data_nef_c17500_2la2 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 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 37 LYS C 1 38 NH2 N 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 TRP middle . . 3 A 3 LYS middle . . 4 A 4 ILE middle . . 5 A 5 PHE middle . . 6 A 6 LYS middle . . 7 A 7 LYS middle . . 8 A 8 ILE middle . . 9 A 9 GLU middle . . 10 A 10 LYS middle . . 11 A 11 VAL middle . . 12 A 12 GLY middle . false 13 A 13 ARG middle . . 14 A 14 ASN middle . . 15 A 15 VAL middle . . 16 A 16 ARG middle . . 17 A 17 ASP middle . . 18 A 18 GLY middle . false 19 A 19 ILE middle . . 20 A 20 ILE middle . . 21 A 21 LYS middle . . 22 A 22 ALA middle . . 23 A 23 GLY middle . false 24 A 24 PRO middle . false 25 A 25 ALA middle . . 26 A 26 VAL middle . . 27 A 27 ALA middle . . 28 A 28 VAL middle . . 29 A 29 VAL middle . . 30 A 30 GLY middle . false 31 A 31 GLN middle . . 32 A 32 ALA middle . . 33 A 33 ALA middle . . 34 A 34 THR middle . . 35 A 35 VAL middle . . 36 A 36 VAL middle . . 37 A 37 LYS middle . . 38 A 38 NH2 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 HBy H 1 1.807 0.002 A 1 ARG HBx H 1 1.580 0.004 A 1 ARG HDx H 1 3.069 0.001 A 1 ARG HDy H 1 3.069 0.001 A 2 TRP HA H 1 4.823 0.001 A 2 TRP HBy H 1 3.339 0.008 A 2 TRP HBx H 1 3.220 0.004 A 2 TRP HD1 H 1 7.347 0.015 A 2 TRP HE1 H 1 10.683 0.000 A 2 TRP HE3 H 1 7.487 0.003 A 2 TRP HH2 H 1 7.069 0.002 A 2 TRP HZ2 H 1 7.380 0.001 A 2 TRP HZ3 H 1 6.912 0.003 A 3 LYS H H 1 9.136 0.004 A 3 LYS HA H 1 4.226 0.008 A 3 LYS HBx H 1 1.903 0.001 A 3 LYS HBy H 1 1.903 0.001 A 3 LYS HEx H 1 2.998 0.004 A 3 LYS HEy H 1 2.998 0.004 A 3 LYS HGx H 1 1.504 0.001 A 3 LYS HGy H 1 1.504 0.001 A 4 ILE H H 1 8.062 0.006 A 4 ILE HA H 1 3.940 0.001 A 4 ILE HB H 1 1.669 0.004 A 4 ILE HD1% H 1 0.640 0.002 A 4 ILE HG1y H 1 1.316 0.015 A 4 ILE HG1x H 1 1.086 0.006 A 4 ILE HG2% H 1 0.814 0.002 A 5 PHE H H 1 7.770 0.002 A 5 PHE HA H 1 4.319 0.001 A 5 PHE HBy H 1 3.273 0.006 A 5 PHE HBx H 1 3.156 0.005 A 5 PHE HDx H 1 7.278 0.001 A 5 PHE HEx H 1 7.274 0.001 A 5 PHE HEy H 1 7.274 0.001 A 5 PHE HZ H 1 7.246 0.001 A 6 LYS H H 1 7.957 0.003 A 6 LYS HA H 1 4.162 0.006 A 6 LYS HBx H 1 1.917 0.008 A 6 LYS HBy H 1 1.917 0.008 A 6 LYS HDx H 1 1.733 0.008 A 6 LYS HDy H 1 1.733 0.008 A 6 LYS HEx H 1 3.005 0.001 A 6 LYS HEy H 1 3.005 0.001 A 6 LYS HGx H 1 1.541 0.010 A 6 LYS HGy H 1 1.541 0.010 A 7 LYS H H 1 7.696 0.004 A 7 LYS HA H 1 4.168 0.002 A 7 LYS HBy H 1 1.960 0.005 A 7 LYS HBx H 1 1.891 0.009 A 7 LYS HDx H 1 1.681 0.002 A 7 LYS HDy H 1 1.681 0.002 A 7 LYS HEx H 1 2.901 0.004 A 7 LYS HEy H 1 2.901 0.004 A 7 LYS HGx H 1 1.524 0.010 A 7 LYS HGy H 1 1.524 0.010 A 8 ILE H H 1 7.761 0.002 A 8 ILE HA H 1 3.771 0.002 A 8 ILE HB H 1 1.967 0.003 A 8 ILE HD1% H 1 0.810 0.002 A 8 ILE HG1y H 1 1.692 0.003 A 8 ILE HG1x H 1 1.114 0.006 A 8 ILE HG2% H 1 0.886 0.008 A 9 GLU H H 1 8.101 0.003 A 9 GLU HA H 1 3.857 0.006 A 9 GLU HBy H 1 2.283 0.005 A 9 GLU HBx H 1 2.172 0.005 A 9 GLU HGx H 1 2.055 0.006 A 9 GLU HGy H 1 2.055 0.006 A 10 LYS H H 1 7.664 0.002 A 10 LYS HA H 1 4.071 0.010 A 10 LYS HBx H 1 1.951 0.012 A 10 LYS HBy H 1 1.951 0.012 A 10 LYS HDx H 1 1.687 0.003 A 10 LYS HDy H 1 1.687 0.003 A 10 LYS HEx H 1 2.979 0.003 A 10 LYS HEy H 1 2.979 0.003 A 10 LYS HGy H 1 1.535 0.006 A 10 LYS HGx H 1 1.449 0.003 A 11 VAL H H 1 7.840 0.003 A 11 VAL HA H 1 3.885 0.004 A 11 VAL HB H 1 2.192 0.007 A 11 VAL HGx% H 1 1.058 0.009 A 11 VAL HGy% H 1 0.943 0.002 A 12 GLY H H 1 8.591 0.002 A 12 GLY HAx H 1 3.728 0.011 A 12 GLY HAy H 1 3.728 0.011 A 13 ARG H H 1 8.254 0.004 A 13 ARG HA H 1 3.982 0.005 A 13 ARG HBy H 1 1.916 0.006 A 13 ARG HBx H 1 1.754 0.007 A 13 ARG HDx H 1 3.208 0.016 A 13 ARG HDy H 1 3.208 0.016 A 13 ARG HE H 1 7.588 0.003 A 13 ARG HGx H 1 1.667 0.005 A 13 ARG HGy H 1 1.667 0.005 A 14 ASN H H 1 8.060 0.002 A 14 ASN HA H 1 4.577 0.003 A 14 ASN HBy H 1 2.967 0.003 A 14 ASN HBx H 1 2.765 0.008 A 14 ASN HD2x H 1 6.953 0.006 A 14 ASN HD2y H 1 7.681 0.001 A 15 VAL H H 1 8.252 0.004 A 15 VAL HA H 1 3.838 0.011 A 15 VAL HB H 1 2.221 0.012 A 15 VAL HGx% H 1 1.023 0.002 A 15 VAL HGy% H 1 0.926 0.004 A 16 ARG H H 1 8.244 0.004 A 16 ARG HA H 1 3.888 0.002 A 16 ARG HBy H 1 2.040 0.004 A 16 ARG HBx H 1 1.845 0.005 A 16 ARG HDx H 1 3.180 0.002 A 16 ARG HDy H 1 3.180 0.002 A 16 ARG HE H 1 7.535 0.002 A 16 ARG HGy H 1 1.718 0.010 A 16 ARG HGx H 1 1.610 0.007 A 17 ASP H H 1 8.288 0.001 A 17 ASP HA H 1 4.495 0.003 A 17 ASP HBx H 1 2.706 0.016 A 17 ASP HBy H 1 2.706 0.016 A 18 GLY H H 1 7.989 0.002 A 18 GLY HAy H 1 3.937 0.002 A 18 GLY HAx H 1 3.832 0.002 A 19 ILE H H 1 8.024 0.001 A 19 ILE HA H 1 3.882 0.003 A 19 ILE HB H 1 1.971 0.006 A 19 ILE HD1% H 1 0.824 0.004 A 19 ILE HG1y H 1 1.680 0.005 A 19 ILE HG1x H 1 1.178 0.014 A 19 ILE HG2% H 1 0.898 0.003 A 20 ILE H H 1 7.709 0.005 A 20 ILE HA H 1 3.973 0.007 A 20 ILE HB H 1 1.900 0.000 A 20 ILE HD1% H 1 0.907 0.013 A 20 ILE HG1x H 1 1.579 0.003 A 20 ILE HG1y H 1 1.579 0.003 A 20 ILE HG2% H 1 1.215 0.010 A 21 LYS H H 1 7.954 0.004 A 21 LYS HA H 1 4.256 0.006 A 21 LYS HBy H 1 1.909 0.004 A 21 LYS HBx H 1 1.831 0.006 A 21 LYS HDx H 1 1.675 0.002 A 21 LYS HDy H 1 1.675 0.002 A 21 LYS HEx H 1 2.983 0.001 A 21 LYS HEy H 1 2.983 0.001 A 21 LYS HGx H 1 1.504 0.007 A 21 LYS HGy H 1 1.504 0.007 A 22 ALA H H 1 8.056 0.003 A 22 ALA HA H 1 4.265 0.003 A 22 ALA HB% H 1 1.442 0.002 A 23 GLY H H 1 8.168 0.002 A 23 GLY HAy H 1 4.123 0.002 A 23 GLY HAx H 1 3.938 0.003 A 24 PRO HA H 1 4.392 0.002 A 24 PRO HBx H 1 2.061 0.002 A 24 PRO HBy H 1 2.354 0.004 A 24 PRO HDx H 1 3.675 0.009 A 24 PRO HDy H 1 3.675 0.009 A 24 PRO HGy H 1 1.985 0.001 A 24 PRO HGx H 1 1.899 0.005 A 25 ALA H H 1 8.092 0.001 A 25 ALA HA H 1 4.197 0.008 A 25 ALA HB% H 1 1.454 0.003 A 26 VAL H H 1 7.794 0.001 A 26 VAL HA H 1 3.937 0.004 A 26 VAL HB H 1 2.199 0.003 A 26 VAL HGx% H 1 1.043 0.002 A 26 VAL HGy% H 1 0.945 0.004 A 27 ALA H H 1 7.986 0.007 A 27 ALA HA H 1 4.213 0.004 A 27 ALA HB% H 1 1.457 0.002 A 28 VAL H H 1 7.968 0.003 A 28 VAL HA H 1 3.768 0.003 A 28 VAL HB H 1 2.155 0.008 A 28 VAL HGx% H 1 1.022 0.003 A 28 VAL HGy% H 1 0.950 0.003 A 29 VAL H H 1 7.998 0.002 A 29 VAL HA H 1 3.762 0.014 A 29 VAL HB H 1 2.177 0.008 A 29 VAL HGx% H 1 1.012 0.014 A 29 VAL HGy% H 1 0.916 0.016 A 30 GLY H H 1 8.285 0.002 A 30 GLY HAy H 1 3.942 0.003 A 30 GLY HAx H 1 3.839 0.004 A 31 GLN H H 1 7.965 0.002 A 31 GLN HA H 1 4.242 0.004 A 31 GLN HBx H 1 2.141 0.007 A 31 GLN HBy H 1 2.141 0.007 A 31 GLN HE2x H 1 6.762 0.001 A 31 GLN HE2y H 1 7.413 0.000 A 31 GLN HGx H 1 2.410 0.003 A 31 GLN HGy H 1 2.410 0.003 A 32 ALA H H 1 8.265 0.005 A 32 ALA HA H 1 4.106 0.020 A 32 ALA HB% H 1 1.458 0.007 A 33 ALA H H 1 8.244 0.002 A 33 ALA HA H 1 4.083 0.011 A 33 ALA HB% H 1 1.461 0.005 A 34 THR H H 1 7.763 0.001 A 34 THR HA H 1 4.278 0.005 A 34 THR HB H 1 4.066 0.002 A 34 THR HG2% H 1 1.256 0.002 A 35 VAL H H 1 7.738 0.001 A 35 VAL HA H 1 3.940 0.007 A 35 VAL HB H 1 2.191 0.006 A 35 VAL HGx% H 1 1.033 0.006 A 35 VAL HGy% H 1 0.944 0.001 A 36 VAL H H 1 7.796 0.003 A 36 VAL HA H 1 3.935 0.006 A 36 VAL HB H 1 2.136 0.003 A 36 VAL HGx% H 1 0.983 0.003 A 36 VAL HGy% H 1 0.947 0.003 A 37 LYS H H 1 7.898 0.002 A 37 LYS HA H 1 4.167 0.002 A 37 LYS HBy H 1 1.859 0.008 A 37 LYS HBx H 1 1.805 0.011 A 37 LYS HDx H 1 1.670 0.003 A 37 LYS HDy H 1 1.670 0.003 A 37 LYS HEx H 1 2.958 0.012 A 37 LYS HEy H 1 2.958 0.012 A 37 LYS HGy H 1 1.528 0.005 A 37 LYS HGx H 1 1.471 0.027 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 34 THR HA A 34 THR HG2% 1.0 . 3.01 2 2 A 32 ALA H A 32 ALA HB% 1.0 . 3.10 3 3 A 27 ALA HB% A 28 VAL H 1.0 . 3.28 4 4 A 31 GLN H A 31 GLN HGx 1.0 . 3.72 5 4 A 31 GLN H A 31 GLN HGy 1.0 . 3.72 6 5 A 31 GLN HA A 31 GLN HGx 1.0 . 3.67 7 5 A 31 GLN HGy A 31 GLN HA 1.0 . 3.67 8 6 A 13 ARG H A 13 ARG HBx 1.0 . 3.36 9 7 A 13 ARG H A 13 ARG HBy 1.0 . 4.03 10 8 A 13 ARG H A 13 ARG HGx 1.0 . 4.16 11 8 A 13 ARG H A 13 ARG HGy 1.0 . 4.16 12 9 A 13 ARG HBx A 13 ARG HE 1.0 . 5.19 13 10 A 14 ASN H A 14 ASN HBy 1.0 . 3.98 14 11 A 14 ASN H A 14 ASN HBx 1.0 . 4.03 15 12 A 15 VAL H A 15 VAL HB 1.0 . 3.76 16 13 A 15 VAL HB A 16 ARG H 1.0 . 4.03 17 14 A 15 VAL H A 15 VAL HGx% 1.0 . 3.84 18 15 A 15 VAL H A 15 VAL HGy% 1.0 . 3.08 19 16 A 16 ARG H A 15 VAL HGy% 1.0 . 3.46 20 17 A 17 ASP H A 17 ASP HBx 1.0 . 3.41 21 17 A 17 ASP H A 17 ASP HBy 1.0 . 3.41 22 18 A 16 ARG HE A 16 ARG HBx 1.0 . 5.05 23 19 A 16 ARG H A 16 ARG HBy 1.0 . 3.93 24 20 A 16 ARG H A 16 ARG HGy 1.0 . 4.68 25 21 A 16 ARG H A 16 ARG HGx 1.0 . 4.68 26 22 A 5 PHE H A 5 PHE HBy 1.0 . 3.99 27 23 A 5 PHE H A 5 PHE HBx 1.0 . 3.99 28 24 A 9 GLU H A 9 GLU HBx 1.0 . 4.05 29 25 A 9 GLU H A 9 GLU HGx 1.0 . 4.27 30 25 A 9 GLU H A 9 GLU HGy 1.0 . 4.27 31 26 A 25 ALA H A 24 PRO HBy 1.0 . 4.63 32 27 A 8 ILE HG1y A 10 LYS H 1.0 . 5.19 33 28 A 10 LYS H A 10 LYS HDx 1.0 . 5.50 34 28 A 10 LYS H A 10 LYS HDy 1.0 . 5.50 35 29 A 10 LYS H A 10 LYS HBx 1.0 . 3.40 36 29 A 10 LYS H A 10 LYS HBy 1.0 . 3.40 37 30 A 10 LYS H A 10 LYS HGx 1.0 . 4.36 38 31 A 10 LYS H A 10 LYS HGy 1.0 . 4.44 39 32 A 6 LYS H A 6 LYS HDx 1.0 . 5.01 40 32 A 6 LYS H A 6 LYS HDy 1.0 . 5.01 41 33 A 6 LYS H A 6 LYS HGx 1.0 . 4.19 42 33 A 6 LYS H A 6 LYS HGy 1.0 . 4.19 43 34 A 7 LYS H A 7 LYS HBy 1.0 . 3.75 44 35 A 7 LYS H A 7 LYS HDx 1.0 . 4.05 45 35 A 7 LYS H A 7 LYS HDy 1.0 . 4.05 46 36 A 7 LYS H A 6 LYS HGx 1.0 . 4.36 47 36 A 6 LYS HGy A 7 LYS H 1.0 . 4.36 48 37 A 7 LYS H A 7 LYS HGx 1.0 . 4.67 49 37 A 7 LYS H A 7 LYS HGy 1.0 . 4.67 50 38 A 7 LYS HBy A 8 ILE H 1.0 . 4.07 51 39 A 8 ILE H A 8 ILE HG1x 1.0 . 3.82 52 40 A 5 PHE H A 4 ILE HG2% 1.0 . 3.76 53 41 A 8 ILE H A 8 ILE HG2% 1.0 . 3.76 54 42 A 8 ILE H A 8 ILE HG1x 1.0 . 4.15 55 43 A 19 ILE H A 19 ILE HB 1.0 . 3.70 56 44 A 11 VAL H A 11 VAL HGx% 1.0 . 3.60 57 45 A 11 VAL H A 11 VAL HGy% 1.0 . 3.32 58 46 A 28 VAL HGx% A 29 VAL H 1.0 . 4.23 59 47 A 29 VAL H A 29 VAL HGx% 1.0 . 4.49 60 48 A 29 VAL H A 29 VAL HGy% 1.0 . 4.49 61 49 A 29 VAL H A 29 VAL HGy% 1.0 . 3.81 62 50 A 4 ILE HA A 4 ILE HD1% 1.0 . 3.55 63 51 A 22 ALA H A 22 ALA HB% 1.0 . 3.04 64 52 A 21 LYS H A 21 LYS HBx 1.0 . 3.90 65 53 A 6 LYS H A 6 LYS HBx 1.0 . 3.58 66 53 A 6 LYS H A 6 LYS HBy 1.0 . 3.58 67 54 A 21 LYS H A 21 LYS HBy 1.0 . 3.90 68 55 A 21 LYS H A 21 LYS HDx 1.0 . 4.38 69 55 A 21 LYS H A 21 LYS HDy 1.0 . 4.38 70 56 A 7 LYS H A 7 LYS HBx 1.0 . 3.91 71 57 A 20 ILE H A 20 ILE HB 1.0 . 3.86 72 58 A 20 ILE H A 20 ILE HG1x 1.0 . 4.25 73 58 A 20 ILE H A 20 ILE HG1y 1.0 . 4.25 74 59 A 20 ILE H A 20 ILE HG2% 1.0 . 3.95 75 60 A 20 ILE H A 19 ILE HG2% 1.0 . 3.55 76 61 A 2 TRP HBx A 2 TRP HZ3 1.0 . 5.02 77 62 A 2 TRP HZ3 A 2 TRP HBy 1.0 . 5.50 78 63 A 2 TRP HA A 2 TRP HD1 1.0 . 4.29 79 64 A 4 ILE H A 4 ILE HB 1.0 . 3.62 80 65 A 4 ILE H A 4 ILE HG1y 1.0 . 4.76 81 66 A 4 ILE H A 4 ILE HG1x 1.0 . 4.76 82 67 A 4 ILE HG2% A 4 ILE H 1.0 . 4.03 83 68 A 4 ILE HD1% A 4 ILE H 1.0 . 4.26 84 69 A 5 PHE HA A 5 PHE HDx 1.0 . 3.48 85 70 A 19 ILE H A 19 ILE HG2% 1.0 . 3.98 86 71 A 19 ILE H A 19 ILE HG1x 1.0 . 4.27 87 72 A 19 ILE H A 19 ILE HG1y 1.0 . 4.27 88 73 A 19 ILE H A 19 ILE HD1% 1.0 . 3.99 89 74 A 21 LYS H A 21 LYS HGx 1.0 . 4.31 90 74 A 21 LYS H A 21 LYS HGy 1.0 . 4.31 91 75 A 26 VAL H A 26 VAL HGx% 1.0 . 3.32 92 76 A 35 VAL HGy% A 36 VAL H 1.0 . 3.71 93 77 A 28 VAL H A 28 VAL HGx% 1.0 . 3.06 94 78 A 28 VAL H A 28 VAL HGy% 1.0 . 3.21 95 79 A 31 GLN H A 31 GLN HBx 1.0 . 3.12 96 79 A 31 GLN H A 31 GLN HBy 1.0 . 3.12 97 80 A 14 ASN HA A 14 ASN HD2x 1.0 . 4.43 98 81 A 14 ASN HA A 14 ASN HD2y 1.0 . 4.43 99 82 A 16 ARG H A 16 ARG HBx 1.0 . 3.93 100 83 A 16 ARG HE A 16 ARG HA 1.0 . 5.39 101 84 A 16 ARG HE A 16 ARG HBy 1.0 . 5.05 102 85 A 14 ASN H A 14 ASN HD2x 1.0 . 4.74 103 86 A 5 PHE H A 5 PHE HDx 1.0 . 3.94 104 87 A 16 ARG H A 16 ARG HDx 1.0 . 4.69 105 87 A 16 ARG H A 16 ARG HDy 1.0 . 4.69 106 88 A 6 LYS H A 5 PHE HA 1.0 . 4.47 107 89 A 37 LYS H A 37 LYS HBx 1.0 . 3.96 108 90 A 37 LYS H A 37 LYS HBy 1.0 . 3.73 109 91 A 37 LYS H A 37 LYS HDx 1.0 . 4.75 110 91 A 37 LYS H A 37 LYS HDy 1.0 . 4.75 111 92 A 36 VAL H A 36 VAL HB 1.0 . 3.49 112 93 A 32 ALA H A 31 GLN HBx 1.0 . 3.51 113 93 A 32 ALA H A 31 GLN HBy 1.0 . 3.51 114 94 A 26 VAL H A 26 VAL HGx% 1.0 . 4.07 115 95 A 36 VAL H A 36 VAL HGx% 1.0 . 4.37 116 96 A 36 VAL H A 36 VAL HGy% 1.0 . 4.37 117 97 A 35 VAL H A 35 VAL HB 1.0 . 3.64 118 98 A 35 VAL H A 35 VAL HGx% 1.0 . 3.27 119 99 A 35 VAL HGy% A 35 VAL H 1.0 . 3.65 120 100 A 34 THR HG2% A 34 THR H 1.0 . 3.78 121 101 A 25 ALA H A 25 ALA HB% 1.0 . 2.94 122 102 A 11 VAL H A 11 VAL HB 1.0 . 3.64 123 103 A 5 PHE H A 4 ILE H 1.0 . 4.31 124 104 A 5 PHE H A 6 LYS H 1.0 . 3.89 125 105 A 6 LYS H A 7 LYS H 1.0 . 4.35 126 106 A 7 LYS H A 8 ILE H 1.0 . 3.94 127 107 A 9 GLU H A 8 ILE H 1.0 . 4.07 128 108 A 9 GLU H A 10 LYS H 1.0 . 4.07 129 109 A 10 LYS H A 11 VAL H 1.0 . 4.05 130 110 A 11 VAL H A 12 GLY H 1.0 . 4.03 131 111 A 13 ARG H A 12 GLY H 1.0 . 3.90 132 112 A 13 ARG H A 14 ASN H 1.0 . 3.97 133 113 A 14 ASN H A 15 VAL H 1.0 . 4.05 134 114 A 15 VAL H A 16 ARG H 1.0 . 2.40 135 115 A 16 ARG H A 17 ASP H 1.0 . 4.15 136 116 A 17 ASP H A 18 GLY H 1.0 . 3.49 137 117 A 19 ILE H A 18 GLY H 1.0 . 3.45 138 118 A 19 ILE H A 20 ILE H 1.0 . 4.00 139 119 A 5 PHE H A 4 ILE HD1% 1.0 . 3.75 140 120 A 21 LYS H A 20 ILE H 1.0 . 4.46 141 121 A 22 ALA H A 21 LYS H 1.0 . 3.75 142 122 A 22 ALA H A 23 GLY H 1.0 . 3.82 143 123 A 25 ALA H A 26 VAL H 1.0 . 4.59 144 124 A 26 VAL H A 27 ALA H 1.0 . 3.49 145 125 A 28 VAL H A 27 ALA H 1.0 . 2.40 146 126 A 28 VAL H A 29 VAL H 1.0 . 3.22 147 127 A 29 VAL H A 30 GLY H 1.0 . 3.86 148 128 A 31 GLN H A 30 GLY H 1.0 . 3.81 149 129 A 32 ALA H A 31 GLN H 1.0 . 3.82 150 130 A 32 ALA H A 33 ALA H 1.0 . 2.80 151 131 A 34 THR H A 33 ALA H 1.0 . 4.10 152 132 A 35 VAL H A 34 THR H 1.0 . 2.90 153 133 A 36 VAL H A 35 VAL H 1.0 . 3.46 154 134 A 36 VAL H A 37 LYS H 1.0 . 3.75 155 135 A 37 LYS H A 35 VAL H 1.0 . 4.95 156 136 A 36 VAL H A 34 THR H 1.0 . 2.97 157 137 A 37 LYS H A 34 THR HB 1.0 . 4.26 158 138 A 37 LYS H A 36 VAL HA 1.0 . 3.82 159 139 A 11 VAL H A 7 LYS HA 1.0 . 4.67 160 140 A 36 VAL H A 35 VAL HA 1.0 . 3.08 161 141 A 36 VAL H A 33 ALA HA 1.0 . 4.14 162 142 A 35 VAL H A 33 ALA H 1.0 . 5.50 163 143 A 32 ALA H A 34 THR H 1.0 . 4.03 164 144 A 31 GLN H A 33 ALA H 1.0 . 4.77 165 145 A 32 ALA H A 30 GLY H 1.0 . 2.62 166 146 A 31 GLN H A 29 VAL H 1.0 . 4.43 167 147 A 28 VAL H A 30 GLY H 1.0 . 3.57 168 148 A 29 VAL H A 27 ALA H 1.0 . 2.40 169 149 A 28 VAL H A 26 VAL H 1.0 . 3.71 170 150 A 25 ALA H A 27 ALA H 1.0 . 3.87 171 151 A 21 LYS H A 23 GLY H 1.0 . 4.91 172 152 A 22 ALA H A 20 ILE H 1.0 . 4.59 173 153 A 17 ASP H A 19 ILE H 1.0 . 4.34 174 154 A 16 ARG H A 18 GLY H 1.0 . 4.73 175 155 A 15 VAL H A 17 ASP H 1.0 . 2.99 176 156 A 14 ASN H A 16 ARG H 1.0 . 4.47 177 157 A 14 ASN H A 12 GLY H 1.0 . 4.84 178 158 A 13 ARG H A 11 VAL H 1.0 . 4.72 179 159 A 10 LYS H A 12 GLY H 1.0 . 4.80 180 160 A 9 GLU H A 11 VAL H 1.0 . 4.80 181 161 A 10 LYS H A 8 ILE H 1.0 . 4.69 182 162 A 9 GLU H A 7 LYS H 1.0 . 4.52 183 163 A 6 LYS H A 8 ILE H 1.0 . 4.33 184 164 A 5 PHE H A 7 LYS H 1.0 . 3.94 185 165 A 6 LYS H A 4 ILE H 1.0 . 4.40 186 166 A 4 ILE H A 3 LYS H 1.0 . 5.27 187 167 A 3 LYS H A 2 TRP HZ2 1.0 . 5.50 188 168 A 34 THR HA A 35 VAL H 1.0 . 3.95 189 169 A 35 VAL H A 34 THR HB 1.0 . 3.75 190 170 A 35 VAL H A 32 ALA HA 1.0 . 4.32 191 171 A 34 THR H A 34 THR HB 1.0 . 3.24 192 172 A 34 THR H A 33 ALA HA 1.0 . 3.40 193 173 A 31 GLN HA A 34 THR H 1.0 . 3.88 194 174 A 33 ALA H A 32 ALA HA 1.0 . 4.26 195 175 A 33 ALA H A 30 GLY HAx 1.0 . 3.54 196 176 A 33 ALA H A 29 VAL HA 1.0 . 4.58 197 177 A 32 ALA H A 31 GLN HA 1.0 . 3.95 198 178 A 32 ALA H A 29 VAL HA 1.0 . 4.11 199 179 A 32 ALA H A 29 VAL HA 1.0 . 4.74 200 180 A 31 GLN H A 28 VAL HA 1.0 . 3.78 201 181 A 31 GLN H A 30 GLY HAx 1.0 . 3.16 202 182 A 31 GLN H A 30 GLY HAx 1.0 . 3.94 203 183 A 31 GLN H A 27 ALA HA 1.0 . 4.89 204 184 A 30 GLY H A 29 VAL HA 1.0 . 4.36 205 185 A 30 GLY H A 27 ALA HA 1.0 . 4.10 206 186 A 30 GLY H A 26 VAL HA 1.0 . 3.70 207 187 A 29 VAL H A 28 VAL HA 1.0 . 4.01 208 188 A 29 VAL H A 26 VAL HA 1.0 . 3.54 209 189 A 29 VAL H A 25 ALA HA 1.0 . 4.56 210 190 A 28 VAL H A 27 ALA HA 1.0 . 4.26 211 191 A 28 VAL H A 25 ALA HA 1.0 . 3.99 212 192 A 27 ALA H A 26 VAL HA 1.0 . 3.99 213 193 A 27 ALA H A 24 PRO HA 1.0 . 4.45 214 194 A 25 ALA H A 24 PRO HA 1.0 . 3.54 215 195 A 23 GLY H A 24 PRO HDx 1.0 . 3.82 216 195 A 23 GLY H A 24 PRO HDy 1.0 . 3.82 217 196 A 25 ALA H A 24 PRO HDx 1.0 . 5.13 218 196 A 25 ALA H A 24 PRO HDy 1.0 . 5.13 219 197 A 3 LYS HA A 3 LYS HEx 1.0 . 5.14 220 197 A 3 LYS HA A 3 LYS HEy 1.0 . 5.14 221 198 A 6 LYS HA A 6 LYS HGx 1.0 . 3.94 222 198 A 6 LYS HGy A 6 LYS HA 1.0 . 3.94 223 199 A 7 LYS HA A 7 LYS HGx 1.0 . 3.66 224 199 A 7 LYS HGy A 7 LYS HA 1.0 . 3.66 225 200 A 7 LYS HA A 10 LYS HBx 1.0 . 3.90 226 200 A 10 LYS HBy A 7 LYS HA 1.0 . 3.90 227 201 A 7 LYS HA A 7 LYS HDx 1.0 . 4.46 228 201 A 7 LYS HDy A 7 LYS HA 1.0 . 4.46 229 202 A 37 LYS HA A 37 LYS HDx 1.0 . 4.79 230 202 A 37 LYS HDy A 37 LYS HA 1.0 . 4.79 231 203 A 6 LYS HA A 6 LYS HDx 1.0 . 3.97 232 203 A 6 LYS HDy A 6 LYS HA 1.0 . 3.97 233 204 A 21 LYS HA A 21 LYS HDx 1.0 . 4.08 234 204 A 21 LYS HDy A 21 LYS HA 1.0 . 4.08 235 205 A 10 LYS HA A 10 LYS HDx 1.0 . 4.30 236 205 A 10 LYS HDy A 10 LYS HA 1.0 . 4.30 237 206 A 20 ILE HA A 20 ILE HG1x 1.0 . 3.89 238 206 A 20 ILE HG1y A 20 ILE HA 1.0 . 3.89 239 207 A 20 ILE HG2% A 20 ILE HA 1.0 . 3.75 240 208 A 19 ILE HG2% A 20 ILE HA 1.0 . 3.67 241 209 A 20 ILE HA A 20 ILE HD1% 1.0 . 3.95 242 210 A 26 VAL HGx% A 26 VAL HA 1.0 . 3.44 243 211 A 4 ILE HG2% A 4 ILE HA 1.0 . 3.35 244 212 A 36 VAL HGy% A 36 VAL HA 1.0 . 3.40 245 213 A 26 VAL HA A 26 VAL HGy% 1.0 . 3.03 246 214 A 35 VAL HGx% A 35 VAL HA 1.0 . 3.44 247 215 A 36 VAL HGx% A 36 VAL HA 1.0 . 3.40 248 216 A 16 ARG HA A 16 ARG HDx 1.0 . 4.29 249 216 A 16 ARG HA A 16 ARG HDy 1.0 . 4.29 250 217 A 16 ARG HA A 16 ARG HGx 1.0 . 4.02 251 218 A 16 ARG HA A 16 ARG HGy 1.0 . 4.02 252 219 A 16 ARG HA A 16 ARG HGx 1.0 . 3.52 253 219 A 16 ARG HA A 16 ARG HGy 1.0 . 3.52 254 220 A 19 ILE HB A 16 ARG HA 1.0 . 3.73 255 221 A 19 ILE HA A 19 ILE HG1y 1.0 . 3.97 256 222 A 19 ILE HA A 19 ILE HG1x 1.0 . 3.46 257 222 A 19 ILE HA A 19 ILE HG1y 1.0 . 3.46 258 223 A 20 ILE HG2% A 16 ARG HA 1.0 . 4.77 259 224 A 19 ILE HG2% A 19 ILE HA 1.0 . 3.04 260 225 A 19 ILE HD1% A 16 ARG HA 1.0 . 3.51 261 226 A 19 ILE HD1% A 19 ILE HA 1.0 . 4.03 262 227 A 11 VAL HGy% A 11 VAL HA 1.0 . 3.12 263 228 A 11 VAL HGx% A 11 VAL HA 1.0 . 3.37 264 229 A 9 GLU HA A 9 GLU HGx 1.0 . 3.55 265 229 A 9 GLU HGy A 9 GLU HA 1.0 . 3.55 266 230 A 8 ILE HG1y A 8 ILE HA 1.0 . 4.02 267 231 A 8 ILE HG2% A 8 ILE HA 1.0 . 3.23 268 232 A 8 ILE HA A 8 ILE HD1% 1.0 . 3.74 269 233 A 28 VAL HGx% A 28 VAL HA 1.0 . 2.90 270 234 A 29 VAL HGx% A 29 VAL HA 1.0 . 3.02 271 235 A 11 VAL HGy% A 8 ILE HA 1.0 . 2.78 272 236 A 15 VAL HA A 15 VAL HGx% 1.0 . 3.29 273 237 A 15 VAL HA A 15 VAL HGy% 1.0 . 3.29 274 238 A 16 ARG HDy A 16 ARG HBx 1.0 . 4.08 275 238 A 16 ARG HBx A 16 ARG HDx 1.0 . 4.08 276 239 A 13 ARG HBy A 13 ARG HDx 1.0 . 4.08 277 239 A 13 ARG HBy A 13 ARG HDy 1.0 . 4.08 278 240 A 13 ARG HBx A 13 ARG HDx 1.0 . 4.01 279 240 A 13 ARG HBx A 13 ARG HDy 1.0 . 4.01 280 241 A 10 LYS HGy A 10 LYS HEx 1.0 . 3.96 281 241 A 10 LYS HEy A 10 LYS HGy 1.0 . 3.96 282 242 A 7 LYS HEx A 7 LYS HGx 1.0 . 4.03 283 242 A 7 LYS HEy A 7 LYS HGx 1.0 . 4.03 284 242 A 7 LYS HGy A 7 LYS HEx 1.0 . 4.03 285 242 A 7 LYS HGy A 7 LYS HEy 1.0 . 4.03 286 243 A 7 LYS HBx A 7 LYS HEx 1.0 . 4.64 287 243 A 7 LYS HBx A 7 LYS HEy 1.0 . 4.64 288 244 A 7 LYS HBy A 7 LYS HEx 1.0 . 4.95 289 244 A 7 LYS HBy A 7 LYS HEy 1.0 . 4.95 290 245 A 3 LYS HBy A 3 LYS HEx 1.0 . 4.49 291 245 A 3 LYS HEy A 3 LYS HBx 1.0 . 4.49 292 245 A 3 LYS HEy A 3 LYS HBy 1.0 . 4.49 293 245 A 3 LYS HBx A 3 LYS HEx 1.0 . 4.49 294 246 A 21 LYS HBy A 21 LYS HEx 1.0 . 4.75 295 246 A 21 LYS HBx A 21 LYS HEx 1.0 . 4.75 296 246 A 21 LYS HEy A 21 LYS HBx 1.0 . 4.75 297 246 A 21 LYS HBy A 21 LYS HEy 1.0 . 4.75 298 247 A 10 LYS HBy A 10 LYS HEx 1.0 . 4.37 299 247 A 10 LYS HBx A 10 LYS HEx 1.0 . 4.37 300 247 A 10 LYS HEy A 10 LYS HBx 1.0 . 4.37 301 247 A 10 LYS HBy A 10 LYS HEy 1.0 . 4.37 302 248 A 6 LYS HBy A 6 LYS HEx 1.0 . 5.08 303 248 A 6 LYS HBx A 6 LYS HEx 1.0 . 5.08 304 248 A 6 LYS HEy A 6 LYS HBx 1.0 . 5.08 305 248 A 6 LYS HBy A 6 LYS HEy 1.0 . 5.08 306 249 A 1 ARG HDy A 1 ARG HBx 1.0 . 3.45 307 249 A 1 ARG HBx A 1 ARG HDx 1.0 . 3.45 308 250 A 37 LYS H A 37 LYS HGy 1.0 . 4.29 309 251 A 10 LYS HEx A 10 LYS HGx 1.0 . 3.96 310 251 A 10 LYS HEy A 10 LYS HGx 1.0 . 3.96 311 252 A 2 TRP HA A 2 TRP HE1 1.0 . 4.76 312 253 A 2 TRP HA A 3 LYS H 1.0 . 4.88 313 254 A 26 VAL H A 25 ALA HA 1.0 . 3.81 314 255 A 23 GLY H A 22 ALA HA 1.0 . 3.65 315 256 A 22 ALA H A 21 LYS HA 1.0 . 3.27 316 257 A 21 LYS H A 20 ILE HA 1.0 . 3.92 317 258 A 20 ILE H A 19 ILE HA 1.0 . 4.12 318 259 A 19 ILE H A 18 GLY HAx 1.0 . 4.26 319 260 A 19 ILE H A 18 GLY HAy 1.0 . 4.17 320 261 A 18 GLY H A 17 ASP HA 1.0 . 4.36 321 262 A 17 ASP H A 16 ARG HA 1.0 . 4.21 322 263 A 16 ARG H A 15 VAL HA 1.0 . 4.22 323 264 A 15 VAL H A 14 ASN HA 1.0 . 4.03 324 265 A 14 ASN H A 13 ARG HA 1.0 . 4.06 325 266 A 13 ARG H A 12 GLY HAx 1.0 . 4.61 326 266 A 13 ARG H A 12 GLY HAy 1.0 . 4.61 327 267 A 12 GLY H A 11 VAL HA 1.0 . 4.61 328 268 A 11 VAL H A 10 LYS HA 1.0 . 4.28 329 269 A 10 LYS H A 9 GLU HA 1.0 . 4.23 330 270 A 9 GLU H A 8 ILE HA 1.0 . 4.20 331 271 A 8 ILE H A 7 LYS HA 1.0 . 4.23 332 272 A 7 LYS H A 6 LYS HA 1.0 . 4.23 333 273 A 5 PHE H A 4 ILE HA 1.0 . 4.00 334 274 A 8 ILE H A 4 ILE HA 1.0 . 4.43 335 275 A 4 ILE H A 3 LYS HA 1.0 . 4.26 336 276 A 37 LYS H A 36 VAL HB 1.0 . 4.05 337 277 A 37 LYS H A 36 VAL HGy% 1.0 . 4.12 338 278 A 37 LYS H A 36 VAL HGx% 1.0 . 4.12 339 279 A 34 THR HG2% A 37 LYS H 1.0 . 4.96 340 280 A 35 VAL HGy% A 37 LYS H 1.0 . 4.80 341 281 A 37 LYS H A 33 ALA HB% 1.0 . 4.91 342 282 A 37 LYS H A 33 ALA HA 1.0 . 4.26 343 283 A 26 VAL H A 26 VAL HB 1.0 . 3.24 344 284 A 36 VAL H A 32 ALA HA 1.0 . 4.86 345 285 A 34 THR HG2% A 35 VAL H 1.0 . 3.99 346 286 A 32 ALA HB% A 35 VAL H 1.0 . 5.29 347 287 A 35 VAL H A 33 ALA HB% 1.0 . 5.50 348 288 A 34 THR H A 33 ALA HB% 1.0 . 3.30 349 289 A 32 ALA HB% A 33 ALA H 1.0 . 3.09 350 290 A 33 ALA H A 33 ALA HB% 1.0 . 3.22 351 291 A 32 ALA H A 31 GLN HGx 1.0 . 4.56 352 291 A 32 ALA H A 31 GLN HGy 1.0 . 4.56 353 292 A 15 VAL H A 15 VAL HGy% 1.0 . 3.84 354 293 A 30 GLY H A 29 VAL HB 1.0 . 3.64 355 294 A 29 VAL HGy% A 30 GLY H 1.0 . 4.34 356 295 A 29 VAL HGx% A 30 GLY H 1.0 . 4.34 357 296 A 28 VAL HGy% A 30 GLY H 1.0 . 4.13 358 297 A 29 VAL H A 29 VAL HB 1.0 . 3.30 359 298 A 27 ALA HB% A 27 ALA H 1.0 . 2.94 360 299 A 29 VAL H A 28 VAL HGy% 1.0 . 3.42 361 300 A 26 VAL H A 25 ALA HB% 1.0 . 3.27 362 301 A 25 ALA H A 24 PRO HBx 1.0 . 4.63 363 302 A 9 GLU H A 7 LYS HBx 1.0 . 4.77 364 303 A 22 ALA HB% A 23 GLY H 1.0 . 3.46 365 304 A 23 GLY H A 19 ILE HG1x 1.0 . 5.18 366 305 A 23 GLY H A 24 PRO HGy 1.0 . 4.58 367 306 A 19 ILE HB A 23 GLY H 1.0 . 5.50 368 307 A 23 GLY H A 24 PRO HGx 1.0 . 5.50 369 308 A 22 ALA H A 18 GLY HAx 1.0 . 4.85 370 309 A 22 ALA H A 18 GLY HAy 1.0 . 4.85 371 310 A 14 ASN H A 11 VAL HA 1.0 . 3.87 372 311 A 22 ALA H A 19 ILE HA 1.0 . 3.87 373 312 A 22 ALA H A 21 LYS HBx 1.0 . 4.31 374 313 A 21 LYS H A 18 GLY HAy 1.0 . 3.34 375 314 A 21 LYS H A 18 GLY HAx 1.0 . 3.95 376 315 A 21 LYS H A 20 ILE HG2% 1.0 . 4.16 377 316 A 21 LYS H A 20 ILE HD1% 1.0 . 3.59 378 317 A 20 ILE H A 17 ASP HA 1.0 . 4.56 379 318 A 20 ILE H A 16 ARG HA 1.0 . 4.44 380 319 A 19 ILE H A 16 ARG HA 1.0 . 3.55 381 320 A 19 ILE H A 15 VAL HA 1.0 . 4.08 382 321 A 19 ILE H A 17 ASP HBx 1.0 . 5.07 383 321 A 17 ASP HBy A 19 ILE H 1.0 . 5.07 384 322 A 14 ASN HA A 18 GLY H 1.0 . 4.69 385 323 A 18 GLY H A 15 VAL HA 1.0 . 3.54 386 324 A 17 ASP H A 14 ASN HA 1.0 . 4.19 387 325 A 17 ASP H A 16 ARG HBy 1.0 . 4.19 388 326 A 18 GLY H A 17 ASP HBx 1.0 . 3.93 389 326 A 17 ASP HBy A 18 GLY H 1.0 . 3.93 390 327 A 16 ARG H A 17 ASP HA 1.0 . 5.50 391 328 A 31 GLN HA A 33 ALA H 1.0 . 5.03 392 329 A 17 ASP H A 13 ARG HA 1.0 . 4.16 393 330 A 17 ASP H A 16 ARG HDx 1.0 . 4.78 394 330 A 17 ASP H A 16 ARG HDy 1.0 . 4.78 395 331 A 14 ASN HBy A 17 ASP H 1.0 . 5.50 396 332 A 14 ASN HBx A 17 ASP H 1.0 . 5.50 397 333 A 17 ASP H A 16 ARG HBx 1.0 . 4.19 398 334 A 17 ASP H A 13 ARG HGx 1.0 . 4.50 399 334 A 13 ARG HGy A 17 ASP H 1.0 . 4.50 400 335 A 17 ASP H A 16 ARG HGx 1.0 . 4.92 401 336 A 17 ASP H A 16 ARG HGy 1.0 . 4.92 402 337 A 17 ASP H A 19 ILE HD1% 1.0 . 5.03 403 338 A 16 ARG H A 13 ARG HA 1.0 . 4.14 404 339 A 14 ASN HBy A 15 VAL H 1.0 . 4.18 405 340 A 14 ASN HBx A 15 VAL H 1.0 . 4.22 406 341 A 15 VAL H A 11 VAL HA 1.0 . 3.98 407 342 A 15 VAL H A 12 GLY HAx 1.0 . 4.40 408 342 A 15 VAL H A 12 GLY HAy 1.0 . 4.40 409 343 A 13 ARG HBy A 14 ASN H 1.0 . 4.93 410 344 A 4 ILE H A 3 LYS HBx 1.0 . 3.66 411 344 A 4 ILE H A 3 LYS HBy 1.0 . 3.66 412 345 A 22 ALA H A 21 LYS HBy 1.0 . 4.31 413 346 A 22 ALA H A 21 LYS HBx 1.0 . 3.78 414 346 A 22 ALA H A 21 LYS HBy 1.0 . 3.78 415 347 A 13 ARG H A 10 LYS HA 1.0 . 3.50 416 348 A 13 ARG H A 9 GLU HA 1.0 . 3.91 417 349 A 12 GLY H A 8 ILE HA 1.0 . 4.00 418 350 A 12 GLY H A 9 GLU HA 1.0 . 4.35 419 351 A 11 VAL HB A 12 GLY H 1.0 . 4.03 420 352 A 12 GLY H A 10 LYS HBx 1.0 . 4.50 421 352 A 10 LYS HBy A 12 GLY H 1.0 . 4.50 422 353 A 11 VAL HGy% A 12 GLY H 1.0 . 3.99 423 354 A 11 VAL HGx% A 12 GLY H 1.0 . 3.87 424 355 A 8 ILE HG2% A 12 GLY H 1.0 . 5.50 425 356 A 12 GLY H A 10 LYS HA 1.0 . 5.00 426 357 A 11 VAL H A 8 ILE HA 1.0 . 4.20 427 358 A 11 VAL H A 10 LYS HBx 1.0 . 3.77 428 358 A 10 LYS HBy A 11 VAL H 1.0 . 3.77 429 359 A 11 VAL H A 10 LYS HDx 1.0 . 4.63 430 359 A 10 LYS HDy A 11 VAL H 1.0 . 4.63 431 360 A 11 VAL H A 7 LYS HGx 1.0 . 4.98 432 360 A 7 LYS HGy A 11 VAL H 1.0 . 4.98 433 361 A 11 VAL H A 10 LYS HGx 1.0 . 4.11 434 361 A 11 VAL H A 10 LYS HGy 1.0 . 4.11 435 362 A 10 LYS H A 6 LYS HA 1.0 . 4.98 436 363 A 10 LYS H A 7 LYS HA 1.0 . 5.30 437 364 A 10 LYS H A 8 ILE HA 1.0 . 4.72 438 365 A 10 LYS H A 9 GLU HBy 1.0 . 4.96 439 366 A 9 GLU HBx A 10 LYS H 1.0 . 4.41 440 367 A 10 LYS H A 9 GLU HGx 1.0 . 4.14 441 367 A 9 GLU HGy A 10 LYS H 1.0 . 4.14 442 368 A 10 LYS H A 8 ILE HD1% 1.0 . 4.85 443 369 A 9 GLU H A 6 LYS HA 1.0 . 3.81 444 370 A 9 GLU H A 5 PHE HA 1.0 . 4.72 445 371 A 9 GLU H A 8 ILE HB 1.0 . 3.99 446 372 A 9 GLU H A 8 ILE HG1x 1.0 . 4.29 447 373 A 9 GLU H A 8 ILE HG1y 1.0 . 4.89 448 374 A 9 GLU H A 8 ILE HG2% 1.0 . 4.08 449 375 A 9 GLU H A 8 ILE HD1% 1.0 . 4.22 450 376 A 8 ILE H A 5 PHE HA 1.0 . 4.39 451 377 A 8 ILE H A 4 ILE HA 1.0 . 3.86 452 378 A 8 ILE H A 7 LYS HBx 1.0 . 4.12 453 379 A 8 ILE H A 7 LYS HGx 1.0 . 4.75 454 379 A 7 LYS HGy A 8 ILE H 1.0 . 4.75 455 380 A 7 LYS H A 4 ILE HD1% 1.0 . 5.22 456 381 A 6 LYS H A 4 ILE HD1% 1.0 . 4.93 457 382 A 7 LYS H A 5 PHE HA 1.0 . 4.78 458 383 A 7 LYS H A 4 ILE HA 1.0 . 4.27 459 384 A 20 ILE H A 19 ILE HD1% 1.0 . 4.42 460 385 A 19 ILE HG2% A 23 GLY H 1.0 . 4.44 461 386 A 28 VAL HGx% A 23 GLY H 1.0 . 4.44 462 387 A 28 VAL HGy% A 23 GLY H 1.0 . 4.47 463 388 A 6 LYS H A 3 LYS HA 1.0 . 3.58 464 389 A 6 LYS H A 5 PHE HBy 1.0 . 4.48 465 390 A 6 LYS H A 5 PHE HBx 1.0 . 4.48 466 391 A 21 LYS H A 21 LYS HEx 1.0 . 4.93 467 391 A 21 LYS H A 21 LYS HEy 1.0 . 4.93 468 392 A 22 ALA H A 28 VAL HGy% 1.0 . 4.61 469 393 A 25 ALA H A 28 VAL HGy% 1.0 . 4.82 470 394 A 9 GLU H A 11 VAL HGy% 1.0 . 4.54 471 395 A 25 ALA H A 28 VAL HGy% 1.0 . 4.83 472 396 A 13 ARG H A 14 ASN HD2x 1.0 . 5.34 473 396 A 13 ARG H A 14 ASN HD2y 1.0 . 5.34 474 397 A 15 VAL H A 14 ASN HD2x 1.0 . 5.34 475 397 A 15 VAL H A 14 ASN HD2y 1.0 . 5.34 476 398 A 2 TRP HZ2 A 3 LYS HBx 1.0 . 5.50 477 398 A 2 TRP HZ2 A 3 LYS HBy 1.0 . 5.50 478 399 A 8 ILE HG1x A 5 PHE HDx 1.0 . 4.62 479 400 A 14 ASN HD2x A 11 VAL HA 1.0 . 4.58 480 400 A 14 ASN HD2y A 11 VAL HA 1.0 . 4.58 481 401 A 14 ASN HA A 17 ASP HBx 1.0 . 3.87 482 401 A 17 ASP HBy A 14 ASN HA 1.0 . 3.87 483 402 A 14 ASN HBx A 11 VAL HA 1.0 . 4.67 484 403 A 4 ILE HA A 3 LYS HA 1.0 . 5.15 485 404 A 27 ALA HA A 26 VAL HA 1.0 . 5.49 486 405 A 21 LYS HA A 20 ILE HA 1.0 . 4.86 487 406 A 6 LYS HA A 9 GLU HA 1.0 . 5.50 488 407 A 28 VAL HA A 27 ALA HA 1.0 . 4.94 489 408 A 22 ALA HA A 24 PRO HDx 1.0 . 4.87 490 408 A 24 PRO HDy A 22 ALA HA 1.0 . 4.87 491 409 A 20 ILE HA A 19 ILE HA 1.0 . 4.79 492 410 A 31 GLN HA A 30 GLY HAx 1.0 . 4.97 493 411 A 15 VAL HA A 12 GLY HAx 1.0 . 4.14 494 411 A 15 VAL HA A 12 GLY HAy 1.0 . 4.14 495 412 A 13 ARG HA A 16 ARG HDx 1.0 . 4.15 496 412 A 16 ARG HDy A 13 ARG HA 1.0 . 4.15 497 413 A 13 ARG HA A 13 ARG HDx 1.0 . 4.62 498 413 A 13 ARG HDy A 13 ARG HA 1.0 . 4.62 499 414 A 20 ILE HA A 21 LYS HEx 1.0 . 5.50 500 414 A 20 ILE HA A 21 LYS HEy 1.0 . 5.50 501 415 A 14 ASN HBy A 11 VAL HA 1.0 . 4.21 502 416 A 10 LYS HA A 10 LYS HEx 1.0 . 4.80 503 416 A 10 LYS HA A 10 LYS HEy 1.0 . 4.80 504 417 A 7 LYS HA A 7 LYS HEx 1.0 . 4.75 505 417 A 7 LYS HA A 7 LYS HEy 1.0 . 4.75 506 418 A 21 LYS HA A 21 LYS HEx 1.0 . 4.72 507 418 A 21 LYS HA A 21 LYS HEy 1.0 . 4.72 508 419 A 6 LYS HA A 6 LYS HEx 1.0 . 5.08 509 419 A 6 LYS HA A 6 LYS HEy 1.0 . 5.08 510 420 A 7 LYS HA A 10 LYS HEx 1.0 . 5.50 511 420 A 7 LYS HA A 10 LYS HEy 1.0 . 5.50 512 421 A 16 ARG HA A 17 ASP HBx 1.0 . 5.50 513 421 A 17 ASP HBy A 16 ARG HA 1.0 . 5.50 514 422 A 17 ASP HBx A 18 GLY HAx 1.0 . 4.59 515 422 A 17 ASP HBy A 18 GLY HAx 1.0 . 4.59 516 422 A 18 GLY HAy A 17 ASP HBx 1.0 . 4.59 517 422 A 17 ASP HBy A 18 GLY HAy 1.0 . 4.59 518 423 A 13 ARG HA A 17 ASP HBx 1.0 . 4.97 519 423 A 17 ASP HBy A 13 ARG HA 1.0 . 4.97 520 424 A 30 GLY HAy A 31 GLN HGx 1.0 . 5.36 521 424 A 31 GLN HGy A 30 GLY HAy 1.0 . 5.36 522 425 A 6 LYS HA A 9 GLU HBy 1.0 . 4.62 523 426 A 35 VAL HB A 32 ALA HA 1.0 . 4.86 524 427 A 36 VAL HB A 33 ALA HA 1.0 . 4.05 525 428 A 6 LYS HA A 9 GLU HGx 1.0 . 4.15 526 428 A 9 GLU HGy A 6 LYS HA 1.0 . 4.15 527 429 A 10 LYS HA A 9 GLU HGx 1.0 . 4.82 528 429 A 9 GLU HGy A 10 LYS HA 1.0 . 4.82 529 430 A 15 VAL HB A 12 GLY HAx 1.0 . 4.83 530 430 A 15 VAL HB A 12 GLY HAy 1.0 . 4.83 531 431 A 11 VAL HB A 12 GLY HAx 1.0 . 4.89 532 431 A 11 VAL HB A 12 GLY HAy 1.0 . 4.89 533 432 A 37 LYS HBy A 33 ALA HA 1.0 . 4.62 534 433 A 28 VAL HA A 24 PRO HGy 1.0 . 4.95 535 434 A 7 LYS HBx A 8 ILE HA 1.0 . 5.07 536 435 A 20 ILE HB A 16 ARG HA 1.0 . 5.27 537 436 A 13 ARG HBy A 10 LYS HA 1.0 . 4.54 538 437 A 37 LYS HBx A 33 ALA HA 1.0 . 5.50 539 438 A 32 ALA HB% A 29 VAL HA 1.0 . 3.22 540 439 A 22 ALA HB% A 24 PRO HDx 1.0 . 4.19 541 439 A 22 ALA HB% A 24 PRO HDy 1.0 . 4.19 542 440 A 30 GLY HAx A 33 ALA HB% 1.0 . 4.27 543 441 A 33 ALA HB% A 30 GLY HAy 1.0 . 3.45 544 442 A 11 VAL HA A 10 LYS HGx 1.0 . 3.66 545 442 A 11 VAL HA A 10 LYS HGy 1.0 . 3.66 546 443 A 21 LYS HBy A 17 ASP HA 1.0 . 4.35 547 444 A 20 ILE HB A 17 ASP HA 1.0 . 4.35 548 445 A 14 ASN HA A 10 LYS HBx 1.0 . 4.78 549 445 A 10 LYS HBy A 14 ASN HA 1.0 . 4.78 550 446 A 13 ARG HBx A 14 ASN HA 1.0 . 4.67 551 447 A 5 PHE HA A 8 ILE HB 1.0 . 5.02 552 448 A 8 ILE HG1x A 5 PHE HA 1.0 . 4.47 553 449 A 13 ARG HA A 16 ARG HBx 1.0 . 4.35 554 449 A 13 ARG HA A 16 ARG HBy 1.0 . 4.35 555 450 A 17 ASP HA A 16 ARG HBx 1.0 . 4.79 556 450 A 17 ASP HA A 16 ARG HBy 1.0 . 4.79 557 451 A 17 ASP HA A 20 ILE HG1x 1.0 . 5.31 558 451 A 20 ILE HG1y A 17 ASP HA 1.0 . 5.31 559 452 A 17 ASP HA A 16 ARG HGx 1.0 . 4.99 560 452 A 16 ARG HGy A 17 ASP HA 1.0 . 4.99 561 453 A 25 ALA HB% A 24 PRO HA 1.0 . 4.08 562 454 A 21 LYS HA A 21 LYS HGx 1.0 . 4.13 563 454 A 21 LYS HGy A 21 LYS HA 1.0 . 4.13 564 455 A 4 ILE HA A 3 LYS HGx 1.0 . 5.20 565 455 A 4 ILE HA A 3 LYS HGy 1.0 . 5.20 566 456 A 18 GLY HAx A 21 LYS HGx 1.0 . 5.34 567 456 A 18 GLY HAy A 21 LYS HGx 1.0 . 5.34 568 456 A 21 LYS HGy A 18 GLY HAx 1.0 . 5.34 569 456 A 21 LYS HGy A 18 GLY HAy 1.0 . 5.34 570 457 A 14 ASN HA A 15 VAL HGx% 1.0 . 4.96 571 457 A 14 ASN HA A 15 VAL HGy% 1.0 . 4.96 572 458 A 20 ILE HD1% A 17 ASP HA 1.0 . 4.68 573 459 A 4 ILE HD1% A 5 PHE HA 1.0 . 4.06 574 460 A 5 PHE HA A 8 ILE HD1% 1.0 . 3.60 575 461 A 5 PHE HA A 8 ILE HD1% 1.0 . 3.69 576 462 A 8 ILE HG2% A 5 PHE HA 1.0 . 3.92 577 463 A 28 VAL HGy% A 24 PRO HA 1.0 . 4.82 578 464 A 28 VAL HGx% A 24 PRO HA 1.0 . 5.50 579 465 A 26 VAL HGx% A 24 PRO HA 1.0 . 5.03 580 466 A 21 LYS HA A 20 ILE HD1% 1.0 . 3.91 581 467 A 34 THR HA A 35 VAL HGx% 1.0 . 4.95 582 468 A 28 VAL HGy% A 22 ALA HA 1.0 . 4.24 583 469 A 28 VAL HGy% A 25 ALA HA 1.0 . 3.64 584 470 A 8 ILE HG2% A 7 LYS HA 1.0 . 5.03 585 471 A 6 LYS HA A 8 ILE HD1% 1.0 . 4.94 586 472 A 19 ILE HG2% A 24 PRO HDx 1.0 . 5.20 587 472 A 19 ILE HG2% A 24 PRO HDy 1.0 . 5.20 588 473 A 15 VAL HGy% A 12 GLY HAx 1.0 . 5.03 589 473 A 12 GLY HAy A 15 VAL HGy% 1.0 . 5.03 590 474 A 11 VAL HGx% A 12 GLY HAx 1.0 . 5.08 591 474 A 11 VAL HGx% A 12 GLY HAy 1.0 . 5.08 592 475 A 11 VAL HGx% A 8 ILE HA 1.0 . 4.29 593 476 A 36 VAL HGy% A 33 ALA HA 1.0 . 3.60 594 477 A 11 VAL HGx% A 10 LYS HA 1.0 . 5.11 595 478 A 35 VAL HGy% A 32 ALA HA 1.0 . 3.70 596 479 A 35 VAL HGx% A 32 ALA HA 1.0 . 3.82 597 480 A 28 VAL HGx% A 25 ALA HA 1.0 . 4.01 598 481 A 19 ILE HA A 19 ILE HG1x 1.0 . 3.97 599 482 A 4 ILE HD1% A 2 TRP HBx 1.0 . 4.57 600 483 A 4 ILE HD1% A 2 TRP HBy 1.0 . 5.50 601 484 A 4 ILE HD1% A 5 PHE HBx 1.0 . 4.43 602 484 A 4 ILE HD1% A 5 PHE HBy 1.0 . 4.43 603 485 A 16 ARG HDx A 17 ASP HBx 1.0 . 5.50 604 485 A 16 ARG HDy A 17 ASP HBx 1.0 . 5.50 605 485 A 17 ASP HBy A 16 ARG HDx 1.0 . 5.50 606 485 A 17 ASP HBy A 16 ARG HDy 1.0 . 5.50 607 486 A 16 ARG HDy A 16 ARG HBy 1.0 . 4.08 608 486 A 16 ARG HBy A 16 ARG HDx 1.0 . 4.08 609 487 A 11 VAL HGx% A 10 LYS HEx 1.0 . 5.50 610 487 A 11 VAL HGx% A 10 LYS HEy 1.0 . 5.50 611 488 A 14 ASN HBy A 11 VAL HGx% 1.0 . 5.50 612 489 A 14 ASN HBy A 15 VAL HGy% 1.0 . 4.33 613 490 A 11 VAL HGy% A 7 LYS HEx 1.0 . 4.63 614 490 A 11 VAL HGy% A 7 LYS HEy 1.0 . 4.63 615 491 A 19 ILE HG2% A 16 ARG HDx 1.0 . 4.09 616 491 A 19 ILE HG2% A 16 ARG HDy 1.0 . 4.09 617 492 A 20 ILE HD1% A 21 LYS HEx 1.0 . 4.14 618 492 A 20 ILE HD1% A 21 LYS HEy 1.0 . 4.14 619 493 A 14 ASN HBy A 11 VAL HGy% 1.0 . 5.47 620 494 A 14 ASN HBx A 15 VAL HGy% 1.0 . 4.42 621 495 A 14 ASN HBy A 17 ASP HBx 1.0 . 5.28 622 495 A 14 ASN HBy A 17 ASP HBy 1.0 . 5.28 623 496 A 32 ALA HB% A 31 GLN HGx 1.0 . 4.30 624 496 A 32 ALA HB% A 31 GLN HGy 1.0 . 4.30 625 497 A 27 ALA HB% A 24 PRO HBx 1.0 . 4.37 626 498 A 11 VAL HGx% A 10 LYS HBx 1.0 . 3.73 627 498 A 10 LYS HBy A 11 VAL HGx% 1.0 . 3.73 628 499 A 11 VAL HGy% A 7 LYS HDx 1.0 . 3.84 629 499 A 7 LYS HDy A 11 VAL HGy% 1.0 . 3.84 630 500 A 28 VAL HGx% A 24 PRO HGy 1.0 . 4.21 631 501 A 4 ILE HD1% A 8 ILE HB 1.0 . 4.49 632 502 A 4 ILE HD1% A 7 LYS HBx 1.0 . 5.17 633 503 A 15 VAL HB A 19 ILE HD1% 1.0 . 4.60 634 504 A 28 VAL HGx% A 22 ALA HB% 1.0 . 3.07 635 505 A 28 VAL HGy% A 25 ALA HB% 1.0 . 3.42 636 506 A 6 LYS HDy A 9 GLU HGx 1.0 . 4.22 637 506 A 6 LYS HDx A 9 GLU HGx 1.0 . 4.22 638 506 A 9 GLU HGy A 6 LYS HDx 1.0 . 4.22 639 506 A 9 GLU HGy A 6 LYS HDy 1.0 . 4.22 640 507 A 27 ALA HB% A 24 PRO HBy 1.0 . 4.37 641 508 A 27 ALA HB% A 24 PRO HBy 1.0 . 3.83 642 508 A 27 ALA HB% A 24 PRO HBx 1.0 . 3.83 643 509 A 22 ALA HB% A 28 VAL HB 1.0 . 3.86 644 510 A 4 ILE HG2% A 2 TRP HD1 1.0 . 5.11 645 511 A 4 ILE HG2% A 5 PHE HE% 1.0 . 4.15 646 512 A 4 ILE HG2% A 5 PHE HDx 1.0 . 4.72 647 513 A 5 PHE HDx A 8 ILE HD1% 1.0 . 4.51 648 514 A 4 ILE HD1% A 5 PHE HDx 1.0 . 3.97 649 515 A 4 ILE HG2% A 5 PHE HZ 1.0 . 4.31 650 516 A 4 ILE HD1% A 5 PHE HZ 1.0 . 4.32 651 517 A 8 ILE HG2% A 5 PHE HDx 1.0 . 4.69 652 518 A 8 ILE HG2% A 5 PHE HZ 1.0 . 4.41 653 519 A 5 PHE HE% A 1 ARG HBx 1.0 . 4.42 654 519 A 5 PHE HE% A 1 ARG HBy 1.0 . 4.42 655 520 A 4 ILE HG2% A 2 TRP HZ3 1.0 . 4.58 656 521 A 4 ILE HD1% A 2 TRP HZ3 1.0 . 4.96 657 522 A 6 LYS H A 4 ILE HG2% 1.0 . 4.60 658 523 A 14 ASN H A 11 VAL HB 1.0 . 5.50 659 524 A 14 ASN H A 15 VAL HB 1.0 . 5.50 660 525 A 29 VAL HA A 30 GLY HAy 1.0 . 5.10 661 526 A 7 LYS HBy A 4 ILE HA 1.0 . 4.12 662 527 A 27 ALA HB% A 30 GLY HAx 1.0 . 3.86 663 528 A 22 ALA HB% A 18 GLY HAx 1.0 . 4.53 664 528 A 22 ALA HB% A 18 GLY HAy 1.0 . 4.53 665 529 A 4 ILE HD1% A 4 ILE HB 1.0 . 3.20 666 530 A 20 ILE HG2% A 20 ILE HD1% 1.0 . 3.32 667 531 A 4 ILE HG2% A 4 ILE HG1y 1.0 . 3.24 668 532 A 8 ILE HD1% A 8 ILE HB 1.0 . 3.38 669 533 A 19 ILE HB A 19 ILE HD1% 1.0 . 3.74 670 534 A 27 ALA HB% A 24 PRO HGy 1.0 . 3.40 671 535 A 8 ILE HG2% A 4 ILE HG1x 1.0 . 4.30 672 535 A 8 ILE HG2% A 4 ILE HG1y 1.0 . 4.30 673 536 A 9 GLU HBx A 10 LYS HBx 1.0 . 4.35 674 536 A 9 GLU HBx A 10 LYS HBy 1.0 . 4.35 675 537 A 35 VAL HGy% A 31 GLN HGx 1.0 . 4.82 676 537 A 31 GLN HGy A 35 VAL HGy% 1.0 . 4.82 677 538 A 35 VAL HGx% A 31 GLN HGx 1.0 . 4.61 678 538 A 31 GLN HGy A 35 VAL HGx% 1.0 . 4.61 679 539 A 4 ILE HG2% A 4 ILE HD1% 1.0 . 3.02 stop_ save_