data_nef_c16857_2kb9 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2VJ2 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 2 CYS SG 1 11 CYS SG 1 14 CYS SG 1 25 CYS SG 1 20 CYS SG 1 31 CYS SG 1 33 CYS SG 1 42 CYS SG stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 ARG start . . 2 A 2 CYS middle -HG . 3 A 3 GLN middle . . 4 A 4 TYR middle . . 5 A 5 GLY middle . false 6 A 6 TRP middle . . 7 A 7 GLN middle . . 8 A 8 GLY middle . false 9 A 9 LEU middle . . 10 A 10 TYR middle . . 11 A 11 CYS middle -HG . 12 A 12 ASP middle . . 13 A 13 LYS middle . . 14 A 14 CYS middle -HG . 15 A 15 ILE middle . . 16 A 16 PRO middle . false 17 A 17 HIS middle . . 18 A 18 PRO middle . false 19 A 19 GLY middle . false 20 A 20 CYS middle -HG . 21 A 21 VAL middle . . 22 A 22 HIS middle . . 23 A 23 GLY middle . false 24 A 24 ILE middle . . 25 A 25 CYS middle -HG . 26 A 26 ASN middle . . 27 A 27 GLU middle . . 28 A 28 PRO middle . false 29 A 29 TRP middle . . 30 A 30 GLN middle . . 31 A 31 CYS middle -HG . 32 A 32 LEU middle . . 33 A 33 CYS middle -HG . 34 A 34 GLU middle . . 35 A 35 THR middle . . 36 A 36 ASN middle . . 37 A 37 TRP middle . . 38 A 38 GLY middle . false 39 A 39 GLY middle . false 40 A 40 GLN middle . . 41 A 41 LEU middle . . 42 A 42 CYS middle -HG . 43 A 43 ASP middle . . 44 A 44 LYS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 ARG HA H 1 4.090 0.000 A 1 ARG HBx H 1 1.920 0.000 A 1 ARG HBy H 1 1.920 0.000 A 1 ARG HDx H 1 3.240 0.000 A 1 ARG HDy H 1 3.240 0.000 A 1 ARG HGx H 1 1.670 0.000 A 1 ARG HGy H 1 1.740 0.000 A 2 CYS H H 1 8.370 0.000 A 2 CYS HA H 1 4.650 0.000 A 2 CYS HBx H 1 2.670 0.000 A 2 CYS HBy H 1 2.720 0.000 A 3 GLN H H 1 7.820 0.000 A 3 GLN HA H 1 4.160 0.000 A 3 GLN HBx H 1 1.350 0.000 A 3 GLN HBy H 1 1.350 0.000 A 3 GLN HGx H 1 1.680 0.000 A 3 GLN HGy H 1 1.810 0.000 A 4 TYR H H 1 8.600 0.000 A 4 TYR HA H 1 4.630 0.000 A 4 TYR HBx H 1 3.020 0.000 A 4 TYR HBy H 1 3.320 0.000 A 4 TYR HDx H 1 7.380 0.000 A 4 TYR HDy H 1 7.380 0.000 A 4 TYR HEx H 1 6.870 0.000 A 4 TYR HEy H 1 6.870 0.000 A 5 GLY H H 1 8.600 0.000 A 5 GLY HAx H 1 2.310 0.000 A 5 GLY HAy H 1 3.620 0.000 A 6 TRP H H 1 7.880 0.000 A 6 TRP HA H 1 4.930 0.000 A 6 TRP HBx H 1 2.980 0.000 A 6 TRP HBy H 1 2.980 0.000 A 6 TRP HD1 H 1 6.740 0.000 A 6 TRP HE1 H 1 10.120 0.000 A 6 TRP HE3 H 1 7.090 0.000 A 6 TRP HH2 H 1 7.210 0.000 A 6 TRP HZ2 H 1 7.460 0.000 A 6 TRP HZ3 H 1 6.860 0.000 A 7 GLN H H 1 9.610 0.000 A 7 GLN HA H 1 5.000 0.000 A 7 GLN HBx H 1 1.750 0.000 A 7 GLN HBy H 1 1.750 0.000 A 7 GLN HE2y H 1 7.130 0.000 A 7 GLN HE2x H 1 6.780 0.000 A 7 GLN HGx H 1 2.130 0.000 A 7 GLN HGy H 1 2.220 0.000 A 8 GLY H H 1 8.150 0.000 A 8 GLY HAx H 1 3.770 0.000 A 8 GLY HAy H 1 4.850 0.000 A 9 LEU H H 1 8.460 0.000 A 9 LEU HA H 1 3.860 0.000 A 9 LEU HBx H 1 1.090 0.000 A 9 LEU HBy H 1 1.330 0.000 A 9 LEU HDx% H 1 0.700 0.000 A 9 LEU HDy% H 1 0.770 0.000 A 9 LEU HG H 1 0.980 0.000 A 10 TYR H H 1 8.720 0.000 A 10 TYR HA H 1 4.770 0.000 A 10 TYR HBx H 1 2.560 0.000 A 10 TYR HBy H 1 3.340 0.000 A 10 TYR HDx H 1 7.130 0.000 A 10 TYR HDy H 1 7.130 0.000 A 10 TYR HEx H 1 6.780 0.000 A 10 TYR HEy H 1 6.780 0.000 A 11 CYS H H 1 7.970 0.000 A 11 CYS HA H 1 4.140 0.000 A 11 CYS HBx H 1 2.870 0.000 A 11 CYS HBy H 1 3.280 0.000 A 12 ASP H H 1 8.460 0.000 A 12 ASP HA H 1 4.530 0.000 A 12 ASP HBx H 1 2.300 0.000 A 12 ASP HBy H 1 2.940 0.000 A 13 LYS H H 1 8.620 0.000 A 13 LYS HA H 1 5.080 0.000 A 13 LYS HBx H 1 1.750 0.000 A 13 LYS HBy H 1 1.750 0.000 A 13 LYS HDx H 1 1.710 0.000 A 13 LYS HDy H 1 1.710 0.000 A 13 LYS HEx H 1 3.100 0.000 A 13 LYS HEy H 1 3.100 0.000 A 13 LYS HGx H 1 1.580 0.000 A 13 LYS HGy H 1 1.580 0.000 A 14 CYS H H 1 8.440 0.000 A 14 CYS HA H 1 3.510 0.000 A 14 CYS HBy H 1 1.940 0.000 A 14 CYS HBx H 1 1.780 0.000 A 15 ILE H H 1 7.210 0.000 A 15 ILE HA H 1 4.040 0.000 A 15 ILE HB H 1 0.430 0.000 A 15 ILE HD1% H 1 0.480 0.000 A 15 ILE HG1x H 1 0.860 0.000 A 15 ILE HG1y H 1 0.860 0.000 A 15 ILE HG2% H 1 1.350 0.000 A 16 PRO HA H 1 4.390 0.000 A 16 PRO HBx H 1 1.980 0.000 A 16 PRO HBy H 1 1.980 0.000 A 16 PRO HDx H 1 3.550 0.000 A 16 PRO HDy H 1 3.700 0.000 A 16 PRO HGx H 1 1.760 0.000 A 16 PRO HGy H 1 1.890 0.000 A 17 HIS H H 1 8.990 0.000 A 17 HIS HA H 1 4.990 0.000 A 17 HIS HBx H 1 2.720 0.000 A 17 HIS HBy H 1 3.240 0.000 A 17 HIS HD2 H 1 7.470 0.000 A 17 HIS HE1 H 1 8.440 0.000 A 18 PRO HA H 1 4.410 0.000 A 18 PRO HBx H 1 2.250 0.000 A 18 PRO HBy H 1 2.250 0.000 A 18 PRO HDx H 1 3.600 0.000 A 18 PRO HDy H 1 3.600 0.000 A 18 PRO HGx H 1 1.810 0.000 A 18 PRO HGy H 1 1.890 0.000 A 19 GLY H H 1 9.170 0.000 A 19 GLY HAx H 1 3.610 0.000 A 19 GLY HAy H 1 4.180 0.000 A 20 CYS H H 1 8.010 0.000 A 20 CYS HA H 1 4.120 0.000 A 20 CYS HBx H 1 2.780 0.000 A 20 CYS HBy H 1 3.260 0.000 A 21 VAL H H 1 8.770 0.000 A 21 VAL HA H 1 3.960 0.000 A 21 VAL HB H 1 1.550 0.000 A 21 VAL HGx% H 1 0.100 0.000 A 21 VAL HGy% H 1 0.930 0.000 A 22 HIS H H 1 7.670 0.000 A 22 HIS HA H 1 4.580 0.000 A 22 HIS HBy H 1 2.680 0.000 A 22 HIS HBx H 1 2.440 0.000 A 22 HIS HD2 H 1 5.390 0.000 A 22 HIS HE1 H 1 8.250 0.000 A 23 GLY H H 1 7.210 0.000 A 23 GLY HAx H 1 3.460 0.000 A 23 GLY HAy H 1 4.960 0.000 A 24 ILE H H 1 8.270 0.000 A 24 ILE HA H 1 4.750 0.000 A 24 ILE HB H 1 2.100 0.000 A 24 ILE HD1% H 1 0.790 0.000 A 24 ILE HG1x H 1 1.120 0.000 A 24 ILE HG1y H 1 1.120 0.000 A 24 ILE HG2% H 1 0.880 0.000 A 25 CYS H H 1 8.530 0.000 A 25 CYS HA H 1 4.930 0.000 A 25 CYS HBy H 1 4.130 0.000 A 25 CYS HBx H 1 2.570 0.000 A 26 ASN H H 1 8.590 0.000 A 26 ASN HA H 1 4.860 0.000 A 26 ASN HBx H 1 2.910 0.000 A 26 ASN HBy H 1 2.910 0.000 A 26 ASN HD2y H 1 7.740 0.000 A 26 ASN HD2x H 1 6.940 0.000 A 27 GLU H H 1 7.980 0.000 A 27 GLU HA H 1 4.460 0.000 A 27 GLU HBx H 1 2.180 0.000 A 27 GLU HBy H 1 2.180 0.000 A 27 GLU HGx H 1 1.490 0.000 A 27 GLU HGy H 1 2.320 0.000 A 28 PRO HA H 1 3.170 0.000 A 28 PRO HBy H 1 1.080 0.000 A 28 PRO HBx H 1 0.790 0.000 A 28 PRO HDy H 1 3.380 0.000 A 28 PRO HDx H 1 2.940 0.000 A 28 PRO HGx H 1 1.350 0.000 A 28 PRO HGy H 1 1.350 0.000 A 29 TRP H H 1 9.040 0.000 A 29 TRP HA H 1 4.220 0.000 A 29 TRP HBx H 1 3.400 0.000 A 29 TRP HBy H 1 3.520 0.000 A 29 TRP HD1 H 1 6.940 0.000 A 29 TRP HE1 H 1 9.360 0.000 A 29 TRP HE3 H 1 7.120 0.000 A 29 TRP HH2 H 1 6.790 0.000 A 29 TRP HZ2 H 1 5.870 0.000 A 29 TRP HZ3 H 1 6.840 0.000 A 30 GLN H H 1 7.160 0.000 A 30 GLN HA H 1 4.470 0.000 A 30 GLN HBx H 1 2.090 0.000 A 30 GLN HBy H 1 2.210 0.000 A 30 GLN HE2x H 1 7.420 0.000 A 30 GLN HE2y H 1 7.420 0.000 A 30 GLN HGx H 1 2.420 0.000 A 30 GLN HGy H 1 2.480 0.000 A 31 CYS H H 1 9.100 0.000 A 31 CYS HA H 1 4.530 0.000 A 31 CYS HBx H 1 2.530 0.000 A 31 CYS HBy H 1 3.230 0.000 A 32 LEU H H 1 9.660 0.000 A 32 LEU HA H 1 4.680 0.000 A 32 LEU HBy H 1 1.750 0.000 A 32 LEU HBx H 1 1.400 0.000 A 32 LEU HDx% H 1 0.820 0.000 A 32 LEU HDy% H 1 0.850 0.000 A 32 LEU HG H 1 1.630 0.000 A 33 CYS H H 1 8.640 0.000 A 33 CYS HA H 1 4.970 0.000 A 33 CYS HBx H 1 2.740 0.000 A 33 CYS HBy H 1 3.450 0.000 A 34 GLU H H 1 8.610 0.000 A 34 GLU HA H 1 4.430 0.000 A 34 GLU HBx H 1 2.030 0.000 A 34 GLU HBy H 1 2.280 0.000 A 34 GLU HGx H 1 2.370 0.000 A 34 GLU HGy H 1 2.460 0.000 A 35 THR H H 1 8.340 0.000 A 35 THR HA H 1 3.850 0.000 A 35 THR HB H 1 3.990 0.000 A 35 THR HG2% H 1 1.260 0.000 A 36 ASN H H 1 8.690 0.000 A 36 ASN HA H 1 4.260 0.000 A 36 ASN HBx H 1 2.600 0.000 A 36 ASN HBy H 1 2.830 0.000 A 36 ASN HD2y H 1 7.340 0.000 A 36 ASN HD2x H 1 6.740 0.000 A 37 TRP H H 1 8.060 0.000 A 37 TRP HA H 1 4.840 0.000 A 37 TRP HBy H 1 3.180 0.000 A 37 TRP HBx H 1 3.080 0.000 A 37 TRP HD1 H 1 6.920 0.000 A 37 TRP HE1 H 1 9.640 0.000 A 37 TRP HE3 H 1 7.630 0.000 A 37 TRP HH2 H 1 7.090 0.000 A 37 TRP HZ2 H 1 7.000 0.000 A 37 TRP HZ3 H 1 6.920 0.000 A 38 GLY H H 1 9.270 0.000 A 38 GLY HAx H 1 3.890 0.000 A 38 GLY HAy H 1 4.890 0.000 A 39 GLY H H 1 8.060 0.000 A 39 GLY HAx H 1 3.840 0.000 A 39 GLY HAy H 1 4.770 0.000 A 40 GLN H H 1 8.670 0.000 A 40 GLN HA H 1 3.990 0.000 A 40 GLN HBx H 1 1.940 0.000 A 40 GLN HBy H 1 2.010 0.000 A 40 GLN HE2y H 1 7.550 0.000 A 40 GLN HE2x H 1 6.870 0.000 A 40 GLN HGx H 1 2.230 0.000 A 40 GLN HGy H 1 2.380 0.000 A 41 LEU H H 1 8.770 0.000 A 41 LEU HA H 1 4.690 0.000 A 41 LEU HBx H 1 1.430 0.000 A 41 LEU HBy H 1 1.890 0.000 A 41 LEU HDx% H 1 0.820 0.000 A 41 LEU HDy% H 1 0.450 0.000 A 41 LEU HG H 1 1.350 0.000 A 42 CYS H H 1 7.870 0.000 A 42 CYS HA H 1 4.400 0.000 A 42 CYS HBx H 1 2.450 0.000 A 42 CYS HBy H 1 2.790 0.000 A 43 ASP H H 1 8.740 0.000 A 43 ASP HA H 1 4.700 0.000 A 43 ASP HBx H 1 2.220 0.000 A 43 ASP HBy H 1 2.980 0.000 A 44 LYS H H 1 8.730 0.000 A 44 LYS HA H 1 4.700 0.000 A 44 LYS HBx H 1 1.840 0.000 A 44 LYS HBy H 1 1.840 0.000 A 44 LYS HDx H 1 1.450 0.000 A 44 LYS HDy H 1 1.580 0.000 A 44 LYS HEx H 1 3.070 0.000 A 44 LYS HEy H 1 3.070 0.000 A 44 LYS HGx H 1 1.690 0.000 A 44 LYS HGy H 1 1.690 0.000 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 4 TYR HA A 5 GLY H 1.0 . 3.49 2 2 A 25 CYS HBy A 27 GLU H 1.0 . 3.76 3 3 A 35 THR H A 35 THR HA 1.0 . 2.94 4 4 A 35 THR HB A 36 ASN H 1.0 . 3.40 5 5 A 43 ASP HA A 44 LYS H 1.0 . 3.49 6 6 A 42 CYS H A 42 CYS HA 1.0 . 2.83 7 7 A 32 LEU H A 32 LEU HBy 1.0 . 3.82 8 8 A 31 CYS H A 31 CYS HBy 1.0 . 4.17 9 9 A 31 CYS H A 31 CYS HBx 1.0 . 4.17 10 10 A 14 CYS HA A 29 TRP H 1.0 . 5.43 11 11 A 21 VAL H A 41 LEU HBy 1.0 . 4.13 12 12 A 21 VAL H A 21 VAL HB 1.0 . 3.41 13 13 A 41 LEU H A 41 LEU HBx 1.0 . 3.32 14 14 A 41 LEU H A 41 LEU HG 1.0 . 3.33 15 15 A 21 VAL H A 21 VAL HGy% 1.0 . 3.27 16 16 A 41 LEU H A 41 LEU HDx% 1.0 . 3.85 17 17 A 41 LEU H A 41 LEU HDy% 1.0 . 3.71 18 18 A 21 VAL H A 21 VAL HGx% 1.0 . 4.18 19 19 A 44 LYS H A 44 LYS HBx 1.0 . 3.89 20 19 A 44 LYS H A 44 LYS HBy 1.0 . 3.89 21 20 A 44 LYS H A 44 LYS HGx 1.0 . 3.49 22 20 A 44 LYS H A 44 LYS HGy 1.0 . 3.49 23 21 A 44 LYS H A 44 LYS HDy 1.0 . 4.15 24 22 A 44 LYS H A 44 LYS HDx 1.0 . 4.15 25 23 A 40 GLN H A 40 GLN HGy 1.0 . 4.62 26 24 A 40 GLN H A 40 GLN HGx 1.0 . 4.62 27 25 A 40 GLN H A 40 GLN HBy 1.0 . 3.54 28 26 A 40 GLN H A 40 GLN HBx 1.0 . 3.54 29 27 A 4 TYR H A 4 TYR HBx 1.0 . 3.82 30 28 A 13 LYS H A 13 LYS HBx 1.0 . 3.23 31 28 A 13 LYS H A 13 LYS HBy 1.0 . 3.23 32 29 A 13 LYS H A 13 LYS HGx 1.0 . 3.94 33 29 A 13 LYS H A 13 LYS HGy 1.0 . 3.94 34 30 A 34 GLU H A 34 GLU HGy 1.0 . 4.68 35 31 A 34 GLU H A 34 GLU HBx 1.0 . 3.50 36 32 A 26 ASN H A 26 ASN HBx 1.0 . 3.27 37 32 A 26 ASN H A 26 ASN HBy 1.0 . 3.27 38 33 A 34 GLU H A 34 GLU HBy 1.0 . 3.50 39 34 A 9 LEU H A 9 LEU HBx 1.0 . 3.37 40 35 A 14 CYS H A 14 CYS HBy 1.0 . 3.86 41 36 A 35 THR H A 35 THR HB 1.0 . 3.05 42 37 A 35 THR H A 35 THR HG2% 1.0 . 3.86 43 38 A 24 ILE H A 24 ILE HB 1.0 . 4.18 44 39 A 24 ILE H A 24 ILE HG2% 1.0 . 3.62 45 40 A 37 TRP H A 37 TRP HBy 1.0 . 3.13 46 41 A 37 TRP H A 37 TRP HBx 1.0 . 3.81 47 42 A 20 CYS H A 20 CYS HBx 1.0 . 3.68 48 43 A 27 GLU H A 27 GLU HGy 1.0 . 4.47 49 44 A 27 GLU H A 27 GLU HBx 1.0 . 4.07 50 44 A 27 GLU H A 27 GLU HBy 1.0 . 4.07 51 45 A 27 GLU H A 27 GLU HGx 1.0 . 4.84 52 46 A 20 CYS H A 20 CYS HBy 1.0 . 3.68 53 47 A 27 GLU H A 26 ASN HBx 1.0 . 4.28 54 47 A 27 GLU H A 26 ASN HBy 1.0 . 4.28 55 48 A 6 TRP H A 6 TRP HBx 1.0 . 3.57 56 48 A 6 TRP H A 6 TRP HBy 1.0 . 3.57 57 49 A 22 HIS H A 22 HIS HBy 1.0 . 3.67 58 50 A 30 GLN H A 30 GLN HGx 1.0 . 4.58 59 51 A 30 GLN H A 30 GLN HBy 1.0 . 4.03 60 52 A 15 ILE H A 15 ILE HG1x 1.0 . 3.45 61 52 A 15 ILE H A 15 ILE HG1y 1.0 . 3.45 62 53 A 15 ILE H A 15 ILE HB 1.0 . 3.89 63 54 A 9 LEU H A 9 LEU HBy 1.0 . 3.37 64 55 A 4 TYR H A 4 TYR HBy 1.0 . 3.82 65 56 A 24 ILE H A 32 LEU HG 1.0 . 5.50 66 57 A 9 LEU H A 9 LEU HG 1.0 . 4.56 67 58 A 9 LEU H A 9 LEU HDy% 1.0 . 4.57 68 59 A 9 LEU H A 9 LEU HDx% 1.0 . 4.57 69 60 A 26 ASN H A 25 CYS HA 1.0 . 2.86 70 61 A 34 GLU H A 33 CYS HA 1.0 . 3.23 71 62 A 25 CYS HBy A 26 ASN H 1.0 . 3.60 72 63 A 34 GLU H A 37 TRP HBy 1.0 . 4.54 73 64 A 26 ASN H A 25 CYS HBx 1.0 . 4.10 74 65 A 34 GLU H A 34 GLU HGx 1.0 . 4.68 75 66 A 26 ASN H A 27 GLU HBx 1.0 . 3.85 76 66 A 26 ASN H A 27 GLU HBy 1.0 . 3.85 77 67 A 26 ASN H A 32 LEU HDx% 1.0 . 3.48 78 68 A 5 GLY H A 15 ILE HD1% 1.0 . 4.15 79 69 A 4 TYR HA A 6 TRP H 1.0 . 4.41 80 70 A 6 TRP H A 15 ILE HD1% 1.0 . 4.45 81 71 A 42 CYS H A 40 GLN HA 1.0 . 4.72 82 72 A 42 CYS H A 41 LEU HBx 1.0 . 4.74 83 73 A 42 CYS H A 41 LEU HG 1.0 . 4.86 84 74 A 6 TRP HA A 7 GLN H 1.0 . 3.13 85 75 A 7 GLN H A 11 CYS HA 1.0 . 5.42 86 76 A 14 CYS HA A 7 GLN H 1.0 . 4.63 87 77 A 7 GLN H A 6 TRP HBx 1.0 . 4.03 88 77 A 6 TRP HBy A 7 GLN H 1.0 . 4.03 89 78 A 7 GLN H A 7 GLN HBx 1.0 . 3.79 90 78 A 7 GLN H A 7 GLN HBy 1.0 . 3.79 91 79 A 7 GLN H A 15 ILE HG1x 1.0 . 4.36 92 79 A 15 ILE HG1y A 7 GLN H 1.0 . 4.36 93 80 A 32 LEU H A 32 LEU HG 1.0 . 3.55 94 81 A 32 LEU H A 32 LEU HDx% 1.0 . 5.20 95 82 A 32 LEU H A 32 LEU HDy% 1.0 . 5.50 96 83 A 32 LEU H A 24 ILE HG1x 1.0 . 4.72 97 83 A 32 LEU H A 24 ILE HG1y 1.0 . 4.72 98 84 A 32 LEU H A 31 CYS HA 1.0 . 2.93 99 85 A 5 GLY HAy A 29 TRP HE1 1.0 . 4.52 100 86 A 29 TRP HE1 A 5 GLY HAx 1.0 . 5.02 101 87 A 29 TRP HE1 A 28 PRO HBy 1.0 . 4.48 102 88 A 29 TRP HE1 A 28 PRO HBx 1.0 . 5.34 103 89 A 42 CYS HA A 38 GLY H 1.0 . 4.79 104 90 A 37 TRP HBy A 38 GLY H 1.0 . 4.45 105 91 A 37 TRP HBx A 38 GLY H 1.0 . 3.66 106 92 A 18 PRO HA A 19 GLY H 1.0 . 3.24 107 93 A 19 GLY H A 17 HIS HA 1.0 . 4.63 108 94 A 31 CYS H A 30 GLN HA 1.0 . 2.87 109 95 A 31 CYS H A 30 GLN HGy 1.0 . 4.92 110 96 A 31 CYS H A 30 GLN HGx 1.0 . 4.92 111 97 A 31 CYS H A 30 GLN HBy 1.0 . 3.99 112 98 A 31 CYS H A 32 LEU HG 1.0 . 4.65 113 99 A 31 CYS H A 32 LEU HDy% 1.0 . 4.06 114 100 A 29 TRP H A 28 PRO HA 1.0 . 3.19 115 101 A 29 TRP H A 14 CYS HBx 1.0 . 4.74 116 102 A 29 TRP H A 28 PRO HBx 1.0 . 4.62 117 103 A 41 LEU H A 39 GLY HAy 1.0 . 4.88 118 104 A 21 VAL H A 20 CYS HA 1.0 . 2.91 119 105 A 41 LEU H A 39 GLY HAx 1.0 . 4.88 120 106 A 21 VAL H A 20 CYS HBy 1.0 . 4.66 121 107 A 21 VAL H A 20 CYS HBx 1.0 . 4.66 122 108 A 41 LEU H A 40 GLN HBy 1.0 . 4.06 123 109 A 41 LEU H A 40 GLN HBx 1.0 . 4.06 124 110 A 42 CYS HA A 43 ASP H 1.0 . 3.35 125 111 A 37 TRP HBx A 43 ASP H 1.0 . 4.90 126 112 A 44 LYS H A 44 LYS HEx 1.0 . 5.43 127 112 A 44 LYS H A 44 LYS HEy 1.0 . 5.43 128 113 A 36 ASN H A 35 THR HG2% 1.0 . 3.88 129 114 A 41 LEU HG A 40 GLN H 1.0 . 5.50 130 115 A 41 LEU HDy% A 40 GLN H 1.0 . 4.62 131 116 A 41 LEU HDx% A 40 GLN H 1.0 . 5.26 132 117 A 32 LEU HA A 33 CYS H 1.0 . 2.54 133 118 A 33 CYS H A 32 LEU HBx 1.0 . 3.75 134 119 A 32 LEU HDy% A 33 CYS H 1.0 . 3.88 135 120 A 24 ILE HA A 25 CYS H 1.0 . 2.97 136 121 A 24 ILE HB A 25 CYS H 1.0 . 2.73 137 122 A 32 LEU HBy A 25 CYS H 1.0 . 5.09 138 123 A 25 CYS H A 24 ILE HG1x 1.0 . 3.73 139 123 A 24 ILE HG1y A 25 CYS H 1.0 . 3.73 140 124 A 24 ILE HG2% A 25 CYS H 1.0 . 3.78 141 125 A 25 CYS H A 24 ILE HD1% 1.0 . 3.95 142 126 A 14 CYS H A 13 LYS HA 1.0 . 2.70 143 127 A 14 CYS H A 13 LYS HBx 1.0 . 3.65 144 127 A 13 LYS HBy A 14 CYS H 1.0 . 3.65 145 128 A 14 CYS H A 13 LYS HGx 1.0 . 4.29 146 128 A 13 LYS HGy A 14 CYS H 1.0 . 4.29 147 129 A 35 THR H A 34 GLU HA 1.0 . 2.68 148 130 A 24 ILE H A 23 GLY HAy 1.0 . 3.16 149 131 A 24 ILE H A 31 CYS HA 1.0 . 5.35 150 132 A 24 ILE H A 23 GLY HAx 1.0 . 3.16 151 133 A 32 LEU HBy A 24 ILE H 1.0 . 4.00 152 134 A 24 ILE H A 32 LEU HBx 1.0 . 4.79 153 135 A 24 ILE H A 24 ILE HG1x 1.0 . 2.97 154 135 A 24 ILE H A 24 ILE HG1y 1.0 . 2.97 155 136 A 24 ILE H A 24 ILE HD1% 1.0 . 4.29 156 137 A 7 GLN HA A 8 GLY H 1.0 . 3.10 157 138 A 8 GLY H A 7 GLN HBx 1.0 . 3.35 158 138 A 7 GLN HBy A 8 GLY H 1.0 . 3.35 159 139 A 21 VAL HGx% A 22 HIS HE1 1.0 . 3.64 160 140 A 37 TRP H A 36 ASN HBx 1.0 . 4.92 161 141 A 39 GLY H A 38 GLY HAy 1.0 . 3.56 162 142 A 20 CYS H A 18 PRO HA 1.0 . 4.78 163 143 A 39 GLY H A 38 GLY HAx 1.0 . 3.56 164 144 A 37 TRP H A 36 ASN HBy 1.0 . 4.92 165 145 A 41 LEU HBy A 20 CYS H 1.0 . 5.22 166 146 A 27 GLU H A 14 CYS HBx 1.0 . 4.80 167 147 A 27 GLU H A 32 LEU HDx% 1.0 . 4.84 168 148 A 41 LEU HDx% A 20 CYS H 1.0 . 5.43 169 149 A 41 LEU HDy% A 20 CYS H 1.0 . 4.36 170 150 A 27 GLU H A 25 CYS HA 1.0 . 4.00 171 151 A 21 VAL HB A 22 HIS H 1.0 . 3.11 172 152 A 21 VAL HGy% A 22 HIS H 1.0 . 4.00 173 153 A 21 VAL HGx% A 22 HIS H 1.0 . 3.51 174 154 A 22 HIS HA A 23 GLY H 1.0 . 2.91 175 155 A 14 CYS HA A 15 ILE H 1.0 . 3.16 176 156 A 28 PRO HA A 6 TRP HH2 1.0 . 4.41 177 157 A 43 ASP HA A 37 TRP HE3 1.0 . 3.50 178 158 A 37 TRP HBy A 37 TRP HE3 1.0 . 4.08 179 159 A 37 TRP HBx A 37 TRP HE3 1.0 . 3.26 180 160 A 22 HIS HBy A 37 TRP HE3 1.0 . 4.78 181 161 A 17 HIS HD2 A 16 PRO HBx 1.0 . 4.39 182 161 A 16 PRO HBy A 17 HIS HD2 1.0 . 4.39 183 162 A 17 HIS HD2 A 16 PRO HGx 1.0 . 3.46 184 163 A 6 TRP HZ2 A 27 GLU HA 1.0 . 3.74 185 164 A 6 TRP HZ2 A 28 PRO HDy 1.0 . 3.74 186 165 A 6 TRP HZ2 A 28 PRO HDx 1.0 . 3.34 187 166 A 27 GLU HGy A 6 TRP HZ2 1.0 . 5.32 188 167 A 6 TRP HZ2 A 28 PRO HGx 1.0 . 4.69 189 167 A 6 TRP HZ2 A 28 PRO HGy 1.0 . 4.69 190 168 A 27 GLU HGx A 6 TRP HZ2 1.0 . 4.73 191 169 A 4 TYR HA A 4 TYR HD% 1.0 . 2.97 192 170 A 32 LEU HDy% A 30 GLN HE2x 1.0 . 3.98 193 170 A 32 LEU HDy% A 30 GLN HE2y 1.0 . 3.98 194 171 A 15 ILE H A 13 LYS HA 1.0 . 4.10 195 172 A 6 TRP HH2 A 27 GLU HA 1.0 . 3.95 196 173 A 14 CYS HBy A 6 TRP HH2 1.0 . 4.77 197 174 A 14 CYS HBy A 15 ILE H 1.0 . 5.18 198 175 A 14 CYS HBx A 6 TRP HH2 1.0 . 3.96 199 176 A 15 ILE H A 15 ILE HD1% 1.0 . 4.70 200 177 A 23 GLY H A 22 HIS HBx 1.0 . 4.17 201 178 A 6 TRP HH2 A 28 PRO HDx 1.0 . 4.14 202 179 A 25 CYS HBy A 30 GLN H 1.0 . 4.28 203 180 A 30 GLN H A 30 GLN HGy 1.0 . 4.58 204 181 A 30 GLN H A 30 GLN HBx 1.0 . 4.03 205 182 A 13 LYS HA A 6 TRP HE3 1.0 . 4.36 206 183 A 6 TRP HA A 6 TRP HE3 1.0 . 3.52 207 184 A 29 TRP HA A 29 TRP HE3 1.0 . 2.94 208 185 A 14 CYS HA A 6 TRP HE3 1.0 . 3.66 209 186 A 6 TRP HE3 A 6 TRP HBx 1.0 . 3.30 210 186 A 6 TRP HBy A 6 TRP HE3 1.0 . 3.30 211 187 A 22 HIS HBy A 37 TRP HH2 1.0 . 3.64 212 188 A 14 CYS HBy A 6 TRP HE3 1.0 . 5.20 213 189 A 6 TRP HE3 A 13 LYS HBx 1.0 . 5.50 214 189 A 13 LYS HBy A 6 TRP HE3 1.0 . 5.50 215 190 A 14 CYS HBx A 6 TRP HE3 1.0 . 5.50 216 191 A 7 GLN HE2y A 15 ILE HG1x 1.0 . 4.57 217 191 A 15 ILE HG1y A 7 GLN HE2y 1.0 . 4.57 218 192 A 29 TRP HE3 A 15 ILE HG1x 1.0 . 4.95 219 192 A 15 ILE HG1y A 29 TRP HE3 1.0 . 4.95 220 193 A 28 PRO HDy A 6 TRP HE1 1.0 . 5.42 221 194 A 28 PRO HDx A 6 TRP HE1 1.0 . 4.20 222 195 A 6 TRP HE1 A 28 PRO HGx 1.0 . 3.98 223 195 A 28 PRO HGy A 6 TRP HE1 1.0 . 3.98 224 196 A 32 LEU H A 24 ILE H 1.0 . 3.50 225 197 A 34 GLU H A 37 TRP HE1 1.0 . 3.90 226 198 A 29 TRP HE1 A 4 TYR HD% 1.0 . 4.03 227 199 A 29 TRP HE1 A 4 TYR HE% 1.0 . 4.06 228 200 A 37 TRP H A 38 GLY H 1.0 . 4.95 229 201 A 38 GLY H A 39 GLY H 1.0 . 5.40 230 202 A 20 CYS H A 19 GLY H 1.0 . 4.27 231 203 A 29 TRP H A 30 GLN H 1.0 . 4.64 232 204 A 29 TRP H A 29 TRP HE3 1.0 . 4.33 233 205 A 41 LEU H A 40 GLN H 1.0 . 3.37 234 206 A 42 CYS H A 41 LEU H 1.0 . 3.31 235 207 A 21 VAL H A 22 HIS H 1.0 . 3.83 236 208 A 9 LEU H A 10 TYR H 1.0 . 4.43 237 209 A 36 ASN H A 37 TRP H 1.0 . 3.39 238 210 A 13 LYS H A 12 ASP H 1.0 . 3.32 239 211 A 27 GLU H A 26 ASN H 1.0 . 2.78 240 212 A 5 GLY H A 6 TRP H 1.0 . 3.46 241 213 A 5 GLY H A 4 TYR HD% 1.0 . 3.44 242 214 A 42 CYS H A 43 ASP H 1.0 . 3.54 243 215 A 10 TYR H A 11 CYS H 1.0 . 4.68 244 216 A 21 VAL H A 20 CYS H 1.0 . 4.92 245 217 A 9 LEU H A 8 GLY H 1.0 . 4.60 246 218 A 12 ASP H A 11 CYS H 1.0 . 4.24 247 219 A 24 ILE H A 25 CYS H 1.0 . 4.77 248 220 A 34 GLU H A 37 TRP HD1 1.0 . 5.01 249 221 A 37 TRP H A 37 TRP HD1 1.0 . 3.94 250 222 A 6 TRP H A 6 TRP HD1 1.0 . 4.55 251 223 A 22 HIS H A 23 GLY H 1.0 . 4.64 252 224 A 35 THR H A 36 ASN H 1.0 . 4.48 253 225 A 5 GLY H A 29 TRP HZ2 1.0 . 3.91 254 226 A 4 TYR HD% A 29 TRP HZ2 1.0 . 4.22 255 227 A 22 HIS H A 22 HIS HD2 1.0 . 4.01 256 228 A 4 TYR HE% A 29 TRP HZ2 1.0 . 4.09 257 229 A 5 GLY HAy A 29 TRP HZ2 1.0 . 4.13 258 230 A 5 GLY HAx A 29 TRP HZ2 1.0 . 3.74 259 231 A 29 TRP HZ2 A 15 ILE HG1x 1.0 . 5.35 260 231 A 15 ILE HG1y A 29 TRP HZ2 1.0 . 5.35 261 232 A 15 ILE HD1% A 29 TRP HZ2 1.0 . 4.72 262 233 A 22 HIS HD2 A 37 TRP HZ3 1.0 . 4.02 263 234 A 43 ASP HA A 22 HIS HD2 1.0 . 3.33 264 235 A 21 VAL HGy% A 22 HIS HD2 1.0 . 4.80 265 236 A 31 CYS H A 30 GLN HBx 1.0 . 3.99 266 237 A 5 GLY HAx A 4 TYR HD% 1.0 . 4.57 267 238 A 4 TYR HA A 29 TRP HZ2 1.0 . 4.91 268 239 A 37 TRP HE3 A 22 HIS HD2 1.0 . 4.57 269 240 A 37 TRP HH2 A 22 HIS HD2 1.0 . 4.78 270 241 A 10 TYR HA A 10 TYR HD% 1.0 . 3.87 271 242 A 37 TRP HD1 A 37 TRP HA 1.0 . 4.62 272 243 A 43 ASP HA A 37 TRP HZ3 1.0 . 3.68 273 244 A 42 CYS HA A 37 TRP HZ3 1.0 . 5.50 274 245 A 29 TRP HA A 29 TRP HD1 1.0 . 4.81 275 246 A 4 TYR HA A 4 TYR HE% 1.0 . 4.82 276 247 A 13 LYS HA A 6 TRP HZ3 1.0 . 4.21 277 248 A 6 TRP HZ3 A 12 ASP HA 1.0 . 4.34 278 249 A 6 TRP HA A 6 TRP HD1 1.0 . 4.61 279 250 A 29 TRP HD1 A 29 TRP HBy 1.0 . 3.68 280 251 A 29 TRP HD1 A 29 TRP HBx 1.0 . 3.68 281 252 A 37 TRP HBy A 37 TRP HD1 1.0 . 3.67 282 253 A 37 TRP HD1 A 36 ASN HBy 1.0 . 4.69 283 254 A 22 HIS HBy A 37 TRP HZ3 1.0 . 3.99 284 255 A 37 TRP HD1 A 36 ASN HBx 1.0 . 4.69 285 256 A 14 CYS HA A 6 TRP HZ3 1.0 . 4.62 286 257 A 5 GLY HAy A 6 TRP HD1 1.0 . 5.09 287 258 A 6 TRP HD1 A 6 TRP HBx 1.0 . 3.57 288 258 A 6 TRP HBy A 6 TRP HD1 1.0 . 3.57 289 259 A 37 TRP HD1 A 34 GLU HGx 1.0 . 5.50 290 260 A 14 CYS HBy A 6 TRP HZ3 1.0 . 4.79 291 261 A 14 CYS HBx A 6 TRP HZ3 1.0 . 5.15 292 262 A 7 GLN HE2y A 15 ILE HG2% 1.0 . 5.24 293 263 A 9 LEU HG A 10 TYR HD% 1.0 . 4.00 294 264 A 10 TYR HD% A 9 LEU HDy% 1.0 . 4.68 295 265 A 10 TYR HD% A 9 LEU HDx% 1.0 . 4.68 296 266 A 28 PRO HBy A 29 TRP HD1 1.0 . 4.00 297 267 A 29 TRP HZ3 A 15 ILE HG1x 1.0 . 3.32 298 267 A 15 ILE HG1y A 29 TRP HZ3 1.0 . 3.32 299 268 A 15 ILE HD1% A 29 TRP HZ3 1.0 . 4.64 300 269 A 15 ILE HB A 29 TRP HZ3 1.0 . 4.49 301 270 A 9 LEU HG A 10 TYR HE% 1.0 . 4.52 302 271 A 7 GLN HE2x A 15 ILE HG1x 1.0 . 4.57 303 271 A 15 ILE HG1y A 7 GLN HE2x 1.0 . 4.57 304 272 A 29 TRP HH2 A 15 ILE HG1x 1.0 . 4.74 305 272 A 15 ILE HG1y A 29 TRP HH2 1.0 . 4.74 306 273 A 10 TYR HE% A 9 LEU HDy% 1.0 . 4.83 307 274 A 10 TYR HE% A 9 LEU HDx% 1.0 . 4.83 308 275 A 15 ILE HD1% A 29 TRP HH2 1.0 . 4.05 309 276 A 6 TRP HZ2 A 27 GLU HBx 1.0 . 5.30 310 276 A 27 GLU HBy A 6 TRP HZ2 1.0 . 5.30 311 277 A 29 TRP HE3 A 18 PRO HGy 1.0 . 5.50 312 278 A 29 TRP HE3 A 18 PRO HGx 1.0 . 5.50 313 279 A 22 HIS HD2 A 37 TRP HZ2 1.0 . 5.50 314 280 A 6 TRP HH2 A 28 PRO HDy 1.0 . 5.35 315 281 A 21 VAL HB A 22 HIS HD2 1.0 . 4.05 316 282 A 21 VAL HGx% A 22 HIS HD2 1.0 . 3.48 317 283 A 15 ILE HG2% A 7 GLN HE2x 1.0 . 5.24 318 284 A 14 CYS HBx A 13 LYS HA 1.0 . 4.44 319 285 A 13 LYS HA A 13 LYS HDx 1.0 . 4.06 320 285 A 13 LYS HA A 13 LYS HDy 1.0 . 4.06 321 286 A 13 LYS HA A 13 LYS HGx 1.0 . 3.58 322 286 A 13 LYS HGy A 13 LYS HA 1.0 . 3.58 323 287 A 11 CYS HA A 7 GLN HA 1.0 . 4.61 324 288 A 7 GLN HA A 7 GLN HGy 1.0 . 3.93 325 289 A 7 GLN HA A 7 GLN HGx 1.0 . 3.93 326 290 A 7 GLN HA A 15 ILE HG1x 1.0 . 5.24 327 290 A 15 ILE HG1y A 7 GLN HA 1.0 . 5.24 328 291 A 15 ILE HD1% A 7 GLN HA 1.0 . 4.90 329 292 A 33 CYS HA A 34 GLU HA 1.0 . 4.71 330 293 A 37 TRP HBy A 33 CYS HA 1.0 . 5.50 331 294 A 7 GLN HA A 6 TRP HBx 1.0 . 4.54 332 294 A 6 TRP HBy A 7 GLN HA 1.0 . 4.54 333 295 A 14 CYS HA A 6 TRP HA 1.0 . 3.41 334 296 A 24 ILE HB A 25 CYS HA 1.0 . 4.74 335 297 A 32 LEU HBy A 25 CYS HA 1.0 . 4.36 336 298 A 32 LEU HG A 25 CYS HA 1.0 . 3.92 337 299 A 25 CYS HA A 24 ILE HG1x 1.0 . 5.45 338 299 A 25 CYS HA A 24 ILE HG1y 1.0 . 5.45 339 300 A 6 TRP HA A 15 ILE HG1x 1.0 . 4.24 340 300 A 15 ILE HG1y A 6 TRP HA 1.0 . 4.24 341 301 A 24 ILE HG2% A 23 GLY HAy 1.0 . 5.04 342 302 A 25 CYS HA A 32 LEU HDx% 1.0 . 3.84 343 303 A 15 ILE HD1% A 6 TRP HA 1.0 . 4.74 344 304 A 37 TRP HE3 A 37 TRP HA 1.0 . 3.90 345 305 A 6 TRP HE3 A 12 ASP HA 1.0 . 3.93 346 306 A 29 TRP HA A 29 TRP HZ3 1.0 . 4.73 347 307 A 34 GLU HA A 37 TRP HD1 1.0 . 4.75 348 308 A 37 TRP HD1 A 34 GLU HGy 1.0 . 5.50 349 309 A 22 HIS HBx A 37 TRP HZ3 1.0 . 5.50 350 310 A 28 PRO HBx A 29 TRP HD1 1.0 . 5.50 351 311 A 24 ILE HB A 24 ILE HA 1.0 . 2.93 352 312 A 20 CYS HA A 41 LEU HA 1.0 . 3.73 353 313 A 27 GLU HA A 28 PRO HDy 1.0 . 3.51 354 314 A 27 GLU HA A 28 PRO HDx 1.0 . 3.17 355 315 A 30 GLN HA A 30 GLN HGy 1.0 . 3.74 356 316 A 30 GLN HA A 30 GLN HGx 1.0 . 3.74 357 317 A 11 CYS HA A 6 TRP HBx 1.0 . 4.34 358 317 A 6 TRP HBy A 11 CYS HA 1.0 . 4.34 359 318 A 25 CYS HBy A 30 GLN HBy 1.0 . 4.25 360 319 A 25 CYS HBy A 30 GLN HBx 1.0 . 4.25 361 320 A 27 GLU HA A 26 ASN HBx 1.0 . 4.87 362 320 A 26 ASN HBy A 27 GLU HA 1.0 . 4.87 363 321 A 42 CYS HA A 37 TRP HBx 1.0 . 4.28 364 322 A 32 LEU HG A 32 LEU HA 1.0 . 4.02 365 323 A 44 LYS HA A 44 LYS HGx 1.0 . 3.61 366 323 A 44 LYS HGy A 44 LYS HA 1.0 . 3.61 367 324 A 41 LEU HG A 41 LEU HA 1.0 . 4.05 368 325 A 24 ILE HG2% A 24 ILE HA 1.0 . 2.91 369 326 A 32 LEU HDy% A 32 LEU HA 1.0 . 3.04 370 327 A 32 LEU HDx% A 32 LEU HA 1.0 . 4.39 371 328 A 41 LEU HDx% A 41 LEU HA 1.0 . 4.71 372 329 A 43 ASP HA A 21 VAL HGy% 1.0 . 3.84 373 330 A 43 ASP HA A 21 VAL HB 1.0 . 3.54 374 331 A 14 CYS HBy A 27 GLU HA 1.0 . 5.42 375 332 A 14 CYS HBx A 27 GLU HA 1.0 . 5.43 376 333 A 27 GLU HA A 28 PRO HGx 1.0 . 4.82 377 333 A 27 GLU HA A 28 PRO HGy 1.0 . 4.82 378 334 A 32 LEU HDy% A 30 GLN HA 1.0 . 5.50 379 335 A 35 THR HG2% A 36 ASN HA 1.0 . 4.69 380 336 A 20 CYS HA A 16 PRO HBx 1.0 . 5.50 381 336 A 20 CYS HA A 16 PRO HBy 1.0 . 5.50 382 337 A 25 CYS HBy A 16 PRO HBx 1.0 . 5.50 383 337 A 25 CYS HBy A 16 PRO HBy 1.0 . 5.50 384 338 A 25 CYS HBy A 14 CYS HBx 1.0 . 4.50 385 339 A 25 CYS HBy A 32 LEU HDx% 1.0 . 4.48 386 340 A 41 LEU HDx% A 20 CYS HA 1.0 . 4.88 387 341 A 21 VAL HGy% A 20 CYS HA 1.0 . 4.47 388 342 A 41 LEU HBx A 20 CYS HA 1.0 . 4.49 389 343 A 41 LEU HBy A 20 CYS HA 1.0 . 3.59 390 344 A 15 ILE HA A 16 PRO HGy 1.0 . 5.27 391 345 A 15 ILE HA A 13 LYS HBx 1.0 . 3.97 392 345 A 13 LYS HBy A 15 ILE HA 1.0 . 3.97 393 346 A 15 ILE HA A 15 ILE HG1x 1.0 . 3.14 394 346 A 15 ILE HG1y A 15 ILE HA 1.0 . 3.14 395 347 A 21 VAL HGy% A 21 VAL HA 1.0 . 3.18 396 348 A 35 THR HA A 35 THR HG2% 1.0 . 2.91 397 349 A 9 LEU HG A 9 LEU HA 1.0 . 4.13 398 350 A 9 LEU HA A 9 LEU HDy% 1.0 . 3.99 399 351 A 9 LEU HA A 9 LEU HDx% 1.0 . 3.99 400 352 A 41 LEU HDy% A 41 LEU HA 1.0 . 3.30 401 353 A 43 ASP HA A 21 VAL HGx% 1.0 . 4.04 402 354 A 21 VAL HGx% A 22 HIS HA 1.0 . 4.51 403 355 A 21 VAL HGx% A 21 VAL HA 1.0 . 2.99 404 356 A 15 ILE HD1% A 7 GLN HBx 1.0 . 3.91 405 356 A 15 ILE HD1% A 7 GLN HBy 1.0 . 3.91 406 357 A 15 ILE HD1% A 7 GLN HGx 1.0 . 4.68 407 358 A 15 ILE HD1% A 7 GLN HGy 1.0 . 4.68 408 359 A 15 ILE HD1% A 5 GLY HAx 1.0 . 4.02 409 360 A 15 ILE HG2% A 15 ILE HG1x 1.0 . 3.82 410 360 A 15 ILE HG1y A 15 ILE HG2% 1.0 . 3.82 411 361 A 7 GLN HBx A 15 ILE HG1x 1.0 . 3.86 412 361 A 7 GLN HBy A 15 ILE HG1x 1.0 . 3.86 413 361 A 15 ILE HG1y A 7 GLN HBx 1.0 . 3.86 414 361 A 15 ILE HG1y A 7 GLN HBy 1.0 . 3.86 415 362 A 32 LEU HBy A 32 LEU HDy% 1.0 . 4.07 416 363 A 5 GLY HAx A 15 ILE HG1x 1.0 . 4.88 417 363 A 15 ILE HG1y A 5 GLY HAx 1.0 . 4.88 418 364 A 14 CYS HA A 15 ILE HD1% 1.0 . 4.94 419 365 A 15 ILE HD1% A 5 GLY HAy 1.0 . 4.97 420 366 A 15 ILE HD1% A 18 PRO HDx 1.0 . 5.48 421 366 A 15 ILE HD1% A 18 PRO HDy 1.0 . 5.48 422 367 A 14 CYS HA A 15 ILE HG1x 1.0 . 3.44 423 367 A 14 CYS HA A 15 ILE HG1y 1.0 . 3.44 424 368 A 5 GLY HAy A 15 ILE HG1x 1.0 . 5.50 425 368 A 15 ILE HG1y A 5 GLY HAy 1.0 . 5.50 426 369 A 15 ILE HG1y A 18 PRO HDx 1.0 . 5.50 427 369 A 15 ILE HG1x A 18 PRO HDx 1.0 . 5.50 428 369 A 18 PRO HDy A 15 ILE HG1x 1.0 . 5.50 429 369 A 15 ILE HG1y A 18 PRO HDy 1.0 . 5.50 430 370 A 15 ILE HD1% A 15 ILE HA 1.0 . 4.08 431 371 A 15 ILE HG2% A 18 PRO HDx 1.0 . 5.39 432 371 A 15 ILE HG2% A 18 PRO HDy 1.0 . 5.39 433 372 A 41 LEU HG A 20 CYS HA 1.0 . 4.98 434 373 A 21 VAL HGx% A 43 ASP HBx 1.0 . 4.70 435 374 A 21 VAL HGy% A 43 ASP HBx 1.0 . 3.53 436 375 A 21 VAL HGy% A 43 ASP HBy 1.0 . 3.53 437 376 A 21 VAL HGx% A 43 ASP HBy 1.0 . 4.70 438 377 A 41 LEU HBy A 21 VAL HGy% 1.0 . 4.29 439 378 A 24 ILE HG2% A 24 ILE HG1x 1.0 . 3.10 440 378 A 24 ILE HG2% A 24 ILE HG1y 1.0 . 3.10 441 379 A 24 ILE HB A 24 ILE HD1% 1.0 . 3.24 442 380 A 24 ILE HG2% A 23 GLY HAx 1.0 . 5.04 443 381 A 24 ILE HA A 24 ILE HG1x 1.0 . 3.92 444 381 A 24 ILE HG1y A 24 ILE HA 1.0 . 3.92 445 382 A 32 LEU HBy A 24 ILE HG1x 1.0 . 3.62 446 382 A 32 LEU HBy A 24 ILE HG1y 1.0 . 3.62 447 383 A 41 LEU HBx A 41 LEU HDx% 1.0 . 3.34 448 384 A 32 LEU HDy% A 32 LEU HBx 1.0 . 3.62 449 385 A 41 LEU HBy A 41 LEU HDx% 1.0 . 3.46 450 386 A 5 GLY HAx A 28 PRO HBx 1.0 . 4.69 451 387 A 32 LEU HBy A 32 LEU HDx% 1.0 . 3.49 452 388 A 32 LEU HDx% A 26 ASN HBx 1.0 . 4.15 453 388 A 26 ASN HBy A 32 LEU HDx% 1.0 . 4.15 454 389 A 5 GLY HAy A 28 PRO HBx 1.0 . 3.86 455 390 A 41 LEU HBx A 41 LEU HDy% 1.0 . 4.03 456 391 A 15 ILE HB A 5 GLY HAx 1.0 . 5.15 457 392 A 15 ILE HB A 18 PRO HDx 1.0 . 5.23 458 392 A 15 ILE HB A 18 PRO HDy 1.0 . 5.23 459 393 A 41 LEU HDy% A 20 CYS HA 1.0 . 3.81 460 394 A 28 PRO HA A 14 CYS HBx 1.0 . 3.66 461 395 A 14 CYS HBy A 28 PRO HA 1.0 . 4.18 462 396 A 5 GLY HAy A 28 PRO HBy 1.0 . 4.66 463 397 A 16 PRO HBx A 20 CYS HBy 1.0 . 5.06 464 397 A 16 PRO HBy A 20 CYS HBy 1.0 . 5.06 465 398 A 41 LEU HBy A 20 CYS HBy 1.0 . 5.50 466 399 A 13 LYS HEy A 13 LYS HGx 1.0 . 4.12 467 399 A 13 LYS HGy A 13 LYS HEx 1.0 . 4.12 468 399 A 13 LYS HGy A 13 LYS HEy 1.0 . 4.12 469 399 A 13 LYS HEx A 13 LYS HGx 1.0 . 4.12 470 400 A 44 LYS HEx A 44 LYS HGx 1.0 . 3.81 471 400 A 44 LYS HEy A 44 LYS HGx 1.0 . 3.81 472 400 A 44 LYS HGy A 44 LYS HEx 1.0 . 3.81 473 400 A 44 LYS HGy A 44 LYS HEy 1.0 . 3.81 474 401 A 20 CYS HBx A 16 PRO HBx 1.0 . 5.06 475 401 A 16 PRO HBy A 20 CYS HBx 1.0 . 5.06 476 402 A 41 LEU HBy A 20 CYS HBx 1.0 . 5.50 477 403 A 25 CYS HBx A 14 CYS HBx 1.0 . 5.47 478 404 A 32 LEU HBy A 25 CYS HBx 1.0 . 5.50 479 405 A 4 TYR H A 4 TYR HBy 1.0 . 3.04 480 405 A 4 TYR H A 4 TYR HBx 1.0 . 3.04 481 406 A 5 GLY H A 4 TYR HBy 1.0 . 4.24 482 406 A 5 GLY H A 4 TYR HBx 1.0 . 4.24 483 407 A 7 GLN H A 7 GLN HGx 1.0 . 3.22 484 407 A 7 GLN H A 7 GLN HGy 1.0 . 3.22 485 408 A 7 GLN HBy A 7 GLN HE2x 1.0 . 4.61 486 408 A 7 GLN HBy A 7 GLN HE2y 1.0 . 4.61 487 408 A 7 GLN HE2y A 7 GLN HBx 1.0 . 4.61 488 408 A 7 GLN HE2x A 7 GLN HBx 1.0 . 4.61 489 409 A 7 GLN HE2x A 7 GLN HGx 1.0 . 3.01 490 409 A 7 GLN HE2y A 7 GLN HGy 1.0 . 3.01 491 409 A 7 GLN HE2x A 7 GLN HGy 1.0 . 3.01 492 409 A 7 GLN HE2y A 7 GLN HGx 1.0 . 3.01 493 410 A 8 GLY H A 7 GLN HGx 1.0 . 2.92 494 410 A 8 GLY H A 7 GLN HGy 1.0 . 2.92 495 411 A 15 ILE HA A 7 GLN HGx 1.0 . 4.79 496 411 A 15 ILE HA A 7 GLN HGy 1.0 . 4.79 497 412 A 7 GLN HGy A 15 ILE HG1x 1.0 . 3.07 498 412 A 15 ILE HG1y A 7 GLN HGx 1.0 . 3.07 499 412 A 15 ILE HG1y A 7 GLN HGy 1.0 . 3.07 500 412 A 7 GLN HGx A 15 ILE HG1x 1.0 . 3.07 501 413 A 15 ILE HD1% A 7 GLN HGx 1.0 . 3.98 502 413 A 15 ILE HD1% A 7 GLN HGy 1.0 . 3.98 503 414 A 7 GLN HE2y A 15 ILE HG2% 1.0 . 4.60 504 414 A 15 ILE HG2% A 7 GLN HE2x 1.0 . 4.60 505 415 A 9 LEU H A 8 GLY HAx 1.0 . 2.80 506 415 A 9 LEU H A 8 GLY HAy 1.0 . 2.80 507 416 A 9 LEU H A 9 LEU HBx 1.0 . 2.75 508 416 A 9 LEU H A 9 LEU HBy 1.0 . 2.75 509 417 A 9 LEU H A 9 LEU HDx% 1.0 . 3.94 510 417 A 9 LEU H A 9 LEU HDy% 1.0 . 3.94 511 418 A 9 LEU HA A 9 LEU HDx% 1.0 . 3.09 512 418 A 9 LEU HA A 9 LEU HDy% 1.0 . 3.09 513 419 A 10 TYR HD% A 9 LEU HBx 1.0 . 4.14 514 419 A 10 TYR HD% A 9 LEU HBy 1.0 . 4.14 515 420 A 10 TYR HE% A 9 LEU HBx 1.0 . 4.42 516 420 A 10 TYR HE% A 9 LEU HBy 1.0 . 4.42 517 421 A 10 TYR HD% A 9 LEU HDx% 1.0 . 3.98 518 421 A 10 TYR HD% A 9 LEU HDy% 1.0 . 3.98 519 422 A 10 TYR HE% A 9 LEU HDx% 1.0 . 3.46 520 422 A 10 TYR HE% A 9 LEU HDy% 1.0 . 3.46 521 423 A 11 CYS H A 11 CYS HBx 1.0 . 3.56 522 423 A 11 CYS H A 11 CYS HBy 1.0 . 3.56 523 424 A 13 LYS HBy A 16 PRO HDx 1.0 . 4.02 524 424 A 13 LYS HBx A 16 PRO HDx 1.0 . 4.02 525 424 A 16 PRO HDy A 13 LYS HBx 1.0 . 4.02 526 424 A 13 LYS HBy A 16 PRO HDy 1.0 . 4.02 527 425 A 15 ILE HA A 16 PRO HDx 1.0 . 2.95 528 425 A 15 ILE HA A 16 PRO HDy 1.0 . 2.95 529 426 A 15 ILE HA A 18 PRO HGy 1.0 . 4.52 530 426 A 15 ILE HA A 18 PRO HGx 1.0 . 4.52 531 427 A 15 ILE HB A 18 PRO HGy 1.0 . 4.39 532 427 A 15 ILE HB A 18 PRO HGx 1.0 . 4.39 533 428 A 15 ILE HG2% A 18 PRO HGy 1.0 . 3.77 534 428 A 15 ILE HG2% A 18 PRO HGx 1.0 . 3.77 535 429 A 15 ILE HG1y A 18 PRO HGy 1.0 . 4.73 536 429 A 18 PRO HGx A 15 ILE HG1x 1.0 . 4.73 537 429 A 15 ILE HG1y A 18 PRO HGx 1.0 . 4.73 538 429 A 15 ILE HG1x A 18 PRO HGy 1.0 . 4.73 539 430 A 16 PRO HBx A 20 CYS HBy 1.0 . 4.25 540 430 A 16 PRO HBy A 20 CYS HBy 1.0 . 4.25 541 430 A 20 CYS HBx A 16 PRO HBx 1.0 . 4.25 542 430 A 16 PRO HBy A 20 CYS HBx 1.0 . 4.25 543 431 A 16 PRO HGy A 20 CYS HBy 1.0 . 5.34 544 431 A 16 PRO HGy A 20 CYS HBx 1.0 . 5.34 545 432 A 17 HIS HBx A 18 PRO HBx 1.0 . 4.87 546 432 A 17 HIS HBy A 18 PRO HBx 1.0 . 4.87 547 432 A 18 PRO HBy A 17 HIS HBx 1.0 . 4.87 548 432 A 17 HIS HBy A 18 PRO HBy 1.0 . 4.87 549 433 A 17 HIS HBy A 18 PRO HGy 1.0 . 3.80 550 433 A 17 HIS HBx A 18 PRO HGy 1.0 . 3.80 551 433 A 18 PRO HGx A 17 HIS HBx 1.0 . 3.80 552 433 A 18 PRO HGx A 17 HIS HBy 1.0 . 3.80 553 434 A 29 TRP HE3 A 18 PRO HGy 1.0 . 4.77 554 434 A 29 TRP HE3 A 18 PRO HGx 1.0 . 4.77 555 435 A 29 TRP HZ3 A 18 PRO HGy 1.0 . 4.74 556 435 A 29 TRP HZ3 A 18 PRO HGx 1.0 . 4.74 557 436 A 41 LEU HDy% A 19 GLY HAx 1.0 . 5.34 558 436 A 41 LEU HDy% A 19 GLY HAy 1.0 . 5.34 559 437 A 20 CYS H A 20 CYS HBy 1.0 . 3.11 560 437 A 20 CYS H A 20 CYS HBx 1.0 . 3.11 561 438 A 21 VAL H A 20 CYS HBy 1.0 . 4.06 562 438 A 21 VAL H A 20 CYS HBx 1.0 . 4.06 563 439 A 41 LEU HDy% A 20 CYS HBy 1.0 . 4.70 564 439 A 41 LEU HDy% A 20 CYS HBx 1.0 . 4.70 565 440 A 21 VAL H A 42 CYS HBx 1.0 . 4.49 566 440 A 21 VAL H A 42 CYS HBy 1.0 . 4.49 567 441 A 21 VAL HB A 43 ASP HBy 1.0 . 4.00 568 441 A 21 VAL HB A 43 ASP HBx 1.0 . 4.00 569 442 A 21 VAL HGx% A 43 ASP HBy 1.0 . 4.12 570 442 A 21 VAL HGx% A 43 ASP HBx 1.0 . 4.12 571 443 A 21 VAL HGy% A 43 ASP HBy 1.0 . 3.09 572 443 A 21 VAL HGy% A 43 ASP HBx 1.0 . 3.09 573 444 A 22 HIS H A 42 CYS HBx 1.0 . 3.50 574 444 A 22 HIS H A 42 CYS HBy 1.0 . 3.50 575 445 A 22 HIS HBx A 23 GLY HAx 1.0 . 4.49 576 445 A 22 HIS HBx A 23 GLY HAy 1.0 . 4.49 577 446 A 22 HIS HD2 A 43 ASP HBy 1.0 . 4.95 578 446 A 22 HIS HD2 A 43 ASP HBx 1.0 . 4.95 579 447 A 24 ILE H A 23 GLY HAx 1.0 . 2.75 580 447 A 24 ILE H A 23 GLY HAy 1.0 . 2.75 581 448 A 24 ILE HG2% A 23 GLY HAx 1.0 . 4.17 582 448 A 24 ILE HG2% A 23 GLY HAy 1.0 . 4.17 583 449 A 23 GLY HAy A 24 ILE HG1x 1.0 . 5.10 584 449 A 23 GLY HAx A 24 ILE HG1x 1.0 . 5.10 585 449 A 24 ILE HG1y A 23 GLY HAx 1.0 . 5.10 586 449 A 24 ILE HG1y A 23 GLY HAy 1.0 . 5.10 587 450 A 25 CYS HA A 30 GLN HBy 1.0 . 5.07 588 450 A 25 CYS HA A 30 GLN HBx 1.0 . 5.07 589 451 A 25 CYS HBy A 30 GLN HBy 1.0 . 3.62 590 451 A 25 CYS HBy A 30 GLN HBx 1.0 . 3.62 591 452 A 26 ASN H A 30 GLN HBy 1.0 . 4.45 592 452 A 26 ASN H A 30 GLN HBx 1.0 . 4.45 593 453 A 26 ASN HD2y A 27 GLU HBx 1.0 . 4.44 594 453 A 26 ASN HD2x A 27 GLU HBx 1.0 . 4.44 595 453 A 27 GLU HBy A 26 ASN HD2y 1.0 . 4.44 596 453 A 27 GLU HBy A 26 ASN HD2x 1.0 . 4.44 597 454 A 27 GLU HGy A 26 ASN HD2y 1.0 . 3.67 598 454 A 27 GLU HGy A 26 ASN HD2x 1.0 . 3.67 599 455 A 32 LEU HDx% A 26 ASN HD2y 1.0 . 5.23 600 455 A 32 LEU HDx% A 26 ASN HD2x 1.0 . 5.23 601 456 A 29 TRP HD1 A 29 TRP HBx 1.0 . 3.05 602 456 A 29 TRP HD1 A 29 TRP HBy 1.0 . 3.05 603 457 A 29 TRP HE3 A 29 TRP HBx 1.0 . 3.59 604 457 A 29 TRP HE3 A 29 TRP HBy 1.0 . 3.59 605 458 A 30 GLN H A 30 GLN HGx 1.0 . 3.93 606 458 A 30 GLN H A 30 GLN HGy 1.0 . 3.93 607 459 A 30 GLN HA A 30 GLN HGx 1.0 . 3.26 608 459 A 30 GLN HA A 30 GLN HGy 1.0 . 3.26 609 460 A 31 CYS H A 30 GLN HBy 1.0 . 3.39 610 460 A 31 CYS H A 30 GLN HBx 1.0 . 3.39 611 461 A 32 LEU HDy% A 30 GLN HBy 1.0 . 5.06 612 461 A 32 LEU HDy% A 30 GLN HBx 1.0 . 5.06 613 462 A 31 CYS H A 30 GLN HGx 1.0 . 4.25 614 462 A 31 CYS H A 30 GLN HGy 1.0 . 4.25 615 463 A 31 CYS H A 31 CYS HBy 1.0 . 3.63 616 463 A 31 CYS H A 31 CYS HBx 1.0 . 3.63 617 464 A 32 LEU HA A 31 CYS HBy 1.0 . 5.34 618 464 A 32 LEU HA A 31 CYS HBx 1.0 . 5.34 619 465 A 32 LEU HG A 31 CYS HBy 1.0 . 5.34 620 465 A 32 LEU HG A 31 CYS HBx 1.0 . 5.34 621 466 A 41 LEU HA A 31 CYS HBy 1.0 . 5.34 622 466 A 41 LEU HA A 31 CYS HBx 1.0 . 5.34 623 467 A 42 CYS H A 31 CYS HBy 1.0 . 5.34 624 467 A 42 CYS H A 31 CYS HBx 1.0 . 5.34 625 468 A 33 CYS H A 33 CYS HBx 1.0 . 3.65 626 468 A 33 CYS H A 33 CYS HBy 1.0 . 3.65 627 469 A 33 CYS HA A 42 CYS HBx 1.0 . 4.64 628 469 A 33 CYS HA A 42 CYS HBy 1.0 . 4.64 629 470 A 34 GLU H A 33 CYS HBx 1.0 . 3.09 630 470 A 34 GLU H A 33 CYS HBy 1.0 . 3.09 631 471 A 33 CYS HBy A 42 CYS HBx 1.0 . 3.69 632 471 A 33 CYS HBx A 42 CYS HBx 1.0 . 3.69 633 471 A 42 CYS HBy A 33 CYS HBx 1.0 . 3.69 634 471 A 42 CYS HBy A 33 CYS HBy 1.0 . 3.69 635 472 A 34 GLU H A 34 GLU HGx 1.0 . 4.12 636 472 A 34 GLU H A 34 GLU HGy 1.0 . 4.12 637 473 A 34 GLU HA A 34 GLU HGx 1.0 . 3.21 638 473 A 34 GLU HA A 34 GLU HGy 1.0 . 3.21 639 474 A 35 THR H A 34 GLU HBy 1.0 . 3.85 640 474 A 35 THR H A 34 GLU HBx 1.0 . 3.85 641 475 A 37 TRP HD1 A 34 GLU HBy 1.0 . 3.15 642 475 A 37 TRP HD1 A 34 GLU HBx 1.0 . 3.15 643 476 A 35 THR H A 34 GLU HGx 1.0 . 3.40 644 476 A 35 THR H A 34 GLU HGy 1.0 . 3.40 645 477 A 37 TRP HD1 A 34 GLU HGx 1.0 . 4.63 646 477 A 37 TRP HD1 A 34 GLU HGy 1.0 . 4.63 647 478 A 35 THR HG2% A 36 ASN HD2y 1.0 . 4.70 648 478 A 35 THR HG2% A 36 ASN HD2x 1.0 . 4.70 649 479 A 36 ASN HA A 36 ASN HD2y 1.0 . 4.16 650 479 A 36 ASN HA A 36 ASN HD2x 1.0 . 4.16 651 480 A 36 ASN HBy A 36 ASN HD2y 1.0 . 3.07 652 480 A 36 ASN HBx A 36 ASN HD2y 1.0 . 3.07 653 480 A 36 ASN HD2x A 36 ASN HBy 1.0 . 3.07 654 480 A 36 ASN HD2x A 36 ASN HBx 1.0 . 3.07 655 481 A 37 TRP H A 36 ASN HBy 1.0 . 4.31 656 481 A 37 TRP H A 36 ASN HBx 1.0 . 4.31 657 482 A 37 TRP HE3 A 43 ASP HBy 1.0 . 5.34 658 482 A 37 TRP HE3 A 43 ASP HBx 1.0 . 5.34 659 483 A 39 GLY H A 38 GLY HAx 1.0 . 2.84 660 483 A 39 GLY H A 38 GLY HAy 1.0 . 2.84 661 484 A 40 GLN H A 39 GLY HAx 1.0 . 2.51 662 484 A 40 GLN H A 39 GLY HAy 1.0 . 2.51 663 485 A 41 LEU H A 39 GLY HAx 1.0 . 4.07 664 485 A 41 LEU H A 39 GLY HAy 1.0 . 4.07 665 486 A 42 CYS H A 39 GLY HAx 1.0 . 4.75 666 486 A 42 CYS H A 39 GLY HAy 1.0 . 4.75 667 487 A 40 GLN H A 40 GLN HBy 1.0 . 2.95 668 487 A 40 GLN H A 40 GLN HBx 1.0 . 2.95 669 488 A 40 GLN H A 40 GLN HGx 1.0 . 4.05 670 488 A 40 GLN H A 40 GLN HGy 1.0 . 4.05 671 489 A 40 GLN HA A 40 GLN HGx 1.0 . 3.67 672 489 A 40 GLN HA A 40 GLN HGy 1.0 . 3.67 673 490 A 41 LEU HG A 40 GLN HBy 1.0 . 4.71 674 490 A 41 LEU HG A 40 GLN HBx 1.0 . 4.71 675 491 A 41 LEU HDy% A 40 GLN HGx 1.0 . 4.81 676 491 A 41 LEU HDy% A 40 GLN HGy 1.0 . 4.81 677 492 A 44 LYS H A 43 ASP HBy 1.0 . 3.83 678 492 A 44 LYS H A 43 ASP HBx 1.0 . 3.83 679 493 A 44 LYS H A 44 LYS HDy 1.0 . 3.46 680 493 A 44 LYS H A 44 LYS HDx 1.0 . 3.46 681 494 A 44 LYS HA A 44 LYS HDy 1.0 . 4.33 682 494 A 44 LYS HA A 44 LYS HDx 1.0 . 4.33 stop_ save_