data_nef_c19750_2mk3 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 2MK3 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 -3 GLY start . false 2 A -2 SER middle . . 3 A -1 HIS middle . . 4 A 0 MET middle . . 5 A 1 SER middle . . 6 A 2 GLY middle . false 7 A 3 ILE middle . . 8 A 4 VAL middle . . 9 A 5 GLN middle . . 10 A 6 GLN middle . . 11 A 7 GLN middle . . 12 A 8 ASN middle . . 13 A 9 ASN middle . . 14 A 10 LEU middle . . 15 A 11 LEU middle . . 16 A 12 ARG middle . . 17 A 13 ALA middle . . 18 A 14 ILE middle . . 19 A 15 GLU middle . . 20 A 16 ALA middle . . 21 A 17 GLN middle . . 22 A 18 GLN middle . . 23 A 19 HIS middle . . 24 A 20 LEU middle . . 25 A 21 LEU middle . . 26 A 22 GLN middle . . 27 A 23 LEU middle . . 28 A 24 THR middle . . 29 A 25 VAL middle . . 30 A 26 TRP middle . . 31 A 27 GLY middle . false 32 A 28 ILE middle . . 33 A 29 LYS middle . . 34 A 30 GLN middle . . 35 A 31 LEU middle . . 36 A 32 GLN middle . . 37 A 33 ALA middle . . 38 A 34 ARG middle . . 39 A 35 SER middle . . 40 A 36 GLY middle . false 41 A 37 GLY middle . false 42 A 38 ARG middle . . 43 A 39 GLY middle . false 44 A 40 GLY middle . false 45 A 41 TRP middle . . 46 A 42 MET middle . . 47 A 43 GLU middle . . 48 A 44 TRP middle . . 49 A 45 ASP middle . . 50 A 46 ARG middle . . 51 A 47 GLU middle . . 52 A 48 ILE middle . . 53 A 49 ASN middle . . 54 A 50 ASN middle . . 55 A 51 TYR middle . . 56 A 52 THR middle . . 57 A 53 SER middle . . 58 A 54 LEU middle . . 59 A 55 ILE middle . . 60 A 56 HIS middle . . 61 A 57 SER middle . . 62 A 58 LEU middle . . 63 A 59 ILE middle . . 64 A 60 GLU middle . . 65 A 61 GLU middle . . 66 A 62 SER middle . . 67 A 63 GLN middle . . 68 A 64 ASN middle . . 69 A 65 GLN middle . . 70 A 66 GLN middle . . 71 A 67 GLU middle . . 72 A 68 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 SER H H 1 8.171 . A 1 SER HA H 1 4.321 . A 1 SER C C 13 175.43 . A 1 SER CA C 13 59.11 . A 1 SER CB C 13 62.91 . A 1 SER N N 15 116.54 . A 2 GLY H H 1 8.294 . A 2 GLY C C 13 174.89 . A 2 GLY CA C 13 45.55 . A 2 GLY N N 15 110.89 . A 3 ILE H H 1 7.861 . A 3 ILE HA H 1 4.032 . A 3 ILE C C 13 176.74 . A 3 ILE CA C 13 62.24 . A 3 ILE CB C 13 37.46 . A 3 ILE N N 15 120.80 . A 4 VAL H H 1 7.857 . A 4 VAL HA H 1 3.883 . A 4 VAL C C 13 176.99 . A 4 VAL CA C 13 63.62 . A 4 VAL CB C 13 31.17 . A 4 VAL N N 15 121.09 . A 5 GLN H H 1 8.051 . A 5 GLN HA H 1 4.235 . A 5 GLN C C 13 176.96 . A 5 GLN CA C 13 56.75 . A 5 GLN CB C 13 28.25 . A 5 GLN N N 15 121.38 . A 6 GLN H H 1 8.018 . A 6 GLN HA H 1 4.368 . A 6 GLN C C 13 176.72 . A 6 GLN CA C 13 56.12 . A 6 GLN CB C 13 28.22 . A 6 GLN N N 15 119.48 . A 7 GLN H H 1 8.151 . A 7 GLN HA H 1 4.189 . A 7 GLN C C 13 176.18 . A 7 GLN CA C 13 56.85 . A 7 GLN CB C 13 28.08 . A 7 GLN N N 15 120.36 . A 8 ASN H H 1 8.256 . A 8 ASN HA H 1 4.452 . A 8 ASN C C 13 176.30 . A 8 ASN CA C 13 54.80 . A 8 ASN CB C 13 38.20 . A 8 ASN N N 15 119.23 . A 9 ASN H H 1 8.319 . A 9 ASN C C 13 177.15 . A 9 ASN CA C 13 54.94 . A 9 ASN CB C 13 37.68 . A 9 ASN N N 15 119.84 . A 10 LEU H H 1 8.194 . A 10 LEU HA H 1 4.134 . A 10 LEU C C 13 178.05 . A 10 LEU CA C 13 57.69 . A 10 LEU CB C 13 40.76 . A 10 LEU N N 15 122.90 . A 11 LEU H H 1 8.030 . A 11 LEU HA H 1 4.008 . A 11 LEU C C 13 178.83 . A 11 LEU CA C 13 57.67 . A 11 LEU CB C 13 40.23 . A 11 LEU N N 15 118.80 . A 12 ARG H H 1 7.845 . A 12 ARG HA H 1 4.013 . A 12 ARG C C 13 178.84 . A 12 ARG CA C 13 58.62 . A 12 ARG CB C 13 29.05 . A 12 ARG N N 15 117.71 . A 13 ALA H H 1 7.681 . A 13 ALA HA H 1 4.194 . A 13 ALA C C 13 180.04 . A 13 ALA CA C 13 54.48 . A 13 ALA CB C 13 17.50 . A 13 ALA N N 15 121.87 . A 14 ILE H H 1 7.975 . A 14 ILE HA H 1 3.733 . A 14 ILE C C 13 177.76 . A 14 ILE CA C 13 64.34 . A 14 ILE CB C 13 37.20 . A 14 ILE N N 15 118.01 . A 15 GLU H H 1 8.110 . A 15 GLU HA H 1 3.952 . A 15 GLU C C 13 177.03 . A 15 GLU CA C 13 57.92 . A 15 GLU CB C 13 27.42 . A 15 GLU N N 15 117.43 . A 16 ALA H H 1 7.457 . A 16 ALA HA H 1 4.343 . A 16 ALA C C 13 178.57 . A 16 ALA CA C 13 52.65 . A 16 ALA CB C 13 18.08 . A 16 ALA N N 15 119.58 . A 17 GLN H H 1 7.642 . A 17 GLN HA H 1 4.431 . A 17 GLN C C 13 176.16 . A 17 GLN CA C 13 54.63 . A 17 GLN CB C 13 26.38 . A 17 GLN N N 15 118.84 . A 18 GLN H H 1 7.975 . A 18 GLN HA H 1 4.017 . A 18 GLN C C 13 177.48 . A 18 GLN CA C 13 58.29 . A 18 GLN CB C 13 28.12 . A 18 GLN N N 15 120.73 . A 19 HIS H H 1 8.697 . A 19 HIS HA H 1 4.674 . A 19 HIS C C 13 176.33 . A 19 HIS CA C 13 56.96 . A 19 HIS CB C 13 27.42 . A 19 HIS N N 15 117.47 . A 20 LEU H H 1 8.026 . A 20 LEU HA H 1 4.050 . A 20 LEU C C 13 179.68 . A 20 LEU CA C 13 57.74 . A 20 LEU CB C 13 40.83 . A 20 LEU N N 15 120.41 . A 21 LEU H H 1 8.433 . A 21 LEU HA H 1 4.059 . A 21 LEU C C 13 178.54 . A 21 LEU CA C 13 58.13 . A 21 LEU CB C 13 40.13 . A 21 LEU N N 15 121.93 . A 22 GLN H H 1 8.087 . A 22 GLN HA H 1 4.013 . A 22 GLN C C 13 179.43 . A 22 GLN CA C 13 58.90 . A 22 GLN CB C 13 27.47 . A 22 GLN N N 15 118.54 . A 23 LEU H H 1 8.013 . A 23 LEU HA H 1 4.231 . A 23 LEU C C 13 178.42 . A 23 LEU CA C 13 57.63 . A 23 LEU CB C 13 41.29 . A 23 LEU N N 15 120.75 . A 24 THR H H 1 8.024 . A 24 THR C C 13 176.18 . A 24 THR N N 15 116.79 . A 25 VAL H H 1 8.068 . A 25 VAL HA H 1 3.575 . A 25 VAL C C 13 177.60 . A 25 VAL CA C 13 66.82 . A 25 VAL CB C 13 30.83 . A 25 VAL N N 15 121.13 . A 26 TRP H H 1 7.983 . A 26 TRP HA H 1 4.180 . A 26 TRP C C 13 178.70 . A 26 TRP CA C 13 61.43 . A 26 TRP CB C 13 27.74 . A 26 TRP N N 15 120.52 . A 27 GLY H H 1 8.846 . A 27 GLY C C 13 174.99 . A 27 GLY CA C 13 47.24 . A 27 GLY N N 15 107.88 . A 28 ILE H H 1 8.427 . A 28 ILE HA H 1 3.612 . A 28 ILE C C 13 178.03 . A 28 ILE CA C 13 64.86 . A 28 ILE CB C 13 36.51 . A 28 ILE N N 15 122.33 . A 29 LYS H H 1 7.993 . A 29 LYS HA H 1 4.022 . A 29 LYS C C 13 180.05 . A 29 LYS CA C 13 59.27 . A 29 LYS CB C 13 30.68 . A 29 LYS N N 15 119.85 . A 30 GLN H H 1 7.800 . A 30 GLN HA H 1 3.840 . A 30 GLN C C 13 178.75 . A 30 GLN CA C 13 57.16 . A 30 GLN CB C 13 26.86 . A 30 GLN N N 15 118.87 . A 31 LEU H H 1 7.873 . A 31 LEU HA H 1 3.966 . A 31 LEU C C 13 179.30 . A 31 LEU CA C 13 57.21 . A 31 LEU CB C 13 40.66 . A 31 LEU N N 15 120.22 . A 32 GLN H H 1 8.216 . A 32 GLN HA H 1 3.943 . A 32 GLN C C 13 177.91 . A 32 GLN CA C 13 58.22 . A 32 GLN CB C 13 28.02 . A 32 GLN N N 15 118.83 . A 33 ALA H H 1 7.647 . A 33 ALA HA H 1 4.185 . A 33 ALA C C 13 179.05 . A 33 ALA CA C 13 53.46 . A 33 ALA CB C 13 17.72 . A 33 ALA N N 15 121.34 . A 34 ARG H H 1 7.612 . A 34 ARG HA H 1 4.306 . A 34 ARG C C 13 176.80 . A 34 ARG CA C 13 56.23 . A 34 ARG CB C 13 29.65 . A 34 ARG N N 15 117.58 . A 35 SER H H 1 7.827 . A 35 SER HA H 1 4.343 . A 35 SER C C 13 175.29 . A 35 SER CA C 13 58.93 . A 35 SER CB C 13 63.37 . A 35 SER N N 15 114.96 . A 36 GLY H H 1 8.132 . A 36 GLY C C 13 174.84 . A 36 GLY CA C 13 45.34 . A 36 GLY N N 15 110.34 . A 37 GLY H H 1 8.190 . A 37 GLY C C 13 174.40 . A 37 GLY CA C 13 44.97 . A 37 GLY N N 15 108.88 . A 38 ARG H H 1 8.118 . A 38 ARG HA H 1 4.315 . A 38 ARG C C 13 176.90 . A 38 ARG CA C 13 56.05 . A 38 ARG CB C 13 29.75 . A 38 ARG N N 15 120.63 . A 39 GLY H H 1 8.374 . A 39 GLY C C 13 174.69 . A 39 GLY CA C 13 45.12 . A 39 GLY N N 15 109.36 . A 40 GLY H H 1 7.995 . A 40 GLY C C 13 174.68 . A 40 GLY CA C 13 45.08 . A 40 GLY N N 15 109.06 . A 41 TRP H H 1 8.176 . A 41 TRP HA H 1 4.399 . A 41 TRP C C 13 177.30 . A 41 TRP CA C 13 58.58 . A 41 TRP CB C 13 28.69 . A 41 TRP N N 15 121.26 . A 42 MET H H 1 8.120 . A 42 MET HA H 1 4.185 . A 42 MET C C 13 177.93 . A 42 MET CA C 13 57.46 . A 42 MET CB C 13 30.92 . A 42 MET N N 15 118.57 . A 43 GLU H H 1 7.834 . A 43 GLU HA H 1 4.199 . A 43 GLU C C 13 177.98 . A 43 GLU CA C 13 57.52 . A 43 GLU CB C 13 27.56 . A 43 GLU N N 15 119.60 . A 44 TRP H H 1 7.824 . A 44 TRP HA H 1 4.492 . A 44 TRP C C 13 177.48 . A 44 TRP CA C 13 58.96 . A 44 TRP CB C 13 28.42 . A 44 TRP N N 15 120.89 . A 45 ASP H H 1 8.325 . A 45 ASP HA H 1 4.352 . A 45 ASP C C 13 177.07 . A 45 ASP CA C 13 55.95 . A 45 ASP CB C 13 38.26 . A 45 ASP N N 15 118.21 . A 46 ARG H H 1 7.860 . A 46 ARG HA H 1 4.101 . A 46 ARG C C 13 178.41 . A 46 ARG CA C 13 58.44 . A 46 ARG CB C 13 29.19 . A 46 ARG N N 15 119.51 . A 47 GLU H H 1 7.874 . A 47 GLU HA H 1 4.287 . A 47 GLU C C 13 178.17 . A 47 GLU CA C 13 57.81 . A 47 GLU CB C 13 27.72 . A 47 GLU N N 15 118.47 . A 48 ILE H H 1 8.199 . A 48 ILE HA H 1 3.929 . A 48 ILE C C 13 178.06 . A 48 ILE CA C 13 64.03 . A 48 ILE CB C 13 36.99 . A 48 ILE N N 15 118.80 . A 49 ASN H H 1 8.085 . A 49 ASN HA H 1 4.599 . A 49 ASN C C 13 177.11 . A 49 ASN CA C 13 55.70 . A 49 ASN CB C 13 38.08 . A 49 ASN N N 15 119.58 . A 50 ASN H H 1 8.020 . A 50 ASN HA H 1 4.534 . A 50 ASN C C 13 177.12 . A 50 ASN CA C 13 55.06 . A 50 ASN CB C 13 37.68 . A 50 ASN N N 15 118.69 . A 51 TYR H H 1 8.106 . A 51 TYR HA H 1 4.534 . A 51 TYR C C 13 177.48 . A 51 TYR CA C 13 60.43 . A 51 TYR CB C 13 37.71 . A 51 TYR N N 15 118.43 . A 52 THR H H 1 8.247 . A 52 THR HA H 1 3.943 . A 52 THR C C 13 176.97 . A 52 THR CA C 13 66.22 . A 52 THR CB C 13 67.58 . A 52 THR N N 15 114.47 . A 53 SER H H 1 8.064 . A 53 SER HA H 1 4.338 . A 53 SER C C 13 176.99 . A 53 SER CA C 13 61.30 . A 53 SER CB C 13 62.02 . A 53 SER N N 15 118.26 . A 54 LEU H H 1 7.631 . A 54 LEU HA H 1 4.250 . A 54 LEU C C 13 179.06 . A 54 LEU CA C 13 57.69 . A 54 LEU CB C 13 40.99 . A 54 LEU N N 15 123.95 . A 55 ILE H H 1 8.051 . A 55 ILE HA H 1 3.719 . A 55 ILE C C 13 177.57 . A 55 ILE CA C 13 64.52 . A 55 ILE CB C 13 36.46 . A 55 ILE N N 15 118.77 . A 56 HIS H H 1 8.339 . A 56 HIS HA H 1 4.255 . A 56 HIS C C 13 176.79 . A 56 HIS CA C 13 59.09 . A 56 HIS CB C 13 27.60 . A 56 HIS N N 15 117.77 . A 57 SER H H 1 8.137 . A 57 SER HA H 1 4.245 . A 57 SER C C 13 175.99 . A 57 SER CA C 13 61.58 . A 57 SER CB C 13 62.28 . A 57 SER N N 15 115.35 . A 58 LEU H H 1 7.914 . A 58 LEU HA H 1 4.162 . A 58 LEU C C 13 178.93 . A 58 LEU CA C 13 57.29 . A 58 LEU CB C 13 41.19 . A 58 LEU N N 15 122.54 . A 59 ILE H H 1 7.921 . A 59 ILE HA H 1 3.789 . A 59 ILE C C 13 178.12 . A 59 ILE CA C 13 63.83 . A 59 ILE CB C 13 37.15 . A 59 ILE N N 15 118.01 . A 60 GLU H H 1 7.925 . A 60 GLU HA H 1 4.134 . A 60 GLU C C 13 177.95 . A 60 GLU CA C 13 57.56 . A 60 GLU CB C 13 27.71 . A 60 GLU N N 15 119.64 . A 61 GLU H H 1 8.048 . A 61 GLU HA H 1 4.245 . A 61 GLU C C 13 177.45 . A 61 GLU CA C 13 57.10 . A 61 GLU CB C 13 27.62 . A 61 GLU N N 15 118.99 . A 62 SER H H 1 7.893 . A 62 SER HA H 1 4.324 . A 62 SER C C 13 174.94 . A 62 SER CA C 13 59.62 . A 62 SER CB C 13 63.13 . A 62 SER N N 15 115.26 . A 63 GLN H H 1 7.824 . A 63 GLN C C 13 176.07 . A 63 GLN CA C 13 55.79 . A 63 GLN CB C 13 28.70 . A 63 GLN N N 15 120.40 . A 64 ASN H H 1 8.059 . A 64 ASN HA H 1 4.695 . A 64 ASN C C 13 175.30 . A 64 ASN CA C 13 53.28 . A 64 ASN CB C 13 38.34 . A 64 ASN N N 15 119.18 . A 65 GLN H H 1 8.144 . A 65 GLN HA H 1 4.320 . A 65 GLN C C 13 175.89 . A 65 GLN CA C 13 55.70 . A 65 GLN CB C 13 28.53 . A 65 GLN N N 15 120.74 . A 66 GLN H H 1 8.199 . A 66 GLN HA H 1 4.320 . A 66 GLN C C 13 175.84 . A 66 GLN CA C 13 55.61 . A 66 GLN CB C 13 28.67 . A 66 GLN N N 15 121.07 . A 67 GLU H H 1 8.194 . A 67 GLU C C 13 175.20 . A 67 GLU CA C 13 55.65 . A 67 GLU CB C 13 28.41 . A 67 GLU N N 15 122.32 . A 68 LYS H H 1 8.194 . A 68 LYS CA C 13 56.76 . A 68 LYS CB C 13 32.56 . A 68 LYS N N 15 127.05 . stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 GLY H A 1 SER HA 1.0 2.9 3.7 2 2 A 2 GLY H A 1 SER HBx 1.0 3.1 4.1 3 2 A 2 GLY H A 1 SER HBy 1.0 3.1 4.1 4 3 A 1 SER HA A 3 ILE H 1.0 3.9 4.9 5 4 A 2 GLY H A 3 ILE H 1.0 2.5 3.1 6 5 A 3 ILE H A 2 GLY HAx 1.0 2.4 3.0 7 5 A 3 ILE H A 2 GLY HAy 1.0 2.4 3.0 8 6 A 3 ILE H A 3 ILE HD11 1.0 3.4 4.2 9 7 A 3 ILE H A 3 ILE HG1x 1.0 2.5 3.1 10 7 A 3 ILE H A 3 ILE HG1y 1.0 2.5 3.1 11 8 A 3 ILE H A 3 ILE HG21 1.0 3.0 3.6 12 9 A 2 GLY H A 4 VAL H 1.0 3.7 4.7 13 10 A 4 VAL H A 2 GLY HAx 1.0 3.3 3.9 14 10 A 2 GLY HAy A 4 VAL H 1.0 3.3 3.9 15 11 A 4 VAL H A 3 ILE HA 1.0 2.5 3.1 16 12 A 4 VAL H A 3 ILE HB 1.0 2.5 3.1 17 13 A 3 ILE HD11 A 4 VAL H 1.0 3.7 4.5 18 14 A 4 VAL H A 3 ILE HG1x 1.0 3.5 4.3 19 14 A 3 ILE HG1y A 4 VAL H 1.0 3.5 4.3 20 15 A 3 ILE HG21 A 4 VAL H 1.0 2.8 3.4 21 16 A 3 ILE H A 5 GLN H 1.0 3.7 4.7 22 17 A 5 GLN H A 4 VAL HA 1.0 3.3 4.1 23 18 A 5 GLN H A 4 VAL HG11 1.0 2.5 3.1 24 19 A 5 GLN H A 4 VAL HG21 1.0 3.0 4.0 25 20 A 4 VAL H A 5 GLN H 1.0 2.3 2.9 26 21 A 5 GLN HE2x A 5 GLN HGx 1.0 2.4 3.2 27 21 A 5 GLN HE2y A 5 GLN HGx 1.0 2.4 3.2 28 21 A 5 GLN HGy A 5 GLN HE2y 1.0 2.4 3.2 29 21 A 5 GLN HE2x A 5 GLN HGy 1.0 2.4 3.2 30 22 A 2 GLY H A 6 GLN H 1.0 4.2 5.2 31 23 A 3 ILE HA A 6 GLN H 1.0 3.3 4.1 32 24 A 4 VAL HA A 6 GLN H 1.0 3.7 4.5 33 25 A 4 VAL H A 6 GLN H 1.0 3.4 4.2 34 26 A 5 GLN H A 6 GLN H 1.0 2.2 2.8 35 27 A 6 GLN H A 5 GLN HA 1.0 3.2 4.0 36 28 A 6 GLN H A 5 GLN HBx 1.0 2.2 3.0 37 28 A 6 GLN H A 5 GLN HBy 1.0 2.2 3.0 38 29 A 6 GLN HE2x A 6 GLN HGx 1.0 2.4 3.2 39 29 A 6 GLN HGy A 6 GLN HE2y 1.0 2.4 3.2 40 29 A 6 GLN HE2x A 6 GLN HGy 1.0 2.4 3.2 41 29 A 6 GLN HE2y A 6 GLN HGx 1.0 2.4 3.2 42 30 A 4 VAL HA A 7 GLN H 1.0 3.5 4.5 43 31 A 4 VAL H A 7 GLN H 1.0 4.3 5.3 44 32 A 5 GLN HA A 7 GLN H 1.0 3.5 4.3 45 33 A 7 GLN H A 5 GLN HBx 1.0 3.7 4.7 46 33 A 5 GLN HBy A 7 GLN H 1.0 3.7 4.7 47 34 A 5 GLN H A 7 GLN H 1.0 3.2 4.0 48 35 A 7 GLN H A 6 GLN HA 1.0 3.2 4.0 49 36 A 7 GLN H A 6 GLN HBx 1.0 2.5 3.1 50 36 A 7 GLN H A 6 GLN HBy 1.0 2.5 3.1 51 37 A 6 GLN H A 7 GLN H 1.0 2.3 2.9 52 38 A 7 GLN HE2x A 7 GLN HGx 1.0 2.4 3.2 53 38 A 7 GLN HGy A 7 GLN HE2y 1.0 2.4 3.2 54 38 A 7 GLN HE2x A 7 GLN HGy 1.0 2.4 3.2 55 38 A 7 GLN HE2y A 7 GLN HGx 1.0 2.4 3.2 56 39 A 4 VAL HA A 8 ASN H 1.0 4.1 5.1 57 40 A 5 GLN HA A 8 ASN H 1.0 3.4 4.2 58 41 A 5 GLN H A 8 ASN H 1.0 4.1 5.1 59 42 A 6 GLN H A 8 ASN H 1.0 3.8 4.8 60 43 A 6 GLN HA A 8 ASN H 1.0 3.5 4.5 61 44 A 7 GLN H A 8 ASN H 1.0 2.3 2.9 62 45 A 8 ASN H A 7 GLN HA 1.0 3.1 3.9 63 46 A 8 ASN H A 7 GLN HBx 1.0 2.2 2.8 64 46 A 8 ASN H A 7 GLN HBy 1.0 2.2 2.8 65 47 A 8 ASN H A 7 GLN HGx 1.0 3.0 3.8 66 47 A 7 GLN HGy A 8 ASN H 1.0 3.0 3.8 67 48 A 8 ASN HBy A 8 ASN HD2y 1.0 2.7 3.5 68 48 A 8 ASN HD2x A 8 ASN HBx 1.0 2.7 3.5 69 48 A 8 ASN HD2x A 8 ASN HBy 1.0 2.7 3.5 70 48 A 8 ASN HBx A 8 ASN HD2y 1.0 2.7 3.5 71 49 A 8 ASN H A 8 ASN HD2y 1.0 3.1 3.9 72 49 A 8 ASN H A 8 ASN HD2x 1.0 3.1 3.9 73 50 A 6 GLN HA A 9 ASN H 1.0 3.5 4.5 74 51 A 7 GLN HA A 9 ASN H 1.0 4.2 5.2 75 52 A 8 ASN H A 9 ASN H 1.0 2.5 3.1 76 53 A 9 ASN H A 8 ASN HBx 1.0 2.6 3.2 77 53 A 8 ASN HBy A 9 ASN H 1.0 2.6 3.2 78 54 A 9 ASN HBy A 9 ASN HD2y 1.0 2.4 3.2 79 54 A 9 ASN HBx A 9 ASN HD2y 1.0 2.4 3.2 80 54 A 9 ASN HD2x A 9 ASN HBx 1.0 2.4 3.2 81 54 A 9 ASN HD2x A 9 ASN HBy 1.0 2.4 3.2 82 55 A 9 ASN H A 9 ASN HD2y 1.0 3.6 4.4 83 55 A 9 ASN H A 9 ASN HD2x 1.0 3.6 4.4 84 56 A 7 GLN HA A 10 LEU H 1.0 3.3 4.1 85 57 A 8 ASN H A 10 LEU H 1.0 3.2 4.0 86 58 A 9 ASN H A 10 LEU H 1.0 2.2 2.8 87 59 A 10 LEU H A 9 ASN HA 1.0 2.6 3.4 88 60 A 10 LEU H A 9 ASN HBx 1.0 2.5 3.1 89 60 A 9 ASN HBy A 10 LEU H 1.0 2.5 3.1 90 61 A 8 ASN H A 11 LEU H 1.0 4.5 5.3 91 62 A 11 LEU H A 8 ASN HA 1.0 3.0 3.8 92 63 A 9 ASN H A 11 LEU H 1.0 3.3 4.1 93 64 A 10 LEU H A 11 LEU H 1.0 2.2 2.8 94 65 A 11 LEU H A 10 LEU HA 1.0 3.1 3.9 95 66 A 11 LEU H A 10 LEU HBx 1.0 2.5 3.1 96 66 A 11 LEU H A 10 LEU HBy 1.0 2.5 3.1 97 67 A 9 ASN HA A 12 ARG H 1.0 3.3 4.1 98 68 A 10 LEU H A 12 ARG H 1.0 3.9 4.9 99 69 A 10 LEU HA A 12 ARG H 1.0 4.1 5.1 100 70 A 11 LEU H A 12 ARG H 1.0 2.4 3.0 101 71 A 12 ARG H A 11 LEU HBx 1.0 2.3 2.9 102 71 A 12 ARG H A 11 LEU HBy 1.0 2.3 2.9 103 72 A 12 ARG H A 11 LEU HD11 1.0 3.4 4.2 104 72 A 12 ARG H A 11 LEU HD21 1.0 3.4 4.2 105 73 A 12 ARG HE A 12 ARG HBx 1.0 4.4 5.4 106 73 A 12 ARG HE A 12 ARG HBy 1.0 4.4 5.4 107 74 A 12 ARG HE A 12 ARG HGx 1.0 2.9 3.7 108 74 A 12 ARG HE A 12 ARG HGy 1.0 2.9 3.7 109 75 A 9 ASN HA A 13 ALA H 1.0 3.5 4.5 110 76 A 10 LEU H A 13 ALA H 1.0 4.1 5.1 111 77 A 10 LEU HA A 13 ALA H 1.0 3.0 3.8 112 78 A 11 LEU H A 13 ALA H 1.0 3.5 4.5 113 79 A 13 ALA H A 11 LEU HBx 1.0 3.6 4.6 114 79 A 11 LEU HBy A 13 ALA H 1.0 3.6 4.6 115 80 A 13 ALA H A 11 LEU HD11 1.0 3.7 4.7 116 80 A 11 LEU HD21 A 13 ALA H 1.0 3.7 4.7 117 81 A 12 ARG H A 13 ALA H 1.0 2.3 2.9 118 82 A 13 ALA H A 12 ARG HA 1.0 3.1 3.7 119 83 A 13 ALA H A 12 ARG HBx 1.0 2.5 3.1 120 83 A 12 ARG HBy A 13 ALA H 1.0 2.5 3.1 121 84 A 13 ALA H A 12 ARG HGx 1.0 4.1 5.1 122 84 A 12 ARG HGy A 13 ALA H 1.0 4.1 5.1 123 85 A 10 LEU HA A 14 ILE H 1.0 3.7 4.7 124 86 A 14 ILE H A 11 LEU HA 1.0 2.8 3.6 125 87 A 14 ILE H A 11 LEU HBx 1.0 4.4 5.4 126 87 A 11 LEU HBy A 14 ILE H 1.0 4.4 5.4 127 88 A 11 LEU H A 14 ILE H 1.0 4.2 5.0 128 89 A 12 ARG H A 14 ILE H 1.0 3.6 4.4 129 90 A 13 ALA H A 14 ILE H 1.0 2.2 2.8 130 91 A 14 ILE H A 13 ALA HA 1.0 3.0 3.6 131 92 A 14 ILE H A 13 ALA HB1 1.0 2.3 2.9 132 93 A 14 ILE H A 14 ILE HD11 1.0 2.9 3.5 133 94 A 14 ILE H A 14 ILE HD11 1.0 2.9 3.5 134 95 A 14 ILE H A 14 ILE HG1x 1.0 2.5 3.1 135 95 A 14 ILE H A 14 ILE HG1y 1.0 2.5 3.1 136 96 A 14 ILE H A 14 ILE HG21 1.0 2.7 3.3 137 97 A 13 ALA H A 15 GLU H 1.0 4.5 5.3 138 98 A 13 ALA HA A 15 GLU H 1.0 4.2 5.2 139 99 A 15 GLU H A 14 ILE HA 1.0 3.1 3.9 140 100 A 15 GLU H A 14 ILE HB 1.0 2.5 3.1 141 101 A 14 ILE HD11 A 15 GLU H 1.0 3.8 4.6 142 102 A 15 GLU H A 14 ILE HG1x 1.0 3.6 4.4 143 102 A 14 ILE HG1y A 15 GLU H 1.0 3.6 4.4 144 103 A 14 ILE HG21 A 15 GLU H 1.0 2.9 3.5 145 104 A 14 ILE H A 15 GLU H 1.0 2.3 2.9 146 105 A 12 ARG HA A 16 ALA H 1.0 3.7 4.7 147 106 A 13 ALA H A 16 ALA H 1.0 3.6 4.6 148 107 A 13 ALA HA A 16 ALA H 1.0 3.2 4.0 149 108 A 14 ILE H A 16 ALA H 1.0 3.3 4.1 150 109 A 14 ILE HA A 16 ALA H 1.0 3.6 4.6 151 110 A 14 ILE HG21 A 16 ALA H 1.0 4.3 5.3 152 111 A 15 GLU H A 16 ALA H 1.0 2.3 2.9 153 112 A 16 ALA H A 15 GLU HA 1.0 2.9 3.7 154 113 A 16 ALA H A 15 GLU HBx 1.0 2.5 3.1 155 113 A 16 ALA H A 15 GLU HBy 1.0 2.5 3.1 156 114 A 16 ALA H A 15 GLU HGx 1.0 3.4 4.2 157 114 A 16 ALA H A 15 GLU HGy 1.0 3.4 4.2 158 115 A 14 ILE HA A 17 GLN H 1.0 4.2 5.2 159 116 A 14 ILE HG21 A 17 GLN H 1.0 3.6 4.6 160 117 A 15 GLU H A 17 GLN H 1.0 4.0 5.0 161 118 A 15 GLU HA A 17 GLN H 1.0 3.4 4.2 162 119 A 16 ALA H A 17 GLN H 1.0 2.2 2.8 163 120 A 17 GLN H A 16 ALA HA 1.0 2.7 3.5 164 121 A 17 GLN H A 16 ALA HB1 1.0 2.8 3.6 165 122 A 16 ALA HB1 A 17 GLN HE2y 1.0 3.1 3.9 166 122 A 16 ALA HB1 A 17 GLN HE2x 1.0 3.1 3.9 167 123 A 17 GLN HA A 17 GLN HE2y 1.0 4.1 5.1 168 123 A 17 GLN HE2x A 17 GLN HA 1.0 4.1 5.1 169 124 A 17 GLN HE2x A 17 GLN HGx 1.0 2.9 3.7 170 124 A 17 GLN HE2y A 17 GLN HGx 1.0 2.9 3.7 171 124 A 17 GLN HGy A 17 GLN HE2y 1.0 2.9 3.7 172 124 A 17 GLN HE2x A 17 GLN HGy 1.0 2.9 3.7 173 125 A 14 ILE HG21 A 18 GLN HE2y 1.0 4.3 5.3 174 125 A 14 ILE HG21 A 18 GLN HE2x 1.0 4.3 5.3 175 126 A 15 GLU HA A 18 GLN H 1.0 4.2 5.2 176 127 A 16 ALA H A 18 GLN H 1.0 4.4 5.4 177 128 A 16 ALA HA A 18 GLN H 1.0 3.4 4.4 178 129 A 17 GLN H A 18 GLN H 1.0 2.3 3.1 179 130 A 17 GLN HA A 18 GLN H 1.0 2.2 2.8 180 131 A 18 GLN H A 17 GLN HBx 1.0 3.3 4.1 181 131 A 18 GLN H A 17 GLN HBy 1.0 3.3 4.1 182 132 A 18 GLN HE2y A 18 GLN HGx 1.0 2.8 3.6 183 132 A 18 GLN HE2x A 18 GLN HGx 1.0 2.8 3.6 184 132 A 18 GLN HGy A 18 GLN HE2y 1.0 2.8 3.6 185 132 A 18 GLN HE2x A 18 GLN HGy 1.0 2.8 3.6 186 133 A 17 GLN HA A 19 HIS H 1.0 3.5 4.3 187 134 A 18 GLN H A 19 HIS H 1.0 2.4 3.0 188 135 A 19 HIS H A 18 GLN HA 1.0 2.5 3.1 189 136 A 19 HIS H A 18 GLN HBx 1.0 2.5 3.1 190 136 A 19 HIS H A 18 GLN HBy 1.0 2.5 3.1 191 137 A 19 HIS H A 18 GLN HGx 1.0 3.6 4.4 192 137 A 18 GLN HGy A 19 HIS H 1.0 3.6 4.4 193 138 A 17 GLN HA A 20 LEU H 1.0 3.3 4.3 194 139 A 18 GLN HA A 20 LEU H 1.0 3.2 4.0 195 140 A 20 LEU H A 18 GLN HBx 1.0 3.8 4.8 196 140 A 18 GLN HBy A 20 LEU H 1.0 3.8 4.8 197 141 A 19 HIS H A 20 LEU H 1.0 2.5 3.1 198 142 A 20 LEU H A 19 HIS HA 1.0 2.9 3.7 199 143 A 20 LEU H A 19 HIS HBx 1.0 2.6 3.4 200 143 A 20 LEU H A 19 HIS HBy 1.0 2.6 3.4 201 144 A 18 GLN HA A 21 LEU H 1.0 2.9 3.7 202 145 A 19 HIS H A 21 LEU H 1.0 4.0 5.0 203 146 A 21 LEU H A 20 LEU HA 1.0 3.2 4.0 204 147 A 21 LEU H A 20 LEU HBx 1.0 2.2 2.8 205 147 A 21 LEU H A 20 LEU HBy 1.0 2.2 2.8 206 148 A 19 HIS HA A 22 GLN H 1.0 3.6 4.6 207 149 A 21 LEU H A 22 GLN H 1.0 2.5 3.1 208 150 A 22 GLN H A 21 LEU HA 1.0 2.9 3.7 209 151 A 22 GLN H A 21 LEU HBx 1.0 2.3 2.9 210 151 A 22 GLN H A 21 LEU HBy 1.0 2.3 2.9 211 152 A 22 GLN H A 21 LEU HD11 1.0 3.2 4.0 212 152 A 22 GLN H A 21 LEU HD21 1.0 3.2 4.0 213 153 A 19 HIS HA A 23 LEU H 1.0 3.8 4.8 214 154 A 20 LEU HA A 23 LEU H 1.0 2.7 3.5 215 155 A 21 LEU H A 23 LEU H 1.0 3.7 4.7 216 156 A 22 GLN H A 23 LEU H 1.0 2.2 2.8 217 157 A 23 LEU H A 22 GLN HA 1.0 2.7 3.5 218 158 A 23 LEU H A 22 GLN HBx 1.0 2.3 2.9 219 158 A 23 LEU H A 22 GLN HBy 1.0 2.3 2.9 220 159 A 23 LEU H A 22 GLN HGx 1.0 3.5 4.3 221 159 A 23 LEU H A 22 GLN HGy 1.0 3.5 4.3 222 160 A 21 LEU H A 24 THR H 1.0 3.7 4.7 223 161 A 22 GLN H A 24 THR H 1.0 3.6 4.4 224 162 A 22 GLN HA A 24 THR H 1.0 3.5 4.3 225 163 A 24 THR H A 23 LEU HA 1.0 3.0 3.8 226 164 A 24 THR H A 23 LEU HBx 1.0 2.2 2.8 227 164 A 24 THR H A 23 LEU HBy 1.0 2.2 2.8 228 165 A 24 THR H A 23 LEU HD11 1.0 2.8 3.6 229 165 A 24 THR H A 23 LEU HD21 1.0 2.8 3.6 230 166 A 24 THR H A 23 LEU HG 1.0 4.0 5.0 231 167 A 21 LEU HA A 25 VAL H 1.0 3.2 4.0 232 168 A 22 GLN HA A 25 VAL H 1.0 2.9 3.7 233 169 A 23 LEU HA A 25 VAL H 1.0 3.8 4.8 234 170 A 25 VAL H A 24 THR HA 1.0 3.1 3.9 235 171 A 25 VAL H A 24 THR HB 1.0 2.4 3.0 236 172 A 25 VAL H A 24 THR HG21 1.0 2.7 3.5 237 172 A 25 VAL H A 24 THR HG1 1.0 2.7 3.5 238 173 A 24 THR H A 25 VAL H 1.0 2.2 2.8 239 174 A 22 GLN HA A 26 TRP H 1.0 3.2 4.0 240 175 A 23 LEU HA A 26 TRP H 1.0 2.8 3.6 241 176 A 26 TRP H A 23 LEU HD11 1.0 4.1 5.1 242 176 A 23 LEU HD21 A 26 TRP H 1.0 4.1 5.1 243 177 A 24 THR H A 26 TRP H 1.0 3.2 4.0 244 178 A 24 THR HB A 26 TRP H 1.0 4.2 5.2 245 179 A 26 TRP H A 25 VAL HA 1.0 3.2 4.0 246 180 A 26 TRP H A 25 VAL HB 1.0 2.5 3.1 247 181 A 26 TRP H A 25 VAL HA 1.0 3.2 4.0 248 182 A 26 TRP H A 25 VAL HG11 1.0 2.6 3.2 249 182 A 26 TRP H A 25 VAL HG21 1.0 2.6 3.2 250 183 A 25 VAL H A 26 TRP H 1.0 2.3 2.9 251 184 A 23 LEU HA A 27 GLY H 1.0 3.6 4.6 252 185 A 27 GLY H A 23 LEU HD11 1.0 3.2 4.2 253 185 A 23 LEU HD21 A 27 GLY H 1.0 3.2 4.2 254 186 A 24 THR HA A 27 GLY H 1.0 3.4 4.2 255 187 A 27 GLY H A 24 THR HG21 1.0 4.2 5.2 256 187 A 24 THR HG1 A 27 GLY H 1.0 4.2 5.2 257 188 A 25 VAL H A 27 GLY H 1.0 4.0 5.0 258 189 A 25 VAL HA A 27 GLY H 1.0 3.7 4.7 259 190 A 26 TRP H A 27 GLY H 1.0 2.5 3.1 260 191 A 27 GLY H A 26 TRP HA 1.0 3.5 4.3 261 192 A 27 GLY H A 26 TRP HBx 1.0 3.5 4.5 262 192 A 27 GLY H A 26 TRP HBy 1.0 3.5 4.5 263 193 A 24 THR HA A 28 ILE H 1.0 3.6 4.6 264 194 A 25 VAL H A 28 ILE H 1.0 3.7 4.7 265 195 A 25 VAL HA A 28 ILE H 1.0 2.7 3.5 266 196 A 26 TRP H A 28 ILE H 1.0 2.9 3.7 267 197 A 27 GLY H A 28 ILE H 1.0 2.5 3.1 268 198 A 28 ILE H A 27 GLY HAx 1.0 2.5 3.1 269 198 A 28 ILE H A 27 GLY HAy 1.0 2.5 3.1 270 199 A 28 ILE H A 28 ILE HG1x 1.0 2.2 2.8 271 199 A 28 ILE H A 28 ILE HG1y 1.0 2.2 2.8 272 200 A 28 ILE H A 28 ILE HG21 1.0 2.7 3.5 273 201 A 25 VAL HA A 29 LYS H 1.0 3.4 4.2 274 202 A 29 LYS H A 25 VAL HG11 1.0 3.8 4.8 275 202 A 25 VAL HG21 A 29 LYS H 1.0 3.8 4.8 276 203 A 26 TRP HA A 29 LYS H 1.0 3.2 4.0 277 204 A 27 GLY H A 29 LYS H 1.0 3.6 4.6 278 205 A 29 LYS H A 27 GLY HAx 1.0 3.8 4.8 279 205 A 27 GLY HAy A 29 LYS H 1.0 3.8 4.8 280 206 A 28 ILE H A 29 LYS H 1.0 2.3 2.9 281 207 A 29 LYS H A 28 ILE HA 1.0 3.0 3.8 282 208 A 29 LYS H A 28 ILE HB 1.0 3.3 4.1 283 209 A 29 LYS H A 28 ILE HD11 1.0 3.5 4.3 284 210 A 29 LYS H A 28 ILE HG1x 1.0 2.5 3.1 285 210 A 28 ILE HG1y A 29 LYS H 1.0 2.5 3.1 286 211 A 28 ILE HG21 A 29 LYS H 1.0 2.8 3.6 287 212 A 26 TRP HA A 30 GLN H 1.0 3.9 4.9 288 213 A 27 GLY H A 30 GLN H 1.0 4.0 5.0 289 214 A 30 GLN H A 27 GLY HAx 1.0 3.0 3.8 290 214 A 27 GLY HAy A 30 GLN H 1.0 3.0 3.8 291 215 A 28 ILE H A 30 GLN H 1.0 3.6 4.6 292 216 A 28 ILE HA A 30 GLN H 1.0 3.6 4.6 293 217 A 29 LYS H A 30 GLN H 1.0 2.3 2.9 294 218 A 30 GLN H A 29 LYS HA 1.0 3.2 4.0 295 219 A 30 GLN H A 29 LYS HBx 1.0 2.8 3.6 296 219 A 30 GLN H A 29 LYS HBy 1.0 2.8 3.6 297 220 A 30 GLN H A 29 LYS HDx 1.0 3.2 4.0 298 220 A 30 GLN H A 29 LYS HDy 1.0 3.2 4.0 299 221 A 30 GLN H A 30 GLN HE2y 1.0 3.4 4.2 300 221 A 30 GLN H A 30 GLN HE2x 1.0 3.4 4.2 301 222 A 30 GLN HBx A 30 GLN HE2y 1.0 3.5 4.5 302 222 A 30 GLN HBy A 30 GLN HE2y 1.0 3.5 4.5 303 222 A 30 GLN HE2x A 30 GLN HBx 1.0 3.5 4.5 304 222 A 30 GLN HE2x A 30 GLN HBy 1.0 3.5 4.5 305 223 A 30 GLN HE2x A 30 GLN HGx 1.0 2.4 3.2 306 223 A 30 GLN HGy A 30 GLN HE2y 1.0 2.4 3.2 307 223 A 30 GLN HE2x A 30 GLN HGy 1.0 2.4 3.2 308 223 A 30 GLN HE2y A 30 GLN HGx 1.0 2.4 3.2 309 224 A 31 LEU H A 27 GLY HAx 1.0 4.1 5.1 310 224 A 27 GLY HAy A 31 LEU H 1.0 4.1 5.1 311 225 A 28 ILE H A 31 LEU H 1.0 4.1 5.1 312 226 A 28 ILE HA A 31 LEU H 1.0 2.8 3.6 313 227 A 29 LYS H A 31 LEU H 1.0 3.5 4.3 314 228 A 29 LYS HA A 31 LEU H 1.0 3.6 4.6 315 229 A 30 GLN H A 31 LEU H 1.0 2.2 2.8 316 230 A 31 LEU H A 30 GLN HA 1.0 3.1 3.9 317 231 A 31 LEU H A 30 GLN HBx 1.0 2.6 3.4 318 231 A 30 GLN HBy A 31 LEU H 1.0 2.6 3.4 319 232 A 31 LEU H A 30 GLN HGx 1.0 4.0 5.0 320 232 A 30 GLN HGy A 31 LEU H 1.0 4.0 5.0 321 233 A 28 ILE HA A 32 GLN H 1.0 3.7 4.7 322 234 A 29 LYS H A 32 GLN H 1.0 3.9 4.9 323 235 A 29 LYS HA A 32 GLN H 1.0 3.0 3.8 324 236 A 30 GLN H A 32 GLN H 1.0 3.5 4.3 325 237 A 30 GLN HA A 32 GLN H 1.0 4.0 5.0 326 238 A 31 LEU H A 32 GLN H 1.0 2.3 2.9 327 239 A 32 GLN H A 31 LEU HA 1.0 2.6 3.4 328 240 A 32 GLN H A 31 LEU HBx 1.0 2.5 3.1 329 240 A 32 GLN H A 31 LEU HBy 1.0 2.5 3.1 330 241 A 32 GLN H A 31 LEU HD11 1.0 3.1 3.9 331 241 A 32 GLN H A 31 LEU HD21 1.0 3.1 3.9 332 242 A 32 GLN H A 31 LEU HG 1.0 2.9 3.7 333 243 A 32 GLN HBx A 32 GLN HE2y 1.0 2.7 3.5 334 243 A 32 GLN HBy A 32 GLN HE2y 1.0 2.7 3.5 335 243 A 32 GLN HE2x A 32 GLN HBx 1.0 2.7 3.5 336 243 A 32 GLN HE2x A 32 GLN HBy 1.0 2.7 3.5 337 244 A 32 GLN HE2y A 32 GLN HGx 1.0 2.4 3.2 338 244 A 32 GLN HE2x A 32 GLN HGx 1.0 2.4 3.2 339 244 A 32 GLN HGy A 32 GLN HE2y 1.0 2.4 3.2 340 244 A 32 GLN HE2x A 32 GLN HGy 1.0 2.4 3.2 341 245 A 29 LYS HA A 33 ALA H 1.0 3.9 4.9 342 246 A 30 GLN H A 33 ALA H 1.0 3.7 4.7 343 247 A 30 GLN HA A 33 ALA H 1.0 3.3 4.1 344 248 A 33 ALA H A 30 GLN HBx 1.0 4.4 5.4 345 248 A 30 GLN HBy A 33 ALA H 1.0 4.4 5.4 346 249 A 31 LEU H A 33 ALA H 1.0 3.8 4.8 347 250 A 31 LEU HA A 33 ALA H 1.0 3.5 4.3 348 251 A 31 LEU HG A 33 ALA H 1.0 4.3 5.3 349 252 A 32 GLN H A 33 ALA H 1.0 2.5 3.1 350 253 A 33 ALA H A 32 GLN HA 1.0 2.9 3.7 351 254 A 33 ALA H A 32 GLN HBx 1.0 2.6 3.2 352 254 A 32 GLN HBy A 33 ALA H 1.0 2.6 3.2 353 255 A 33 ALA H A 32 GLN HGx 1.0 3.5 4.3 354 255 A 32 GLN HGy A 33 ALA H 1.0 3.5 4.3 355 256 A 30 GLN HA A 34 ARG H 1.0 4.2 5.2 356 257 A 31 LEU HA A 34 ARG H 1.0 3.1 3.9 357 258 A 32 GLN H A 34 ARG H 1.0 3.9 4.9 358 259 A 32 GLN HA A 34 ARG H 1.0 3.6 4.6 359 260 A 34 ARG H A 32 GLN HBx 1.0 4.2 5.2 360 260 A 32 GLN HBy A 34 ARG H 1.0 4.2 5.2 361 261 A 33 ALA H A 34 ARG H 1.0 2.0 2.6 362 262 A 34 ARG H A 33 ALA HA 1.0 2.8 3.6 363 263 A 34 ARG H A 33 ALA HB1 1.0 2.6 3.2 364 264 A 34 ARG HE A 34 ARG HGx 1.0 3.0 3.8 365 264 A 34 ARG HE A 34 ARG HGy 1.0 3.0 3.8 366 265 A 34 ARG HE A 34 ARG HH1% 1.0 2.6 3.2 367 265 A 34 ARG HE A 34 ARG HH2% 1.0 2.6 3.2 368 266 A 32 GLN HA A 35 SER H 1.0 2.8 3.6 369 267 A 33 ALA H A 35 SER H 1.0 3.5 4.5 370 268 A 33 ALA HA A 35 SER H 1.0 4.0 5.0 371 269 A 33 ALA HB1 A 35 SER H 1.0 4.1 5.1 372 270 A 34 ARG H A 35 SER H 1.0 2.3 2.9 373 271 A 35 SER H A 34 ARG HA 1.0 2.5 3.1 374 272 A 35 SER H A 34 ARG HBx 1.0 3.2 4.0 375 272 A 35 SER H A 34 ARG HBy 1.0 3.2 4.0 376 273 A 35 SER H A 34 ARG HGx 1.0 2.8 3.6 377 273 A 34 ARG HGy A 35 SER H 1.0 2.8 3.6 378 274 A 36 GLY H A 35 SER HA 1.0 2.7 3.5 379 275 A 35 SER H A 36 GLY H 1.0 4.0 5.0 380 276 A 36 GLY H A 37 GLY H 1.0 2.8 3.6 381 277 A 37 GLY H A 38 ARG H 1.0 3.3 4.1 382 278 A 38 ARG H A 37 GLY HAx 1.0 2.3 2.9 383 278 A 38 ARG H A 37 GLY HAy 1.0 2.3 2.9 384 279 A 38 ARG HE A 38 ARG HH1% 1.0 2.4 3.2 385 279 A 38 ARG HE A 38 ARG HH2% 1.0 2.4 3.2 386 280 A 38 ARG HE A 38 ARG HGx 1.0 2.5 3.3 387 280 A 38 ARG HE A 38 ARG HGy 1.0 2.5 3.3 388 281 A 39 GLY H A 37 GLY HAx 1.0 3.8 4.8 389 281 A 37 GLY HAy A 39 GLY H 1.0 3.8 4.8 390 282 A 38 ARG H A 39 GLY H 1.0 2.6 3.2 391 283 A 39 GLY H A 38 ARG HA 1.0 2.3 2.9 392 284 A 39 GLY H A 38 ARG HBx 1.0 2.8 3.6 393 284 A 39 GLY H A 38 ARG HBy 1.0 2.8 3.6 394 285 A 39 GLY H A 38 ARG HGx 1.0 4.4 5.4 395 285 A 38 ARG HGy A 39 GLY H 1.0 4.4 5.4 396 286 A 39 GLY H A 40 GLY H 1.0 3.6 4.6 397 287 A 40 GLY H A 41 TRP H 1.0 4.0 5.0 398 288 A 41 TRP H A 40 GLY HAx 1.0 2.1 2.7 399 288 A 41 TRP H A 40 GLY HAy 1.0 2.1 2.7 400 289 A 42 MET H A 40 GLY HAx 1.0 3.5 4.5 401 289 A 40 GLY HAy A 42 MET H 1.0 3.5 4.5 402 290 A 41 TRP H A 42 MET H 1.0 2.4 3.0 403 291 A 42 MET H A 41 TRP HA 1.0 2.7 3.5 404 292 A 42 MET H A 41 TRP HBx 1.0 2.9 3.7 405 292 A 42 MET H A 41 TRP HBy 1.0 2.9 3.7 406 293 A 41 TRP H A 43 GLU H 1.0 4.0 5.0 407 294 A 41 TRP HA A 43 GLU H 1.0 4.2 5.2 408 295 A 43 GLU H A 41 TRP HBx 1.0 4.1 5.1 409 295 A 41 TRP HBy A 43 GLU H 1.0 4.1 5.1 410 296 A 42 MET H A 43 GLU H 1.0 2.5 3.1 411 297 A 43 GLU H A 42 MET HA 1.0 2.6 3.2 412 298 A 41 TRP HA A 44 TRP H 1.0 3.9 4.9 413 299 A 42 MET H A 44 TRP H 1.0 4.4 5.4 414 300 A 42 MET HA A 44 TRP H 1.0 4.3 5.3 415 301 A 43 GLU H A 44 TRP H 1.0 2.5 3.1 416 302 A 44 TRP H A 43 GLU HA 1.0 3.4 4.0 417 303 A 44 TRP H A 43 GLU HBx 1.0 2.3 2.9 418 303 A 44 TRP H A 43 GLU HBy 1.0 2.3 2.9 419 304 A 44 TRP H A 43 GLU HGx 1.0 3.0 3.8 420 304 A 44 TRP H A 43 GLU HGy 1.0 3.0 3.8 421 305 A 41 TRP HA A 45 ASP H 1.0 4.4 5.4 422 306 A 42 MET HA A 45 ASP H 1.0 3.1 3.9 423 307 A 43 GLU HA A 45 ASP H 1.0 3.2 4.0 424 308 A 45 ASP H A 43 GLU HBx 1.0 3.4 4.2 425 308 A 43 GLU HBy A 45 ASP H 1.0 3.4 4.2 426 309 A 44 TRP H A 45 ASP H 1.0 2.3 2.9 427 310 A 45 ASP H A 44 TRP HA 1.0 2.8 3.6 428 311 A 45 ASP H A 44 TRP HBx 1.0 2.9 3.7 429 311 A 45 ASP H A 44 TRP HBy 1.0 2.9 3.7 430 312 A 45 ASP H A 44 TRP HD1 1.0 4.3 5.3 431 313 A 43 GLU HA A 46 ARG H 1.0 4.0 5.0 432 314 A 44 TRP HA A 46 ARG H 1.0 3.5 4.5 433 315 A 46 ARG H A 44 TRP HBx 1.0 3.9 4.9 434 315 A 44 TRP HBy A 46 ARG H 1.0 3.9 4.9 435 316 A 45 ASP H A 46 ARG H 1.0 2.4 3.0 436 317 A 46 ARG H A 45 ASP HA 1.0 2.8 3.6 437 318 A 46 ARG H A 45 ASP HBx 1.0 2.6 3.2 438 318 A 46 ARG H A 45 ASP HBy 1.0 2.6 3.2 439 319 A 46 ARG HE A 46 ARG HBx 1.0 2.9 3.7 440 319 A 46 ARG HE A 46 ARG HBy 1.0 2.9 3.7 441 320 A 46 ARG HE A 46 ARG HH1% 1.0 2.6 3.2 442 320 A 46 ARG HE A 46 ARG HH2% 1.0 2.6 3.2 443 321 A 46 ARG HE A 46 ARG HGx 1.0 2.4 3.2 444 321 A 46 ARG HE A 46 ARG HGy 1.0 2.4 3.2 445 322 A 43 GLU HA A 47 GLU H 1.0 4.0 5.0 446 323 A 44 TRP HA A 47 GLU H 1.0 3.2 4.0 447 324 A 45 ASP H A 47 GLU H 1.0 3.9 4.9 448 325 A 45 ASP HA A 47 GLU H 1.0 3.5 4.5 449 326 A 46 ARG H A 47 GLU H 1.0 2.3 2.9 450 327 A 47 GLU H A 46 ARG HA 1.0 2.8 3.6 451 328 A 47 GLU H A 46 ARG HDx 1.0 4.1 5.1 452 328 A 47 GLU H A 46 ARG HDy 1.0 4.1 5.1 453 329 A 47 GLU H A 46 ARG HGx 1.0 3.3 4.1 454 329 A 46 ARG HGy A 47 GLU H 1.0 3.3 4.1 455 330 A 44 TRP HA A 48 ILE H 1.0 4.0 5.0 456 331 A 45 ASP HA A 48 ILE H 1.0 3.2 4.0 457 332 A 46 ARG H A 48 ILE H 1.0 3.4 4.2 458 333 A 46 ARG HA A 48 ILE H 1.0 3.7 4.7 459 334 A 48 ILE H A 46 ARG HBx 1.0 3.6 4.6 460 334 A 46 ARG HBy A 48 ILE H 1.0 3.6 4.6 461 335 A 47 GLU H A 48 ILE H 1.0 2.3 2.9 462 336 A 48 ILE H A 47 GLU HA 1.0 2.8 3.6 463 337 A 48 ILE H A 47 GLU HBx 1.0 2.7 3.5 464 337 A 48 ILE H A 47 GLU HBy 1.0 2.7 3.5 465 338 A 48 ILE H A 47 GLU HGx 1.0 3.5 4.3 466 338 A 48 ILE H A 47 GLU HGy 1.0 3.5 4.3 467 339 A 48 ILE H A 48 ILE HD11 1.0 2.8 3.6 468 340 A 48 ILE H A 48 ILE HG1x 1.0 2.6 3.4 469 340 A 48 ILE H A 48 ILE HG1y 1.0 2.6 3.4 470 341 A 48 ILE H A 48 ILE HG21 1.0 2.7 3.5 471 342 A 45 ASP HA A 49 ASN H 1.0 4.4 5.4 472 343 A 46 ARG HA A 49 ASN H 1.0 3.9 4.9 473 344 A 47 GLU H A 49 ASN H 1.0 3.4 4.2 474 345 A 47 GLU HA A 49 ASN H 1.0 3.5 4.3 475 346 A 48 ILE H A 49 ASN H 1.0 2.2 2.8 476 347 A 49 ASN H A 48 ILE HA 1.0 2.6 3.4 477 348 A 49 ASN H A 48 ILE HB 1.0 3.3 4.1 478 349 A 48 ILE HD11 A 49 ASN H 1.0 3.3 4.1 479 350 A 49 ASN H A 48 ILE HG1x 1.0 2.4 3.2 480 350 A 48 ILE HG1y A 49 ASN H 1.0 2.4 3.2 481 351 A 48 ILE HG21 A 49 ASN H 1.0 3.5 4.3 482 352 A 49 ASN HBx A 49 ASN HD2y 1.0 2.3 3.1 483 352 A 49 ASN HBy A 49 ASN HD2y 1.0 2.3 3.1 484 352 A 49 ASN HD2x A 49 ASN HBx 1.0 2.3 3.1 485 352 A 49 ASN HD2x A 49 ASN HBy 1.0 2.3 3.1 486 353 A 49 ASN H A 49 ASN HD2y 1.0 3.1 3.9 487 353 A 49 ASN H A 49 ASN HD2x 1.0 3.1 3.9 488 354 A 48 ILE HD11 A 49 ASN HD2y 1.0 3.8 4.8 489 354 A 48 ILE HD11 A 49 ASN HD2x 1.0 3.8 4.8 490 355 A 46 ARG HA A 50 ASN H 1.0 4.4 5.4 491 356 A 47 GLU H A 50 ASN H 1.0 3.9 4.9 492 357 A 47 GLU HA A 50 ASN H 1.0 3.0 3.8 493 358 A 48 ILE H A 50 ASN H 1.0 3.2 4.0 494 359 A 48 ILE HA A 50 ASN H 1.0 3.6 4.6 495 360 A 49 ASN H A 50 ASN H 1.0 2.3 2.9 496 361 A 50 ASN H A 49 ASN HA 1.0 3.3 4.1 497 362 A 50 ASN H A 49 ASN HBx 1.0 2.8 3.6 498 362 A 49 ASN HBy A 50 ASN H 1.0 2.8 3.6 499 363 A 50 ASN HBx A 50 ASN HD2y 1.0 2.4 3.2 500 363 A 50 ASN HBy A 50 ASN HD2y 1.0 2.4 3.2 501 363 A 50 ASN HD2x A 50 ASN HBx 1.0 2.4 3.2 502 363 A 50 ASN HD2x A 50 ASN HBy 1.0 2.4 3.2 503 364 A 50 ASN HA A 50 ASN HD2y 1.0 3.4 4.2 504 364 A 50 ASN HD2x A 50 ASN HA 1.0 3.4 4.2 505 365 A 50 ASN H A 50 ASN HD2y 1.0 3.2 4.0 506 365 A 50 ASN H A 50 ASN HD2x 1.0 3.2 4.0 507 366 A 47 GLU HA A 51 TYR H 1.0 3.5 4.5 508 367 A 48 ILE HA A 51 TYR H 1.0 3.0 3.8 509 368 A 48 ILE HG21 A 51 TYR H 1.0 4.1 5.1 510 369 A 49 ASN HA A 51 TYR H 1.0 3.5 4.3 511 370 A 50 ASN H A 51 TYR H 1.0 2.2 2.8 512 371 A 49 ASN HA A 52 THR H 1.0 3.8 4.8 513 372 A 50 ASN H A 52 THR H 1.0 3.5 4.3 514 373 A 51 TYR H A 52 THR H 1.0 2.2 2.8 515 374 A 52 THR H A 51 TYR HA 1.0 3.1 3.9 516 375 A 52 THR H A 51 TYR HBx 1.0 2.8 3.6 517 375 A 52 THR H A 51 TYR HBy 1.0 2.8 3.6 518 376 A 52 THR H A 51 TYR HD% 1.0 4.1 5.1 519 377 A 49 ASN HA A 53 SER H 1.0 4.1 5.1 520 378 A 50 ASN HA A 53 SER H 1.0 3.6 4.6 521 379 A 52 THR H A 53 SER H 1.0 2.3 2.9 522 380 A 53 SER H A 52 THR HA 1.0 2.8 3.6 523 381 A 53 SER H A 52 THR HB 1.0 2.6 3.2 524 382 A 53 SER H A 52 THR HG21 1.0 3.0 3.8 525 382 A 53 SER H A 52 THR HG1 1.0 3.0 3.8 526 383 A 51 TYR HA A 54 LEU H 1.0 3.1 3.9 527 384 A 52 THR H A 54 LEU H 1.0 3.9 4.9 528 385 A 52 THR HA A 54 LEU H 1.0 3.8 4.8 529 386 A 53 SER H A 54 LEU H 1.0 2.3 2.9 530 387 A 54 LEU H A 53 SER HA 1.0 3.2 4.0 531 388 A 54 LEU H A 53 SER HBx 1.0 3.3 4.1 532 388 A 54 LEU H A 53 SER HBy 1.0 3.3 4.1 533 389 A 52 THR HA A 55 ILE H 1.0 3.7 4.7 534 390 A 55 ILE H A 52 THR HG21 1.0 4.0 5.0 535 390 A 52 THR HG1 A 55 ILE H 1.0 4.0 5.0 536 391 A 53 SER H A 55 ILE H 1.0 3.5 4.3 537 392 A 53 SER HA A 55 ILE H 1.0 3.7 4.7 538 393 A 54 LEU H A 55 ILE H 1.0 2.3 2.9 539 394 A 55 ILE H A 54 LEU HA 1.0 2.9 3.7 540 395 A 55 ILE H A 54 LEU HBx 1.0 2.2 2.8 541 395 A 55 ILE H A 54 LEU HBy 1.0 2.2 2.8 542 396 A 55 ILE H A 55 ILE HD11 1.0 3.3 4.1 543 397 A 55 ILE H A 55 ILE HG1x 1.0 2.8 3.6 544 397 A 55 ILE H A 55 ILE HG1y 1.0 2.8 3.6 545 398 A 55 ILE H A 55 ILE HG21 1.0 2.2 3.0 546 399 A 53 SER HA A 56 HIS H 1.0 3.5 4.5 547 400 A 54 LEU H A 56 HIS H 1.0 3.8 4.8 548 401 A 56 HIS H A 54 LEU HBx 1.0 4.4 5.4 549 401 A 54 LEU HBy A 56 HIS H 1.0 4.4 5.4 550 402 A 55 ILE H A 56 HIS H 1.0 2.4 3.0 551 403 A 56 HIS H A 55 ILE HA 1.0 3.4 4.2 552 404 A 56 HIS H A 55 ILE HB 1.0 3.3 4.1 553 405 A 55 ILE HD11 A 56 HIS H 1.0 3.8 4.8 554 406 A 56 HIS H A 55 ILE HG1x 1.0 4.2 5.2 555 406 A 55 ILE HG1y A 56 HIS H 1.0 4.2 5.2 556 407 A 55 ILE HG21 A 56 HIS H 1.0 2.4 3.2 557 408 A 53 SER HA A 57 SER H 1.0 3.9 4.9 558 409 A 55 ILE H A 57 SER H 1.0 3.6 4.6 559 410 A 55 ILE HA A 57 SER H 1.0 4.2 5.2 560 411 A 56 HIS H A 57 SER H 1.0 2.5 3.1 561 412 A 57 SER H A 56 HIS HBx 1.0 2.6 3.2 562 412 A 57 SER H A 56 HIS HBy 1.0 2.6 3.2 563 413 A 55 ILE HA A 58 LEU H 1.0 3.5 4.5 564 414 A 56 HIS H A 58 LEU H 1.0 3.7 4.7 565 415 A 58 LEU H A 56 HIS HA 1.0 3.0 3.8 566 416 A 58 LEU H A 57 SER HA 1.0 2.7 3.5 567 417 A 58 LEU H A 57 SER HBx 1.0 2.8 3.6 568 417 A 58 LEU H A 57 SER HBy 1.0 2.8 3.6 569 418 A 57 SER H A 58 LEU H 1.0 2.3 2.9 570 419 A 55 ILE HA A 59 ILE H 1.0 3.7 4.7 571 420 A 56 HIS H A 59 ILE H 1.0 4.0 5.0 572 421 A 57 SER H A 59 ILE H 1.0 3.5 4.5 573 422 A 59 ILE H A 58 LEU HA 1.0 3.1 3.9 574 423 A 59 ILE H A 58 LEU HBx 1.0 3.0 3.8 575 423 A 59 ILE H A 58 LEU HBy 1.0 3.0 3.8 576 424 A 59 ILE H A 58 LEU HG 1.0 2.9 3.7 577 425 A 59 ILE H A 59 ILE HD11 1.0 2.8 3.6 578 426 A 59 ILE H A 59 ILE HG1x 1.0 2.6 3.4 579 426 A 59 ILE H A 59 ILE HG1y 1.0 2.6 3.4 580 427 A 59 ILE H A 59 ILE HG21 1.0 2.7 3.5 581 428 A 57 SER H A 60 GLU H 1.0 3.9 4.9 582 429 A 57 SER HA A 60 GLU H 1.0 3.5 4.5 583 430 A 58 LEU HA A 60 GLU H 1.0 4.3 5.3 584 431 A 60 GLU H A 58 LEU HBx 1.0 3.9 4.9 585 431 A 58 LEU HBy A 60 GLU H 1.0 3.9 4.9 586 432 A 59 ILE H A 60 GLU H 1.0 2.5 3.1 587 433 A 60 GLU H A 59 ILE HA 1.0 3.0 3.8 588 434 A 59 ILE HD11 A 60 GLU H 1.0 3.7 4.7 589 435 A 60 GLU H A 59 ILE HG1x 1.0 4.1 5.1 590 435 A 59 ILE HG1y A 60 GLU H 1.0 4.1 5.1 591 436 A 59 ILE HG21 A 60 GLU H 1.0 2.4 3.2 592 437 A 58 LEU HA A 61 GLU H 1.0 3.5 4.5 593 438 A 59 ILE HA A 61 GLU H 1.0 4.4 5.4 594 439 A 59 ILE HG21 A 61 GLU H 1.0 4.4 5.4 595 440 A 60 GLU H A 61 GLU H 1.0 2.5 3.1 596 441 A 61 GLU H A 60 GLU HA 1.0 2.8 3.6 597 442 A 61 GLU H A 60 GLU HBx 1.0 3.1 3.9 598 442 A 61 GLU H A 60 GLU HBy 1.0 3.1 3.9 599 443 A 61 GLU H A 60 GLU HGx 1.0 4.2 5.2 600 443 A 61 GLU H A 60 GLU HGy 1.0 4.2 5.2 601 444 A 58 LEU HA A 62 SER H 1.0 4.2 5.2 602 445 A 59 ILE HA A 62 SER H 1.0 3.5 4.5 603 446 A 59 ILE HG21 A 62 SER H 1.0 4.4 5.4 604 447 A 60 GLU HA A 62 SER H 1.0 3.9 4.9 605 448 A 61 GLU H A 62 SER H 1.0 2.3 2.9 606 449 A 62 SER H A 61 GLU HA 1.0 2.7 3.5 607 450 A 62 SER H A 61 GLU HBx 1.0 2.6 3.4 608 450 A 62 SER H A 61 GLU HBy 1.0 2.6 3.4 609 451 A 60 GLU HA A 63 GLN H 1.0 4.2 5.2 610 452 A 61 GLU HA A 63 GLN H 1.0 4.4 5.4 611 453 A 62 SER H A 63 GLN H 1.0 2.5 3.1 612 454 A 63 GLN H A 62 SER HBx 1.0 2.5 3.3 613 454 A 63 GLN H A 62 SER HBy 1.0 2.5 3.3 614 455 A 63 GLN HE2y A 63 GLN HGx 1.0 2.5 3.3 615 455 A 63 GLN HGy A 63 GLN HE2y 1.0 2.5 3.3 616 455 A 63 GLN HE2x A 63 GLN HGy 1.0 2.5 3.3 617 455 A 63 GLN HE2x A 63 GLN HGx 1.0 2.5 3.3 618 456 A 59 ILE HG21 A 63 GLN HE2y 1.0 4.4 5.4 619 456 A 59 ILE HG21 A 63 GLN HE2x 1.0 4.4 5.4 620 457 A 62 SER H A 64 ASN H 1.0 4.4 5.4 621 458 A 63 GLN H A 64 ASN H 1.0 3.1 3.9 622 459 A 64 ASN H A 63 GLN HA 1.0 2.1 2.9 623 460 A 64 ASN H A 63 GLN HBx 1.0 3.3 4.1 624 460 A 64 ASN H A 63 GLN HBy 1.0 3.3 4.1 625 461 A 64 ASN H A 63 GLN HGx 1.0 3.6 4.6 626 461 A 63 GLN HGy A 64 ASN H 1.0 3.6 4.6 627 462 A 64 ASN HBy A 64 ASN HD2y 1.0 2.4 3.2 628 462 A 64 ASN HBx A 64 ASN HD2y 1.0 2.4 3.2 629 462 A 64 ASN HD2x A 64 ASN HBx 1.0 2.4 3.2 630 462 A 64 ASN HD2x A 64 ASN HBy 1.0 2.4 3.2 631 463 A 64 ASN H A 65 GLN H 1.0 3.7 4.7 632 464 A 65 GLN H A 64 ASN HA 1.0 2.3 3.1 633 465 A 65 GLN H A 64 ASN HBx 1.0 3.2 4.0 634 465 A 64 ASN HBy A 65 GLN H 1.0 3.2 4.0 635 466 A 65 GLN H A 66 GLN H 1.0 3.7 4.7 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 5 GLN C A 6 GLN N A 6 GLN CA A 6 GLN C 1.0 -89.584 -49.584 PHI 2 2 A 6 GLN N A 6 GLN CA A 6 GLN C A 7 GLN N 1.0 -54.958 -14.958 PSI 3 3 A 6 GLN C A 7 GLN N A 7 GLN CA A 7 GLN C 1.0 -88.332 -48.332 PHI 4 4 A 7 GLN N A 7 GLN CA A 7 GLN C A 8 ASN N 1.0 -56.788 -16.788 PSI 5 5 A 7 GLN C A 8 ASN N A 8 ASN CA A 8 ASN C 1.0 -86.855 -46.855 PHI 6 6 A 8 ASN N A 8 ASN CA A 8 ASN C A 9 ASN N 1.0 -58.047 -18.047 PSI 7 7 A 8 ASN C A 9 ASN N A 9 ASN CA A 9 ASN C 1.0 -86.816 -46.816 PHI 8 8 A 9 ASN N A 9 ASN CA A 9 ASN C A 10 LEU N 1.0 -56.924 -16.924 PSI 9 9 A 9 ASN C A 10 LEU N A 10 LEU CA A 10 LEU C 1.0 -86.040 -46.040 PHI 10 10 A 10 LEU N A 10 LEU CA A 10 LEU C A 11 LEU N 1.0 -63.149 -23.149 PSI 11 11 A 10 LEU C A 11 LEU N A 11 LEU CA A 11 LEU C 1.0 -83.507 -43.507 PHI 12 12 A 11 LEU N A 11 LEU CA A 11 LEU C A 12 ARG N 1.0 -60.088 -20.088 PSI 13 13 A 11 LEU C A 12 ARG N A 12 ARG CA A 12 ARG C 1.0 -85.879 -45.879 PHI 14 14 A 12 ARG N A 12 ARG CA A 12 ARG C A 13 ALA N 1.0 -58.932 -18.932 PSI 15 15 A 12 ARG C A 13 ALA N A 13 ALA CA A 13 ALA C 1.0 -86.544 -46.544 PHI 16 16 A 13 ALA N A 13 ALA CA A 13 ALA C A 14 ILE N 1.0 -60.495 -20.495 PSI 17 17 A 13 ALA C A 14 ILE N A 14 ILE CA A 14 ILE C 1.0 -84.378 -44.378 PHI 18 18 A 14 ILE N A 14 ILE CA A 14 ILE C A 15 GLU N 1.0 -63.833 -23.833 PSI 19 19 A 14 ILE C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -86.216 -46.216 PHI 20 20 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 ALA N 1.0 -64.221 -4.221 PSI 21 21 A 15 GLU C A 16 ALA N A 16 ALA CA A 16 ALA C 1.0 -120.860 -80.860 PHI 22 22 A 16 ALA N A 16 ALA CA A 16 ALA C A 17 GLN N 1.0 0.108 40.108 PSI 23 23 A 16 ALA C A 17 GLN N A 17 GLN CA A 17 GLN C 1.0 -130.000 -90.000 PHI 24 24 A 17 GLN N A 17 GLN CA A 17 GLN C A 18 GLN N 1.0 0.500 40.500 PSI 25 25 A 17 GLN C A 18 GLN N A 18 GLN CA A 18 GLN C 1.0 -95.000 -35.000 PHI 26 26 A 18 GLN N A 18 GLN CA A 18 GLN C A 19 HIS N 1.0 -55.500 -15.500 PSI 27 27 A 18 GLN C A 19 HIS N A 19 HIS CA A 19 HIS C 1.0 -85.000 -45.000 PHI 28 28 A 19 HIS N A 19 HIS CA A 19 HIS C A 20 LEU N 1.0 -58.029 -18.029 PSI 29 29 A 19 HIS C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -86.984 -46.984 PHI 30 30 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 LEU N 1.0 -50.651 -30.651 PSI 31 31 A 20 LEU C A 21 LEU N A 21 LEU CA A 21 LEU C 1.0 -84.005 -44.005 PHI 32 32 A 21 LEU N A 21 LEU CA A 21 LEU C A 22 GLN N 1.0 -62.659 -22.659 PSI 33 33 A 21 LEU C A 22 GLN N A 22 GLN CA A 22 GLN C 1.0 -84.401 -44.401 PHI 34 34 A 22 GLN N A 22 GLN CA A 22 GLN C A 23 LEU N 1.0 -58.427 -18.427 PSI 35 35 A 22 GLN C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -86.690 -46.690 PHI 36 36 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 THR N 1.0 -61.261 -21.261 PSI 37 37 A 23 LEU C A 24 THR N A 24 THR CA A 24 THR C 1.0 -86.728 -46.728 PHI 38 38 A 24 THR N A 24 THR CA A 24 THR C A 25 VAL N 1.0 -57.544 -17.544 PSI 39 39 A 24 THR C A 25 VAL N A 25 VAL CA A 25 VAL C 1.0 -83.274 -43.274 PHI 40 40 A 25 VAL N A 25 VAL CA A 25 VAL C A 26 TRP N 1.0 -63.177 -23.177 PSI 41 41 A 25 VAL C A 26 TRP N A 26 TRP CA A 26 TRP C 1.0 -82.882 -42.882 PHI 42 42 A 26 TRP N A 26 TRP CA A 26 TRP C A 27 GLY N 1.0 -64.854 -24.854 PSI 43 43 A 26 TRP C A 27 GLY N A 27 GLY CA A 27 GLY C 1.0 -83.310 -43.310 PHI 44 44 A 27 GLY N A 27 GLY CA A 27 GLY C A 28 ILE N 1.0 -63.914 -23.914 PSI 45 45 A 27 GLY C A 28 ILE N A 28 ILE CA A 28 ILE C 1.0 -84.331 -44.331 PHI 46 46 A 28 ILE N A 28 ILE CA A 28 ILE C A 29 LYS N 1.0 -62.911 -22.911 PSI 47 47 A 28 ILE C A 29 LYS N A 29 LYS CA A 29 LYS C 1.0 -83.928 -43.928 PHI 48 48 A 29 LYS N A 29 LYS CA A 29 LYS C A 30 GLN N 1.0 -61.494 -21.494 PSI 49 49 A 29 LYS C A 30 GLN N A 30 GLN CA A 30 GLN C 1.0 -87.152 -47.152 PHI 50 50 A 30 GLN N A 30 GLN CA A 30 GLN C A 31 LEU N 1.0 -60.580 -20.580 PSI 51 51 A 30 GLN C A 31 LEU N A 31 LEU CA A 31 LEU C 1.0 -85.248 -45.248 PHI 52 52 A 31 LEU N A 31 LEU CA A 31 LEU C A 32 GLN N 1.0 -51.848 -31.848 PSI 53 53 A 31 LEU C A 32 GLN N A 32 GLN CA A 32 GLN C 1.0 -85.836 -45.836 PHI 54 54 A 32 GLN N A 32 GLN CA A 32 GLN C A 33 ALA N 1.0 -57.387 -17.387 PSI 55 55 A 32 GLN C A 33 ALA N A 33 ALA CA A 33 ALA C 1.0 -85.891 -45.891 PHI 56 56 A 33 ALA N A 33 ALA CA A 33 ALA C A 34 ARG N 1.0 -50.000 -30.000 PSI 57 57 A 33 ALA C A 34 ARG N A 34 ARG CA A 34 ARG C 1.0 -83.836 -43.836 PHI 58 58 A 34 ARG N A 34 ARG CA A 34 ARG C A 35 SER N 1.0 -55.969 -15.969 PSI 59 59 A 40 GLY C A 41 TRP N A 41 TRP CA A 41 TRP C 1.0 -105.900 -65.900 PHI 60 60 A 41 TRP N A 41 TRP CA A 41 TRP C A 42 MET N 1.0 -54.326 -34.326 PSI 61 61 A 41 TRP C A 42 MET N A 42 MET CA A 42 MET C 1.0 -87.151 -47.151 PHI 62 62 A 42 MET N A 42 MET CA A 42 MET C A 43 GLU N 1.0 -59.228 -19.228 PSI 63 63 A 42 MET C A 43 GLU N A 43 GLU CA A 43 GLU C 1.0 -87.476 -47.476 PHI 64 64 A 43 GLU N A 43 GLU CA A 43 GLU C A 44 TRP N 1.0 -60.000 -20.000 PSI 65 65 A 43 GLU C A 44 TRP N A 44 TRP CA A 44 TRP C 1.0 -85.314 -45.314 PHI 66 66 A 44 TRP N A 44 TRP CA A 44 TRP C A 45 ASP N 1.0 -60.500 -20.500 PSI 67 67 A 44 TRP C A 45 ASP N A 45 ASP CA A 45 ASP C 1.0 -85.064 -45.064 PHI 68 68 A 45 ASP N A 45 ASP CA A 45 ASP C A 46 ARG N 1.0 -50.560 -30.560 PSI 69 69 A 45 ASP C A 46 ARG N A 46 ARG CA A 46 ARG C 1.0 -95.000 -35.000 PHI 70 70 A 46 ARG N A 46 ARG CA A 46 ARG C A 47 GLU N 1.0 -61.914 -21.914 PSI 71 71 A 46 ARG C A 47 GLU N A 47 GLU CA A 47 GLU C 1.0 -85.324 -45.324 PHI 72 72 A 47 GLU N A 47 GLU CA A 47 GLU C A 48 ILE N 1.0 -60.773 -20.773 PSI 73 73 A 47 GLU C A 48 ILE N A 48 ILE CA A 48 ILE C 1.0 -84.304 -44.304 PHI 74 74 A 48 ILE N A 48 ILE CA A 48 ILE C A 49 ASN N 1.0 -62.450 -22.450 PSI 75 75 A 48 ILE C A 49 ASN N A 49 ASN CA A 49 ASN C 1.0 -86.316 -46.316 PHI 76 76 A 49 ASN N A 49 ASN CA A 49 ASN C A 50 ASN N 1.0 -57.997 -17.997 PSI 77 77 A 49 ASN C A 50 ASN N A 50 ASN CA A 50 ASN C 1.0 -87.190 -47.190 PHI 78 78 A 50 ASN N A 50 ASN CA A 50 ASN C A 51 TYR N 1.0 -47.913 -27.913 PSI 79 79 A 50 ASN C A 51 TYR N A 51 TYR CA A 51 TYR C 1.0 -85.017 -45.017 PHI 80 80 A 51 TYR N A 51 TYR CA A 51 TYR C A 52 THR N 1.0 -50.739 -30.739 PSI 81 81 A 51 TYR C A 52 THR N A 52 THR CA A 52 THR C 1.0 -84.031 -44.031 PHI 82 82 A 52 THR N A 52 THR CA A 52 THR C A 53 SER N 1.0 -60.693 -20.693 PSI 83 83 A 52 THR C A 53 SER N A 53 SER CA A 53 SER C 1.0 -85.872 -45.872 PHI 84 84 A 53 SER N A 53 SER CA A 53 SER C A 54 LEU N 1.0 -59.679 -19.679 PSI 85 85 A 53 SER C A 54 LEU N A 54 LEU CA A 54 LEU C 1.0 -85.349 -45.349 PHI 86 86 A 54 LEU N A 54 LEU CA A 54 LEU C A 55 ILE N 1.0 -63.079 -23.079 PSI 87 87 A 54 LEU C A 55 ILE N A 55 ILE CA A 55 ILE C 1.0 -92.898 -32.898 PHI 88 88 A 55 ILE N A 55 ILE CA A 55 ILE C A 56 HIS N 1.0 -63.581 -23.581 PSI 89 89 A 55 ILE C A 56 HIS N A 56 HIS CA A 56 HIS C 1.0 -85.574 -45.574 PHI 90 90 A 56 HIS N A 56 HIS CA A 56 HIS C A 57 SER N 1.0 -57.832 -17.832 PSI 91 91 A 56 HIS C A 57 SER N A 57 SER CA A 57 SER C 1.0 -86.086 -46.086 PHI 92 92 A 57 SER N A 57 SER CA A 57 SER C A 58 LEU N 1.0 -59.845 -19.845 PSI 93 93 A 57 SER C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -85.495 -45.495 PHI 94 94 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 ILE N 1.0 -63.321 -23.321 PSI 95 95 A 58 LEU C A 59 ILE N A 59 ILE CA A 59 ILE C 1.0 -87.934 -47.934 PHI 96 96 A 59 ILE N A 59 ILE CA A 59 ILE C A 60 GLU N 1.0 -61.403 -21.403 PSI 97 97 A 59 ILE C A 60 GLU N A 60 GLU CA A 60 GLU C 1.0 -86.048 -46.048 PHI 98 98 A 60 GLU N A 60 GLU CA A 60 GLU C A 61 GLU N 1.0 -57.989 -17.989 PSI 99 99 A 60 GLU C A 61 GLU N A 61 GLU CA A 61 GLU C 1.0 -88.875 -48.875 PHI 100 100 A 61 GLU N A 61 GLU CA A 61 GLU C A 62 SER N 1.0 -54.259 -14.259 PSI 101 101 A 61 GLU C A 62 SER N A 62 SER CA A 62 SER C 1.0 -90.434 -50.434 PHI 102 102 A 62 SER N A 62 SER CA A 62 SER C A 63 GLN N 1.0 -48.516 -8.516 PSI stop_ save_ save_CNS/XPLOR_dipolar_coupling_3 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_3 save_