813 597 A 26 GLN HA A 26 GLN HGy 1.0 1.8 4.5 814 598 A 24 THR HA A 19 CYS HB2 1.0 1.8 3.5 815 599 A 16 PRO HA A 16 PRO HB3 1.0 1.8 2.8 816 600 A 31 TYR HA A 30 PRO HG2 1.0 1.8 6.5 817 601 A 7 GLN HA A 34 GLN HGx 1.0 1.8 4.5 818 601 A 7 GLN HA A 34 GLN HGy 1.0 1.8 4.5 819 602 A 7 GLN HA A 7 GLN HGy 1.0 1.8 3.5 820 603 A 30 PRO HB3 A 30 PRO HA 1.0 1.8 2.8 821 604 A 28 LEU HA A 28 LEU HBy 1.0 1.8 3.5 822 605 A 28 LEU HA A 28 LEU HBx 1.0 1.8 2.8 823 605 A 28 LEU HA A 28 LEU HG 1.0 1.8 2.8 824 606 A 26 GLN HA A 26 GLN HB3 1.0 1.8 3.5 825 607 A 26 GLN HA A 26 GLN HB2 1.0 1.8 3.5 826 608 A 16 PRO HA A 18 VAL HB 1.0 1.8 4.5 827 608 A 16 PRO HA A 16 PRO HGx 1.0 1.8 4.5 828 609 A 16 PRO HA A 16 PRO HB2 1.0 1.8 4.5 829 610 A 7 GLN HA A 7 GLN HB2 1.0 1.8 3.5 830 611 A 30 PRO HG3 A 30 PRO HA 1.0 1.8 4.5 831 612 A 5 TYR HA A 34 GLN HGx 1.0 1.8 3.5 832 612 A 5 TYR HA A 34 GLN HGy 1.0 1.8 3.5 833 613 A 36 LEU HA A 36 LEU HB2 1.0 1.8 2.8 834 613 A 36 LEU HA A 36 LEU HB3 1.0 1.8 2.8 835 614 A 7 GLN HA A 7 GLN HB3 1.0 1.8 4.5 836 615 A 17 THR HA A 17 THR HG2% 1.0 1.8 3.5 837 616 A 17 THR HB A 17 THR HG2% 1.0 1.8 2.8 838 617 A 24 THR HA A 24 THR HG2% 1.0 1.8 3.5 839 618 A 31 TYR HA A 11 ILE HB 1.0 1.8 4.5 840 619 A 30 PRO HB2 A 30 PRO HA 1.0 1.8 3.5 841 620 A 28 LEU HA A 28 LEU HDx% 1.0 1.8 5.5 842 621 A 28 LEU HA A 28 LEU HDy% 1.0 1.8 3.5 843 622 A 36 LEU HA A 36 LEU HDy% 1.0 1.8 2.8 844 623 A 33 SER HB2 A 27 VAL HG2% 1.0 1.8 4.5 845 624 A 9 GLY HAy A 7 GLN HGx 1.0 1.8 4.5 846 624 A 7 GLN HA A 7 GLN HGx 1.0 1.8 4.5 847 625 A 18 VAL HA A 18 VAL HG1% 1.0 1.8 2.8 848 625 A 18 VAL HA A 18 VAL HG2% 1.0 1.8 2.8 849 626 A 23 THR HA A 23 THR HG2% 1.0 1.8 3.5 850 627 A 36 LEU HA A 23 THR HG2% 1.0 1.8 5.5 851 628 A 4 HIS HA A 23 THR HG2% 1.0 1.8 4.5 852 629 A 21 SER HA A 21 SER HB2 1.0 1.8 4.5 853 629 A 21 SER HA A 21 SER HB3 1.0 1.8 4.5 854 630 A 27 VAL HA A 33 SER HB3 1.0 1.8 2.8 855 631 B 1 MAN H5 B 1 MAN H6y 1.0 1.8 3.5 856 632 B 1 MAN H5 B 1 MAN H3 1.0 1.8 3.5 857 632 B 1 MAN H5 B 1 MAN H6x 1.0 1.8 3.5 858 633 B 1 MAN H4 B 1 MAN H3 1.0 1.8 3.5 859 633 B 1 MAN H4 B 1 MAN H6x 1.0 1.8 3.5 860 633 A 12 GLY HA2 B 1 MAN H4 1.0 1.8 3.5 861 634 A 30 PRO HD3 A 29 ASN HB2 1.0 1.8 2.8 862 634 A 30 PRO HD3 A 29 ASN HB3 1.0 1.8 2.8 863 635 A 30 PRO HD2 A 29 ASN HB2 1.0 1.8 2.8 864 635 A 30 PRO HD2 A 29 ASN HB3 1.0 1.8 2.8 865 636 A 9 GLY HAx A 33 SER HB2 1.0 1.8 3.5 866 636 A 10 GLY HAx A 33 SER HB2 1.0 1.8 3.5 867 637 A 25 CYS HB2 A 8 CYS HB3 1.0 1.8 3.5 868 638 A 2 GLN HGy A 16 PRO HDx 1.0 1.8 4.5 869 639 A 1 THR HB A 19 CYS HB2 1.0 1.8 5.5 870 639 A 20 ALA HA A 19 CYS HB2 1.0 1.8 5.5 871 639 A 18 VAL HA A 19 CYS HB2 1.0 1.8 5.5 872 640 A 1 THR HB A 18 VAL HB 1.0 1.8 3.5 873 640 A 18 VAL HA A 18 VAL HB 1.0 1.8 3.5 874 641 A 27 VAL HA A 27 VAL HB 1.0 1.8 3.5 875 642 A 27 VAL HA A 28 LEU HBx 1.0 1.8 5.5 876 642 A 27 VAL HA A 28 LEU HG 1.0 1.8 5.5 877 643 A 30 PRO HD3 A 30 PRO HG2 1.0 1.8 3.5 878 644 A 30 PRO HD3 A 30 PRO HG3 1.0 1.8 3.5 879 645 A 30 PRO HD2 A 30 PRO HG2 1.0 1.8 3.5 880 646 A 30 PRO HD2 A 30 PRO HG3 1.0 1.8 3.5 881 647 A 16 PRO HDy A 16 PRO HGx 1.0 1.8 2.8 882 648 A 16 PRO HDx A 16 PRO HGx 1.0 1.8 2.8 883 649 A 11 ILE HA A 11 ILE HG13 1.0 1.8 4.5 884 650 A 1 THR HB A 1 THR HG2% 1.0 1.8 3.5 885 651 A 20 ALA HA A 20 ALA HB% 1.0 1.8 2.8 886 652 A 24 THR HB A 24 THR HG2% 1.0 1.8 2.8 887 653 A 1 THR HA A 1 THR HG2% 1.0 1.8 3.5 888 654 A 27 VAL HA A 27 VAL HG2% 1.0 1.8 2.8 889 655 A 11 ILE HA A 11 ILE HG2% 1.0 1.8 3.5 890 656 A 27 VAL HA A 27 VAL HG1% 1.0 1.8 3.5 891 657 A 23 THR HB A 23 THR HG2% 1.0 1.8 2.8 892 658 A 9 GLY HAy A 33 SER HB2 1.0 1.8 5.5 893 658 A 9 GLY HAy A 13 TYR HB2 1.0 1.8 5.5 894 659 A 5 TYR HA A 5 TYR HBy 1.0 1.8 4.5 895 660 A 30 PRO HD3 A 29 ASN HB2 1.0 1.8 3.5 896 660 A 30 PRO HD3 A 29 ASN HB3 1.0 1.8 3.5 897 661 A 4 HIS HA A 4 HIS HB3 1.0 1.8 3.5 898 661 A 5 TYR HA A 5 TYR HBx 1.0 1.8 3.5 899 662 A 4 HIS HA A 4 HIS HB2 1.0 1.8 3.5 900 663 A 30 PRO HD2 A 29 ASN HB2 1.0 1.8 3.5 901 663 A 30 PRO HD2 A 29 ASN HB3 1.0 1.8 3.5 902 664 A 19 CYS HB3 A 35 CYS HB2 1.0 1.8 3.5 903 665 A 19 CYS HB3 A 35 CYS HB3 1.0 1.8 4.5 904 666 A 6 GLY HA3 A 2 GLN HGy 1.0 1.8 5.5 905 667 A 8 CYS HB2 A 25 CYS HB2 1.0 1.8 4.5 906 668 A 4 HIS HB2 A 23 THR HG2% 1.0 1.8 4.5 907 669 A 16 PRO HA A 16 PRO HB3 1.0 1.8 5.5 908 670 A 9 GLY HAx A 33 SER HB2 1.0 1.8 3.5 909 670 A 10 GLY HAx A 13 TYR HB2 1.0 1.8 3.5 910 670 A 10 GLY HAx A 33 SER HB2 1.0 1.8 3.5 911 671 A 7 GLN HA A 7 GLN HGy 1.0 1.8 5.5 912 672 A 30 PRO HB3 A 30 PRO HA 1.0 1.8 4.5 913 673 A 7 GLN HA A 7 GLN HB2 1.0 1.8 5.5 914 674 A 5 TYR HA A 34 GLN HGx 1.0 1.8 4.5 915 674 A 5 TYR HA A 34 GLN HGy 1.0 1.8 4.5 916 675 A 30 PRO HD3 A 30 PRO HG2 1.0 1.8 4.5 917 676 A 6 GLY HA3 A 2 GLN HGx 1.0 1.8 5.5 918 677 A 30 PRO HD2 A 30 PRO HG2 1.0 1.8 3.5 919 678 A 7 GLN HB2 A 7 GLN HGy 1.0 1.8 2.8 920 678 A 26 GLN HGx A 26 GLN HB3 1.0 1.8 2.8 921 679 A 26 GLN HGy A 26 GLN HB2 1.0 1.8 3.5 922 680 A 2 GLN HGx A 2 GLN HBy 1.0 1.8 2.8 923 680 A 30 PRO HB3 A 30 PRO HG3 1.0 1.8 2.8 924 681 A 34 GLN HBx A 34 GLN HGx 1.0 1.8 2.8 925 681 A 34 GLN HGy A 34 GLN HBx 1.0 1.8 2.8 926 682 A 30 PRO HB3 A 11 ILE HD1% 1.0 1.8 4.5 927 683 A 30 PRO HG3 A 30 PRO HA 1.0 1.8 5.5 928 684 A 7 GLN HA A 7 GLN HB3 1.0 1.8 5.5 929 685 A 18 VAL HA A 18 VAL HB 1.0 1.8 4.5 930 686 A 1 THR HA A 18 VAL HB 1.0 1.8 5.5 931 687 A 27 VAL HA A 27 VAL HB 1.0 1.8 4.5 932 688 A 30 PRO HD3 A 30 PRO HG3 1.0 1.8 4.5 933 689 A 16 PRO HDy A 16 PRO HGx 1.0 1.8 2.8 934 689 A 16 PRO HDy A 16 PRO HGy 1.0 1.8 2.8 935 690 A 15 GLY HA3 A 16 PRO HGx 1.0 1.8 4.5 936 690 A 15 GLY HA3 A 16 PRO HGy 1.0 1.8 4.5 937 691 A 16 PRO HDx A 16 PRO HGx 1.0 1.8 3.5 938 692 A 30 PRO HD2 A 30 PRO HG3 1.0 1.8 3.5 939 693 A 2 GLN HBx A 16 PRO HDx 1.0 1.8 5.5 940 693 A 16 PRO HB2 A 16 PRO HDx 1.0 1.8 5.5 941 694 A 16 PRO HB2 A 16 PRO HDy 1.0 1.8 4.5 942 695 A 11 ILE HA A 11 ILE HG13 1.0 1.8 4.5 943 696 A 2 GLN HGy A 2 GLN HBy 1.0 1.8 3.5 944 696 A 2 GLN HGy A 2 GLN HBx 1.0 1.8 3.5 945 697 A 26 GLN HGx A 26 GLN HB2 1.0 1.8 2.8 946 697 A 30 PRO HB3 A 30 PRO HG3 1.0 1.8 2.8 947 698 A 34 GLN HBx A 34 GLN HGx 1.0 1.8 2.8 948 698 A 34 GLN HGy A 34 GLN HBx 1.0 1.8 2.8 949 699 A 36 LEU HG A 34 GLN HGx 1.0 1.8 3.5 950 699 A 34 GLN HGy A 36 LEU HG 1.0 1.8 3.5 951 700 A 2 GLN HBx A 16 PRO HGx 1.0 1.8 2.8 952 700 A 16 PRO HB2 A 16 PRO HGx 1.0 1.8 2.8 953 701 A 36 LEU HDy% A 34 GLN HGx 1.0 1.8 4.5 954 701 A 34 GLN HGy A 36 LEU HDy% 1.0 1.8 4.5 955 702 A 18 VAL HB A 18 VAL HG1% 1.0 1.8 2.8 956 702 A 18 VAL HB A 18 VAL HG2% 1.0 1.8 2.8 957 703 A 28 LEU HBy A 28 LEU HDy% 1.0 1.8 2.8 958 703 A 27 VAL HB A 27 VAL HG2% 1.0 1.8 2.8 959 703 A 26 GLN HB2 A 36 LEU HDx% 1.0 1.8 2.8 960 704 A 34 GLN HBy A 36 LEU HDy% 1.0 1.8 4.5 961 705 A 27 VAL HG1% A 27 VAL HB 1.0 1.8 2.8 962 706 A 11 ILE HG13 A 11 ILE HD1% 1.0 1.8 2.8 963 707 A 3 SER HA A 20 ALA HB% 1.0 1.8 4.5 964 707 A 31 TYR HA A 11 ILE HB 1.0 1.8 4.5 965 708 A 30 PRO HB2 A 30 PRO HA 1.0 1.8 4.5 966 709 A 20 ALA HA A 20 ALA HB% 1.0 1.8 3.5 967 710 A 20 ALA HB% A 21 SER HB2 1.0 1.8 4.5 968 710 A 10 GLY HAx A 11 ILE HB 1.0 1.8 4.5 969 710 A 21 SER HB3 A 20 ALA HB% 1.0 1.8 4.5 970 711 A 20 ALA HA A 1 THR HG2% 1.0 1.8 3.5 971 712 A 1 THR HA A 1 THR HG2% 1.0 1.8 3.5 972 713 A 24 THR HB A 24 THR HG2% 1.0 1.8 3.5 973 714 A 18 VAL HA A 18 VAL HG1% 1.0 1.8 2.8 974 714 A 18 VAL HA A 18 VAL HG2% 1.0 1.8 2.8 975 715 A 1 THR HA A 18 VAL HG1% 1.0 1.8 4.5 976 716 A 27 VAL HA A 27 VAL HG2% 1.0 1.8 3.5 977 717 A 27 VAL HA A 27 VAL HG1% 1.0 1.8 4.5 978 718 A 9 GLY HAx A 17 THR HG2% 1.0 1.8 3.5 979 719 A 30 PRO HD2 A 30 PRO HB2 1.0 1.8 4.5 980 720 A 11 ILE HA A 11 ILE HG12 1.0 1.8 4.5 981 721 A 11 ILE HA A 11 ILE HG2% 1.0 1.8 3.5 982 722 A 12 GLY HA2 A 11 ILE HG2% 1.0 1.8 4.5 983 723 A 33 SER HB3 A 27 VAL HG2% 1.0 1.8 5.5 984 724 A 7 GLN HB2 A 7 GLN HGx 1.0 1.8 3.5 985 725 A 30 PRO HG2 A 30 PRO HB2 1.0 1.8 3.5 986 726 A 30 PRO HB2 A 30 PRO HG3 1.0 1.8 4.5 987 727 A 28 LEU HBx A 28 LEU HDx% 1.0 1.8 3.5 988 727 A 28 LEU HG A 28 LEU HDx% 1.0 1.8 3.5 989 728 A 18 VAL HB A 18 VAL HG1% 1.0 1.8 2.8 990 728 A 18 VAL HB A 18 VAL HG2% 1.0 1.8 2.8 991 729 A 28 LEU HBy A 28 LEU HDy% 1.0 1.8 2.8 992 729 A 27 VAL HB A 27 VAL HG2% 1.0 1.8 2.8 993 729 A 26 GLN HB2 A 36 LEU HDx% 1.0 1.8 2.8 994 730 A 28 LEU HG A 28 LEU HDy% 1.0 1.8 3.5 995 730 A 28 LEU HBx A 28 LEU HDy% 1.0 1.8 3.5 996 731 A 27 VAL HG1% A 27 VAL HB 1.0 1.8 2.8 997 732 A 7 GLN HB3 A 7 GLN HGx 1.0 1.8 4.5 998 733 A 36 LEU HDx% A 36 LEU HB2 1.0 1.8 2.8 999 733 A 36 LEU HB3 A 36 LEU HDx% 1.0 1.8 2.8 1000 734 A 20 ALA HB% A 23 THR HG2% 1.0 1.8 2.8 1001 734 A 11 ILE HB A 11 ILE HD1% 1.0 1.8 2.8 1002 735 A 11 ILE HG2% A 11 ILE HD1% 1.0 1.8 2.8 1003 736 A 4 HIS HA A 23 THR HG2% 1.0 1.8 4.5 1004 737 A 23 THR HB A 23 THR HG2% 1.0 1.8 2.8 1005 738 A 22 GLY HA2 A 23 THR HG2% 1.0 1.8 5.5 1006 738 A 19 CYS HB3 A 23 THR HG2% 1.0 1.8 5.5 1007 739 A 35 CYS HB2 A 23 THR HG2% 1.0 1.8 4.5 1008 740 A 4 HIS HB2 A 23 THR HG2% 1.0 1.8 4.5 1009 741 A 30 PRO HB3 A 11 ILE HD1% 1.0 1.8 4.5 1010 742 A 11 ILE HG13 A 11 ILE HD1% 1.0 1.8 2.8 1011 743 A 24 THR H A 36 LEU H 1.0 1.8 3.5 1012 744 A 34 GLN H A 27 VAL H 1.0 1.8 4.5 1013 744 A 34 GLN H A 28 LEU H 1.0 1.8 4.5 1014 745 A 5 TYR H A 6 GLY H 1.0 1.8 4.5 1015 746 A 26 GLN H A 27 VAL H 1.0 1.8 3.5 1016 746 A 34 GLN H A 28 LEU H 1.0 1.8 3.5 1017 747 A 10 GLY H A 13 TYR HDx 1.0 1.8 4.5 1018 747 A 10 GLY H A 13 TYR HDy 1.0 1.8 4.5 1019 748 A 14 SER H A 13 TYR HDx 1.0 1.8 5.5 1020 748 A 14 SER H A 13 TYR HDy 1.0 1.8 5.5 1021 749 A 13 TYR H A 13 TYR HDx 1.0 1.8 4.5 1022 749 A 8 CYS H A 13 TYR HDy 1.0 1.8 4.5 1023 749 A 13 TYR H A 13 TYR HDy 1.0 1.8 4.5 1024 749 A 32 TYR H A 32 TYR HDx 1.0 1.8 4.5 1025 749 A 8 CYS H A 13 TYR HDx 1.0 1.8 4.5 1026 749 A 32 TYR H A 32 TYR HDy 1.0 1.8 4.5 1027 750 A 31 TYR HD% A 11 ILE H 1.0 1.8 5.5 1028 751 A 7 GLN HE21 A 13 TYR HDx 1.0 1.8 3.5 1029 751 A 7 GLN HE21 A 32 TYR HDx 1.0 1.8 3.5 1030 751 A 7 GLN HE21 A 13 TYR HDy 1.0 1.8 3.5 1031 751 A 7 GLN HE21 A 32 TYR HDy 1.0 1.8 3.5 1032 752 A 9 GLY H A 7 GLN HE21 1.0 1.8 5.5 1033 753 A 9 GLY H A 13 TYR HDx 1.0 1.8 4.5 1034 753 A 9 GLY H A 13 TYR HDy 1.0 1.8 4.5 1035 754 A 5 TYR HD% A 34 GLN HE21 1.0 1.8 4.5 1036 755 A 8 CYS H A 2 GLN HE21 1.0 1.8 3.5 1037 755 A 13 TYR H A 10 GLY H 1.0 1.8 3.5 1038 755 A 32 TYR H A 29 ASN H 1.0 1.8 3.5 1039 756 A 32 TYR H A 33 SER H 1.0 1.8 4.5 1040 756 A 8 CYS H A 33 SER H 1.0 1.8 4.5 1041 757 A 31 TYR HD% A 11 ILE H 1.0 1.8 5.5 1042 758 A 14 SER H A 13 TYR HDx 1.0 1.8 5.5 1043 758 A 14 SER H A 13 TYR HDy 1.0 1.8 5.5 1044 759 A 10 GLY H A 13 TYR HDx 1.0 1.8 4.5 1045 759 A 10 GLY H A 13 TYR HDy 1.0 1.8 4.5 1046 760 A 33 SER H A 10 GLY H 1.0 1.8 5.5 1047 760 A 9 GLY H A 10 GLY H 1.0 1.8 5.5 1048 761 A 23 THR H A 21 SER H 1.0 1.8 4.5 1049 761 A 21 SER H A 20 ALA H 1.0 1.8 4.5 1050 762 A 6 GLY H A 35 CYS H 1.0 1.8 4.5 1051 763 A 5 TYR HD% A 6 GLY H 1.0 1.8 5.5 1052 763 A 4 HIS HD2 A 6 GLY H 1.0 1.8 5.5 1053 764 A 32 TYR HE% A 7 GLN H 1.0 1.8 5.5 1054 765 A 22 GLY H A 21 SER H 1.0 1.8 5.5 1055 766 A 24 THR H A 25 CYS H 1.0 1.8 5.5 1056 767 A 5 TYR HD% A 34 GLN HE21 1.0 1.8 4.5 1057 768 A 32 TYR HE% A 34 GLN HE21 1.0 1.8 5.5 1058 769 A 33 SER H A 7 GLN HE21 1.0 1.8 4.5 1059 770 A 8 CYS HA A 2 GLN HE21 1.0 1.8 4.5 1060 771 A 15 GLY H A 13 TYR HDx 1.0 1.8 5.5 1061 771 A 15 GLY H A 13 TYR HDy 1.0 1.8 5.5 1062 772 A 8 CYS HA A 13 TYR HDx 1.0 1.8 5.5 1063 772 A 33 SER HA A 32 TYR HDx 1.0 1.8 5.5 1064 772 A 8 CYS HA A 13 TYR HDy 1.0 1.8 5.5 1065 772 A 33 SER HA A 32 TYR HDy 1.0 1.8 5.5 1066 773 A 13 TYR HE% A 15 GLY H 1.0 1.8 5.5 1067 774 A 13 TYR HE% A 14 SER HA 1.0 1.8 5.5 1068 774 A 13 TYR HE% A 17 THR HA 1.0 1.8 5.5 1069 775 A 18 VAL H A 17 THR HA 1.0 1.8 4.5 1070 776 A 7 GLN HE21 A 10 GLY HAx 1.0 1.8 5.5 1071 777 A 25 CYS H A 24 THR HA 1.0 1.8 2.8 1072 778 A 11 ILE H A 10 GLY HAy 1.0 1.8 3.5 1073 779 A 6 GLY HA3 A 2 GLN HE22 1.0 1.8 5.5 1074 780 A 19 CYS HB3 A 2 GLN HE22 1.0 1.8 6.5 1075 781 A 31 TYR HD% A 30 PRO HD3 1.0 1.8 5.5 1076 782 A 31 TYR HD% A 10 GLY HAx 1.0 1.8 5.5 1077 782 A 31 TYR HD% A 11 ILE HA 1.0 1.8 5.5 1078 783 A 26 GLN HE21 A 24 THR HB 1.0 1.8 5.5 1079 784 A 7 GLN HE22 A 10 GLY HAy 1.0 1.8 5.5 1080 784 A 12 GLY HA3 A 7 GLN HE22 1.0 1.8 5.5 1081 785 A 31 TYR HE% A 30 PRO HD2 1.0 1.8 5.5 1082 786 A 31 TYR HE% A 31 TYR HA 1.0 1.8 5.5 1083 787 A 4 HIS HD2 A 23 THR HB 1.0 1.8 5.5 1084 788 A 32 TYR HA A 29 ASN HD22 1.0 1.8 5.5 1085 788 A 26 GLN HE21 A 26 GLN HA 1.0 1.8 5.5 1086 789 A 26 GLN HE21 A 23 THR HA 1.0 1.8 5.5 1087 789 A 2 GLN HA A 2 GLN HE22 1.0 1.8 5.5 1088 789 A 17 THR HA A 2 GLN HE22 1.0 1.8 5.5 1089 790 A 14 SER HA A 13 TYR HDy 1.0 1.8 5.5 1090 790 A 17 THR HA A 13 TYR HDx 1.0 1.8 5.5 1091 790 A 17 THR HA A 13 TYR HDy 1.0 1.8 5.5 1092 790 A 14 SER HA A 13 TYR HDx 1.0 1.8 5.5 1093 791 A 5 TYR HD% A 36 LEU HA 1.0 1.8 5.5 1094 792 A 6 GLY H A 4 HIS HB3 1.0 1.8 5.5 1095 792 A 6 GLY H A 5 TYR HBx 1.0 1.8 5.5 1096 793 A 29 ASN H A 32 TYR HB3 1.0 1.8 5.5 1097 794 A 32 TYR H A 32 TYR HB3 1.0 1.8 4.5 1098 795 A 4 HIS HD2 A 5 TYR HBy 1.0 1.8 5.5 1099 796 A 31 TYR HD% A 30 PRO HG2 1.0 1.8 5.5 1100 797 A 4 HIS HD2 A 34 GLN HGx 1.0 1.8 5.5 1101 797 A 4 HIS HD2 A 34 GLN HGy 1.0 1.8 5.5 1102 798 A 2 GLN H A 2 GLN HBy 1.0 1.8 4.5 1103 799 A 27 VAL H A 27 VAL HG2% 1.0 1.8 2.8 1104 800 A 7 GLN HE21 A 7 GLN HB3 1.0 1.8 5.5 1105 801 A 20 ALA H A 1 THR HG2% 1.0 1.8 5.5 1106 802 A 31 TYR H A 30 PRO HB2 1.0 1.8 5.5 1107 803 A 32 TYR H A 31 TYR HB3 1.0 1.8 5.5 1108 804 A 11 ILE H A 31 TYR HB3 1.0 1.8 5.5 1109 805 A 8 CYS H A 33 SER HB3 1.0 1.8 5.5 1110 805 A 13 TYR H B 1 MAN H5 1.0 1.8 5.5 1111 806 A 20 ALA H A 35 CYS HB2 1.0 1.8 5.5 1112 807 A 6 GLY H A 5 TYR HBy 1.0 1.8 5.5 1113 808 A 32 TYR H A 29 ASN HB2 1.0 1.8 5.5 1114 808 A 32 TYR H A 29 ASN HB3 1.0 1.8 5.5 1115 809 A 8 CYS H A 7 GLN HB2 1.0 1.8 5.5 1116 810 A 5 TYR HE% A 5 TYR HBx 1.0 1.8 5.5 1117 810 A 5 TYR HE% A 4 HIS HB3 1.0 1.8 5.5 1118 811 A 4 HIS HD2 A 35 CYS HB2 1.0 1.8 5.5 1119 812 A 13 TYR HE% A 13 TYR HB3 1.0 1.8 5.5 1120 813 A 32 TYR HE% A 32 TYR HB2 1.0 1.8 5.5 1121 814 A 13 TYR HE% A 8 CYS HB3 1.0 1.8 5.5 1122 814 A 13 TYR HE% A 13 TYR HB2 1.0 1.8 5.5 1123 815 A 32 TYR HE% A 32 TYR HB3 1.0 1.8 5.5 1124 816 A 18 VAL H A 17 THR HG2% 1.0 1.8 5.5 1125 817 A 34 GLN HE21 A 36 LEU HDy% 1.0 1.8 5.5 1126 818 A 31 TYR HD% A 11 ILE HG2% 1.0 1.8 4.5 1127 819 A 28 LEU HDy% A 32 TYR HDx 1.0 1.8 4.5 1128 819 A 28 LEU HDy% A 32 TYR HDy 1.0 1.8 4.5 1129 820 A 32 TYR HE% A 28 LEU HDy% 1.0 1.8 5.5 1130 821 A 8 CYS HA A 17 THR HG2% 1.0 1.8 5.5 1131 822 A 33 SER HA A 28 LEU HDy% 1.0 1.8 4.5 1132 822 A 33 SER HA A 27 VAL HG2% 1.0 1.8 4.5 1133 823 A 33 SER HA A 28 LEU HDx% 1.0 1.8 5.5 1134 824 A 4 HIS HD2 A 23 THR HG2% 1.0 1.8 4.5 1135 825 A 28 LEU HA A 27 VAL HG1% 1.0 1.8 5.5 1136 826 A 27 VAL HG1% A 30 PRO HA 1.0 1.8 5.5 1137 827 A 36 LEU HA A 36 LEU HG 1.0 1.8 4.5 1138 828 A 3 SER HA A 20 ALA HB% 1.0 1.8 3.5 1139 829 A 26 GLN HA A 27 VAL HG2% 1.0 1.8 4.5 1140 830 A 35 CYS HB2 A 23 THR HG2% 1.0 1.8 4.5 1141 831 A 23 THR HB A 35 CYS HB2 1.0 1.8 4.5 1142 832 A 23 THR HB A 35 CYS HB3 1.0 1.8 4.5 1143 833 A 16 PRO HB3 A 16 PRO HDx 1.0 1.8 4.5 1144 834 A 28 LEU HBy A 29 ASN HB2 1.0 1.8 5.5 1145 834 A 29 ASN HB3 A 30 PRO HG3 1.0 1.8 5.5 1146 834 A 29 ASN HB3 A 28 LEU HBy 1.0 1.8 5.5 1147 834 A 30 PRO HG3 A 29 ASN HB2 1.0 1.8 5.5 1148 835 A 30 PRO HG2 A 29 ASN HB2 1.0 1.8 5.5 1149 835 A 29 ASN HB3 A 30 PRO HG2 1.0 1.8 5.5 1150 836 A 35 CYS HB2 A 2 GLN HGx 1.0 1.8 5.5 1151 836 A 35 CYS HB2 A 19 CYS HB2 1.0 1.8 5.5 1152 837 A 26 GLN HGy A 26 GLN HB3 1.0 1.8 3.5 1153 838 A 26 GLN HGy A 26 GLN HB2 1.0 1.8 3.5 1154 839 A 7 GLN HGy A 7 GLN HB3 1.0 1.8 3.5 1155 840 A 35 CYS HB2 A 19 CYS HB2 1.0 1.8 5.5 1156 841 A 30 PRO HG2 A 29 ASN HB2 1.0 1.8 4.5 1157 841 A 29 ASN HB3 A 30 PRO HG2 1.0 1.8 4.5 1158 842 A 16 PRO HB3 A 16 PRO HDx 1.0 1.8 4.5 1159 843 A 34 GLN HBy A 36 LEU HG 1.0 1.8 4.5 1160 844 A 7 GLN HGy A 7 GLN HB3 1.0 1.8 4.5 1161 845 A 26 GLN HGy A 36 LEU HB2 1.0 1.8 4.5 1162 845 A 26 GLN HGy A 36 LEU HB3 1.0 1.8 4.5 1163 846 A 26 GLN HGy A 26 GLN HB3 1.0 1.8 3.5 1164 847 A 2 GLN HGx A 2 GLN HBx 1.0 1.8 3.5 1165 848 A 16 PRO HB2 A 16 PRO HGx 1.0 1.8 2.8 1166 849 A 36 LEU HG A 34 GLN HGx 1.0 1.8 4.5 1167 849 A 34 GLN HGy A 36 LEU HG 1.0 1.8 4.5 1168 850 A 30 PRO HG2 A 30 PRO HB2 1.0 1.8 3.5 1169 851 A 36 LEU HG A 36 LEU HB2 1.0 1.8 2.8 1170 851 A 36 LEU HB3 A 36 LEU HG 1.0 1.8 2.8 1171 852 A 11 ILE HG13 A 11 ILE HB 1.0 1.8 3.5 1172 853 A 28 LEU HDx% A 34 GLN HGx 1.0 1.8 4.5 1173 853 A 34 GLN HGy A 28 LEU HDx% 1.0 1.8 4.5 1174 853 A 7 GLN HB2 A 7 GLN HGx 1.0 1.8 4.5 1175 854 A 36 LEU HG A 36 LEU HB2 1.0 1.8 2.8 1176 854 A 36 LEU HB3 A 36 LEU HG 1.0 1.8 2.8 1177 855 A 30 PRO HG2 A 30 PRO HB3 1.0 1.8 2.8 1178 855 A 26 GLN HGx A 26 GLN HB3 1.0 1.8 2.8 1179 856 A 16 PRO HB3 A 16 PRO HGx 1.0 1.8 2.8 1180 857 A 26 GLN HGy A 36 LEU HDx% 1.0 1.8 4.5 1181 858 A 28 LEU HBy A 28 LEU HDx% 1.0 1.8 3.5 1182 859 A 28 LEU HBx A 28 LEU HDx% 1.0 1.8 3.5 1183 859 A 28 LEU HG A 28 LEU HDx% 1.0 1.8 3.5 1184 860 A 28 LEU HG A 28 LEU HDy% 1.0 1.8 3.5 1185 860 A 28 LEU HBx A 28 LEU HDy% 1.0 1.8 3.5 1186 861 A 36 LEU HG A 36 LEU HDx% 1.0 1.8 2.8 1187 862 A 11 ILE HG2% A 11 ILE HB 1.0 1.8 2.8 1188 863 A 36 LEU HG A 36 LEU HDy% 1.0 1.8 2.8 1189 864 A 34 GLN HBx A 28 LEU HDx% 1.0 1.8 4.5 1190 865 A 34 GLN HBy A 36 LEU HG 1.0 1.8 4.5 1191 866 A 36 LEU HG A 36 LEU HDy% 1.0 1.8 2.8 1192 866 A 36 LEU HG A 36 LEU HDx% 1.0 1.8 2.8 1193 867 A 11 ILE HG2% A 11 ILE HB 1.0 1.8 2.8 1194 868 A 11 ILE HB A 11 ILE HD1% 1.0 1.8 2.8 1195 869 A 11 ILE HG13 A 11 ILE HB 1.0 1.8 3.5 1196 870 A 1 THR HG2% A 18 VAL HG1% 1.0 1.8 3.5 1197 871 A 11 ILE HG12 A 11 ILE HD1% 1.0 1.8 3.5 1198 872 A 11 ILE HG2% A 11 ILE HD1% 1.0 1.8 2.8 1199 873 A 11 ILE HA A 11 ILE HB 1.0 1.8 4.5 1200 874 A 30 PRO HD2 A 30 PRO HB2 1.0 1.8 4.5 1201 875 A 11 ILE HA A 11 ILE HG12 1.0 1.8 3.5 1202 876 A 33 SER HB3 A 27 VAL HG2% 1.0 1.8 5.5 1203 877 A 28 LEU HBy A 28 LEU HDx% 1.0 1.8 4.5 1204 878 A 16 PRO HA A 17 THR HG2% 1.0 1.8 5.5 1205 879 A 36 LEU H A 25 CYS H 1.0 1.8 4.5 1206 879 A 26 GLN H A 25 CYS H 1.0 1.8 4.5 1207 880 A 24 THR H A 25 CYS H 1.0 1.8 5.5 1208 881 A 5 TYR H A 4 HIS H 1.0 1.8 5.5 1209 882 A 22 GLY H A 21 SER H 1.0 1.8 5.5 1210 883 A 26 GLN HE22 A 36 LEU HDx% 1.0 1.8 5.5 1211 884 A 7 GLN HE22 A 10 GLY HAx 1.0 1.8 5.5 1212 885 A 8 CYS H A 7 GLN HE21 1.0 1.8 5.5 1213 885 A 13 TYR H A 7 GLN HE21 1.0 1.8 5.5 1214 885 A 32 TYR H A 7 GLN HE21 1.0 1.8 5.5 1215 886 A 36 LEU H A 26 GLN HE21 1.0 1.8 5.5 1216 887 A 24 THR H A 26 GLN HE21 1.0 1.8 5.5 1217 888 A 9 GLY H A 10 GLY H 1.0 1.8 5.5 1218 889 A 36 LEU H A 26 GLN HE22 1.0 1.8 5.5 1219 889 A 34 GLN H A 33 SER H 1.0 1.8 5.5 1220 890 A 36 LEU H A 35 CYS HA 1.0 1.8 4.5 1221 891 A 4 HIS HB3 A 23 THR HG2% 1.0 1.8 5.5 1222 892 A 30 PRO HD3 A 30 PRO HB3 1.0 1.8 5.5 1223 893 A 32 TYR HB3 A 28 LEU HBy 1.0 1.8 4.5 1224 894 A 18 VAL HB A 1 THR HG2% 1.0 1.8 4.5 1225 895 A 3 SER HA A 1 THR HG2% 1.0 1.8 4.5 1226 895 A 31 TYR HA A 30 PRO HB2 1.0 1.8 4.5 1227 896 A 10 GLY HAy A 27 VAL HG2% 1.0 1.8 4.5 1228 896 A 12 GLY HA3 A 11 ILE HG2% 1.0 1.8 4.5 1229 897 A 16 PRO HB2 A 16 PRO HDy 1.0 1.8 5.5 1230 898 A 13 TYR HB2 A 7 GLN HGx 1.0 1.8 5.5 1231 899 A 32 TYR HB3 A 28 LEU HDx% 1.0 1.8 5.5 1232 900 A 13 TYR HE% A 7 GLN HGx 1.0 1.8 5.5 1233 901 A 13 TYR HE% A 16 PRO HGy 1.0 1.8 5.5 1234 901 A 13 TYR HE% A 7 GLN HB2 1.0 1.8 5.5 1235 902 A 24 THR H A 36 LEU H 1.0 1.8 4.5 1236 903 A 34 GLN H A 33 SER HA 1.0 1.8 2.8 1237 904 A 36 LEU H A 35 CYS HA 1.0 1.8 2.8 1238 905 A 32 TYR H A 31 TYR H 1.0 1.8 3.5 1239 906 A 28 LEU H A 32 TYR HDx 1.0 1.8 5.5 1240 906 A 28 LEU H A 32 TYR HDy 1.0 1.8 5.5 1241 906 A 29 ASN H A 32 TYR HDy 1.0 1.8 5.5 1242 906 A 29 ASN H A 32 TYR HDx 1.0 1.8 5.5 1243 907 A 33 SER HA A 28 LEU H 1.0 1.8 3.5 1244 908 A 35 CYS HA A 35 CYS H 1.0 1.8 4.5 1245 909 A 32 TYR H A 31 TYR H 1.0 1.8 3.5 1246 910 A 8 CYS H A 2 GLN HE21 1.0 1.8 4.5 1247 910 A 13 TYR H A 10 GLY H 1.0 1.8 4.5 1248 910 A 32 TYR H A 29 ASN H 1.0 1.8 4.5 1249 911 A 9 GLY H A 8 CYS H 1.0 1.8 4.5 1250 912 A 8 CYS H A 8 CYS HA 1.0 1.8 4.5 1251 913 A 31 TYR H A 31 TYR HD% 1.0 1.8 4.5 1252 914 A 32 TYR HE% A 32 TYR HDx 1.0 1.8 2.8 1253 914 A 32 TYR HE% A 32 TYR HDy 1.0 1.8 2.8 1254 915 A 4 HIS HD2 A 4 HIS HE1 1.0 1.8 5.5 1255 915 A 5 TYR HD% A 4 HIS HE1 1.0 1.8 5.5 1256 916 A 4 HIS HE1 A 5 TYR HE% 1.0 1.8 5.5 1257 917 A 9 GLY H A 8 CYS H 1.0 1.8 4.5 1258 918 A 31 TYR HD% A 31 TYR HE% 1.0 1.8 2.8 1259 919 A 32 TYR HE% A 32 TYR HDx 1.0 1.8 2.8 1260 919 A 32 TYR HE% A 32 TYR HDy 1.0 1.8 2.8 1261 920 A 5 TYR HD% A 5 TYR HE% 1.0 1.8 2.8 1262 921 A 5 TYR HD% A 5 TYR HE% 1.0 1.8 2.8 1263 922 A 9 GLY H A 8 CYS HA 1.0 1.8 4.5 1264 922 A 33 SER H A 33 SER HA 1.0 1.8 4.5 1265 923 A 13 TYR HE% A 8 CYS HA 1.0 1.8 4.5 1266 924 A 34 GLN H A 33 SER HA 1.0 1.8 2.8 1267 925 A 36 LEU H A 35 CYS HA 1.0 1.8 2.8 1268 926 A 31 TYR H A 31 TYR HA 1.0 1.8 5.5 1269 927 A 33 SER HA A 28 LEU H 1.0 1.8 3.5 1270 928 A 35 CYS HA A 35 CYS H 1.0 1.8 4.5 1271 929 A 29 ASN H A 29 ASN HA 1.0 1.8 4.5 1272 930 A 34 GLN HA A 35 CYS H 1.0 1.8 2.8 1273 931 A 8 CYS H A 34 GLN HA 1.0 1.8 5.5 1274 932 A 33 SER H A 33 SER HA 1.0 1.8 4.5 1275 933 A 13 TYR HE% A 8 CYS HA 1.0 1.8 4.5 1276 934 A 32 TYR HE% A 34 GLN HA 1.0 1.8 5.5 1277 935 A 24 THR H A 24 THR HA 1.0 1.8 4.5 1278 936 A 36 LEU H A 36 LEU HA 1.0 1.8 3.5 1279 937 A 12 GLY H A 14 SER HA 1.0 1.8 4.5 1280 937 A 36 LEU H A 23 THR HA 1.0 1.8 4.5 1281 938 A 26 GLN H A 25 CYS HA 1.0 1.8 2.8 1282 939 A 28 LEU H A 28 LEU HA 1.0 1.8 4.5 1283 940 A 2 GLN HA A 2 GLN HE21 1.0 1.8 4.5 1284 940 A 29 ASN H A 28 LEU HA 1.0 1.8 4.5 1285 941 A 31 TYR HA A 11 ILE H 1.0 1.8 4.5 1286 942 A 35 CYS H A 7 GLN HA 1.0 1.8 5.5 1287 943 A 23 THR H A 23 THR HA 1.0 1.8 5.5 1288 944 A 8 CYS H A 7 GLN HA 1.0 1.8 3.5 1289 945 A 32 TYR H A 32 TYR HA 1.0 1.8 4.5 1290 946 A 32 TYR H A 31 TYR HA 1.0 1.8 4.5 1291 947 A 31 TYR HD% A 31 TYR HA 1.0 1.8 3.5 1292 948 A 28 LEU HA A 32 TYR HDx 1.0 1.8 5.5 1293 948 A 28 LEU HA A 32 TYR HDy 1.0 1.8 5.5 1294 949 A 32 TYR HA A 32 TYR HDx 1.0 1.8 2.8 1295 949 A 32 TYR HA A 32 TYR HDy 1.0 1.8 2.8 1296 950 A 33 SER H A 32 TYR HA 1.0 1.8 2.8 1297 951 A 4 HIS HD2 A 36 LEU HA 1.0 1.8 3.5 1298 952 A 31 TYR HE% A 31 TYR HA 1.0 1.8 5.5 1299 953 A 7 GLN HA A 13 TYR HDy 1.0 1.8 4.5 1300 953 A 7 GLN HA A 32 TYR HDx 1.0 1.8 4.5 1301 953 A 7 GLN HA A 13 TYR HDx 1.0 1.8 4.5 1302 953 A 7 GLN HA A 32 TYR HDy 1.0 1.8 4.5 1303 953 A 9 GLY HAy A 13 TYR HDx 1.0 1.8 4.5 1304 953 A 9 GLY HAy A 13 TYR HDy 1.0 1.8 4.5 1305 954 A 9 GLY H A 9 GLY HAy 1.0 1.8 4.5 1306 955 A 4 HIS HD2 A 4 HIS HA 1.0 1.8 2.8 1307 955 A 5 TYR HD% A 5 TYR HA 1.0 1.8 2.8 1308 956 A 32 TYR HE% A 32 TYR HA 1.0 1.8 5.5 1309 957 A 32 TYR HE% A 7 GLN HA 1.0 1.8 4.5 1310 958 A 5 TYR HE% A 5 TYR HA 1.0 1.8 5.5 1311 958 A 13 TYR HE% A 15 GLY HA2 1.0 1.8 5.5 1312 959 A 8 CYS HA A 17 THR HA 1.0 1.8 4.5 1313 960 A 33 SER HA A 26 GLN HA 1.0 1.8 5.5 1314 960 A 8 CYS HA A 19 CYS HA 1.0 1.8 5.5 1315 960 A 33 SER HA A 32 TYR HA 1.0 1.8 5.5 1316 961 A 35 CYS HA A 25 CYS HA 1.0 1.8 3.5 1317 962 A 24 THR H A 24 THR HB 1.0 1.8 4.5 1318 963 A 24 THR H A 23 THR HB 1.0 1.8 3.5 1319 964 A 34 GLN H A 27 VAL HA 1.0 1.8 4.5 1320 965 A 12 GLY H A 12 GLY HA2 1.0 1.8 3.5 1321 965 A 12 GLY H A 11 ILE HA 1.0 1.8 3.5 1322 966 A 12 GLY H B 1 MAN H5 1.0 1.8 3.5 1323 966 A 34 GLN H A 33 SER HB3 1.0 1.8 3.5 1324 967 A 28 LEU H A 27 VAL HA 1.0 1.8 2.8 1325 968 A 35 CYS H A 4 HIS HA 1.0 1.8 5.5 1326 968 A 35 CYS H A 5 TYR HA 1.0 1.8 5.5 1327 969 A 11 ILE H A 11 ILE HA 1.0 1.8 4.5 1328 969 A 11 ILE H A 10 GLY HAx 1.0 1.8 4.5 1329 970 A 31 TYR HD% A 30 PRO HD3 1.0 1.8 5.5 1330 971 A 31 TYR HD% A 30 PRO HD2 1.0 1.8 4.5 1331 972 A 9 GLY HAx A 13 TYR HDx 1.0 1.8 4.5 1332 972 A 9 GLY HAx A 13 TYR HDy 1.0 1.8 4.5 1333 973 A 9 GLY H A 9 GLY HAx 1.0 1.8 4.5 1334 974 A 4 HIS HD2 A 23 THR HB 1.0 1.8 5.5 1335 975 A 33 SER H A 33 SER HB3 1.0 1.8 4.5 1336 976 A 33 SER HA A 27 VAL HA 1.0 1.8 2.8 1337 977 A 8 CYS HA A 8 CYS HB2 1.0 1.8 2.8 1338 978 A 35 CYS HA A 23 THR HB 1.0 1.8 4.5 1339 979 A 36 LEU H A 35 CYS HB2 1.0 1.8 4.5 1340 980 A 12 GLY H A 13 TYR HB3 1.0 1.8 5.5 1341 980 A 26 GLN H A 25 CYS HB3 1.0 1.8 5.5 1342 980 A 36 LEU H A 35 CYS HB3 1.0 1.8 5.5 1343 981 A 12 GLY H A 13 TYR HB2 1.0 1.8 4.5 1344 981 A 34 GLN H A 33 SER HB2 1.0 1.8 4.5 1345 982 A 31 TYR H A 31 TYR HB2 1.0 1.8 4.5 1346 983 A 29 ASN H A 29 ASN HB2 1.0 1.8 4.5 1347 983 A 29 ASN H A 29 ASN HB3 1.0 1.8 4.5 1348 984 A 35 CYS H A 35 CYS HB2 1.0 1.8 4.5 1349 985 A 35 CYS H A 35 CYS HB3 1.0 1.8 4.5 1350 986 A 2 GLN HE21 A 8 CYS HB3 1.0 1.8 5.5 1351 986 A 10 GLY H A 13 TYR HB2 1.0 1.8 5.5 1352 987 A 32 TYR H A 32 TYR HB2 1.0 1.8 3.5 1353 988 A 31 TYR HD% A 31 TYR HB3 1.0 1.8 3.5 1354 989 A 31 TYR HD% A 29 ASN HB2 1.0 1.8 4.5 1355 989 A 31 TYR HD% A 29 ASN HB3 1.0 1.8 4.5 1356 990 A 31 TYR HD% A 31 TYR HB2 1.0 1.8 2.8 1357 991 A 31 TYR HE% A 31 TYR HB3 1.0 1.8 5.5 1358 992 A 5 TYR HD% A 5 TYR HBy 1.0 1.8 2.8 1359 993 A 5 TYR HD% A 5 TYR HBx 1.0 1.8 2.8 1360 994 A 4 HIS HD2 A 35 CYS HB3 1.0 1.8 4.5 1361 994 A 4 HIS HD2 A 4 HIS HB2 1.0 1.8 4.5 1362 995 A 31 TYR HE% A 31 TYR HB2 1.0 1.8 4.5 1363 996 A 9 GLY H A 33 SER HB2 1.0 1.8 4.5 1364 997 A 33 SER H A 33 SER HB2 1.0 1.8 4.5 1365 998 A 13 TYR HB3 A 13 TYR HDx 1.0 1.8 3.5 1366 998 A 13 TYR HB3 A 13 TYR HDy 1.0 1.8 3.5 1367 999 A 5 TYR HE% A 5 TYR HBy 1.0 1.8 5.5 1368 1000 A 5 TYR HE% A 5 TYR HBx 1.0 1.8 4.5 1369 1000 A 5 TYR HE% A 4 HIS HB3 1.0 1.8 4.5 1370 1001 A 32 TYR HE% A 32 TYR HB2 1.0 1.8 5.5 1371 1002 A 8 CYS HA A 8 CYS HB3 1.0 1.8 2.8 1372 1003 A 35 CYS HA A 35 CYS HB2 1.0 1.8 3.5 1373 1004 A 35 CYS HA A 35 CYS HB3 1.0 1.8 4.5 1374 1005 A 36 LEU H A 26 GLN HGy 1.0 1.8 4.5 1375 1005 A 26 GLN H A 26 GLN HGy 1.0 1.8 4.5 1376 1006 A 36 LEU H A 26 GLN HGx 1.0 1.8 4.5 1377 1006 A 26 GLN H A 26 GLN HGx 1.0 1.8 4.5 1378 1007 A 36 LEU H A 34 GLN HGx 1.0 1.8 4.5 1379 1007 A 34 GLN H A 26 GLN HB3 1.0 1.8 4.5 1380 1007 A 34 GLN H A 34 GLN HGy 1.0 1.8 4.5 1381 1007 A 36 LEU H A 34 GLN HGy 1.0 1.8 4.5 1382 1007 A 34 GLN H A 34 GLN HGx 1.0 1.8 4.5 1383 1008 A 26 GLN H A 26 GLN HB3 1.0 1.8 4.5 1384 1009 A 29 ASN H A 32 TYR HB3 1.0 1.8 5.5 1385 1010 A 35 CYS H A 34 GLN HGx 1.0 1.8 3.5 1386 1010 A 35 CYS H A 34 GLN HGy 1.0 1.8 3.5 1387 1011 A 32 TYR H A 32 TYR HB3 1.0 1.8 4.5 1388 1012 A 32 TYR HB3 A 32 TYR HDy 1.0 1.8 2.8 1389 1012 A 32 TYR HB3 A 32 TYR HDx 1.0 1.8 2.8 1390 1013 A 7 GLN HGy A 32 TYR HDx 1.0 1.8 4.5 1391 1013 A 7 GLN HGy A 32 TYR HDy 1.0 1.8 4.5 1392 1014 A 33 SER H A 7 GLN HGy 1.0 1.8 4.5 1393 1015 A 5 TYR HD% A 34 GLN HGx 1.0 1.8 4.5 1394 1015 A 5 TYR HD% A 34 GLN HGy 1.0 1.8 4.5 1395 1016 A 7 GLN HB2 A 32 TYR HDx 1.0 1.8 4.5 1396 1016 A 7 GLN HB2 A 32 TYR HDy 1.0 1.8 4.5 1397 1017 A 32 TYR HE% A 32 TYR HB3 1.0 1.8 5.5 1398 1018 A 32 TYR HE% A 7 GLN HGy 1.0 1.8 4.5 1399 1019 A 32 TYR HE% A 7 GLN HB2 1.0 1.8 3.5 1400 1020 A 33 SER HA A 7 GLN HGy 1.0 1.8 5.5 1401 1020 A 8 CYS HA A 2 GLN HGx 1.0 1.8 5.5 1402 1021 A 8 CYS HA A 2 GLN HGy 1.0 1.8 5.5 1403 1022 A 26 GLN H A 26 GLN HB2 1.0 1.8 3.5 1404 1023 A 34 GLN H A 26 GLN HB2 1.0 1.8 3.5 1405 1023 A 34 GLN H A 28 LEU HBy 1.0 1.8 3.5 1406 1023 A 34 GLN H A 34 GLN HBy 1.0 1.8 3.5 1407 1024 A 36 LEU H A 36 LEU HB2 1.0 1.8 2.8 1408 1024 A 36 LEU H A 36 LEU HB3 1.0 1.8 2.8 1409 1025 A 36 LEU H A 36 LEU HG 1.0 1.8 4.5 1410 1026 A 27 VAL H A 27 VAL HB 1.0 1.8 3.5 1411 1026 A 28 LEU H A 28 LEU HBy 1.0 1.8 3.5 1412 1027 A 28 LEU H A 28 LEU HBx 1.0 1.8 3.5 1413 1027 A 28 LEU H A 28 LEU HG 1.0 1.8 3.5 1414 1028 A 29 ASN H A 28 LEU HBy 1.0 1.8 4.5 1415 1029 A 35 CYS H A 2 GLN HBy 1.0 1.8 4.5 1416 1029 A 35 CYS H A 34 GLN HBy 1.0 1.8 4.5 1417 1030 A 2 GLN HE21 A 2 GLN HBx 1.0 1.8 4.5 1418 1030 A 29 ASN H A 28 LEU HBx 1.0 1.8 4.5 1419 1031 A 35 CYS H A 34 GLN HBx 1.0 1.8 4.5 1420 1032 A 11 ILE H A 11 ILE HG13 1.0 1.8 4.5 1421 1033 A 28 LEU HBy A 32 TYR HDx 1.0 1.8 3.5 1422 1033 A 28 LEU HBy A 32 TYR HDy 1.0 1.8 3.5 1423 1034 A 28 LEU HG A 32 TYR HDx 1.0 1.8 3.5 1424 1034 A 28 LEU HG A 32 TYR HDy 1.0 1.8 3.5 1425 1034 A 28 LEU HBx A 32 TYR HDx 1.0 1.8 3.5 1426 1034 A 28 LEU HBx A 32 TYR HDy 1.0 1.8 3.5 1427 1035 A 34 GLN HBx A 32 TYR HDx 1.0 1.8 4.5 1428 1035 A 34 GLN HBx A 32 TYR HDy 1.0 1.8 4.5 1429 1036 A 4 HIS HD2 A 36 LEU HB2 1.0 1.8 4.5 1430 1036 A 5 TYR HD% A 34 GLN HBx 1.0 1.8 4.5 1431 1036 A 4 HIS HD2 A 36 LEU HB3 1.0 1.8 4.5 1432 1037 A 32 TYR HE% A 34 GLN HBy 1.0 1.8 3.5 1433 1038 A 32 TYR HE% A 34 GLN HBx 1.0 1.8 3.5 1434 1039 A 33 SER HA A 28 LEU HBy 1.0 1.8 4.5 1435 1039 A 8 CYS HA A 2 GLN HBy 1.0 1.8 4.5 1436 1040 A 33 SER HA A 28 LEU HBx 1.0 1.8 4.5 1437 1040 A 8 CYS HA A 2 GLN HBx 1.0 1.8 4.5 1438 1040 A 33 SER HA A 28 LEU HG 1.0 1.8 4.5 1439 1041 A 35 CYS HA A 36 LEU HB2 1.0 1.8 4.5 1440 1041 A 35 CYS HA A 36 LEU HB3 1.0 1.8 4.5 1441 1042 A 24 THR H A 24 THR HG2% 1.0 1.8 4.5 1442 1043 A 34 GLN H A 28 LEU HDy% 1.0 1.8 3.5 1443 1043 A 12 GLY H A 11 ILE HG2% 1.0 1.8 3.5 1444 1044 A 27 VAL H A 27 VAL HG2% 1.0 1.8 4.5 1445 1045 A 11 ILE H A 11 ILE HB 1.0 1.8 5.5 1446 1046 A 29 ASN H A 28 LEU HDy% 1.0 1.8 5.5 1447 1047 A 29 ASN H A 27 VAL HG1% 1.0 1.8 3.5 1448 1048 A 17 THR HG2% A 13 TYR HDx 1.0 1.8 4.5 1449 1048 A 17 THR HG2% A 13 TYR HDy 1.0 1.8 4.5 1450 1049 A 31 TYR HD% A 11 ILE HB 1.0 1.8 3.5 1451 1050 A 31 TYR HD% A 11 ILE HG2% 1.0 1.8 4.5 1452 1051 A 5 TYR HD% A 36 LEU HG 1.0 1.8 5.5 1453 1051 A 4 HIS HD2 A 36 LEU HG 1.0 1.8 5.5 1454 1052 A 31 TYR HE% A 11 ILE HB 1.0 1.8 4.5 1455 1053 A 28 LEU HDx% A 32 TYR HDx 1.0 1.8 3.5 1456 1053 A 28 LEU HDx% A 32 TYR HDy 1.0 1.8 3.5 1457 1054 A 9 GLY H A 7 GLN HGx 1.0 1.8 4.5 1458 1055 A 4 HIS HD2 A 36 LEU HDy% 1.0 1.8 3.5 1459 1055 A 5 TYR HD% A 36 LEU HDy% 1.0 1.8 3.5 1460 1056 A 28 LEU HDy% A 32 TYR HDx 1.0 1.8 4.5 1461 1056 A 28 LEU HDy% A 32 TYR HDy 1.0 1.8 4.5 1462 1057 A 26 GLN HE22 A 36 LEU HDx% 1.0 1.8 3.5 1463 1057 A 31 TYR HE% A 11 ILE HG2% 1.0 1.8 3.5 1464 1058 A 13 TYR HE% A 17 THR HG2% 1.0 1.8 3.5 1465 1059 A 32 TYR HE% A 28 LEU HDx% 1.0 1.8 3.5 1466 1060 A 5 TYR HE% A 36 LEU HDy% 1.0 1.8 3.5 1467 1061 A 32 TYR HE% A 28 LEU HDy% 1.0 1.8 5.5 1468 1062 A 33 SER HA A 28 LEU HDx% 1.0 1.8 5.5 1469 1063 A 33 SER HA A 28 LEU HDy% 1.0 1.8 4.5 1470 1063 A 33 SER HA A 27 VAL HG2% 1.0 1.8 4.5 1471 1064 A 33 SER HA A 27 VAL HG1% 1.0 1.8 5.5 1472 1065 A 8 CYS HA A 17 THR HG2% 1.0 1.8 4.5 1473 1066 A 24 THR H A 23 THR HG2% 1.0 1.8 4.5 1474 1067 A 12 GLY H A 11 ILE HD1% 1.0 1.8 5.5 1475 1067 A 36 LEU H A 23 THR HG2% 1.0 1.8 5.5 1476 1068 A 4 HIS HE1 A 23 THR HG2% 1.0 1.8 5.5 1477 1069 A 23 THR H A 23 THR HG2% 1.0 1.8 5.5 1478 1070 A 31 TYR HD% A 11 ILE HD1% 1.0 1.8 5.5 1479 1071 A 4 HIS HD2 A 23 THR HG2% 1.0 1.8 3.5 1480 1072 A 31 TYR HE% A 11 ILE HD1% 1.0 1.8 4.5 1481 1073 A 26 GLN H A 25 CYS HA 1.0 1.8 2.8 1482 1074 A 24 THR H A 24 THR HA 1.0 1.8 4.5 1483 1075 A 36 LEU H A 36 LEU HA 1.0 1.8 3.5 1484 1076 A 24 THR H A 24 THR HB 1.0 1.8 5.5 1485 1077 A 34 GLN H A 27 VAL HA 1.0 1.8 4.5 1486 1078 A 24 THR H A 23 THR HB 1.0 1.8 3.5 1487 1079 A 12 GLY H A 12 GLY HA2 1.0 1.8 4.5 1488 1080 A 12 GLY H B 1 MAN H5 1.0 1.8 3.5 1489 1080 A 34 GLN H A 33 SER HB3 1.0 1.8 3.5 1490 1081 A 36 LEU H A 25 CYS HB2 1.0 1.8 5.5 1491 1081 A 26 GLN H A 25 CYS HB2 1.0 1.8 5.5 1492 1082 A 36 LEU H A 35 CYS HB2 1.0 1.8 5.5 1493 1083 A 26 GLN H A 33 SER HB2 1.0 1.8 4.5 1494 1083 A 26 GLN H A 8 CYS HB3 1.0 1.8 4.5 1495 1083 A 34 GLN H A 33 SER HB2 1.0 1.8 4.5 1496 1084 A 36 LEU H A 26 GLN HGy 1.0 1.8 4.5 1497 1084 A 26 GLN H A 26 GLN HGy 1.0 1.8 4.5 1498 1085 A 36 LEU H A 26 GLN HGx 1.0 1.8 5.5 1499 1085 A 26 GLN H A 26 GLN HGx 1.0 1.8 5.5 1500 1086 A 34 GLN H A 26 GLN HB3 1.0 1.8 4.5 1501 1086 A 26 GLN H A 26 GLN HB3 1.0 1.8 4.5 1502 1087 A 34 GLN H A 34 GLN HBy 1.0 1.8 4.5 1503 1088 A 36 LEU H A 36 LEU HB2 1.0 1.8 3.5 1504 1088 A 36 LEU H A 36 LEU HB3 1.0 1.8 3.5 1505 1089 A 26 GLN H A 36 LEU HG 1.0 1.8 4.5 1506 1089 A 36 LEU H A 36 LEU HG 1.0 1.8 4.5 1507 1090 A 26 GLN H A 28 LEU HDy% 1.0 1.8 4.5 1508 1090 A 26 GLN H A 36 LEU HDx% 1.0 1.8 4.5 1509 1090 A 34 GLN H A 36 LEU HDx% 1.0 1.8 4.5 1510 1090 A 36 LEU H A 36 LEU HDx% 1.0 1.8 4.5 1511 1090 A 34 GLN H A 28 LEU HDy% 1.0 1.8 4.5 1512 1091 A 35 CYS H A 7 GLN HA 1.0 1.8 4.5 1513 1092 A 31 TYR HA A 11 ILE H 1.0 1.8 4.5 1514 1093 A 28 LEU H A 27 VAL HA 1.0 1.8 2.8 1515 1094 A 31 TYR H A 29 ASN HB2 1.0 1.8 4.5 1516 1094 A 29 ASN H A 29 ASN HB2 1.0 1.8 4.5 1517 1094 A 31 TYR H A 29 ASN HB3 1.0 1.8 4.5 1518 1094 A 29 ASN H A 29 ASN HB3 1.0 1.8 4.5 1519 1095 A 31 TYR H A 31 TYR HB2 1.0 1.8 4.5 1520 1096 A 35 CYS H A 35 CYS HB2 1.0 1.8 4.5 1521 1097 A 14 SER H A 13 TYR HB3 1.0 1.8 3.5 1522 1097 A 35 CYS H A 35 CYS HB3 1.0 1.8 3.5 1523 1098 A 35 CYS H A 34 GLN HGx 1.0 1.8 4.5 1524 1098 A 35 CYS H A 34 GLN HGy 1.0 1.8 4.5 1525 1099 A 27 VAL H A 27 VAL HB 1.0 1.8 3.5 1526 1099 A 29 ASN H A 28 LEU HBy 1.0 1.8 3.5 1527 1099 A 28 LEU H A 28 LEU HBy 1.0 1.8 3.5 1528 1100 A 28 LEU H A 28 LEU HBx 1.0 1.8 3.5 1529 1100 A 29 ASN H A 28 LEU HBx 1.0 1.8 3.5 1530 1100 A 28 LEU H A 28 LEU HG 1.0 1.8 3.5 1531 1101 A 27 VAL H A 27 VAL HG2% 1.0 1.8 4.5 1532 1102 A 28 LEU H A 27 VAL HG1% 1.0 1.8 3.5 1533 1102 A 29 ASN H A 27 VAL HG1% 1.0 1.8 3.5 1534 1103 A 13 TYR H A 13 TYR HA 1.0 1.8 4.5 1535 1103 A 32 TYR H A 32 TYR HA 1.0 1.8 4.5 1536 1104 A 8 CYS H A 7 GLN HA 1.0 1.8 3.5 1537 1105 A 32 TYR H A 31 TYR HA 1.0 1.8 4.5 1538 1106 A 32 TYR H A 31 TYR HB2 1.0 1.8 5.5 1539 1106 A 13 TYR H A 13 TYR HB3 1.0 1.8 5.5 1540 1107 A 8 CYS H A 8 CYS HB3 1.0 1.8 4.5 1541 1107 A 13 TYR H A 13 TYR HB2 1.0 1.8 4.5 1542 1107 A 32 TYR H A 32 TYR HB2 1.0 1.8 4.5 1543 1108 A 32 TYR H A 32 TYR HB3 1.0 1.8 4.5 1544 1109 A 13 TYR HA A 13 TYR HDy 1.0 1.8 2.8 1545 1109 A 32 TYR HA A 32 TYR HDx 1.0 1.8 2.8 1546 1109 A 13 TYR HA A 13 TYR HDx 1.0 1.8 2.8 1547 1109 A 32 TYR HA A 32 TYR HDy 1.0 1.8 2.8 1548 1110 A 31 TYR HD% A 31 TYR HA 1.0 1.8 3.5 1549 1111 A 9 GLY HAy A 13 TYR HDx 1.0 1.8 3.5 1550 1111 A 9 GLY HAy A 13 TYR HDy 1.0 1.8 3.5 1551 1112 A 31 TYR HD% A 31 TYR HB3 1.0 1.8 3.5 1552 1113 A 35 CYS HB2 A 2 GLN HE22 1.0 1.8 5.5 1553 1114 A 31 TYR HD% A 31 TYR HB2 1.0 1.8 2.8 1554 1115 A 13 TYR HB3 A 13 TYR HDx 1.0 1.8 3.5 1555 1115 A 13 TYR HB3 A 13 TYR HDy 1.0 1.8 3.5 1556 1116 A 13 TYR HB2 A 13 TYR HDx 1.0 1.8 2.8 1557 1116 A 32 TYR HB2 A 32 TYR HDx 1.0 1.8 2.8 1558 1116 A 13 TYR HB2 A 13 TYR HDy 1.0 1.8 2.8 1559 1116 A 32 TYR HB2 A 32 TYR HDy 1.0 1.8 2.8 1560 1117 A 32 TYR HB3 A 32 TYR HDy 1.0 1.8 3.5 1561 1117 A 32 TYR HB3 A 32 TYR HDx 1.0 1.8 3.5 1562 1118 A 7 GLN HGy A 32 TYR HDx 1.0 1.8 5.5 1563 1118 A 7 GLN HGy A 32 TYR HDy 1.0 1.8 5.5 1564 1119 A 28 LEU HBy A 32 TYR HDx 1.0 1.8 4.5 1565 1119 A 28 LEU HBy A 32 TYR HDy 1.0 1.8 4.5 1566 1120 A 28 LEU HG A 32 TYR HDx 1.0 1.8 4.5 1567 1120 A 28 LEU HG A 32 TYR HDy 1.0 1.8 4.5 1568 1120 A 28 LEU HBx A 32 TYR HDx 1.0 1.8 4.5 1569 1120 A 28 LEU HBx A 32 TYR HDy 1.0 1.8 4.5 1570 1121 A 31 TYR HD% A 11 ILE HB 1.0 1.8 4.5 1571 1122 A 31 TYR HD% A 11 ILE HG2% 1.0 1.8 4.5 1572 1123 A 28 LEU HDx% A 32 TYR HDx 1.0 1.8 4.5 1573 1123 A 28 LEU HDx% A 32 TYR HDy 1.0 1.8 4.5 1574 1124 A 31 TYR HD% A 11 ILE HD1% 1.0 1.8 5.5 1575 1125 A 33 SER H A 32 TYR HA 1.0 1.8 2.8 1576 1126 A 4 HIS HD2 A 36 LEU HA 1.0 1.8 3.5 1577 1127 A 9 GLY H A 7 GLN HA 1.0 1.8 4.5 1578 1127 A 33 SER H A 7 GLN HA 1.0 1.8 4.5 1579 1128 A 9 GLY H A 9 GLY HAy 1.0 1.8 4.5 1580 1129 A 32 TYR HE% A 7 GLN HA 1.0 1.8 4.5 1581 1130 A 4 HIS HD2 A 4 HIS HA 1.0 1.8 2.8 1582 1130 A 5 TYR HD% A 5 TYR HA 1.0 1.8 2.8 1583 1131 A 5 TYR HD% A 5 TYR HBy 1.0 1.8 3.5 1584 1132 A 5 TYR HD% A 5 TYR HBx 1.0 1.8 3.5 1585 1133 A 4 HIS HD2 A 4 HIS HB2 1.0 1.8 4.5 1586 1134 A 9 GLY H A 33 SER HB2 1.0 1.8 3.5 1587 1135 A 33 SER H A 7 GLN HGy 1.0 1.8 4.5 1588 1136 A 32 TYR HE% A 7 GLN HGy 1.0 1.8 5.5 1589 1137 A 32 TYR HE% A 7 GLN HB2 1.0 1.8 3.5 1590 1138 A 32 TYR HE% A 34 GLN HBy 1.0 1.8 4.5 1591 1139 A 13 TYR HE% A 7 GLN HB3 1.0 1.8 5.5 1592 1140 A 32 TYR HE% A 34 GLN HBx 1.0 1.8 4.5 1593 1141 A 13 TYR HE% A 17 THR HG2% 1.0 1.8 4.5 1594 1142 A 4 HIS HD2 A 36 LEU HDy% 1.0 1.8 3.5 1595 1142 A 5 TYR HD% A 36 LEU HDy% 1.0 1.8 3.5 1596 1143 A 31 TYR HE% A 11 ILE HG2% 1.0 1.8 4.5 1597 1144 A 32 TYR HE% A 28 LEU HDx% 1.0 1.8 4.5 1598 1145 A 5 TYR HE% A 36 LEU HDy% 1.0 1.8 4.5 1599 1146 A 4 HIS HD2 A 23 THR HG2% 1.0 1.8 4.5 1600 1147 A 33 SER HA A 27 VAL HA 1.0 1.8 3.5 1601 1148 A 33 SER HA A 33 SER HB3 1.0 1.8 3.5 1602 1149 A 8 CYS HA A 8 CYS HB2 1.0 1.8 3.5 1603 1150 A 29 ASN HA A 29 ASN HB2 1.0 1.8 2.8 1604 1150 A 29 ASN HA A 29 ASN HB3 1.0 1.8 2.8 1605 1151 A 8 CYS HA A 8 CYS HB3 1.0 1.8 2.8 1606 1152 A 35 CYS HA A 25 CYS HB2 1.0 1.8 5.5 1607 1153 A 35 CYS HA A 35 CYS HB2 1.0 1.8 3.5 1608 1154 A 35 CYS HA A 35 CYS HB3 1.0 1.8 4.5 1609 1155 A 8 CYS HA A 2 GLN HBx 1.0 1.8 4.5 1610 1155 A 33 SER HA A 28 LEU HG 1.0 1.8 4.5 1611 1156 A 29 ASN HA A 30 PRO HG3 1.0 1.8 5.5 1612 1157 A 34 GLN HA A 34 GLN HBy 1.0 1.8 5.5 1613 1158 A 34 GLN HA A 34 GLN HBx 1.0 1.8 4.5 1614 1159 A 33 SER HA A 27 VAL HG1% 1.0 1.8 5.5 1615 1160 A 29 ASN HA A 27 VAL HG1% 1.0 1.8 4.5 1616 1161 A 17 THR HA A 17 THR HB 1.0 1.8 2.8 1617 1162 A 24 THR HA A 24 THR HB 1.0 1.8 2.8 1618 1163 A 21 SER HA A 21 SER HB2 1.0 1.8 2.8 1619 1163 A 21 SER HA A 21 SER HB3 1.0 1.8 2.8 1620 1164 A 24 THR HA A 19 CYS HB3 1.0 1.8 4.5 1621 1164 A 16 PRO HA A 16 PRO HDy 1.0 1.8 4.5 1622 1165 A 27 VAL HA A 33 SER HB3 1.0 1.8 2.8 1623 1166 A 17 THR HA A 25 CYS HB2 1.0 1.8 5.5 1624 1167 A 25 CYS HA A 8 CYS HB2 1.0 1.8 4.5 1625 1167 A 17 THR HB A 8 CYS HB2 1.0 1.8 4.5 1626 1168 A 25 CYS HA A 25 CYS HB2 1.0 1.8 3.5 1627 1169 B 1 MAN H5 B 1 MAN H6y 1.0 1.8 3.5 1628 1170 A 31 TYR HA A 31 TYR HB3 1.0 1.8 3.5 1629 1171 A 5 TYR HA A 5 TYR HBy 1.0 1.8 3.5 1630 1172 A 14 SER HA A 13 TYR HB2 1.0 1.8 4.5 1631 1172 B 1 MAN H1 A 13 TYR HB2 1.0 1.8 4.5 1632 1172 A 17 THR HA A 8 CYS HB3 1.0 1.8 4.5 1633 1173 A 23 THR HA A 35 CYS HB2 1.0 1.8 6.5 1634 1174 A 17 THR HB A 25 CYS HB3 1.0 1.8 3.5 1635 1174 A 13 TYR HA A 13 TYR HB3 1.0 1.8 3.5 1636 1174 A 25 CYS HA A 25 CYS HB3 1.0 1.8 3.5 1637 1175 A 32 TYR HA A 32 TYR HB2 1.0 1.8 2.8 1638 1175 A 13 TYR HA A 13 TYR HB2 1.0 1.8 2.8 1639 1176 A 17 THR HB A 25 CYS HB3 1.0 1.8 3.5 1640 1176 A 25 CYS HA A 25 CYS HB3 1.0 1.8 3.5 1641 1177 A 25 CYS HA A 35 CYS HB2 1.0 1.8 5.5 1642 1178 A 31 TYR HA A 31 TYR HB2 1.0 1.8 3.5 1643 1179 A 9 GLY HAy A 33 SER HB2 1.0 1.8 4.5 1644 1179 A 9 GLY HAy A 13 TYR HB2 1.0 1.8 4.5 1645 1180 A 4 HIS HA A 4 HIS HB3 1.0 1.8 2.8 1646 1180 A 5 TYR HA A 5 TYR HBx 1.0 1.8 2.8 1647 1181 A 32 TYR HA A 32 TYR HB3 1.0 1.8 4.5 1648 1182 A 26 GLN HA A 26 GLN HGx 1.0 1.8 3.5 1649 1183 A 26 GLN HA A 26 GLN HGy 1.0 1.8 4.5 1650 1184 A 16 PRO HA A 16 PRO HB3 1.0 1.8 2.8 1651 1185 A 24 THR HA A 19 CYS HB2 1.0 1.8 3.5 1652 1186 A 7 GLN HA A 7 GLN HGy 1.0 1.8 3.5 1653 1187 A 30 PRO HB3 A 30 PRO HA 1.0 1.8 2.8 1654 1188 A 5 TYR HA A 34 GLN HGx 1.0 1.8 4.5 1655 1188 A 5 TYR HA A 34 GLN HGy 1.0 1.8 4.5 1656 1189 A 28 LEU HA A 28 LEU HBy 1.0 1.8 4.5 1657 1190 A 2 GLN HA A 2 GLN HBx 1.0 1.8 2.8 1658 1190 A 28 LEU HA A 28 LEU HBx 1.0 1.8 2.8 1659 1190 A 28 LEU HA A 28 LEU HG 1.0 1.8 2.8 1660 1191 A 19 CYS HA A 2 GLN HBy 1.0 1.8 4.5 1661 1192 A 26 GLN HA A 26 GLN HB3 1.0 1.8 3.5 1662 1193 A 26 GLN HA A 26 GLN HB2 1.0 1.8 3.5 1663 1194 A 16 PRO HA A 16 PRO HGy 1.0 1.8 5.5 1664 1195 A 16 PRO HA A 18 VAL HB 1.0 1.8 4.5 1665 1195 A 16 PRO HA A 16 PRO HGx 1.0 1.8 4.5 1666 1196 A 16 PRO HA A 16 PRO HB2 1.0 1.8 4.5 1667 1197 A 7 GLN HA A 7 GLN HB2 1.0 1.8 3.5 1668 1198 A 6 GLY HA2 A 34 GLN HGx 1.0 1.8 4.5 1669 1198 A 30 PRO HG2 A 30 PRO HA 1.0 1.8 4.5 1670 1198 A 6 GLY HA2 A 34 GLN HGy 1.0 1.8 4.5 1671 1199 A 30 PRO HG3 A 30 PRO HA 1.0 1.8 4.5 1672 1200 A 27 VAL HA A 26 GLN HB3 1.0 1.8 4.5 1673 1200 A 15 GLY HA2 A 16 PRO HGy 1.0 1.8 4.5 1674 1201 A 1 THR HB A 18 VAL HB 1.0 1.8 3.5 1675 1201 A 18 VAL HA A 18 VAL HB 1.0 1.8 3.5 1676 1202 A 36 LEU HA A 36 LEU HB2 1.0 1.8 2.8 1677 1202 A 36 LEU HA A 36 LEU HB3 1.0 1.8 2.8 1678 1203 A 7 GLN HA A 7 GLN HB3 1.0 1.8 4.5 1679 1204 A 17 THR HA A 17 THR HG2% 1.0 1.8 3.5 1680 1205 A 17 THR HB A 17 THR HG2% 1.0 1.8 2.8 1681 1206 A 24 THR HA A 24 THR HG2% 1.0 1.8 3.5 1682 1207 A 3 SER HA A 20 ALA HB% 1.0 1.8 3.5 1683 1208 A 30 PRO HB2 A 30 PRO HA 1.0 1.8 3.5 1684 1209 A 1 THR HB A 1 THR HG2% 1.0 1.8 2.8 1685 1210 A 28 LEU HA A 28 LEU HDy% 1.0 1.8 4.5 1686 1211 A 36 LEU HA A 36 LEU HDy% 1.0 1.8 2.8 1687 1212 A 18 VAL HA A 18 VAL HG1% 1.0 1.8 2.8 1688 1212 A 18 VAL HA A 18 VAL HG2% 1.0 1.8 2.8 1689 1213 A 23 THR HA A 23 THR HG2% 1.0 1.8 3.5 1690 1214 A 36 LEU HA A 23 THR HG2% 1.0 1.8 5.5 1691 1215 A 27 VAL HG1% A 30 PRO HA 1.0 1.8 5.5 1692 1216 A 19 CYS HA A 19 CYS HB3 1.0 1.8 3.5 1693 1217 A 24 THR HA A 24 THR HB 1.0 1.8 2.8 1694 1218 A 3 SER HA A 3 SER HBy 1.0 1.8 3.5 1695 1219 A 31 TYR HA A 10 GLY HAx 1.0 1.8 3.5 1696 1219 A 3 SER HA A 3 SER HBx 1.0 1.8 3.5 1697 1220 A 21 SER HA A 21 SER HB2 1.0 1.8 2.8 1698 1220 A 21 SER HA A 21 SER HB3 1.0 1.8 2.8 1699 1221 A 30 PRO HD3 A 29 ASN HB2 1.0 1.8 2.8 1700 1221 A 30 PRO HD3 A 29 ASN HB3 1.0 1.8 2.8 1701 1222 A 30 PRO HD2 A 29 ASN HB2 1.0 1.8 2.8 1702 1222 A 30 PRO HD2 A 29 ASN HB3 1.0 1.8 2.8 1703 1223 A 4 HIS HA A 35 CYS HB2 1.0 1.8 4.5 1704 1224 A 4 HIS HA A 4 HIS HB2 1.0 1.8 3.5 1705 1225 A 4 HIS HA A 35 CYS HB3 1.0 1.8 4.5 1706 1226 A 9 GLY HAx A 33 SER HB2 1.0 1.8 3.5 1707 1226 A 10 GLY HAx A 13 TYR HB2 1.0 1.8 3.5 1708 1226 A 10 GLY HAx A 33 SER HB2 1.0 1.8 3.5 1709 1227 A 23 THR HB A 35 CYS HB2 1.0 1.8 3.5 1710 1228 A 2 GLN HGy A 16 PRO HDx 1.0 1.8 4.5 1711 1229 A 6 GLY HA3 A 2 GLN HGx 1.0 1.8 4.5 1712 1229 A 2 GLN HGx A 16 PRO HDx 1.0 1.8 4.5 1713 1230 A 27 VAL HA A 27 VAL HB 1.0 1.8 3.5 1714 1231 A 30 PRO HD3 A 30 PRO HG2 1.0 1.8 3.5 1715 1232 A 1 THR HA A 18 VAL HB 1.0 1.8 4.5 1716 1233 A 30 PRO HD3 A 30 PRO HG3 1.0 1.8 3.5 1717 1234 A 30 PRO HD2 A 30 PRO HG2 1.0 1.8 3.5 1718 1235 A 30 PRO HD2 A 30 PRO HG3 1.0 1.8 3.5 1719 1236 A 16 PRO HDy A 16 PRO HGx 1.0 1.8 2.8 1720 1237 A 16 PRO HDx A 16 PRO HGx 1.0 1.8 2.8 1721 1238 A 11 ILE HA A 11 ILE HG13 1.0 1.8 4.5 1722 1239 A 20 ALA HA A 20 ALA HB% 1.0 1.8 2.8 1723 1240 A 24 THR HB A 24 THR HG2% 1.0 1.8 2.8 1724 1241 A 1 THR HA A 1 THR HG2% 1.0 1.8 3.5 1725 1242 A 27 VAL HA A 27 VAL HG2% 1.0 1.8 2.8 1726 1243 A 11 ILE HA A 11 ILE HG2% 1.0 1.8 3.5 1727 1244 A 4 HIS HA A 23 THR HG2% 1.0 1.8 3.5 1728 1245 A 27 VAL HA A 27 VAL HG1% 1.0 1.8 3.5 1729 1246 A 23 THR HB A 23 THR HG2% 1.0 1.8 2.8 1730 1247 A 25 CYS HA A 25 CYS HB2 1.0 1.8 2.8 1731 1248 A 17 THR HB A 25 CYS HB3 1.0 1.8 3.5 1732 1248 A 13 TYR HA A 13 TYR HB3 1.0 1.8 3.5 1733 1249 A 25 CYS HA A 25 CYS HB3 1.0 1.8 3.5 1734 1250 A 24 THR HA A 35 CYS HB3 1.0 1.8 4.5 1735 1250 A 24 THR HA A 25 CYS HB3 1.0 1.8 4.5 1736 1251 A 32 TYR HA A 32 TYR HB2 1.0 1.8 2.8 1737 1251 A 13 TYR HA A 13 TYR HB2 1.0 1.8 2.8 1738 1252 A 31 TYR HA A 31 TYR HB3 1.0 1.8 3.5 1739 1253 A 36 LEU HA A 35 CYS HB2 1.0 1.8 6.5 1740 1254 A 31 TYR HA A 31 TYR HB2 1.0 1.8 3.5 1741 1255 A 12 GLY HA3 A 31 TYR HB2 1.0 1.8 4.5 1742 1255 A 12 GLY HA3 A 13 TYR HB3 1.0 1.8 4.5 1743 1255 A 10 GLY HAy A 13 TYR HB3 1.0 1.8 4.5 1744 1256 A 9 GLY HAy A 13 TYR HB2 1.0 1.8 4.5 1745 1257 A 5 TYR HA A 5 TYR HBy 1.0 1.8 3.5 1746 1258 A 4 HIS HA A 4 HIS HB3 1.0 1.8 2.8 1747 1258 A 5 TYR HA A 5 TYR HBx 1.0 1.8 2.8 1748 1259 A 4 HIS HA A 35 CYS HB3 1.0 1.8 2.8 1749 1259 A 4 HIS HA A 4 HIS HB2 1.0 1.8 2.8 1750 1260 A 8 CYS HB2 A 25 CYS HB2 1.0 1.8 4.5 1751 1261 A 25 CYS HB2 A 8 CYS HB3 1.0 1.8 3.5 1752 1262 A 4 HIS HB2 A 23 THR HG2% 1.0 1.8 3.5 1753 1263 A 32 TYR HA A 32 TYR HB3 1.0 1.8 3.5 1754 1264 A 26 GLN HA A 26 GLN HGy 1.0 1.8 4.5 1755 1265 A 32 TYR HA A 7 GLN HGy 1.0 1.8 2.8 1756 1265 A 26 GLN HA A 26 GLN HGx 1.0 1.8 2.8 1757 1266 A 19 CYS HA A 19 CYS HB2 1.0 1.8 3.5 1758 1267 A 26 GLN HA A 26 GLN HB3 1.0 1.8 2.8 1759 1268 A 16 PRO HA A 16 PRO HB3 1.0 1.8 2.8 1760 1269 A 7 GLN HA A 7 GLN HGy 1.0 1.8 3.5 1761 1270 A 24 THR HA A 19 CYS HB2 1.0 1.8 3.5 1762 1271 A 30 PRO HB3 A 30 PRO HA 1.0 1.8 2.8 1763 1272 A 6 GLY HA2 A 34 GLN HGx 1.0 1.8 4.5 1764 1272 A 30 PRO HG2 A 30 PRO HA 1.0 1.8 4.5 1765 1272 A 6 GLY HA2 A 34 GLN HGy 1.0 1.8 4.5 1766 1273 A 7 GLN HA A 7 GLN HB2 1.0 1.8 2.8 1767 1274 A 15 GLY HA2 A 16 PRO HGx 1.0 1.8 4.5 1768 1274 A 27 VAL HA A 26 GLN HB3 1.0 1.8 4.5 1769 1274 A 15 GLY HA2 A 16 PRO HGy 1.0 1.8 4.5 1770 1275 A 30 PRO HG2 A 30 PRO HB3 1.0 1.8 2.8 1771 1275 A 26 GLN HGx A 26 GLN HB3 1.0 1.8 2.8 1772 1276 A 26 GLN HGy A 26 GLN HB2 1.0 1.8 3.5 1773 1277 A 7 GLN HB2 A 7 GLN HGy 1.0 1.8 2.8 1774 1277 A 26 GLN HGx A 26 GLN HB3 1.0 1.8 2.8 1775 1278 A 26 GLN HGx A 26 GLN HB2 1.0 1.8 3.5 1776 1279 A 30 PRO HB3 A 30 PRO HG3 1.0 1.8 2.8 1777 1280 A 2 GLN HGx A 2 GLN HBx 1.0 1.8 3.5 1778 1281 A 34 GLN HBx A 34 GLN HGx 1.0 1.8 2.8 1779 1281 A 34 GLN HGy A 34 GLN HBx 1.0 1.8 2.8 1780 1282 A 30 PRO HB3 A 11 ILE HD1% 1.0 1.8 4.5 1781 1283 A 26 GLN HA A 26 GLN HB2 1.0 1.8 3.5 1782 1284 A 19 CYS HA A 2 GLN HBx 1.0 1.8 4.5 1783 1285 A 19 CYS HA A 2 GLN HBy 1.0 1.8 3.5 1784 1286 A 16 PRO HA A 16 PRO HGy 1.0 1.8 3.5 1785 1287 A 30 PRO HG3 A 30 PRO HA 1.0 1.8 4.5 1786 1288 A 16 PRO HA A 16 PRO HB2 1.0 1.8 3.5 1787 1289 A 7 GLN HA A 7 GLN HB3 1.0 1.8 3.5 1788 1290 A 6 GLY HA2 A 34 GLN HBx 1.0 1.8 5.5 1789 1291 A 36 LEU HA A 36 LEU HB2 1.0 1.8 2.8 1790 1291 A 36 LEU HA A 36 LEU HB3 1.0 1.8 2.8 1791 1292 A 31 TYR HA A 11 ILE HG13 1.0 1.8 4.5 1792 1293 A 5 TYR HA A 34 GLN HGx 1.0 1.8 3.5 1793 1293 A 5 TYR HA A 34 GLN HGy 1.0 1.8 3.5 1794 1294 A 1 THR HB A 18 VAL HB 1.0 1.8 3.5 1795 1294 A 18 VAL HA A 18 VAL HB 1.0 1.8 3.5 1796 1295 A 27 VAL HA A 27 VAL HB 1.0 1.8 3.5 1797 1296 A 30 PRO HD3 A 30 PRO HG3 1.0 1.8 3.5 1798 1297 A 1 THR HA A 18 VAL HB 1.0 1.8 4.5 1799 1298 A 27 VAL HA A 28 LEU HBx 1.0 1.8 5.5 1800 1298 A 27 VAL HA A 28 LEU HG 1.0 1.8 5.5 1801 1299 A 16 PRO HDy A 16 PRO HGx 1.0 1.8 2.8 1802 1299 A 16 PRO HDy A 16 PRO HGy 1.0 1.8 2.8 1803 1300 A 16 PRO HDx A 16 PRO HGx 1.0 1.8 2.8 1804 1301 A 11 ILE HA A 11 ILE HG13 1.0 1.8 3.5 1805 1302 A 8 CYS HB3 A 2 GLN HBy 1.0 1.8 5.5 1806 1303 A 2 GLN HGy A 2 GLN HBy 1.0 1.8 3.5 1807 1303 A 2 GLN HGy A 2 GLN HBx 1.0 1.8 3.5 1808 1304 A 16 PRO HB3 A 16 PRO HGx 1.0 1.8 2.8 1809 1305 A 2 GLN HGx A 2 GLN HBy 1.0 1.8 2.8 1810 1305 A 26 GLN HGx A 26 GLN HB2 1.0 1.8 2.8 1811 1305 A 30 PRO HB3 A 30 PRO HG3 1.0 1.8 2.8 1812 1306 A 34 GLN HBx A 34 GLN HGx 1.0 1.8 2.8 1813 1306 A 34 GLN HGy A 34 GLN HBx 1.0 1.8 2.8 1814 1307 A 18 VAL HB A 18 VAL HG1% 1.0 1.8 2.8 1815 1307 A 18 VAL HB A 18 VAL HG2% 1.0 1.8 2.8 1816 1308 A 28 LEU HBy A 28 LEU HDy% 1.0 1.8 2.8 1817 1308 A 27 VAL HB A 27 VAL HG2% 1.0 1.8 2.8 1818 1308 A 26 GLN HB2 A 36 LEU HDx% 1.0 1.8 2.8 1819 1309 A 27 VAL HG1% A 27 VAL HB 1.0 1.8 2.8 1820 1310 A 11 ILE HG13 A 11 ILE HD1% 1.0 1.8 2.8 1821 1311 A 17 THR HB A 17 THR HG2% 1.0 1.8 2.8 1822 1312 A 26 GLN HA A 27 VAL HG2% 1.0 1.8 3.5 1823 1313 A 16 PRO HA A 17 THR HG2% 1.0 1.8 3.5 1824 1313 A 36 LEU HA A 36 LEU HG 1.0 1.8 3.5 1825 1314 A 3 SER HA A 20 ALA HB% 1.0 1.8 2.8 1826 1314 A 31 TYR HA A 11 ILE HB 1.0 1.8 2.8 1827 1315 A 9 GLY HAy A 17 THR HG2% 1.0 1.8 4.5 1828 1316 A 30 PRO HB2 A 30 PRO HA 1.0 1.8 3.5 1829 1317 A 3 SER HA A 1 THR HG2% 1.0 1.8 4.5 1830 1317 A 31 TYR HA A 30 PRO HB2 1.0 1.8 4.5 1831 1318 A 24 THR HA A 24 THR HG2% 1.0 1.8 3.5 1832 1319 A 7 GLN HA A 7 GLN HGx 1.0 1.8 3.5 1833 1320 A 36 LEU HA A 36 LEU HDy% 1.0 1.8 2.8 1834 1321 A 31 TYR HA A 11 ILE HG2% 1.0 1.8 4.5 1835 1322 A 10 GLY HAy A 27 VAL HG2% 1.0 1.8 3.5 1836 1322 A 12 GLY HA3 A 11 ILE HG2% 1.0 1.8 3.5 1837 1323 A 27 VAL HG1% A 30 PRO HA 1.0 1.8 4.5 1838 1324 A 1 THR HB A 20 ALA HB% 1.0 1.8 4.5 1839 1325 A 20 ALA HA A 20 ALA HB% 1.0 1.8 2.8 1840 1326 A 1 THR HB A 1 THR HG2% 1.0 1.8 2.8 1841 1327 A 20 ALA HA A 1 THR HG2% 1.0 1.8 3.5 1842 1328 A 1 THR HA A 1 THR HG2% 1.0 1.8 2.8 1843 1329 A 24 THR HB A 24 THR HG2% 1.0 1.8 2.8 1844 1330 A 18 VAL HA A 18 VAL HG1% 1.0 1.8 2.8 1845 1330 A 18 VAL HA A 18 VAL HG2% 1.0 1.8 2.8 1846 1331 A 1 THR HA A 18 VAL HG1% 1.0 1.8 4.5 1847 1332 A 27 VAL HA A 27 VAL HG2% 1.0 1.8 2.8 1848 1333 A 27 VAL HA A 27 VAL HG1% 1.0 1.8 2.8 1849 1334 A 11 ILE HA A 11 ILE HB 1.0 1.8 3.5 1850 1335 A 11 ILE HA A 11 ILE HG12 1.0 1.8 3.5 1851 1336 A 11 ILE HA A 11 ILE HG2% 1.0 1.8 2.8 1852 1337 A 30 PRO HG2 A 30 PRO HB2 1.0 1.8 3.5 1853 1338 A 28 LEU HBy A 28 LEU HDx% 1.0 1.8 3.5 1854 1339 A 28 LEU HBx A 28 LEU HDx% 1.0 1.8 3.5 1855 1339 A 28 LEU HG A 28 LEU HDx% 1.0 1.8 3.5 1856 1340 A 18 VAL HB A 18 VAL HG1% 1.0 1.8 2.8 1857 1340 A 18 VAL HB A 18 VAL HG2% 1.0 1.8 2.8 1858 1341 A 28 LEU HG A 28 LEU HDy% 1.0 1.8 3.5 1859 1341 A 28 LEU HBx A 28 LEU HDy% 1.0 1.8 3.5 1860 1342 A 28 LEU HBy A 28 LEU HDy% 1.0 1.8 2.8 1861 1342 A 27 VAL HB A 27 VAL HG2% 1.0 1.8 2.8 1862 1342 A 26 GLN HB2 A 36 LEU HDx% 1.0 1.8 2.8 1863 1343 A 27 VAL HG1% A 27 VAL HB 1.0 1.8 2.8 1864 1344 A 36 LEU HDx% A 36 LEU HB2 1.0 1.8 2.8 1865 1344 A 36 LEU HB3 A 36 LEU HDx% 1.0 1.8 2.8 1866 1345 A 11 ILE HB A 11 ILE HD1% 1.0 1.8 2.8 1867 1346 A 11 ILE HG2% A 11 ILE HD1% 1.0 1.8 2.8 1868 1347 A 31 TYR HA A 11 ILE HD1% 1.0 1.8 4.5 1869 1348 A 36 LEU HA A 23 THR HG2% 1.0 1.8 4.5 1870 1349 A 22 GLY HA3 A 23 THR HG2% 1.0 1.8 4.5 1871 1350 A 11 ILE HD1% A 30 PRO HA 1.0 1.8 4.5 1872 1351 A 4 HIS HA A 23 THR HG2% 1.0 1.8 3.5 1873 1352 A 23 THR HB A 23 THR HG2% 1.0 1.8 2.8 1874 1353 A 4 HIS HB3 A 23 THR HG2% 1.0 1.8 4.5 1875 1354 A 35 CYS HB2 A 23 THR HG2% 1.0 1.8 4.5 1876 1355 A 4 HIS HB2 A 23 THR HG2% 1.0 1.8 3.5 1877 1356 A 30 PRO HB3 A 11 ILE HD1% 1.0 1.8 4.5 1878 1357 A 11 ILE HG13 A 11 ILE HD1% 1.0 1.8 2.8 1879 1358 A 24 THR H A 36 LEU H 1.0 1.8 4.5 1880 1359 A 34 GLN H A 27 VAL H 1.0 1.8 4.5 1881 1359 A 34 GLN H A 28 LEU H 1.0 1.8 4.5 1882 1360 A 34 GLN H A 35 CYS H 1.0 1.8 4.5 1883 1360 A 36 LEU H A 35 CYS H 1.0 1.8 4.5 1884 1361 A 26 GLN H A 27 VAL H 1.0 1.8 4.5 1885 1361 A 34 GLN H A 28 LEU H 1.0 1.8 4.5 1886 1362 A 26 GLN H A 35 CYS H 1.0 1.8 4.5 1887 1362 A 34 GLN H A 35 CYS H 1.0 1.8 4.5 1888 1362 A 36 LEU H A 35 CYS H 1.0 1.8 4.5 1889 1363 A 31 TYR HE% A 30 PRO HD2 1.0 1.8 5.5 1890 1364 A 33 SER H A 10 GLY HAx 1.0 1.8 5.5 1891 1365 A 9 GLY H A 33 SER HB3 1.0 1.8 5.5 1892 1366 A 33 SER H A 10 GLY HAy 1.0 1.8 5.5 1893 1366 A 33 SER H A 7 GLN HA 1.0 1.8 5.5 1894 1367 A 29 ASN HA A 30 PRO HD2 1.0 1.8 3.5 1895 1368 A 29 ASN HA A 29 ASN HB2 1.0 1.8 2.8 1896 1368 A 29 ASN HA A 29 ASN HB3 1.0 1.8 2.8 1897 1369 A 30 PRO HD3 A 29 ASN HA 1.0 1.8 2.8 1898 1370 A 24 THR HA A 19 CYS HB3 1.0 1.8 4.5 1899 1370 A 16 PRO HA A 16 PRO HDy 1.0 1.8 4.5 1900 1371 A 31 TYR H A 31 TYR HB3 1.0 1.8 5.5 1901 1372 A 35 CYS H A 36 LEU HA 1.0 1.8 5.5 1902 1372 A 4 HIS HE1 A 36 LEU HA 1.0 1.8 5.5 1903 1373 A 8 CYS H A 7 GLN HGy 1.0 1.8 4.5 1904 1374 A 31 TYR H A 31 TYR HD% 1.0 1.8 4.5 1905 1375 A 31 TYR HD% A 30 PRO HB3 1.0 1.8 5.5 1906 1376 A 31 TYR HD% A 30 PRO HG2 1.0 1.8 5.5 1907 1377 A 31 TYR HE% A 30 PRO HG2 1.0 1.8 5.5 1908 1378 A 26 GLN HE22 A 26 GLN HGx 1.0 1.8 5.5 1909 1379 A 31 TYR HD% A 11 ILE HG13 1.0 1.8 5.5 1910 1380 A 5 TYR HE% A 4 HIS HB2 1.0 1.8 5.5 1911 1380 A 13 TYR HE% A 13 TYR HB3 1.0 1.8 5.5 1912 1381 A 32 TYR H A 32 TYR HDx 1.0 1.8 5.5 1913 1381 A 32 TYR H A 32 TYR HDy 1.0 1.8 5.5 1914 1382 A 32 TYR H A 31 TYR HD% 1.0 1.8 5.5 1915 1383 A 29 ASN H A 29 ASN HA 1.0 1.8 4.5 1916 1384 A 29 ASN HA A 30 PRO HG3 1.0 1.8 5.5 1917 1385 A 29 ASN HA A 30 PRO HG2 1.0 1.8 5.5 1918 1386 A 29 ASN HA A 27 VAL HG1% 1.0 1.8 4.5 1919 1387 A 35 CYS HA A 36 LEU HG 1.0 1.8 4.5 1920 1388 A 30 PRO HD3 A 30 PRO HG2 1.0 1.8 3.5 1921 1389 A 30 PRO HD2 A 30 PRO HB2 1.0 1.8 4.5 1922 1390 A 33 SER HB3 A 27 VAL HG2% 1.0 1.8 5.5 1923 1391 A 16 PRO HB3 A 16 PRO HDx 1.0 1.8 4.5 1924 1392 A 2 GLN HGy A 16 PRO HDx 1.0 1.8 4.5 1925 1393 A 2 GLN HBx A 16 PRO HDx 1.0 1.8 4.5 1926 1393 A 16 PRO HB2 A 16 PRO HDx 1.0 1.8 4.5 1927 1394 A 30 PRO HD2 A 30 PRO HG3 1.0 1.8 3.5 1928 1395 A 30 PRO HD2 A 30 PRO HG2 1.0 1.8 3.5 1929 1396 A 9 GLY HAx A 33 SER HB2 1.0 1.8 3.5 1930 1396 A 10 GLY HAx A 13 TYR HB2 1.0 1.8 3.5 1931 1396 A 10 GLY HAx A 33 SER HB2 1.0 1.8 3.5 1932 1397 A 23 THR HB A 35 CYS HB2 1.0 1.8 4.5 1933 1398 A 23 THR HB A 35 CYS HB3 1.0 1.8 4.5 1934 1399 A 30 PRO HD3 A 29 ASN HB2 1.0 1.8 2.8 1935 1399 A 30 PRO HD3 A 29 ASN HB3 1.0 1.8 2.8 1936 1400 A 30 PRO HD2 A 29 ASN HB2 1.0 1.8 2.8 1937 1400 A 30 PRO HD2 A 29 ASN HB3 1.0 1.8 2.8 1938 1401 A 19 CYS HB3 A 35 CYS HB3 1.0 1.8 4.5 1939 1402 A 19 CYS HB3 A 35 CYS HB2 1.0 1.8 3.5 1940 1403 A 6 GLY HA2 A 2 GLN HGy 1.0 1.8 6.5 1941 1404 A 30 PRO HD3 A 29 ASN HA 1.0 1.8 2.8 1942 1405 A 1 THR HB A 1 THR HA 1.0 1.8 3.5 1943 1406 A 3 SER HA A 3 SER HBx 1.0 1.8 2.8 1944 1407 A 1 THR HB A 1 THR HA 1.0 1.8 3.5 1945 1408 A 24 THR HA A 23 THR HB 1.0 1.8 4.5 1946 1408 A 36 LEU HA A 23 THR HB 1.0 1.8 4.5 1947 1409 A 16 PRO HA A 16 PRO HDx 1.0 1.8 5.5 1948 1410 A 19 CYS HA A 1 THR HA 1.0 1.8 5.5 1949 1411 A 14 SER HA B 1 MAN H2 1.0 1.8 2.8 1950 1411 A 23 THR HA A 23 THR HB 1.0 1.8 2.8 1951 1412 A 8 CYS HA A 17 THR HA 1.0 1.8 3.5 1952 1413 A 9 GLY H A 9 GLY HAx 1.0 1.8 4.5 1953 1414 A 9 GLY HAx A 13 TYR HDx 1.0 1.8 4.5 1954 1414 A 9 GLY HAx A 13 TYR HDy 1.0 1.8 4.5 1955 1415 A 4 HIS HD2 A 23 THR HB 1.0 1.8 5.5 1956 1416 A 33 SER H A 33 SER HB3 1.0 1.8 4.5 1957 1416 A 9 GLY H A 33 SER HB3 1.0 1.8 4.5 1958 1417 A 32 TYR HE% A 5 TYR HA 1.0 1.8 5.5 1959 1417 A 5 TYR HE% A 5 TYR HA 1.0 1.8 5.5 1960 1418 A 31 TYR HD% A 30 PRO HD2 1.0 1.8 5.5 1961 1419 A 2 GLN HE21 A 6 GLY HA3 1.0 1.8 5.5 1962 1419 A 7 GLN H A 6 GLY HA3 1.0 1.8 5.5 1963 1420 A 31 TYR H A 31 TYR HB3 1.0 1.8 5.5 1964 1421 A 11 ILE H A 10 GLY HAx 1.0 1.8 4.5 1965 1422 A 8 CYS H A 9 GLY HAx 1.0 1.8 5.5 1966 1422 A 32 TYR H A 10 GLY HAx 1.0 1.8 5.5 1967 1423 A 7 GLN H A 6 GLY HA2 1.0 1.8 5.5 1968 1424 A 31 TYR H A 31 TYR HA 1.0 1.8 5.5 1969 1425 A 11 ILE H A 10 GLY HAy 1.0 1.8 5.5 1970 1426 A 31 TYR HE% A 12 GLY HA3 1.0 1.8 5.5 1971 1426 A 33 SER H A 10 GLY HAy 1.0 1.8 5.5 1972 1427 A 23 THR H A 21 SER HA 1.0 1.8 5.5 1973 1428 A 30 PRO HD3 A 29 ASN H 1.0 1.8 5.5 1974 1428 A 2 GLN HE21 A 3 SER HBy 1.0 1.8 5.5 1975 1428 A 31 TYR H A 30 PRO HD3 1.0 1.8 5.5 1976 1429 A 3 SER HBy A 2 GLN HE22 1.0 1.8 6.5 1977 1430 A 29 ASN H A 30 PRO HD2 1.0 1.8 5.5 1978 1431 A 12 GLY H A 13 TYR HB3 1.0 1.8 4.5 1979 1431 A 36 LEU H A 35 CYS HB3 1.0 1.8 4.5 1980 1432 A 2 GLN HE21 A 8 CYS HB3 1.0 1.8 5.5 1981 1432 A 10 GLY H A 13 TYR HB2 1.0 1.8 5.5 1982 1433 A 28 LEU H A 32 TYR HB3 1.0 1.8 5.5 1983 1433 A 29 ASN H A 32 TYR HB3 1.0 1.8 5.5 1984 1434 A 29 ASN HD22 A 29 ASN HB2 1.0 1.8 5.5 1985 1434 A 31 TYR HD% A 29 ASN HB2 1.0 1.8 5.5 1986 1434 A 31 TYR HD% A 29 ASN HB3 1.0 1.8 5.5 1987 1434 A 29 ASN HB3 A 29 ASN HD22 1.0 1.8 5.5 1988 1435 B 1 MAN H1 A 14 SER HBx 1.0 1.8 2.8 1989 1435 A 14 SER HA A 14 SER HBx 1.0 1.8 2.8 1990 1435 B 1 MAN H1 B 1 MAN H4 1.0 1.8 2.8 1991 1436 A 23 THR HB A 35 CYS HB3 1.0 1.8 4.5 1992 1437 A 35 CYS HB2 A 2 GLN HGx 1.0 1.8 5.5 1993 1437 A 35 CYS HB2 A 19 CYS HB2 1.0 1.8 5.5 1994 1438 A 30 PRO HG2 A 29 ASN HB2 1.0 1.8 5.5 1995 1438 A 29 ASN HB3 A 30 PRO HG2 1.0 1.8 5.5 1996 1439 A 28 LEU HBy A 29 ASN HB2 1.0 1.8 5.5 1997 1439 A 29 ASN HB3 A 30 PRO HG3 1.0 1.8 5.5 1998 1439 A 29 ASN HB3 A 28 LEU HBy 1.0 1.8 5.5 1999 1439 A 30 PRO HG3 A 29 ASN HB2 1.0 1.8 5.5 2000 1440 A 6 GLY HA3 A 2 GLN HGx 1.0 1.8 4.5 2001 1440 A 2 GLN HGx A 16 PRO HDx 1.0 1.8 4.5 2002 1441 A 19 CYS HB3 A 23 THR HG2% 1.0 1.8 5.5 2003 1442 A 1 THR HA A 2 GLN HBx 1.0 1.8 5.5 2004 1442 A 1 THR HA A 16 PRO HB2 1.0 1.8 5.5 2005 1443 A 26 GLN HGy A 26 GLN HB2 1.0 1.8 4.5 2006 1444 A 26 GLN HGy A 26 GLN HB3 1.0 1.8 3.5 2007 1445 A 7 GLN HGy A 7 GLN HB3 1.0 1.8 4.5 2008 1446 A 16 PRO HB3 A 16 PRO HDx 1.0 1.8 5.5 2009 1447 A 30 PRO HG2 A 29 ASN HB2 1.0 1.8 5.5 2010 1447 A 29 ASN HB3 A 30 PRO HG2 1.0 1.8 5.5 2011 1448 A 35 CYS HB2 A 19 CYS HB2 1.0 1.8 5.5 2012 1449 A 16 PRO HB3 A 16 PRO HDy 1.0 1.8 5.5 2013 1450 A 19 CYS HB3 A 35 CYS HB2 1.0 1.8 4.5 2014 1451 A 8 CYS HB2 A 25 CYS HB2 1.0 1.8 4.5 2015 1452 A 8 CYS H A 7 GLN HGy 1.0 1.8 4.5 2016 1453 A 7 GLN HB2 A 32 TYR HDx 1.0 1.8 5.5 2017 1453 A 7 GLN HB2 A 32 TYR HDy 1.0 1.8 5.5 2018 1454 A 33 SER HA A 28 LEU HBy 1.0 1.8 5.5 2019 1455 A 18 VAL HB A 1 THR HG2% 1.0 1.8 4.5 2020 1456 A 30 PRO HB2 A 30 PRO HG3 1.0 1.8 4.5 2021 1457 A 34 GLN HBy A 36 LEU HG 1.0 1.8 4.5 2022 1458 A 26 GLN HB3 A 36 LEU HG 1.0 1.8 5.5 2023 1459 A 11 ILE HB A 11 ILE HD1% 1.0 1.8 2.8 2024 1460 A 36 LEU HG A 36 LEU HDy% 1.0 1.8 2.8 2025 1460 A 36 LEU HG A 36 LEU HDx% 1.0 1.8 2.8 2026 1461 A 11 ILE HG2% A 11 ILE HB 1.0 1.8 2.8 2027 1462 A 1 THR HG2% A 18 VAL HG1% 1.0 1.8 3.5 2028 1463 A 11 ILE HG12 A 11 ILE HD1% 1.0 1.8 2.8 2029 1464 A 11 ILE HG2% A 11 ILE HD1% 1.0 1.8 2.8 2030 1465 A 34 GLN HBy A 36 LEU HG 1.0 1.8 4.5 2031 1466 A 36 LEU HG A 34 GLN HGx 1.0 1.8 4.5 2032 1466 A 34 GLN HGy A 36 LEU HG 1.0 1.8 4.5 2033 1467 A 30 PRO HG2 A 30 PRO HB2 1.0 1.8 3.5 2034 1468 A 30 PRO HB2 A 30 PRO HG3 1.0 1.8 4.5 2035 1469 A 36 LEU HG A 36 LEU HB2 1.0 1.8 2.8 2036 1469 A 36 LEU HB3 A 36 LEU HG 1.0 1.8 2.8 2037 1470 A 36 LEU HG A 36 LEU HB2 1.0 1.8 2.8 2038 1470 A 36 LEU HB3 A 36 LEU HG 1.0 1.8 2.8 2039 1471 A 7 GLN HGy A 7 GLN HB3 1.0 1.8 3.5 2040 1472 A 26 GLN HGy A 36 LEU HB2 1.0 1.8 4.5 2041 1472 A 26 GLN HGy A 36 LEU HB3 1.0 1.8 4.5 2042 1473 A 11 ILE HG2% A 11 ILE HB 1.0 1.8 2.8 2043 1474 A 36 LEU HG A 36 LEU HDy% 1.0 1.8 2.8 2044 1475 A 36 LEU HDx% A 36 LEU HB2 1.0 1.8 2.8 2045 1475 A 36 LEU HB3 A 36 LEU HDx% 1.0 1.8 2.8 2046 1476 A 28 LEU HBx A 28 LEU HDx% 1.0 1.8 3.5 2047 1476 A 28 LEU HG A 28 LEU HDx% 1.0 1.8 3.5 2048 1477 A 28 LEU HBy A 28 LEU HDx% 1.0 1.8 3.5 2049 1477 A 34 GLN HBy A 28 LEU HDx% 1.0 1.8 3.5 2050 1478 A 28 LEU HG A 28 LEU HDy% 1.0 1.8 3.5 2051 1478 A 28 LEU HBx A 28 LEU HDy% 1.0 1.8 3.5 2052 1479 A 11 ILE HA A 11 ILE HG12 1.0 1.8 3.5 2053 1480 A 11 ILE HA A 11 ILE HB 1.0 1.8 4.5 2054 1481 A 9 GLY HAx A 17 THR HG2% 1.0 1.8 4.5 2055 1482 A 31 TYR HA A 11 ILE HB 1.0 1.8 4.5 2056 1483 A 9 GLY HAy A 7 GLN HGx 1.0 1.8 4.5 2057 1483 A 7 GLN HA A 7 GLN HGx 1.0 1.8 4.5 2058 1484 A 28 LEU HA A 28 LEU HDx% 1.0 1.8 5.5 2059 1485 A 31 TYR HA A 11 ILE HG2% 1.0 1.8 4.5 2060 1486 A 36 LEU HA A 36 LEU HDx% 1.0 1.8 4.5 2061 1487 A 36 LEU HA A 36 LEU HG 1.0 1.8 4.5 2062 1488 A 26 GLN HA A 27 VAL HG2% 1.0 1.8 4.5 2063 1489 A 3 SER HA A 1 THR HG2% 1.0 1.8 4.5 2064 1489 A 31 TYR HA A 30 PRO HB2 1.0 1.8 4.5 2065 1490 A 28 LEU HDy% A 32 TYR HDx 1.0 1.8 4.5 2066 1490 A 28 LEU HDy% A 32 TYR HDy 1.0 1.8 4.5 2067 1491 A 9 GLY H A 7 GLN HGx 1.0 1.8 3.5 2068 1492 A 12 GLY H A 11 ILE HG12 1.0 1.8 5.5 2069 1492 A 36 LEU H A 36 LEU HDy% 1.0 1.8 5.5 2070 1493 A 28 LEU H A 28 LEU HDx% 1.0 1.8 5.5 2071 1494 A 34 GLN H A 28 LEU HDx% 1.0 1.8 5.5 2072 1495 A 24 THR H A 24 THR HG2% 1.0 1.8 5.5 2073 1496 A 8 CYS H A 7 GLN HGx 1.0 1.8 5.5 2074 1497 A 11 ILE H A 11 ILE HB 1.0 1.8 5.5 2075 1498 A 11 ILE H A 11 ILE HG13 1.0 1.8 5.5 2076 1499 A 35 CYS H A 34 GLN HBx 1.0 1.8 5.5 2077 1500 A 17 THR HG2% A 13 TYR HDx 1.0 1.8 5.5 2078 1500 A 17 THR HG2% A 13 TYR HDy 1.0 1.8 5.5 2079 1501 A 32 TYR HE% A 28 LEU HDy% 1.0 1.8 5.5 2080 1502 A 33 SER HA A 28 LEU HDy% 1.0 1.8 5.5 2081 1502 A 33 SER HA A 27 VAL HG2% 1.0 1.8 5.5 2082 1503 A 33 SER HA A 28 LEU HDx% 1.0 1.8 5.5 2083 1504 A 8 CYS HA A 17 THR HG2% 1.0 1.8 5.5 2084 1505 A 27 VAL HA A 28 LEU HBx 1.0 1.8 5.5 2085 1505 A 27 VAL HA A 28 LEU HG 1.0 1.8 5.5 2086 1506 A 32 TYR HB2 A 28 LEU HDy% 1.0 1.8 5.5 2087 1506 A 33 SER HB2 A 27 VAL HG2% 1.0 1.8 5.5 2088 1507 A 13 TYR HB2 A 7 GLN HGx 1.0 1.8 5.5 2089 1508 A 35 CYS HB2 A 23 THR HG2% 1.0 1.8 4.5 2090 1508 A 4 HIS HB3 A 23 THR HG2% 1.0 1.8 4.5 2091 1509 A 11 ILE HD1% A 30 PRO HA 1.0 1.8 5.5 2092 1510 A 22 GLY HA3 A 23 THR HG2% 1.0 1.8 5.5 2093 1511 A 31 TYR HA A 11 ILE HD1% 1.0 1.8 5.5 2094 1512 A 23 THR H A 23 THR HG2% 1.0 1.8 5.5 2095 1513 A 27 VAL HG1% A 11 ILE HD1% 1.0 1.8 5.5 2096 1514 A 15 GLY HA3 A 16 PRO HGx 1.0 1.8 4.5 2097 1514 A 15 GLY HA3 A 16 PRO HGy 1.0 1.8 4.5 2098 1515 A 3 SER HBy A 2 GLN HGx 1.0 1.8 5.5 2099 1515 A 30 PRO HD3 A 30 PRO HB3 1.0 1.8 5.5 2100 1516 A 32 TYR HB2 A 32 TYR HDx 1.0 1.8 2.8 2101 1516 A 32 TYR HB2 A 32 TYR HDy 1.0 1.8 2.8 2102 1517 A 9 GLY H A 7 GLN HGy 1.0 1.8 4.5 2103 1518 A 27 VAL H A 27 VAL HG1% 1.0 1.8 4.5 2104 1518 A 28 LEU H A 27 VAL HG1% 1.0 1.8 4.5 2105 1519 A 34 GLN H A 28 LEU HBy 1.0 1.8 3.5 2106 1519 A 26 GLN H A 26 GLN HB2 1.0 1.8 3.5 2107 1520 A 30 PRO HD2 A 30 PRO HB2 1.0 1.8 4.5 2108 1521 A 33 SER HB3 A 27 VAL HG2% 1.0 1.8 5.5 2109 1522 A 32 TYR HB2 A 28 LEU HBx 1.0 1.8 5.5 2110 1522 A 8 CYS HB3 A 2 GLN HBx 1.0 1.8 5.5 2111 1523 A 20 ALA HB% A 21 SER HB2 1.0 1.8 4.5 2112 1523 A 21 SER HB3 A 20 ALA HB% 1.0 1.8 4.5 2113 1524 A 3 SER HA A 3 SER HBy 1.0 1.8 3.5 2114 1525 A 19 CYS HA A 19 CYS HB3 1.0 1.8 3.5 2115 1526 A 36 LEU HG A 36 LEU HDx% 1.0 1.8 2.8 2116 1527 A 7 GLN HB2 A 7 GLN HGx 1.0 1.8 4.5 2117 1528 A 13 TYR HE% A 7 GLN HB3 1.0 1.8 5.5 2118 1529 A 5 TYR HE% A 34 GLN HGx 1.0 1.8 5.5 2119 1529 A 13 TYR HE% A 16 PRO HGy 1.0 1.8 5.5 2120 1529 A 5 TYR HE% A 34 GLN HGy 1.0 1.8 5.5 2121 1529 A 13 TYR HE% A 7 GLN HB2 1.0 1.8 5.5 2122 1530 A 13 TYR HE% A 16 PRO HA 1.0 1.8 5.5 2123 1531 A 13 TYR HE% A 7 GLN HA 1.0 1.8 6.5 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 1 THR C A 2 GLN N A 2 GLN CA A 2 GLN C 1.0 -144.2 -67.0 PHI 2 2 A 2 GLN N A 2 GLN CA A 2 GLN C A 3 SER N 1.0 108.6 170.6 PSI 3 3 A 2 GLN C A 3 SER N A 3 SER CA A 3 SER C 1.0 -93.8 -53.8 PHI 4 4 A 3 SER N A 3 SER CA A 3 SER C A 4 HIS N 1.0 113.0 176.2 PSI 5 5 A 4 HIS C A 5 TYR N A 5 TYR CA A 5 TYR C 1.0 40.5 80.5 PHI 6 6 A 5 TYR N A 5 TYR CA A 5 TYR C A 6 GLY N 1.0 7.8 58.4 PSI 7 7 A 9 GLY C A 10 GLY N A 10 GLY CA A 10 GLY C 1.0 -109.9 -55.3 PHI 8 8 A 10 GLY N A 10 GLY CA A 10 GLY C A 11 ILE N 1.0 132.0 207.0 PSI 9 9 A 10 GLY C A 11 ILE N A 11 ILE CA A 11 ILE C 1.0 -78.7 -38.7 PHI 10 10 A 11 ILE N A 11 ILE CA A 11 ILE C A 12 GLY N 1.0 113.6 153.6 PSI 11 11 A 11 ILE C A 12 GLY N A 12 GLY CA A 12 GLY C 1.0 68.7 110.9 PHI 12 12 A 12 GLY N A 12 GLY CA A 12 GLY C A 13 TYR N 1.0 -26.2 22.0 PSI 13 13 A 12 GLY C A 13 TYR N A 13 TYR CA A 13 TYR C 1.0 -127.0 -43.0 PHI 14 14 A 13 TYR N A 13 TYR CA A 13 TYR C A 14 SER N 1.0 115.6 161.8 PSI 15 15 A 16 PRO C A 17 THR N A 17 THR CA A 17 THR C 1.0 -138.1 -60.5 PHI 16 16 A 17 THR N A 17 THR CA A 17 THR C A 18 VAL N 1.0 -31.5 32.3 PSI 17 17 A 17 THR C A 18 VAL N A 18 VAL CA A 18 VAL C 1.0 -109.7 -56.1 PHI 18 18 A 18 VAL N A 18 VAL CA A 18 VAL C A 19 CYS N 1.0 110.2 150.2 PSI 19 19 A 18 VAL C A 19 CYS N A 19 CYS CA A 19 CYS C 1.0 -89.8 -49.8 PHI 20 20 A 19 CYS N A 19 CYS CA A 19 CYS C A 20 ALA N 1.0 112.6 167.2 PSI 21 21 A 20 ALA C A 21 SER N A 21 SER CA A 21 SER C 1.0 -77.5 -37.5 PHI 22 22 A 21 SER N A 21 SER CA A 21 SER C A 22 GLY N 1.0 112.6 152.6 PSI 23 23 A 21 SER C A 22 GLY N A 22 GLY CA A 22 GLY C 1.0 70.1 110.1 PHI 24 24 A 22 GLY N A 22 GLY CA A 22 GLY C A 23 THR N 1.0 -19.9 20.1 PSI 25 25 A 22 GLY C A 23 THR N A 23 THR CA A 23 THR C 1.0 -150.3 -110.3 PHI 26 26 A 23 THR N A 23 THR CA A 23 THR C A 24 THR N 1.0 136.9 176.9 PSI 27 27 A 23 THR C A 24 THR N A 24 THR CA A 24 THR C 1.0 -157.4 -100.4 PHI 28 28 A 24 THR N A 24 THR CA A 24 THR C A 25 CYS N 1.0 127.9 168.1 PSI 29 29 A 24 THR C A 25 CYS N A 25 CYS CA A 25 CYS C 1.0 -91.1 -51.1 PHI 30 30 A 25 CYS N A 25 CYS CA A 25 CYS C A 26 GLN N 1.0 98.2 164.4 PSI 31 31 A 25 CYS C A 26 GLN N A 26 GLN CA A 26 GLN C 1.0 -130.3 -51.1 PHI 32 32 A 26 GLN N A 26 GLN CA A 26 GLN C A 27 VAL N 1.0 110.2 162.8 PSI 33 33 A 26 GLN C A 27 VAL N A 27 VAL CA A 27 VAL C 1.0 -105.0 -49.2 PHI 34 34 A 27 VAL N A 27 VAL CA A 27 VAL C A 28 LEU N 1.0 94.3 167.1 PSI 35 35 A 29 ASN C A 30 PRO N A 30 PRO CA A 30 PRO C 1.0 -80.9 -40.9 PHI 36 36 A 30 PRO N A 30 PRO CA A 30 PRO C A 31 TYR N 1.0 -43.2 -3.2 PSI 37 37 A 30 PRO C A 31 TYR N A 31 TYR CA A 31 TYR C 1.0 -116.7 -76.7 PHI 38 38 A 31 TYR N A 31 TYR CA A 31 TYR C A 32 TYR N 1.0 -23.4 16.6 PSI 39 39 A 31 TYR C A 32 TYR N A 32 TYR CA A 32 TYR C 1.0 -90.7 -48.1 PHI 40 40 A 32 TYR N A 32 TYR CA A 32 TYR C A 33 SER N 1.0 116.0 156.0 PSI 41 41 A 32 TYR C A 33 SER N A 33 SER CA A 33 SER C 1.0 -143.9 -88.3 PHI 42 42 A 33 SER N A 33 SER CA A 33 SER C A 34 GLN N 1.0 112.0 157.0 PSI 43 43 A 33 SER C A 34 GLN N A 34 GLN CA A 34 GLN C 1.0 -153.5 -113.5 PHI 44 44 A 34 GLN N A 34 GLN CA A 34 GLN C A 35 CYS N 1.0 117.8 167.2 PSI 45 45 A 34 GLN C A 35 CYS N A 35 CYS CA A 35 CYS C 1.0 -105.4 -61.0 PHI 46 46 A 35 CYS N A 35 CYS CA A 35 CYS C A 36 LEU N 1.0 104.3 155.9 PSI 47 47 A 4 HIS N A 4 HIS CA A 4 HIS CB A 4 HIS CG 1.0 150.0 210.0 CHI1 48 48 A 7 GLN N A 7 GLN CA A 7 GLN CB A 7 GLN CG 1.0 150.0 210.0 CHI1 49 49 A 8 CYS N A 8 CYS CA A 8 CYS CB A 8 CYS SG 1.0 30.0 90.0 CHI1 50 50 A 11 ILE N A 11 ILE CA A 11 ILE CB A 11 ILE CG1 1.0 -90.0 -30.0 CHI1 51 51 A 11 ILE CA A 11 ILE CB A 11 ILE CG1 A 11 ILE CD1 1.0 150.0 210.0 CHI2 52 52 A 13 TYR N A 13 TYR CA A 13 TYR CB A 13 TYR CG 1.0 150.0 210.0 CHI1 53 53 A 17 THR N A 17 THR CA A 17 THR CB A 17 THR OG1 1.0 30.0 90.0 CHI1 54 54 A 18 VAL N A 18 VAL CA A 18 VAL CB A 18 VAL CG1 1.0 150.0 210.0 CHI1 55 55 A 19 CYS N A 19 CYS CA A 19 CYS CB A 19 CYS SG 1.0 -90.0 -30.0 CHI1 56 56 A 23 THR N A 23 THR CA A 23 THR CB A 23 THR OG1 1.0 30.0 90.0 CHI1 57 57 A 24 THR N A 24 THR CA A 24 THR CB A 24 THR OG1 1.0 30.0 90.0 CHI1 58 58 A 25 CYS N A 25 CYS CA A 25 CYS CB A 25 CYS SG 1.0 150.0 210.0 CHI1 59 59 A 26 GLN N A 26 GLN CA A 26 GLN CB A 26 GLN CG 1.0 -90.0 -30.0 CHI1 60 60 A 27 VAL N A 27 VAL CA A 27 VAL CB A 27 VAL CG1 1.0 150.0 210.0 CHI1 61 61 A 31 TYR N A 31 TYR CA A 31 TYR CB A 31 TYR CG 1.0 -90.0 -30.0 CHI1 62 62 A 32 TYR N A 32 TYR CA A 32 TYR CB A 32 TYR CG 1.0 150.0 210.0 CHI1 63 63 A 33 SER N A 33 SER CA A 33 SER CB A 33 SER OG 1.0 -90.0 -30.0 CHI1 64 64 A 35 CYS N A 35 CYS CA A 35 CYS CB A 35 CYS SG 1.0 -90.0 -30.0 CHI1 stop_ save_