data_nef_c34279_6go0 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 34278 PDB 6GO0 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly 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 LYS start . . 2 A 2 LYS middle . . 3 A 3 LYS middle . . 4 A 4 LYS middle . . 5 A 5 GLN middle . . 6 A 6 SER middle . . 7 A 7 TRP middle . . 8 A 8 TYR middle . . 9 A 9 ALA middle . . 10 A 10 ALA middle . . 11 A 11 ALA middle . . 12 A 12 GLY middle . false 13 A 13 ASP middle . . 14 A 14 ALA middle . . 15 A 15 ILE middle . . 16 A 16 VAL middle . . 17 A 17 SER middle . . 18 A 18 PHE middle . . 19 A 19 GLY middle . false 20 A 20 GLU middle . . 21 A 21 GLY middle . false 22 A 22 PHE middle . . 23 A 23 LEU middle . . 24 A 24 ASN middle . . 25 A 25 ALA middle . . 26 A 26 TRP end . . 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 LYS HA H 1 4.206 0.03 A 1 LYS HB2 H 1 1.735 0.03 A 1 LYS HB3 H 1 1.7 0.03 A 1 LYS HD2 H 1 1.661 0.03 A 1 LYS HD3 H 1 1.661 0.03 A 1 LYS HE2 H 1 2.965 0.03 A 1 LYS HE3 H 1 2.965 0.03 A 1 LYS HG2 H 1 1.426 0.03 A 1 LYS HG3 H 1 1.426 0.03 A 1 LYS HZ1 H 1 7.501 0.03 A 1 LYS HZ2 H 1 7.501 0.03 A 1 LYS HZ3 H 1 7.501 0.03 A 1 LYS CD C 13 29.014 0.30 A 1 LYS CE C 13 41.785 0.30 A 1 LYS CG C 13 24.551 0.30 A 2 LYS H H 1 8.616 0.03 A 2 LYS HA H 1 4.321 0.03 A 2 LYS HB2 H 1 1.78 0.03 A 2 LYS HB3 H 1 1.724 0.03 A 2 LYS HD2 H 1 1.66 0.03 A 2 LYS HD3 H 1 1.66 0.03 A 2 LYS HE2 H 1 2.973 0.03 A 2 LYS HE3 H 1 2.973 0.03 A 2 LYS HG2 H 1 1.415 0.03 A 2 LYS HG3 H 1 1.415 0.03 A 2 LYS CA C 13 56.285 0.30 A 2 LYS CB C 13 33.083 0.30 A 2 LYS CD C 13 29.014 0.30 A 2 LYS CE C 13 41.785 0.30 A 2 LYS CG C 13 24.609 0.30 A 3 LYS H H 1 8.402 0.03 A 3 LYS HA H 1 4.252 0.03 A 3 LYS HB2 H 1 1.764 0.03 A 3 LYS HB3 H 1 1.729 0.03 A 3 LYS HD2 H 1 1.662 0.03 A 3 LYS HD3 H 1 1.662 0.03 A 3 LYS HE2 H 1 2.963 0.03 A 3 LYS HE3 H 1 2.963 0.03 A 3 LYS HG2 H 1 1.399 0.03 A 3 LYS HG3 H 1 1.399 0.03 A 3 LYS CA C 13 56.166 0.30 A 3 LYS CB C 13 33.123 0.30 A 3 LYS CD C 13 29.014 0.30 A 3 LYS CE C 13 41.785 0.30 A 3 LYS CG C 13 24.58 0.30 A 3 LYS N N 15 123.816 0.30 A 4 LYS H H 1 8.328 0.03 A 4 LYS HA H 1 4.258 0.03 A 4 LYS HB2 H 1 1.768 0.03 A 4 LYS HB3 H 1 1.72 0.03 A 4 LYS HD2 H 1 1.665 0.03 A 4 LYS HD3 H 1 1.665 0.03 A 4 LYS HE2 H 1 2.98 0.03 A 4 LYS HE3 H 1 2.98 0.03 A 4 LYS HG2 H 1 1.402 0.03 A 4 LYS HG3 H 1 1.434 0.03 A 4 LYS CA C 13 56.166 0.30 A 4 LYS CB C 13 33.187 0.30 A 4 LYS CD C 13 29.014 0.30 A 4 LYS CE C 13 41.785 0.30 A 4 LYS CG C 13 24.58 0.30 A 4 LYS N N 15 123.449 0.30 A 5 GLN H H 1 8.346 0.03 A 5 GLN HA H 1 4.389 0.03 A 5 GLN HB2 H 1 1.922 0.03 A 5 GLN HB3 H 1 2.019 0.03 A 5 GLN HE21 H 1 7.461 0.03 A 5 GLN HE22 H 1 6.748 0.03 A 5 GLN HG2 H 1 2.364 0.03 A 5 GLN HG3 H 1 2.329 0.03 A 5 GLN CA C 13 55.351 0.30 A 5 GLN CB C 13 30.482 0.30 A 5 GLN CG C 13 33.743 0.30 A 5 GLN N N 15 122.702 0.30 A 5 GLN NE2 N 15 111.433 0.30 A 6 SER H H 1 8.514 0.03 A 6 SER HA H 1 4.489 0.03 A 6 SER HB2 H 1 3.888 0.03 A 6 SER HB3 H 1 3.829 0.03 A 6 SER CB C 13 64.423 0.30 A 6 SER N N 15 118.894 0.30 A 7 TRP H H 1 8.951 0.03 A 7 TRP HA H 1 4.315 0.03 A 7 TRP HB2 H 1 3.357 0.03 A 7 TRP HB3 H 1 3.144 0.03 A 7 TRP HD1 H 1 7.476 0.03 A 7 TRP HE1 H 1 10.752 0.03 A 7 TRP HE3 H 1 7.113 0.03 A 7 TRP HH2 H 1 7.017 0.03 A 7 TRP HZ2 H 1 7.469 0.03 A 7 TRP HZ3 H 1 6.87 0.03 A 7 TRP CA C 13 60.113 0.30 A 7 TRP CB C 13 28.526 0.30 A 7 TRP CD1 C 13 127.734 0.30 A 7 TRP CE3 C 13 120.275 0.30 A 7 TRP CH2 C 13 123.576 0.30 A 7 TRP CZ2 C 13 114.683 0.30 A 7 TRP CZ3 C 13 120.931 0.30 A 7 TRP N N 15 123.378 0.30 A 7 TRP NE1 N 15 130.931 0.30 A 8 TYR H H 1 6.816 0.03 A 8 TYR HA H 1 3.958 0.03 A 8 TYR HB2 H 1 2.739 0.03 A 8 TYR HB3 H 1 2.297 0.03 A 8 TYR HD1 H 1 6.679 0.03 A 8 TYR HD2 H 1 6.679 0.03 A 8 TYR HEx H 1 6.826 0.03 A 8 TYR HEy H 1 6.826 0.03 A 8 TYR CA C 13 59.623 0.30 A 8 TYR CB C 13 37.348 0.30 A 8 TYR CD1 C 13 132.457 0.30 A 8 TYR CE1 C 13 118.472 0.30 A 8 TYR N N 15 115.931 0.30 A 9 ALA H H 1 7.407 0.03 A 9 ALA HA H 1 4 0.03 A 9 ALA HB% H 1 1.419 0.03 A 9 ALA CA C 13 54.88 0.30 A 9 ALA CB C 13 18.222 0.30 A 9 ALA N N 15 123.05 0.30 A 10 ALA H H 1 7.887 0.03 A 10 ALA HA H 1 4.029 0.03 A 10 ALA HB% H 1 1.403 0.03 A 10 ALA CA C 13 54.891 0.30 A 10 ALA CB C 13 18.137 0.30 A 10 ALA N N 15 120.043 0.30 A 11 ALA H H 1 8.327 0.03 A 11 ALA HA H 1 4.01 0.03 A 11 ALA HB% H 1 1.288 0.03 A 11 ALA CA C 13 55.576 0.30 A 11 ALA CB C 13 17.93 0.30 A 11 ALA N N 15 120.872 0.30 A 12 GLY H H 1 8.461 0.03 A 12 GLY HA2 H 1 3.64 0.03 A 12 GLY HA3 H 1 3.731 0.03 A 12 GLY N N 15 104.961 0.30 A 13 ASP H H 1 8.431 0.03 A 13 ASP HA H 1 4.416 0.03 A 13 ASP HBy H 1 2.978 0.03 A 13 ASP HBx H 1 2.906 0.03 A 13 ASP CA C 13 55.37 0.30 A 13 ASP CB C 13 37.525 0.30 A 13 ASP N N 15 119.146 0.30 A 14 ALA H H 1 7.918 0.03 A 14 ALA HA H 1 4.202 0.03 A 14 ALA HB% H 1 1.565 0.03 A 14 ALA CA C 13 54.911 0.30 A 14 ALA CB C 13 18.172 0.30 A 14 ALA N N 15 123.095 0.30 A 15 ILE H H 1 8.218 0.03 A 15 ILE HA H 1 3.732 0.03 A 15 ILE HB H 1 2.045 0.03 A 15 ILE HD1% H 1 0.835 0.03 A 15 ILE HG12 H 1 1.905 0.03 A 15 ILE HG13 H 1 1.06 0.03 A 15 ILE HG2% H 1 0.949 0.03 A 15 ILE CA C 13 65.489 0.30 A 15 ILE CB C 13 38.009 0.30 A 15 ILE CD1 C 13 13.464 0.30 A 15 ILE CG1 C 13 29.397 0.30 A 15 ILE CG2 C 13 17.453 0.30 A 15 ILE N N 15 118.736 0.30 A 16 VAL H H 1 8.099 0.03 A 16 VAL HA H 1 3.653 0.03 A 16 VAL HB H 1 2.193 0.03 A 16 VAL HG1% H 1 0.955 0.03 A 16 VAL HG2% H 1 1.095 0.03 A 16 VAL CA C 13 66.934 0.30 A 16 VAL CB C 13 31.454 0.30 A 16 VAL CG1 C 13 21.305 0.30 A 16 VAL CG2 C 13 23.328 0.30 A 16 VAL N N 15 119.179 0.30 A 17 SER H H 1 8.134 0.03 A 17 SER HA H 1 4.212 0.03 A 17 SER HB2 H 1 3.924 0.03 A 17 SER HB3 H 1 3.983 0.03 A 17 SER CA C 13 61.878 0.30 A 17 SER CB C 13 62.722 0.30 A 17 SER N N 15 114.444 0.30 A 18 PHE H H 1 8.297 0.03 A 18 PHE HA H 1 4.419 0.03 A 18 PHE HB2 H 1 3.216 0.03 A 18 PHE HB3 H 1 3.295 0.03 A 18 PHE HD1 H 1 7.247 0.03 A 18 PHE HD2 H 1 7.247 0.03 A 18 PHE HE1 H 1 7.246 0.03 A 18 PHE HE2 H 1 7.246 0.03 A 18 PHE HZ H 1 7.18 0.03 A 18 PHE CB C 13 39.366 0.30 A 18 PHE CD1 C 13 131.773 0.30 A 18 PHE CE1 C 13 130.876 0.30 A 18 PHE CZ C 13 129.466 0.30 A 18 PHE N N 15 121.489 0.30 A 19 GLY H H 1 8.828 0.03 A 19 GLY HA2 H 1 3.729 0.03 A 19 GLY HA3 H 1 3.729 0.03 A 19 GLY CA C 13 47.153 0.30 A 19 GLY N N 15 106.874 0.30 A 20 GLU H H 1 8.616 0.03 A 20 GLU HA H 1 4.029 0.03 A 20 GLU HB2 H 1 2.22 0.03 A 20 GLU HB3 H 1 2.111 0.03 A 20 GLU HG2 H 1 2.476 0.03 A 20 GLU HG3 H 1 2.657 0.03 A 20 GLU CA C 13 58.93 0.30 A 20 GLU CB C 13 27.764 0.30 A 20 GLU CG C 13 33.47 0.30 A 21 GLY H H 1 7.886 0.03 A 21 GLY HA2 H 1 3.901 0.03 A 21 GLY HA3 H 1 3.81 0.03 A 21 GLY CA C 13 46.294 0.30 A 21 GLY N N 15 105.97 0.30 A 22 PHE H H 1 7.857 0.03 A 22 PHE HA H 1 4.332 0.03 A 22 PHE HB2 H 1 3.044 0.03 A 22 PHE HB3 H 1 2.883 0.03 A 22 PHE HD1 H 1 7.141 0.03 A 22 PHE HD2 H 1 7.141 0.03 A 22 PHE HE1 H 1 7.07 0.03 A 22 PHE HE2 H 1 7.07 0.03 A 22 PHE HZ H 1 7.071 0.03 A 22 PHE CA C 13 60.083 0.30 A 22 PHE CB C 13 39.517 0.30 A 22 PHE CD1 C 13 131.71 0.30 A 22 PHE CE1 C 13 130.912 0.30 A 22 PHE CZ C 13 129.144 0.30 A 22 PHE N N 15 120.309 0.30 A 23 LEU H H 1 7.873 0.03 A 23 LEU HA H 1 4.091 0.03 A 23 LEU HB2 H 1 1.772 0.03 A 23 LEU HB3 H 1 1.609 0.03 A 23 LEU HDx% H 1 0.897 0.03 A 23 LEU HDy% H 1 0.849 0.03 A 23 LEU HG H 1 1.781 0.03 A 23 LEU CA C 13 56.625 0.30 A 23 LEU CB C 13 41.853 0.30 A 23 LEU CDy C 13 25.299 0.30 A 23 LEU CDx C 13 23.559 0.30 A 23 LEU CG C 13 26.916 0.30 A 23 LEU N N 15 117.786 0.30 A 24 ASN H H 1 7.848 0.03 A 24 ASN HA H 1 4.532 0.03 A 24 ASN HB2 H 1 2.794 0.03 A 24 ASN HB3 H 1 2.794 0.03 A 24 ASN HD21 H 1 7.527 0.03 A 24 ASN HD22 H 1 6.811 0.03 A 24 ASN CB C 13 38.86 0.30 A 24 ASN N N 15 114.977 0.30 A 24 ASN ND2 N 15 111.948 0.30 A 25 ALA H H 1 7.601 0.03 A 25 ALA HA H 1 4.333 0.03 A 25 ALA HB% H 1 1.326 0.03 A 25 ALA CA C 13 52.224 0.30 A 25 ALA CB C 13 19.464 0.30 A 25 ALA N N 15 120.256 0.30 A 26 TRP H H 1 7.751 0.03 A 26 TRP HA H 1 4.459 0.03 A 26 TRP HB2 H 1 3.247 0.03 A 26 TRP HB3 H 1 3.139 0.03 A 26 TRP HD1 H 1 7.216 0.03 A 26 TRP HE1 H 1 10.294 0.03 A 26 TRP HE3 H 1 7.506 0.03 A 26 TRP HH2 H 1 7.061 0.03 A 26 TRP HZ2 H 1 7.434 0.03 A 26 TRP HZ3 H 1 6.977 0.03 A 26 TRP CB C 13 29.318 0.30 A 26 TRP CD1 C 13 126.564 0.30 A 26 TRP CE3 C 13 120.55 0.30 A 26 TRP CH2 C 13 123.521 0.30 A 26 TRP CZ2 C 13 114.102 0.30 A 26 TRP CZ3 C 13 121.057 0.30 A 26 TRP N N 15 119.623 0.30 A 26 TRP NE1 N 15 129.502 0.30 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 16 VAL HG1% A 20 GLU H 1.0 . 4.97 2 2 A 15 ILE HG2% A 16 VAL H 1.0 . 3.70 3 3 A 15 ILE HG2% A 18 PHE H 1.0 . 4.54 4 4 A 11 ALA HB% A 12 GLY H 1.0 . 3.43 5 5 A 11 ALA HB% A 11 ALA H 1.0 . 3.10 6 6 A 15 ILE H A 15 ILE HG13 1.0 . 3.91 7 7 A 16 VAL HG2% A 17 SER H 1.0 . 4.15 8 8 A 11 ALA H A 10 ALA HB% 1.0 . 3.63 9 9 A 12 GLY H A 10 ALA HB% 1.0 . 4.51 10 10 A 6 SER H A 9 ALA HB% 1.0 . 3.81 11 11 A 10 ALA HB% A 13 ASP H 1.0 . 5.50 12 12 A 9 ALA HB% A 10 ALA H 1.0 . 3.24 13 13 A 10 ALA HB% A 10 ALA H 1.0 . 3.39 14 14 A 9 ALA HB% A 7 TRP H 1.0 . 5.11 15 15 A 15 ILE HG2% A 19 GLY H 1.0 . 4.57 16 16 A 12 GLY H A 14 ALA HB% 1.0 . 4.91 17 17 A 11 ALA H A 14 ALA HB% 1.0 . 4.65 18 18 A 16 VAL H A 14 ALA HB% 1.0 . 5.21 19 19 A 6 SER H A 5 GLN HB2 1.0 . 4.53 20 20 A 6 SER H A 5 GLN HB3 1.0 . 4.53 21 21 A 15 ILE H A 15 ILE HG12 1.0 . 3.91 22 22 A 15 ILE H A 15 ILE HB 1.0 . 3.25 23 23 A 16 VAL H A 15 ILE HB 1.0 . 3.56 24 24 A 14 ALA HB% A 14 ALA H 1.0 . 3.09 25 25 A 10 ALA H A 14 ALA HB% 1.0 . 5.06 26 26 A 23 LEU H A 23 LEU HG 1.0 . 2.91 27 27 A 16 VAL H A 16 VAL HB 1.0 . 3.36 28 28 A 17 SER H A 16 VAL HB 1.0 . 3.39 29 29 A 21 GLY H A 20 GLU HB2 1.0 . 3.95 30 30 A 5 GLN H A 5 GLN HG3 1.0 . 4.45 31 31 A 5 GLN H A 5 GLN HG2 1.0 . 4.45 32 32 A 20 GLU H A 20 GLU HB2 1.0 . 3.58 33 33 A 20 GLU H A 20 GLU HB3 1.0 . 3.58 34 34 A 20 GLU H A 20 GLU HG3 1.0 . 4.01 35 35 A 13 ASP H A 13 ASP HBy 1.0 . 3.48 36 36 A 24 ASN H A 24 ASN HB2 1.0 . 3.07 37 36 A 24 ASN H A 24 ASN HB3 1.0 . 3.07 38 37 A 22 PHE H A 22 PHE HB3 1.0 . 3.13 39 38 A 14 ALA H A 13 ASP HBy 1.0 . 3.78 40 39 A 22 PHE H A 22 PHE HB2 1.0 . 3.13 41 40 A 25 ALA H A 24 ASN HB2 1.0 . 3.77 42 40 A 24 ASN HB3 A 25 ALA H 1.0 . 3.77 43 41 A 9 ALA H A 8 TYR HB2 1.0 . 4.33 44 42 A 7 TRP HB3 A 7 TRP HD1 1.0 . 3.83 45 43 A 7 TRP HD1 A 7 TRP HB2 1.0 . 3.83 46 44 A 18 PHE H A 18 PHE HB2 1.0 . 3.32 47 45 A 18 PHE H A 18 PHE HB3 1.0 . 3.29 48 46 A 19 GLY H A 18 PHE HB3 1.0 . 3.84 49 47 A 19 GLY H A 18 PHE HB2 1.0 . 3.67 50 48 A 7 TRP H A 7 TRP HB2 1.0 . 3.75 51 49 A 7 TRP H A 7 TRP HB3 1.0 . 3.53 52 50 A 6 SER H A 6 SER HB3 1.0 . 3.89 53 51 A 6 SER H A 6 SER HB2 1.0 . 3.89 54 52 A 11 ALA H A 10 ALA HA 1.0 . 3.52 55 53 A 18 PHE H A 15 ILE HA 1.0 . 3.59 56 54 A 15 ILE H A 12 GLY HA2 1.0 . 4.28 57 55 A 18 PHE H A 16 VAL HA 1.0 . 4.38 58 56 A 18 PHE H A 17 SER HB3 1.0 . 4.48 59 57 A 12 GLY H A 8 TYR HA 1.0 . 5.22 60 58 A 23 LEU HA A 26 TRP H 1.0 . 4.45 61 59 A 25 ALA H A 23 LEU HA 1.0 . 4.63 62 60 A 7 TRP HD1 A 7 TRP HA 1.0 . 4.57 63 61 A 26 TRP HA A 26 TRP HE3 1.0 . 4.78 64 62 A 7 TRP HD1 A 6 SER HA 1.0 . 4.45 65 63 A 26 TRP H A 24 ASN HA 1.0 . 4.51 66 64 A 5 GLN H A 4 LYS HA 1.0 . 3.44 67 65 A 13 ASP H A 14 ALA HA 1.0 . 5.41 68 66 A 2 LYS HA A 3 LYS H 1.0 . 3.18 69 67 A 11 ALA H A 7 TRP HA 1.0 . 4.25 70 68 A 5 GLN H A 6 SER HA 1.0 . 4.64 71 69 A 15 ILE H A 13 ASP HA 1.0 . 4.46 72 70 A 17 SER H A 13 ASP HA 1.0 . 4.18 73 71 A 16 VAL H A 13 ASP HA 1.0 . 4.42 74 72 A 6 SER H A 5 GLN HA 1.0 . 2.95 75 73 A 20 GLU H A 17 SER HA 1.0 . 4.87 76 74 A 20 GLU H A 18 PHE HA 1.0 . 4.63 77 75 A 19 GLY H A 17 SER HA 1.0 . 4.97 78 76 A 7 TRP H A 6 SER HA 1.0 . 3.24 79 77 A 7 TRP HE1 A 8 TYR HD% 1.0 . 4.98 80 78 A 19 GLY H A 18 PHE HD% 1.0 . 4.42 81 79 A 22 PHE H A 22 PHE HD% 1.0 . 4.61 82 80 A 6 SER H A 9 ALA H 1.0 . 4.77 83 81 A 7 TRP HE3 A 8 TYR H 1.0 . 4.01 84 82 A 8 TYR HD% A 7 TRP HH2 1.0 . 4.75 85 83 A 8 TYR HD% A 7 TRP HZ3 1.0 . 4.71 86 84 A 9 ALA H A 8 TYR H 1.0 . 3.27 87 85 A 18 PHE HE% A 18 PHE HZ 1.0 . 2.44 88 86 A 26 TRP H A 24 ASN HD21 1.0 . 4.40 89 87 A 25 ALA H A 26 TRP H 1.0 . 3.35 90 88 A 24 ASN H A 25 ALA H 1.0 . 3.41 91 89 A 10 ALA H A 9 ALA H 1.0 . 3.47 92 90 A 19 GLY H A 21 GLY H 1.0 . 4.53 93 91 A 17 SER H A 19 GLY H 1.0 . 4.56 94 92 A 15 ILE H A 13 ASP H 1.0 . 4.28 95 93 A 16 VAL H A 15 ILE H 1.0 . 3.43 96 94 A 18 PHE H A 17 SER H 1.0 . 3.54 97 95 A 12 GLY H A 11 ALA H 1.0 . 3.40 98 96 A 6 SER H A 5 GLN H 1.0 . 4.11 99 97 A 20 GLU H A 19 GLY H 1.0 . 3.59 100 98 A 18 PHE H A 19 GLY H 1.0 . 3.55 101 99 A 7 TRP H A 7 TRP HD1 1.0 . 3.81 102 100 A 13 ASP H A 14 ALA H 1.0 . 3.40 103 101 A 20 GLU H A 21 GLY H 1.0 . 3.51 104 102 A 11 ALA H A 10 ALA H 1.0 . 3.41 105 103 A 15 ILE H A 14 ALA H 1.0 . 3.49 106 104 A 17 SER H A 14 ALA H 1.0 . 5.44 107 105 A 16 VAL H A 14 ALA H 1.0 . 4.60 108 106 A 6 SER H A 7 TRP H 1.0 . 4.78 109 107 A 7 TRP HE1 A 8 TYR H 1.0 . 5.50 110 108 A 7 TRP HE1 A 8 TYR HE% 1.0 . 5.50 111 109 A 7 TRP H A 8 TYR H 1.0 . 3.76 112 110 A 7 TRP H A 8 TYR HD% 1.0 . 4.37 113 111 A 11 ALA H A 9 ALA H 1.0 . 4.50 114 112 A 18 PHE H A 18 PHE HD% 1.0 . 4.02 115 113 A 15 ILE H A 18 PHE HD% 1.0 . 5.50 116 114 A 10 ALA H A 8 TYR H 1.0 . 4.60 117 115 A 23 LEU H A 22 PHE HD% 1.0 . 3.69 118 116 A 8 TYR HD% A 7 TRP HZ2 1.0 . 3.56 119 117 A 9 ALA H A 8 TYR HD% 1.0 . 4.35 120 118 A 22 PHE HD% A 24 ASN HD21 1.0 . 4.93 121 119 A 26 TRP H A 26 TRP HD1 1.0 . 4.34 122 120 A 21 GLY H A 18 PHE HD% 1.0 . 5.14 123 121 A 22 PHE H A 18 PHE HD% 1.0 . 4.97 124 122 A 8 TYR HD% A 7 TRP HE3 1.0 . 4.57 125 123 A 8 TYR HD% A 8 TYR H 1.0 . 2.98 126 124 A 18 PHE HA A 18 PHE HD% 1.0 . 3.56 127 125 A 26 TRP HA A 26 TRP HD1 1.0 . 4.45 128 126 A 26 TRP HD1 A 25 ALA HA 1.0 . 5.30 129 127 A 22 PHE HD% A 22 PHE HA 1.0 . 3.63 130 128 A 22 PHE HA A 22 PHE HE% 1.0 . 4.89 131 129 A 6 SER HA A 8 TYR H 1.0 . 4.54 132 130 A 14 ALA HA A 18 PHE HD% 1.0 . 5.49 133 131 A 9 ALA H A 7 TRP HA 1.0 . 4.85 134 132 A 23 LEU HA A 26 TRP HD1 1.0 . 4.95 135 133 A 8 TYR HA A 7 TRP HE3 1.0 . 3.68 136 134 A 8 TYR HA A 7 TRP HZ3 1.0 . 4.08 137 135 A 8 TYR HE% A 9 ALA HA 1.0 . 4.56 138 136 A 8 TYR H A 6 SER HB2 1.0 . 4.47 139 137 A 8 TYR HE% A 6 SER HB2 1.0 . 4.80 140 138 A 8 TYR HD% A 9 ALA HA 1.0 . 3.96 141 139 A 8 TYR HD% A 6 SER HB2 1.0 . 4.73 142 140 A 7 TRP HB2 A 7 TRP HE3 1.0 . 3.60 143 141 A 7 TRP HB2 A 8 TYR H 1.0 . 4.32 144 142 A 7 TRP HB3 A 8 TYR H 1.0 . 4.21 145 143 A 8 TYR H A 8 TYR HB3 1.0 . 3.69 146 144 A 25 ALA H A 25 ALA HB% 1.0 . 3.26 147 145 A 23 LEU HG A 22 PHE HD% 1.0 . 4.27 148 146 A 22 PHE HD% A 25 ALA HB% 1.0 . 4.82 149 147 A 11 ALA HB% A 8 TYR H 1.0 . 5.18 150 148 A 9 ALA HB% A 8 TYR HE% 1.0 . 4.30 151 149 A 9 ALA HB% A 8 TYR HD% 1.0 . 4.33 152 150 A 22 PHE HD% A 23 LEU HDy% 1.0 . 4.42 153 151 A 22 PHE HD% A 23 LEU HDx% 1.0 . 4.61 154 152 A 22 PHE HE% A 23 LEU HDy% 1.0 . 4.77 155 153 A 22 PHE HE% A 23 LEU HDx% 1.0 . 5.50 156 154 A 23 LEU HDy% A 20 GLU HA 1.0 . 4.38 157 155 A 23 LEU HDx% A 20 GLU HA 1.0 . 4.23 158 156 A 23 LEU HA A 23 LEU HDx% 1.0 . 4.01 159 157 A 11 ALA HB% A 8 TYR HA 1.0 . 3.42 160 158 A 15 ILE HA A 15 ILE HD1% 1.0 . 3.83 161 159 A 15 ILE HA A 15 ILE HG13 1.0 . 3.57 162 160 A 9 ALA HB% A 6 SER HB3 1.0 . 4.32 163 161 A 9 ALA HB% A 6 SER HB2 1.0 . 4.32 164 162 A 14 ALA HB% A 11 ALA HA 1.0 . 3.15 165 163 A 14 ALA HB% A 15 ILE HA 1.0 . 4.28 166 164 A 23 LEU HG A 20 GLU HA 1.0 . 3.61 167 165 A 15 ILE HA A 15 ILE HG12 1.0 . 3.57 168 166 A 15 ILE HB A 16 VAL HA 1.0 . 4.48 169 167 A 20 GLU HA A 20 GLU HG2 1.0 . 3.87 170 168 A 20 GLU HA A 20 GLU HG3 1.0 . 3.87 171 169 A 10 ALA HA A 13 ASP HBx 1.0 . 4.23 172 170 A 10 ALA HA A 13 ASP HBy 1.0 . 4.23 173 171 A 18 PHE HB2 A 15 ILE HA 1.0 . 3.62 174 172 A 18 PHE HB3 A 15 ILE HA 1.0 . 4.26 175 173 A 18 PHE HB3 A 19 GLY HA2 1.0 . 4.48 176 173 A 18 PHE HB3 A 19 GLY HA3 1.0 . 4.48 177 174 A 8 TYR HA A 8 TYR HD% 1.0 . 3.84 178 175 A 8 TYR HD% A 6 SER HB3 1.0 . 4.73 179 176 A 8 TYR H A 6 SER HB3 1.0 . 4.47 180 177 A 8 TYR HE% A 6 SER HB3 1.0 . 4.80 181 178 A 15 ILE HA A 18 PHE HD% 1.0 . 4.11 182 179 A 23 LEU HA A 22 PHE HD% 1.0 . 4.25 183 180 A 9 ALA H A 6 SER HB3 1.0 . 4.83 184 181 A 9 ALA H A 6 SER HB2 1.0 . 4.83 185 182 A 8 TYR H A 8 TYR HB2 1.0 . 3.69 186 183 A 10 ALA H A 10 ALA HA 1.0 . 2.88 187 184 A 17 SER H A 17 SER HB2 1.0 . 3.54 188 185 A 17 SER H A 17 SER HB3 1.0 . 3.54 189 186 A 17 SER H A 15 ILE HA 1.0 . 4.25 190 187 A 18 PHE H A 17 SER HB2 1.0 . 4.48 191 188 A 11 ALA H A 8 TYR HA 1.0 . 3.87 192 189 A 12 GLY H A 11 ALA HA 1.0 . 3.48 193 190 A 20 GLU H A 18 PHE H 1.0 . 5.01 194 191 A 7 TRP H A 6 SER HB3 1.0 . 4.14 195 192 A 7 TRP H A 6 SER HB2 1.0 . 4.14 196 193 A 13 ASP H A 13 ASP HBx 1.0 . 3.48 197 194 A 20 GLU H A 20 GLU HG2 1.0 . 4.01 198 195 A 15 ILE H A 16 VAL HB 1.0 . 4.88 199 196 A 13 ASP H A 14 ALA HB% 1.0 . 4.20 200 197 A 15 ILE H A 14 ALA HB% 1.0 . 3.56 201 198 A 17 SER H A 14 ALA HB% 1.0 . 4.89 202 199 A 3 LYS H A 2 LYS HG2 1.0 . 3.86 203 199 A 3 LYS H A 2 LYS HG3 1.0 . 3.86 204 200 A 21 GLY H A 20 GLU HB3 1.0 . 3.95 205 201 A 9 ALA H A 8 TYR HB3 1.0 . 4.33 206 202 A 24 ASN H A 25 ALA HB% 1.0 . 4.61 207 203 A 11 ALA HB% A 10 ALA H 1.0 . 4.30 208 204 A 26 TRP H A 25 ALA HB% 1.0 . 3.85 209 205 A 9 ALA HB% A 9 ALA H 1.0 . 3.02 210 206 A 14 ALA HB% A 18 PHE HD% 1.0 . 4.92 211 207 A 11 ALA HB% A 7 TRP HE3 1.0 . 3.98 212 208 A 15 ILE HG2% A 18 PHE HD% 1.0 . 4.73 213 209 A 23 LEU H A 23 LEU HDx% 1.0 . 4.12 214 210 A 23 LEU H A 23 LEU HDy% 1.0 . 4.01 215 211 A 11 ALA HB% A 7 TRP HZ3 1.0 . 4.47 216 212 A 16 VAL HG1% A 13 ASP HA 1.0 . 4.41 217 213 A 16 VAL HG2% A 13 ASP HA 1.0 . 3.96 218 214 A 16 VAL HG1% A 17 SER HA 1.0 . 4.15 219 215 A 23 LEU HA A 23 LEU HDy% 1.0 . 3.28 220 216 A 2 LYS HA A 2 LYS HG2 1.0 . 3.44 221 216 A 2 LYS HA A 2 LYS HG3 1.0 . 3.44 222 217 A 9 ALA HB% A 5 GLN HA 1.0 . 4.06 223 218 A 9 ALA HB% A 6 SER HA 1.0 . 4.42 224 219 A 14 ALA HB% A 10 ALA HA 1.0 . 3.50 225 220 A 16 VAL HB A 13 ASP HA 1.0 . 3.73 226 221 A 17 SER HA A 20 GLU HB3 1.0 . 4.08 227 222 A 17 SER HA A 20 GLU HB2 1.0 . 4.08 228 223 A 12 GLY HA2 A 15 ILE HD1% 1.0 . 4.00 229 224 A 16 VAL HG1% A 16 VAL HA 1.0 . 3.06 230 225 A 15 ILE HG2% A 15 ILE HA 1.0 . 3.15 231 226 A 16 VAL HG2% A 12 GLY HA3 1.0 . 4.42 232 227 A 16 VAL HG2% A 16 VAL HA 1.0 . 3.05 233 228 A 15 ILE HG2% A 11 ALA HA 1.0 . 5.50 234 229 A 16 VAL HG1% A 20 GLU HG3 1.0 . 4.26 235 230 A 9 ALA HB% A 5 GLN HB2 1.0 . 3.65 236 231 A 1 LYS HD3 A 1 LYS HG2 1.0 . 2.64 237 231 A 1 LYS HD2 A 1 LYS HG2 1.0 . 2.64 238 231 A 1 LYS HG3 A 1 LYS HD2 1.0 . 2.64 239 231 A 1 LYS HG3 A 1 LYS HD3 1.0 . 2.64 240 232 A 2 LYS HD2 A 2 LYS HG2 1.0 . 2.90 241 232 A 2 LYS HG3 A 2 LYS HD2 1.0 . 2.90 242 232 A 2 LYS HG3 A 2 LYS HD3 1.0 . 2.90 243 232 A 2 LYS HD3 A 2 LYS HG2 1.0 . 2.90 244 233 A 23 LEU HDx% A 23 LEU HB2 1.0 . 3.66 245 234 A 23 LEU HDy% A 23 LEU HB2 1.0 . 3.90 246 235 A 16 VAL HG2% A 15 ILE HB 1.0 . 3.73 247 236 A 15 ILE HB A 15 ILE HD1% 1.0 . 3.25 248 237 A 23 LEU HDx% A 23 LEU HB3 1.0 . 3.66 249 238 A 23 LEU HDy% A 23 LEU HB3 1.0 . 3.90 250 239 A 14 ALA HB% A 15 ILE HD1% 1.0 . 4.42 251 240 A 9 ALA HB% A 5 GLN HB3 1.0 . 3.65 252 241 A 16 VAL HG1% A 20 GLU HG2 1.0 . 4.26 253 242 A 11 ALA HB% A 15 ILE HD1% 1.0 . 3.48 254 243 A 15 ILE HG2% A 15 ILE HD1% 1.0 . 2.60 255 244 A 15 ILE HG2% A 11 ALA HB% 1.0 . 5.05 256 245 A 11 ALA HB% A 14 ALA HB% 1.0 . 4.20 257 246 A 14 ALA H A 13 ASP HBx 1.0 . 3.78 258 247 A 7 TRP H A 7 TRP HE3 1.0 . 5.18 259 248 A 14 ALA H A 10 ALA HA 1.0 . 4.03 260 249 A 16 VAL H A 16 VAL HG2% 1.0 . 3.10 261 250 A 15 ILE H A 16 VAL HG2% 1.0 . 4.42 262 251 A 16 VAL HG1% A 17 SER H 1.0 . 3.66 263 252 A 15 ILE HG2% A 15 ILE H 1.0 . 3.83 264 253 A 15 ILE H A 15 ILE HD1% 1.0 . 3.99 265 254 A 25 ALA HB% A 24 ASN HB2 1.0 . 4.67 266 254 A 24 ASN HB3 A 25 ALA HB% 1.0 . 4.67 267 255 A 7 TRP HD1 A 8 TYR H 1.0 . 4.25 268 256 A 21 GLY H A 18 PHE HA 1.0 . 4.56 269 257 A 10 ALA H A 7 TRP HA 1.0 . 4.13 270 258 A 1 LYS HZ% A 1 LYS HG2 1.0 . 4.38 271 258 A 1 LYS HG3 A 1 LYS HZ% 1.0 . 4.38 272 259 A 18 PHE HD% A 15 ILE HD1% 1.0 . 5.50 273 260 A 24 ASN HD21 A 23 LEU HDy% 1.0 . 5.50 274 261 A 16 VAL H A 15 ILE HD1% 1.0 . 4.43 275 262 A 12 GLY H A 16 VAL HG2% 1.0 . 5.50 276 263 A 16 VAL HG2% A 13 ASP H 1.0 . 5.17 277 264 A 12 GLY H A 15 ILE HD1% 1.0 . 5.14 278 265 A 16 VAL HG2% A 14 ALA H 1.0 . 5.50 279 266 A 11 ALA HB% A 14 ALA H 1.0 . 5.47 280 267 A 20 GLU H A 16 VAL HA 1.0 . 4.53 281 268 A 23 LEU HA A 24 ASN HD21 1.0 . 5.50 282 269 A 9 ALA H A 10 ALA HA 1.0 . 5.50 283 270 A 10 ALA HA A 5 GLN HE21 1.0 . 4.87 284 271 A 7 TRP HD1 A 6 SER HB2 1.0 . 5.50 285 272 A 7 TRP HD1 A 6 SER HB3 1.0 . 5.50 286 273 A 14 ALA H A 16 VAL HB 1.0 . 5.50 287 274 A 15 ILE HB A 14 ALA H 1.0 . 5.16 288 275 A 20 GLU H A 21 GLY HA3 1.0 . 5.06 289 276 A 17 SER H A 18 PHE HB3 1.0 . 5.50 290 277 A 17 SER H A 18 PHE HB2 1.0 . 4.38 291 278 A 10 ALA HA A 5 GLN HE22 1.0 . 4.87 292 279 A 26 TRP HD1 A 25 ALA HB% 1.0 . 5.02 293 280 A 15 ILE HG2% A 14 ALA HB% 1.0 . 5.06 294 281 A 16 VAL HG1% A 20 GLU HA 1.0 . 5.50 295 282 A 18 PHE HD% A 21 GLY HA3 1.0 . 5.09 296 283 A 2 LYS H A 1 LYS HB2 1.0 . 4.46 297 283 A 1 LYS HB3 A 2 LYS H 1.0 . 4.46 298 284 A 3 LYS H A 2 LYS HB2 1.0 . 4.03 299 284 A 3 LYS H A 2 LYS HB3 1.0 . 4.03 300 285 A 3 LYS H A 3 LYS HB2 1.0 . 3.69 301 285 A 3 LYS H A 3 LYS HB3 1.0 . 3.69 302 286 A 4 LYS H A 4 LYS HB2 1.0 . 3.31 303 286 A 4 LYS H A 4 LYS HB3 1.0 . 3.31 304 287 A 4 LYS H A 4 LYS HG2 1.0 . 3.43 305 287 A 4 LYS H A 4 LYS HG3 1.0 . 3.43 306 288 A 4 LYS HB2 A 4 LYS HE2 1.0 . 2.81 307 288 A 4 LYS HB3 A 4 LYS HE2 1.0 . 2.81 308 288 A 4 LYS HE3 A 4 LYS HB2 1.0 . 2.81 309 288 A 4 LYS HB3 A 4 LYS HE3 1.0 . 2.81 310 289 A 4 LYS HG3 A 5 GLN HB2 1.0 . 3.89 311 289 A 5 GLN HB3 A 4 LYS HG2 1.0 . 3.89 312 289 A 4 LYS HG3 A 5 GLN HB3 1.0 . 3.89 313 289 A 4 LYS HG2 A 5 GLN HB2 1.0 . 3.89 314 290 A 4 LYS HG3 A 5 GLN HG2 1.0 . 3.25 315 290 A 4 LYS HG2 A 5 GLN HG2 1.0 . 3.25 316 290 A 5 GLN HG3 A 4 LYS HG2 1.0 . 3.25 317 290 A 4 LYS HG3 A 5 GLN HG3 1.0 . 3.25 318 291 A 5 GLN H A 5 GLN HB2 1.0 . 3.30 319 291 A 5 GLN H A 5 GLN HB3 1.0 . 3.30 320 292 A 5 GLN HA A 5 GLN HG2 1.0 . 3.74 321 292 A 5 GLN HA A 5 GLN HG3 1.0 . 3.74 322 293 A 6 SER H A 5 GLN HB2 1.0 . 3.82 323 293 A 6 SER H A 5 GLN HB3 1.0 . 3.82 324 294 A 9 ALA HB% A 5 GLN HB2 1.0 . 3.20 325 294 A 9 ALA HB% A 5 GLN HB3 1.0 . 3.20 326 295 A 6 SER H A 5 GLN HG2 1.0 . 4.35 327 295 A 6 SER H A 5 GLN HG3 1.0 . 4.35 328 296 A 9 ALA HB% A 5 GLN HG2 1.0 . 2.84 329 296 A 9 ALA HB% A 5 GLN HG3 1.0 . 2.84 330 297 A 9 ALA HB% A 5 GLN HE21 1.0 . 3.96 331 297 A 9 ALA HB% A 5 GLN HE22 1.0 . 3.96 332 298 A 10 ALA HA A 5 GLN HE21 1.0 . 4.10 333 298 A 10 ALA HA A 5 GLN HE22 1.0 . 4.10 334 299 A 10 ALA HB% A 5 GLN HE21 1.0 . 4.81 335 299 A 10 ALA HB% A 5 GLN HE22 1.0 . 4.81 336 300 A 6 SER H A 6 SER HB3 1.0 . 3.35 337 300 A 6 SER H A 6 SER HB2 1.0 . 3.35 338 301 A 7 TRP H A 6 SER HB3 1.0 . 3.52 339 301 A 7 TRP H A 6 SER HB2 1.0 . 3.52 340 302 A 8 TYR H A 6 SER HB3 1.0 . 3.88 341 302 A 8 TYR H A 6 SER HB2 1.0 . 3.88 342 303 A 8 TYR HD% A 6 SER HB3 1.0 . 3.85 343 303 A 8 TYR HD% A 6 SER HB2 1.0 . 3.85 344 304 A 8 TYR HE% A 6 SER HB3 1.0 . 4.13 345 304 A 8 TYR HE% A 6 SER HB2 1.0 . 4.13 346 305 A 9 ALA H A 6 SER HB3 1.0 . 4.18 347 305 A 9 ALA H A 6 SER HB2 1.0 . 4.18 348 306 A 9 ALA H A 8 TYR HB3 1.0 . 3.74 349 306 A 9 ALA H A 8 TYR HB2 1.0 . 3.74 350 307 A 10 ALA HA A 13 ASP HBx 1.0 . 3.60 351 307 A 10 ALA HA A 13 ASP HBy 1.0 . 3.60 352 308 A 10 ALA HB% A 13 ASP HBx 1.0 . 5.21 353 308 A 10 ALA HB% A 13 ASP HBy 1.0 . 5.21 354 309 A 13 ASP H A 13 ASP HBx 1.0 . 3.02 355 309 A 13 ASP H A 13 ASP HBy 1.0 . 3.02 356 310 A 14 ALA H A 13 ASP HBx 1.0 . 3.27 357 310 A 14 ALA H A 13 ASP HBy 1.0 . 3.27 358 311 A 14 ALA HB% A 13 ASP HBx 1.0 . 5.13 359 311 A 14 ALA HB% A 13 ASP HBy 1.0 . 5.13 360 312 A 14 ALA HA A 17 SER HB3 1.0 . 3.33 361 312 A 14 ALA HA A 17 SER HB2 1.0 . 3.33 362 313 A 14 ALA HB% A 17 SER HB3 1.0 . 4.42 363 313 A 14 ALA HB% A 17 SER HB2 1.0 . 4.42 364 314 A 15 ILE H A 15 ILE HG13 1.0 . 3.26 365 314 A 15 ILE H A 15 ILE HG12 1.0 . 3.26 366 315 A 15 ILE HA A 15 ILE HG13 1.0 . 3.09 367 315 A 15 ILE HA A 15 ILE HG12 1.0 . 3.09 368 316 A 15 ILE HG2% A 15 ILE HG13 1.0 . 3.32 369 316 A 15 ILE HG2% A 15 ILE HG12 1.0 . 3.32 370 317 A 16 VAL HG1% A 17 SER HB3 1.0 . 4.51 371 317 A 16 VAL HG1% A 17 SER HB2 1.0 . 4.51 372 318 A 16 VAL HG1% A 20 GLU HG3 1.0 . 3.63 373 318 A 16 VAL HG1% A 20 GLU HG2 1.0 . 3.63 374 319 A 17 SER HA A 17 SER HB3 1.0 . 2.64 375 319 A 17 SER HA A 17 SER HB2 1.0 . 2.64 376 320 A 17 SER HA A 20 GLU HB3 1.0 . 3.51 377 320 A 17 SER HA A 20 GLU HB2 1.0 . 3.51 378 321 A 18 PHE HD% A 22 PHE HB3 1.0 . 5.32 379 321 A 18 PHE HD% A 22 PHE HB2 1.0 . 5.32 380 322 A 20 GLU H A 20 GLU HB3 1.0 . 3.08 381 322 A 20 GLU H A 20 GLU HB2 1.0 . 3.08 382 323 A 20 GLU H A 20 GLU HG3 1.0 . 3.37 383 323 A 20 GLU H A 20 GLU HG2 1.0 . 3.37 384 324 A 20 GLU HA A 20 GLU HG3 1.0 . 3.27 385 324 A 20 GLU HA A 20 GLU HG2 1.0 . 3.27 386 325 A 23 LEU H A 23 LEU HB2 1.0 . 3.22 387 325 A 23 LEU H A 23 LEU HB3 1.0 . 3.22 388 326 A 23 LEU HDx% A 23 LEU HB2 1.0 . 3.15 389 326 A 23 LEU HDx% A 23 LEU HB3 1.0 . 3.15 390 327 A 23 LEU HDy% A 23 LEU HB2 1.0 . 3.27 391 327 A 23 LEU HDy% A 23 LEU HB3 1.0 . 3.27 392 328 A 26 TRP H A 26 TRP HB2 1.0 . 3.22 393 328 A 26 TRP H A 26 TRP HB3 1.0 . 3.22 394 329 A 18 PHE H A 14 ALA HA 1.0 . 5.29 395 330 A 22 PHE H A 18 PHE HA 1.0 . 5.50 396 331 A 3 LYS H A 1 LYS HA 1.0 . 5.22 397 332 A 12 GLY H A 9 ALA HA 1.0 . 4.44 398 333 A 3 LYS H A 2 LYS H 1.0 . 4.50 399 334 A 22 PHE H A 21 GLY HA2 1.0 . 3.42 400 335 A 22 PHE H A 21 GLY HA3 1.0 . 3.45 401 336 A 13 ASP H A 12 GLY HA2 1.0 . 3.51 402 337 A 13 ASP H A 12 GLY HA3 1.0 . 3.33 403 338 A 16 VAL H A 15 ILE HA 1.0 . 3.40 404 339 A 17 SER H A 16 VAL HA 1.0 . 3.37 405 340 A 7 TRP HA A 8 TYR H 1.0 . 3.46 406 341 A 9 ALA H A 8 TYR HA 1.0 . 3.29 407 342 A 14 ALA H A 13 ASP HA 1.0 . 3.33 408 343 A 18 PHE H A 17 SER HA 1.0 . 3.44 409 344 A 20 GLU H A 19 GLY HA2 1.0 . 3.51 410 344 A 20 GLU H A 19 GLY HA3 1.0 . 3.51 411 345 A 21 GLY H A 20 GLU HA 1.0 . 3.32 412 346 A 25 ALA H A 24 ASN HA 1.0 . 3.52 413 347 A 26 TRP H A 25 ALA HA 1.0 . 3.50 414 348 A 16 VAL HG1% A 20 GLU H 1.0 . 4.97 415 349 A 15 ILE HG2% A 16 VAL H 1.0 . 3.70 416 350 A 15 ILE HG2% A 18 PHE H 1.0 . 4.54 417 351 A 11 ALA HB% A 12 GLY H 1.0 . 3.43 418 352 A 11 ALA HB% A 11 ALA H 1.0 . 3.10 419 353 A 15 ILE H A 15 ILE HG13 1.0 . 3.91 420 354 A 16 VAL HG2% A 17 SER H 1.0 . 4.15 421 355 A 11 ALA H A 10 ALA HB% 1.0 . 3.63 422 356 A 12 GLY H A 10 ALA HB% 1.0 . 4.51 423 357 A 6 SER H A 9 ALA HB% 1.0 . 3.81 424 358 A 10 ALA HB% A 13 ASP H 1.0 . 5.50 425 359 A 9 ALA HB% A 10 ALA H 1.0 . 3.24 426 360 A 10 ALA HB% A 10 ALA H 1.0 . 3.39 427 361 A 9 ALA HB% A 7 TRP H 1.0 . 5.11 428 362 A 15 ILE HG2% A 19 GLY H 1.0 . 4.57 429 363 A 12 GLY H A 14 ALA HB% 1.0 . 4.91 430 364 A 11 ALA H A 14 ALA HB% 1.0 . 4.65 431 365 A 16 VAL H A 14 ALA HB% 1.0 . 5.21 432 366 A 6 SER H A 5 GLN HB2 1.0 . 4.53 433 367 A 6 SER H A 5 GLN HB3 1.0 . 4.53 434 368 A 15 ILE H A 15 ILE HG12 1.0 . 3.91 435 369 A 15 ILE H A 15 ILE HB 1.0 . 3.25 436 370 A 16 VAL H A 15 ILE HB 1.0 . 3.56 437 371 A 14 ALA HB% A 14 ALA H 1.0 . 3.09 438 372 A 10 ALA H A 14 ALA HB% 1.0 . 5.06 439 373 A 23 LEU H A 23 LEU HG 1.0 . 2.91 440 374 A 16 VAL H A 16 VAL HB 1.0 . 3.36 441 375 A 17 SER H A 16 VAL HB 1.0 . 3.39 442 376 A 21 GLY H A 20 GLU HB2 1.0 . 3.95 443 377 A 5 GLN H A 5 GLN HG3 1.0 . 4.45 444 378 A 5 GLN H A 5 GLN HG2 1.0 . 4.45 445 379 A 20 GLU H A 20 GLU HB2 1.0 . 3.58 446 380 A 20 GLU H A 20 GLU HB3 1.0 . 3.58 447 381 A 20 GLU H A 20 GLU HG3 1.0 . 4.01 448 382 A 13 ASP H A 13 ASP HBy 1.0 . 3.48 449 383 A 24 ASN H A 24 ASN HB2 1.0 . 3.07 450 383 A 24 ASN H A 24 ASN HB3 1.0 . 3.07 451 384 A 22 PHE H A 22 PHE HB3 1.0 . 3.13 452 385 A 14 ALA H A 13 ASP HBy 1.0 . 3.78 453 386 A 22 PHE H A 22 PHE HB2 1.0 . 3.13 454 387 A 25 ALA H A 24 ASN HB2 1.0 . 3.77 455 387 A 24 ASN HB3 A 25 ALA H 1.0 . 3.77 456 388 A 9 ALA H A 8 TYR HB2 1.0 . 4.33 457 389 A 7 TRP HB3 A 7 TRP HD1 1.0 . 3.83 458 390 A 7 TRP HD1 A 7 TRP HB2 1.0 . 3.83 459 391 A 18 PHE H A 18 PHE HB2 1.0 . 3.32 460 392 A 18 PHE H A 18 PHE HB3 1.0 . 3.29 461 393 A 19 GLY H A 18 PHE HB3 1.0 . 3.84 462 394 A 19 GLY H A 18 PHE HB2 1.0 . 3.67 463 395 A 7 TRP H A 7 TRP HB2 1.0 . 3.75 464 396 A 7 TRP H A 7 TRP HB3 1.0 . 3.53 465 397 A 6 SER H A 6 SER HB3 1.0 . 3.89 466 398 A 6 SER H A 6 SER HB2 1.0 . 3.89 467 399 A 11 ALA H A 10 ALA HA 1.0 . 3.52 468 400 A 18 PHE H A 15 ILE HA 1.0 . 3.59 469 401 A 15 ILE H A 12 GLY HA2 1.0 . 4.28 470 402 A 18 PHE H A 16 VAL HA 1.0 . 4.38 471 403 A 18 PHE H A 17 SER HB3 1.0 . 4.48 472 404 A 12 GLY H A 8 TYR HA 1.0 . 5.22 473 405 A 12 GLY H A 9 ALA HA 1.0 . 5.43 474 406 A 23 LEU HA A 26 TRP H 1.0 . 4.45 475 407 A 25 ALA H A 23 LEU HA 1.0 . 4.63 476 408 A 7 TRP HD1 A 7 TRP HA 1.0 . 4.57 477 409 A 26 TRP HA A 26 TRP HE3 1.0 . 4.78 478 410 A 7 TRP HD1 A 6 SER HA 1.0 . 4.45 479 411 A 26 TRP H A 24 ASN HA 1.0 . 4.51 480 412 A 5 GLN H A 4 LYS HA 1.0 . 3.44 481 413 A 13 ASP H A 14 ALA HA 1.0 . 5.41 482 414 A 2 LYS HA A 3 LYS H 1.0 . 3.18 483 415 A 11 ALA H A 7 TRP HA 1.0 . 4.25 484 416 A 5 GLN H A 6 SER HA 1.0 . 4.64 485 417 A 15 ILE H A 13 ASP HA 1.0 . 4.46 486 418 A 17 SER H A 13 ASP HA 1.0 . 4.18 487 419 A 16 VAL H A 13 ASP HA 1.0 . 4.42 488 420 A 6 SER H A 5 GLN HA 1.0 . 2.95 489 421 A 20 GLU H A 17 SER HA 1.0 . 4.87 490 422 A 20 GLU H A 18 PHE HA 1.0 . 4.63 491 423 A 19 GLY H A 17 SER HA 1.0 . 4.97 492 424 A 7 TRP H A 6 SER HA 1.0 . 3.24 493 425 A 7 TRP HE1 A 8 TYR HD% 1.0 . 4.98 494 426 A 19 GLY H A 18 PHE HD% 1.0 . 4.42 495 427 A 22 PHE H A 22 PHE HD% 1.0 . 4.61 496 428 A 6 SER H A 9 ALA H 1.0 . 4.77 497 429 A 7 TRP HE3 A 8 TYR H 1.0 . 4.01 498 430 A 8 TYR HD% A 7 TRP HH2 1.0 . 4.75 499 431 A 8 TYR HD% A 7 TRP HZ3 1.0 . 4.71 500 432 A 9 ALA H A 8 TYR H 1.0 . 3.27 501 433 A 18 PHE HE% A 18 PHE HZ 1.0 . 2.44 502 434 A 26 TRP H A 24 ASN HD21 1.0 . 4.40 503 435 A 25 ALA H A 26 TRP H 1.0 . 3.35 504 436 A 24 ASN H A 25 ALA H 1.0 . 3.41 505 437 A 10 ALA H A 9 ALA H 1.0 . 3.47 506 438 A 19 GLY H A 21 GLY H 1.0 . 4.53 507 439 A 17 SER H A 19 GLY H 1.0 . 4.56 508 440 A 15 ILE H A 13 ASP H 1.0 . 4.28 509 441 A 16 VAL H A 15 ILE H 1.0 . 3.43 510 442 A 18 PHE H A 17 SER H 1.0 . 3.54 511 443 A 12 GLY H A 11 ALA H 1.0 . 3.40 512 444 A 6 SER H A 5 GLN H 1.0 . 4.11 513 445 A 20 GLU H A 19 GLY H 1.0 . 3.59 514 446 A 18 PHE H A 19 GLY H 1.0 . 3.55 515 447 A 7 TRP H A 7 TRP HD1 1.0 . 3.81 516 448 A 13 ASP H A 14 ALA H 1.0 . 3.40 517 449 A 20 GLU H A 21 GLY H 1.0 . 3.51 518 450 A 11 ALA H A 10 ALA H 1.0 . 3.41 519 451 A 15 ILE H A 14 ALA H 1.0 . 3.49 520 452 A 17 SER H A 14 ALA H 1.0 . 5.44 521 453 A 16 VAL H A 14 ALA H 1.0 . 4.60 522 454 A 6 SER H A 7 TRP H 1.0 . 4.78 523 455 A 7 TRP HE1 A 8 TYR H 1.0 . 5.50 524 456 A 7 TRP HE1 A 8 TYR HE% 1.0 . 5.50 525 457 A 7 TRP H A 8 TYR H 1.0 . 3.76 526 458 A 7 TRP H A 8 TYR HD% 1.0 . 4.37 527 459 A 11 ALA H A 9 ALA H 1.0 . 4.50 528 460 A 18 PHE H A 18 PHE HD% 1.0 . 4.02 529 461 A 15 ILE H A 18 PHE HD% 1.0 . 5.50 530 462 A 10 ALA H A 8 TYR H 1.0 . 4.60 531 463 A 23 LEU H A 22 PHE HD% 1.0 . 3.69 532 464 A 8 TYR HD% A 7 TRP HZ2 1.0 . 3.56 533 465 A 9 ALA H A 8 TYR HD% 1.0 . 4.35 534 466 A 22 PHE HD% A 24 ASN HD21 1.0 . 4.93 535 467 A 26 TRP H A 26 TRP HD1 1.0 . 4.34 536 468 A 21 GLY H A 18 PHE HD% 1.0 . 5.14 537 469 A 22 PHE H A 18 PHE HD% 1.0 . 4.97 538 470 A 8 TYR HD% A 7 TRP HE3 1.0 . 4.57 539 471 A 8 TYR HD% A 8 TYR H 1.0 . 2.98 540 472 A 18 PHE HA A 18 PHE HD% 1.0 . 3.56 541 473 A 26 TRP HA A 26 TRP HD1 1.0 . 4.45 542 474 A 26 TRP HD1 A 25 ALA HA 1.0 . 5.30 543 475 A 22 PHE HD% A 22 PHE HA 1.0 . 3.63 544 476 A 22 PHE HA A 22 PHE HE% 1.0 . 4.89 545 477 A 6 SER HA A 8 TYR H 1.0 . 4.54 546 478 A 14 ALA HA A 18 PHE HD% 1.0 . 5.49 547 479 A 9 ALA H A 7 TRP HA 1.0 . 4.85 548 480 A 23 LEU HA A 26 TRP HD1 1.0 . 4.95 549 481 A 8 TYR HA A 7 TRP HE3 1.0 . 3.68 550 482 A 8 TYR HA A 7 TRP HZ3 1.0 . 4.08 551 483 A 8 TYR HE% A 9 ALA HA 1.0 . 4.56 552 484 A 8 TYR H A 6 SER HB2 1.0 . 4.47 553 485 A 8 TYR HE% A 6 SER HB2 1.0 . 4.80 554 486 A 8 TYR HD% A 9 ALA HA 1.0 . 3.96 555 487 A 8 TYR HD% A 6 SER HB2 1.0 . 4.73 556 488 A 7 TRP HB2 A 7 TRP HE3 1.0 . 3.60 557 489 A 7 TRP HB2 A 8 TYR H 1.0 . 4.32 558 490 A 7 TRP HB3 A 8 TYR H 1.0 . 4.21 559 491 A 8 TYR H A 8 TYR HB3 1.0 . 3.69 560 492 A 25 ALA H A 25 ALA HB% 1.0 . 3.26 561 493 A 23 LEU HG A 22 PHE HD% 1.0 . 4.27 562 494 A 22 PHE HD% A 25 ALA HB% 1.0 . 4.82 563 495 A 11 ALA HB% A 8 TYR H 1.0 . 5.18 564 496 A 9 ALA HB% A 8 TYR HE% 1.0 . 4.30 565 497 A 9 ALA HB% A 8 TYR HD% 1.0 . 4.33 566 498 A 22 PHE HD% A 23 LEU HDy% 1.0 . 4.42 567 499 A 22 PHE HD% A 23 LEU HDx% 1.0 . 4.61 568 500 A 22 PHE HE% A 23 LEU HDy% 1.0 . 4.77 569 501 A 22 PHE HE% A 23 LEU HDx% 1.0 . 5.50 570 502 A 23 LEU HDy% A 20 GLU HA 1.0 . 4.38 571 503 A 23 LEU HDx% A 20 GLU HA 1.0 . 4.23 572 504 A 23 LEU HA A 23 LEU HDx% 1.0 . 4.01 573 505 A 11 ALA HB% A 8 TYR HA 1.0 . 3.42 574 506 A 15 ILE HA A 15 ILE HD1% 1.0 . 3.83 575 507 A 15 ILE HA A 15 ILE HG13 1.0 . 3.57 576 508 A 9 ALA HB% A 6 SER HB3 1.0 . 4.32 577 509 A 9 ALA HB% A 6 SER HB2 1.0 . 4.32 578 510 A 14 ALA HB% A 11 ALA HA 1.0 . 3.15 579 511 A 14 ALA HB% A 15 ILE HA 1.0 . 4.28 580 512 A 23 LEU HG A 20 GLU HA 1.0 . 3.61 581 513 A 15 ILE HA A 15 ILE HG12 1.0 . 3.57 582 514 A 15 ILE HB A 16 VAL HA 1.0 . 4.48 583 515 A 20 GLU HA A 20 GLU HG2 1.0 . 3.87 584 516 A 20 GLU HA A 20 GLU HG3 1.0 . 3.87 585 517 A 10 ALA HA A 13 ASP HBx 1.0 . 4.23 586 518 A 10 ALA HA A 13 ASP HBy 1.0 . 4.23 587 519 A 18 PHE HB2 A 15 ILE HA 1.0 . 3.62 588 520 A 18 PHE HB3 A 15 ILE HA 1.0 . 4.26 589 521 A 18 PHE HB3 A 19 GLY HA2 1.0 . 4.48 590 521 A 18 PHE HB3 A 19 GLY HA3 1.0 . 4.48 591 522 A 8 TYR HA A 8 TYR HD% 1.0 . 3.84 592 523 A 8 TYR HD% A 6 SER HB3 1.0 . 4.73 593 524 A 8 TYR H A 6 SER HB3 1.0 . 4.47 594 525 A 8 TYR HE% A 6 SER HB3 1.0 . 4.80 595 526 A 15 ILE HA A 18 PHE HD% 1.0 . 4.11 596 527 A 23 LEU HA A 22 PHE HD% 1.0 . 4.25 597 528 A 9 ALA H A 6 SER HB3 1.0 . 4.83 598 529 A 9 ALA H A 6 SER HB2 1.0 . 4.83 599 530 A 8 TYR H A 8 TYR HB2 1.0 . 3.69 600 531 A 10 ALA H A 10 ALA HA 1.0 . 2.88 601 532 A 17 SER H A 17 SER HB2 1.0 . 3.54 602 533 A 17 SER H A 17 SER HB3 1.0 . 3.54 603 534 A 17 SER H A 15 ILE HA 1.0 . 4.25 604 535 A 18 PHE H A 17 SER HB2 1.0 . 4.48 605 536 A 11 ALA H A 8 TYR HA 1.0 . 3.87 606 537 A 12 GLY H A 11 ALA HA 1.0 . 3.48 607 538 A 20 GLU H A 18 PHE H 1.0 . 5.01 608 539 A 7 TRP H A 6 SER HB3 1.0 . 4.14 609 540 A 7 TRP H A 6 SER HB2 1.0 . 4.14 610 541 A 13 ASP H A 13 ASP HBx 1.0 . 3.48 611 542 A 20 GLU H A 20 GLU HG2 1.0 . 4.01 612 543 A 15 ILE H A 16 VAL HB 1.0 . 4.88 613 544 A 13 ASP H A 14 ALA HB% 1.0 . 4.20 614 545 A 15 ILE H A 14 ALA HB% 1.0 . 3.56 615 546 A 17 SER H A 14 ALA HB% 1.0 . 4.89 616 547 A 3 LYS H A 2 LYS HG2 1.0 . 3.86 617 547 A 3 LYS H A 2 LYS HG3 1.0 . 3.86 618 548 A 21 GLY H A 20 GLU HB3 1.0 . 3.95 619 549 A 9 ALA H A 8 TYR HB3 1.0 . 4.33 620 550 A 24 ASN H A 25 ALA HB% 1.0 . 4.61 621 551 A 11 ALA HB% A 10 ALA H 1.0 . 4.30 622 552 A 26 TRP H A 25 ALA HB% 1.0 . 3.85 623 553 A 9 ALA HB% A 9 ALA H 1.0 . 3.02 624 554 A 14 ALA HB% A 18 PHE HD% 1.0 . 4.92 625 555 A 11 ALA HB% A 7 TRP HE3 1.0 . 3.98 626 556 A 15 ILE HG2% A 18 PHE HD% 1.0 . 4.73 627 557 A 23 LEU H A 23 LEU HDx% 1.0 . 4.12 628 558 A 23 LEU H A 23 LEU HDy% 1.0 . 4.01 629 559 A 11 ALA HB% A 7 TRP HZ3 1.0 . 4.47 630 560 A 16 VAL HG1% A 13 ASP HA 1.0 . 4.41 631 561 A 16 VAL HG2% A 13 ASP HA 1.0 . 3.96 632 562 A 16 VAL HG1% A 17 SER HA 1.0 . 4.15 633 563 A 23 LEU HA A 23 LEU HDy% 1.0 . 3.28 634 564 A 2 LYS HA A 2 LYS HG2 1.0 . 3.44 635 564 A 2 LYS HA A 2 LYS HG3 1.0 . 3.44 636 565 A 9 ALA HB% A 5 GLN HA 1.0 . 4.06 637 566 A 9 ALA HB% A 6 SER HA 1.0 . 4.42 638 567 A 14 ALA HB% A 10 ALA HA 1.0 . 3.50 639 568 A 16 VAL HB A 13 ASP HA 1.0 . 3.73 640 569 A 17 SER HA A 20 GLU HB3 1.0 . 4.08 641 570 A 17 SER HA A 20 GLU HB2 1.0 . 4.08 642 571 A 12 GLY HA2 A 15 ILE HD1% 1.0 . 4.00 643 572 A 16 VAL HG1% A 16 VAL HA 1.0 . 3.06 644 573 A 15 ILE HG2% A 15 ILE HA 1.0 . 3.15 645 574 A 16 VAL HG2% A 12 GLY HA3 1.0 . 4.42 646 575 A 16 VAL HG2% A 16 VAL HA 1.0 . 3.05 647 576 A 15 ILE HG2% A 11 ALA HA 1.0 . 5.50 648 577 A 16 VAL HG1% A 20 GLU HG3 1.0 . 4.26 649 578 A 9 ALA HB% A 5 GLN HB2 1.0 . 3.65 650 579 A 1 LYS HD3 A 1 LYS HG2 1.0 . 2.64 651 579 A 1 LYS HD2 A 1 LYS HG2 1.0 . 2.64 652 579 A 1 LYS HG3 A 1 LYS HD2 1.0 . 2.64 653 579 A 1 LYS HG3 A 1 LYS HD3 1.0 . 2.64 654 580 A 2 LYS HD2 A 2 LYS HG2 1.0 . 2.90 655 580 A 2 LYS HG3 A 2 LYS HD2 1.0 . 2.90 656 580 A 2 LYS HG3 A 2 LYS HD3 1.0 . 2.90 657 580 A 2 LYS HD3 A 2 LYS HG2 1.0 . 2.90 658 581 A 23 LEU HDx% A 23 LEU HB2 1.0 . 3.66 659 582 A 23 LEU HDy% A 23 LEU HB2 1.0 . 3.90 660 583 A 16 VAL HG2% A 15 ILE HB 1.0 . 3.73 661 584 A 15 ILE HB A 15 ILE HD1% 1.0 . 3.25 662 585 A 23 LEU HDx% A 23 LEU HB3 1.0 . 3.66 663 586 A 23 LEU HDy% A 23 LEU HB3 1.0 . 3.90 664 587 A 14 ALA HB% A 15 ILE HD1% 1.0 . 4.42 665 588 A 9 ALA HB% A 5 GLN HB3 1.0 . 3.65 666 589 A 16 VAL HG1% A 20 GLU HG2 1.0 . 4.26 667 590 A 11 ALA HB% A 15 ILE HD1% 1.0 . 3.48 668 591 A 15 ILE HG2% A 15 ILE HD1% 1.0 . 2.60 669 592 A 15 ILE HG2% A 11 ALA HB% 1.0 . 5.05 670 593 A 11 ALA HB% A 14 ALA HB% 1.0 . 4.20 671 594 A 14 ALA H A 13 ASP HBx 1.0 . 3.78 672 595 A 7 TRP H A 7 TRP HE3 1.0 . 5.18 673 596 A 14 ALA H A 10 ALA HA 1.0 . 4.03 674 597 A 16 VAL H A 16 VAL HG2% 1.0 . 3.10 675 598 A 15 ILE H A 16 VAL HG2% 1.0 . 4.42 676 599 A 16 VAL HG1% A 17 SER H 1.0 . 3.66 677 600 A 15 ILE HG2% A 15 ILE H 1.0 . 3.83 678 601 A 15 ILE H A 15 ILE HD1% 1.0 . 3.99 679 602 A 25 ALA HB% A 24 ASN HB2 1.0 . 4.67 680 602 A 24 ASN HB3 A 25 ALA HB% 1.0 . 4.67 681 603 A 7 TRP HD1 A 8 TYR H 1.0 . 4.25 682 604 A 21 GLY H A 18 PHE HA 1.0 . 4.56 683 605 A 10 ALA H A 7 TRP HA 1.0 . 4.13 684 606 A 1 LYS HZ% A 1 LYS HG2 1.0 . 4.38 685 606 A 1 LYS HG3 A 1 LYS HZ% 1.0 . 4.38 686 607 A 18 PHE HD% A 15 ILE HD1% 1.0 . 5.50 687 608 A 24 ASN HD21 A 23 LEU HDy% 1.0 . 5.50 688 609 A 16 VAL H A 15 ILE HD1% 1.0 . 4.43 689 610 A 12 GLY H A 16 VAL HG2% 1.0 . 5.50 690 611 A 16 VAL HG2% A 13 ASP H 1.0 . 5.17 691 612 A 12 GLY H A 15 ILE HD1% 1.0 . 5.14 692 613 A 16 VAL HG2% A 14 ALA H 1.0 . 5.50 693 614 A 11 ALA HB% A 14 ALA H 1.0 . 5.47 694 615 A 20 GLU H A 16 VAL HA 1.0 . 4.53 695 616 A 23 LEU HA A 24 ASN HD21 1.0 . 5.50 696 617 A 9 ALA H A 10 ALA HA 1.0 . 5.50 697 618 A 10 ALA HA A 5 GLN HE21 1.0 . 4.87 698 619 A 7 TRP HD1 A 6 SER HB2 1.0 . 5.50 699 620 A 7 TRP HD1 A 6 SER HB3 1.0 . 5.50 700 621 A 14 ALA H A 16 VAL HB 1.0 . 5.50 701 622 A 15 ILE HB A 14 ALA H 1.0 . 5.16 702 623 A 20 GLU H A 21 GLY HA3 1.0 . 5.06 703 624 A 17 SER H A 18 PHE HB3 1.0 . 5.50 704 625 A 17 SER H A 18 PHE HB2 1.0 . 4.38 705 626 A 10 ALA HA A 5 GLN HE22 1.0 . 4.87 706 627 A 26 TRP HD1 A 25 ALA HB% 1.0 . 5.02 707 628 A 15 ILE HG2% A 14 ALA HB% 1.0 . 5.06 708 629 A 16 VAL HG1% A 20 GLU HA 1.0 . 5.50 709 630 A 18 PHE HD% A 21 GLY HA3 1.0 . 5.09 710 631 A 2 LYS H A 1 LYS HB2 1.0 . 4.46 711 631 A 1 LYS HB3 A 2 LYS H 1.0 . 4.46 712 632 A 3 LYS H A 2 LYS HB2 1.0 . 4.03 713 632 A 3 LYS H A 2 LYS HB3 1.0 . 4.03 714 633 A 3 LYS H A 3 LYS HB2 1.0 . 3.69 715 633 A 3 LYS H A 3 LYS HB3 1.0 . 3.69 716 634 A 4 LYS H A 4 LYS HB2 1.0 . 3.31 717 634 A 4 LYS H A 4 LYS HB3 1.0 . 3.31 718 635 A 4 LYS H A 4 LYS HG2 1.0 . 3.43 719 635 A 4 LYS H A 4 LYS HG3 1.0 . 3.43 720 636 A 4 LYS HB2 A 4 LYS HE2 1.0 . 2.81 721 636 A 4 LYS HB3 A 4 LYS HE2 1.0 . 2.81 722 636 A 4 LYS HE3 A 4 LYS HB2 1.0 . 2.81 723 636 A 4 LYS HB3 A 4 LYS HE3 1.0 . 2.81 724 637 A 4 LYS HG3 A 5 GLN HB2 1.0 . 3.89 725 637 A 5 GLN HB3 A 4 LYS HG2 1.0 . 3.89 726 637 A 4 LYS HG3 A 5 GLN HB3 1.0 . 3.89 727 637 A 4 LYS HG2 A 5 GLN HB2 1.0 . 3.89 728 638 A 4 LYS HG3 A 5 GLN HG2 1.0 . 3.25 729 638 A 4 LYS HG2 A 5 GLN HG2 1.0 . 3.25 730 638 A 5 GLN HG3 A 4 LYS HG2 1.0 . 3.25 731 638 A 4 LYS HG3 A 5 GLN HG3 1.0 . 3.25 732 639 A 5 GLN H A 5 GLN HB2 1.0 . 3.30 733 639 A 5 GLN H A 5 GLN HB3 1.0 . 3.30 734 640 A 5 GLN HA A 5 GLN HG2 1.0 . 3.74 735 640 A 5 GLN HA A 5 GLN HG3 1.0 . 3.74 736 641 A 6 SER H A 5 GLN HB2 1.0 . 3.82 737 641 A 6 SER H A 5 GLN HB3 1.0 . 3.82 738 642 A 9 ALA HB% A 5 GLN HB2 1.0 . 3.20 739 642 A 9 ALA HB% A 5 GLN HB3 1.0 . 3.20 740 643 A 6 SER H A 5 GLN HG2 1.0 . 4.35 741 643 A 6 SER H A 5 GLN HG3 1.0 . 4.35 742 644 A 9 ALA HB% A 5 GLN HG2 1.0 . 2.84 743 644 A 9 ALA HB% A 5 GLN HG3 1.0 . 2.84 744 645 A 9 ALA HB% A 5 GLN HE21 1.0 . 3.96 745 645 A 9 ALA HB% A 5 GLN HE22 1.0 . 3.96 746 646 A 10 ALA HA A 5 GLN HE21 1.0 . 4.10 747 646 A 10 ALA HA A 5 GLN HE22 1.0 . 4.10 748 647 A 10 ALA HB% A 5 GLN HE21 1.0 . 4.81 749 647 A 10 ALA HB% A 5 GLN HE22 1.0 . 4.81 750 648 A 6 SER H A 6 SER HB3 1.0 . 3.35 751 648 A 6 SER H A 6 SER HB2 1.0 . 3.35 752 649 A 7 TRP H A 6 SER HB3 1.0 . 3.52 753 649 A 7 TRP H A 6 SER HB2 1.0 . 3.52 754 650 A 8 TYR H A 6 SER HB3 1.0 . 3.88 755 650 A 8 TYR H A 6 SER HB2 1.0 . 3.88 756 651 A 8 TYR HD% A 6 SER HB3 1.0 . 3.85 757 651 A 8 TYR HD% A 6 SER HB2 1.0 . 3.85 758 652 A 8 TYR HE% A 6 SER HB3 1.0 . 4.13 759 652 A 8 TYR HE% A 6 SER HB2 1.0 . 4.13 760 653 A 9 ALA H A 6 SER HB3 1.0 . 4.18 761 653 A 9 ALA H A 6 SER HB2 1.0 . 4.18 762 654 A 9 ALA H A 8 TYR HB3 1.0 . 3.74 763 654 A 9 ALA H A 8 TYR HB2 1.0 . 3.74 764 655 A 10 ALA HA A 13 ASP HBx 1.0 . 3.60 765 655 A 10 ALA HA A 13 ASP HBy 1.0 . 3.60 766 656 A 10 ALA HB% A 13 ASP HBx 1.0 . 5.21 767 656 A 10 ALA HB% A 13 ASP HBy 1.0 . 5.21 768 657 A 13 ASP H A 13 ASP HBx 1.0 . 3.02 769 657 A 13 ASP H A 13 ASP HBy 1.0 . 3.02 770 658 A 14 ALA H A 13 ASP HBx 1.0 . 3.27 771 658 A 14 ALA H A 13 ASP HBy 1.0 . 3.27 772 659 A 14 ALA HB% A 13 ASP HBx 1.0 . 5.13 773 659 A 14 ALA HB% A 13 ASP HBy 1.0 . 5.13 774 660 A 14 ALA HA A 17 SER HB3 1.0 . 3.33 775 660 A 14 ALA HA A 17 SER HB2 1.0 . 3.33 776 661 A 14 ALA HB% A 17 SER HB3 1.0 . 4.42 777 661 A 14 ALA HB% A 17 SER HB2 1.0 . 4.42 778 662 A 15 ILE H A 15 ILE HG13 1.0 . 3.26 779 662 A 15 ILE H A 15 ILE HG12 1.0 . 3.26 780 663 A 15 ILE HA A 15 ILE HG13 1.0 . 3.09 781 663 A 15 ILE HA A 15 ILE HG12 1.0 . 3.09 782 664 A 15 ILE HG2% A 15 ILE HG13 1.0 . 3.32 783 664 A 15 ILE HG2% A 15 ILE HG12 1.0 . 3.32 784 665 A 16 VAL HG1% A 17 SER HB3 1.0 . 4.51 785 665 A 16 VAL HG1% A 17 SER HB2 1.0 . 4.51 786 666 A 16 VAL HG1% A 20 GLU HG3 1.0 . 3.63 787 666 A 16 VAL HG1% A 20 GLU HG2 1.0 . 3.63 788 667 A 17 SER HA A 17 SER HB3 1.0 . 2.64 789 667 A 17 SER HA A 17 SER HB2 1.0 . 2.64 790 668 A 17 SER HA A 20 GLU HB3 1.0 . 3.51 791 668 A 17 SER HA A 20 GLU HB2 1.0 . 3.51 792 669 A 18 PHE HD% A 22 PHE HB3 1.0 . 5.32 793 669 A 18 PHE HD% A 22 PHE HB2 1.0 . 5.32 794 670 A 20 GLU H A 20 GLU HB3 1.0 . 3.08 795 670 A 20 GLU H A 20 GLU HB2 1.0 . 3.08 796 671 A 20 GLU H A 20 GLU HG3 1.0 . 3.37 797 671 A 20 GLU H A 20 GLU HG2 1.0 . 3.37 798 672 A 20 GLU HA A 20 GLU HG3 1.0 . 3.27 799 672 A 20 GLU HA A 20 GLU HG2 1.0 . 3.27 800 673 A 23 LEU H A 23 LEU HB2 1.0 . 3.22 801 673 A 23 LEU H A 23 LEU HB3 1.0 . 3.22 802 674 A 23 LEU HDx% A 23 LEU HB2 1.0 . 3.15 803 674 A 23 LEU HDx% A 23 LEU HB3 1.0 . 3.15 804 675 A 23 LEU HDy% A 23 LEU HB2 1.0 . 3.27 805 675 A 23 LEU HDy% A 23 LEU HB3 1.0 . 3.27 806 676 A 26 TRP H A 26 TRP HB2 1.0 . 3.22 807 676 A 26 TRP H A 26 TRP HB3 1.0 . 3.22 stop_ save_