################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 51534 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name Sox2(aa1-42)_assign _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 2 '2D 1H-15N HSQC' . . . 51534 1 3 '3D HNCO' . . . 51534 1 4 '3D HNCACB' . . . 51534 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $software_2 . . 51534 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 MET C C 13 175.7560153 0 . 1 . . . . . 2 MET C . 51534 1 2 . 1 . 1 2 2 MET CA C 13 55.93438358 0 . 1 . . . . . 2 MET CA . 51534 1 3 . 1 . 1 2 2 MET CB C 13 32.73096013 0 . 1 . . . . . 2 MET CB . 51534 1 4 . 1 . 1 3 3 TYR H H 1 8.205240802 0.001640600176 . 1 . . . . . 3 TYR H . 51534 1 5 . 1 . 1 3 3 TYR C C 13 175.0922314 0 . 1 . . . . . 3 TYR C . 51534 1 6 . 1 . 1 3 3 TYR CA C 13 57.49600548 0 . 1 . . . . . 3 TYR CA . 51534 1 7 . 1 . 1 3 3 TYR CB C 13 38.43797834 0 . 1 . . . . . 3 TYR CB . 51534 1 8 . 1 . 1 3 3 TYR N N 15 120.5452687 0.004272099676 . 1 . . . . . 3 TYR N . 51534 1 9 . 1 . 1 4 4 ASN H H 1 8.153011581 0.003049206028 . 1 . . . . . 4 ASN H . 51534 1 10 . 1 . 1 4 4 ASN C C 13 174.6873275 0 . 1 . . . . . 4 ASN C . 51534 1 11 . 1 . 1 4 4 ASN CA C 13 52.904923 0 . 1 . . . . . 4 ASN CA . 51534 1 12 . 1 . 1 4 4 ASN CB C 13 38.46826279 0 . 1 . . . . . 4 ASN CB . 51534 1 13 . 1 . 1 4 4 ASN N N 15 120.6130929 0.0347461201 . 1 . . . . . 4 ASN N . 51534 1 14 . 1 . 1 5 5 MET H H 1 8.137394424 0.002275598118 . 1 . . . . . 5 MET H . 51534 1 15 . 1 . 1 5 5 MET C C 13 176.064256 0 . 1 . . . . . 5 MET C . 51534 1 16 . 1 . 1 5 5 MET CA C 13 55.87061901 0 . 1 . . . . . 5 MET CA . 51534 1 17 . 1 . 1 5 5 MET CB C 13 32.08881598 0 . 1 . . . . . 5 MET CB . 51534 1 18 . 1 . 1 5 5 MET N N 15 120.5701057 0.02807910524 . 1 . . . . . 5 MET N . 51534 1 19 . 1 . 1 6 6 MET H H 1 8.16569581 0.001557803305 . 1 . . . . . 6 MET H . 51534 1 20 . 1 . 1 6 6 MET C C 13 176.1988483 0 . 1 . . . . . 6 MET C . 51534 1 21 . 1 . 1 6 6 MET CA C 13 55.36416743 0 . 1 . . . . . 6 MET CA . 51534 1 22 . 1 . 1 6 6 MET CB C 13 32.29165583 0 . 1 . . . . . 6 MET CB . 51534 1 23 . 1 . 1 6 6 MET N N 15 120.4594586 0.07586613967 . 1 . . . . . 6 MET N . 51534 1 24 . 1 . 1 7 7 GLU H H 1 8.216519586 0.002675010975 . 1 . . . . . 7 GLU H . 51534 1 25 . 1 . 1 7 7 GLU C C 13 176.4993963 0 . 1 . . . . . 7 GLU C . 51534 1 26 . 1 . 1 7 7 GLU CA C 13 56.622218 0 . 1 . . . . . 7 GLU CA . 51534 1 27 . 1 . 1 7 7 GLU CB C 13 29.83546878 0 . 1 . . . . . 7 GLU CB . 51534 1 28 . 1 . 1 7 7 GLU N N 15 121.8314714 0.007545477339 . 1 . . . . . 7 GLU N . 51534 1 29 . 1 . 1 8 8 THR H H 1 7.94516074 0 . 1 . . . . . 8 THR H . 51534 1 30 . 1 . 1 8 8 THR C C 13 174.2249788 0 . 1 . . . . . 8 THR C . 51534 1 31 . 1 . 1 8 8 THR CA C 13 61.9981361 0 . 1 . . . . . 8 THR CA . 51534 1 32 . 1 . 1 8 8 THR CB C 13 69.51235764 0 . 1 . . . . . 8 THR CB . 51534 1 33 . 1 . 1 8 8 THR N N 15 114.6586315 0.009151675888 . 1 . . . . . 8 THR N . 51534 1 34 . 1 . 1 9 9 GLU H H 1 8.183723113 0.003189613222 . 1 . . . . . 9 GLU H . 51534 1 35 . 1 . 1 9 9 GLU C C 13 175.8901773 0 . 1 . . . . . 9 GLU C . 51534 1 36 . 1 . 1 9 9 GLU CA C 13 56.39514132 0 . 1 . . . . . 9 GLU CA . 51534 1 37 . 1 . 1 9 9 GLU CB C 13 30.10660048 0 . 1 . . . . . 9 GLU CB . 51534 1 38 . 1 . 1 9 9 GLU N N 15 123.2884831 0.009151675888 . 1 . . . . . 9 GLU N . 51534 1 39 . 1 . 1 10 10 LEU H H 1 8.103993014 0.0003517327814 . 1 . . . . . 10 LEU H . 51534 1 40 . 1 . 1 10 10 LEU C C 13 176.7205541 0 . 1 . . . . . 10 LEU C . 51534 1 41 . 1 . 1 10 10 LEU CA C 13 54.78417376 0 . 1 . . . . . 10 LEU CA . 51534 1 42 . 1 . 1 10 10 LEU CB C 13 41.9279691 0 . 1 . . . . . 10 LEU CB . 51534 1 43 . 1 . 1 10 10 LEU N N 15 123.9147119 0.005972909676 . 1 . . . . . 10 LEU N . 51534 1 44 . 1 . 1 11 11 LYS H H 1 8.158807107 0.0008623985936 . 1 . . . . . 11 LYS H . 51534 1 45 . 1 . 1 11 11 LYS C C 13 173.6223845 0 . 1 . . . . . 11 LYS C . 51534 1 46 . 1 . 1 11 11 LYS CA C 13 53.5558969 0 . 1 . . . . . 11 LYS CA . 51534 1 47 . 1 . 1 11 11 LYS CB C 13 32.17456494 0 . 1 . . . . . 11 LYS CB . 51534 1 48 . 1 . 1 11 11 LYS N N 15 124.0629957 0.00000190735 . 1 . . . . . 11 LYS N . 51534 1 49 . 1 . 1 13 13 PRO C C 13 177.0560173 0 . 1 . . . . . 13 PRO C . 51534 1 50 . 1 . 1 13 13 PRO CA C 13 62.90152933 0 . 1 . . . . . 13 PRO CA . 51534 1 51 . 1 . 1 13 13 PRO CB C 13 31.88074181 0 . 1 . . . . . 13 PRO CB . 51534 1 52 . 1 . 1 14 14 GLY H H 1 8.105328292 0.001657763072 . 1 . . . . . 14 GLY H . 51534 1 53 . 1 . 1 14 14 GLY C C 13 171.6448927 0 . 1 . . . . . 14 GLY C . 51534 1 54 . 1 . 1 14 14 GLY CA C 13 44.25703691 0 . 1 . . . . . 14 GLY CA . 51534 1 55 . 1 . 1 14 14 GLY N N 15 108.8051849 0.01158881234 . 1 . . . . . 14 GLY N . 51534 1 56 . 1 . 1 15 15 PRO C C 13 177.087546 0 . 1 . . . . . 15 PRO C . 51534 1 57 . 1 . 1 15 15 PRO CA C 13 63.00310431 0 . 1 . . . . . 15 PRO CA . 51534 1 58 . 1 . 1 15 15 PRO CB C 13 31.6747132 0 . 1 . . . . . 15 PRO CB . 51534 1 59 . 1 . 1 16 16 GLN H H 1 8.414541911 0.002301879616 . 1 . . . . . 16 GLN H . 51534 1 60 . 1 . 1 16 16 GLN C C 13 175.9499276 0 . 1 . . . . . 16 GLN C . 51534 1 61 . 1 . 1 16 16 GLN CA C 13 55.64784732 0 . 1 . . . . . 16 GLN CA . 51534 1 62 . 1 . 1 16 16 GLN CB C 13 29.09041127 0 . 1 . . . . . 16 GLN CB . 51534 1 63 . 1 . 1 16 16 GLN N N 15 120.4130894 0.004269285171 . 1 . . . . . 16 GLN N . 51534 1 64 . 1 . 1 17 17 GLN H H 1 8.310026256 0.001052891727 . 1 . . . . . 17 GLN H . 51534 1 65 . 1 . 1 17 17 GLN C C 13 176.0372017 0 . 1 . . . . . 17 GLN C . 51534 1 66 . 1 . 1 17 17 GLN CA C 13 55.76986859 0 . 1 . . . . . 17 GLN CA . 51534 1 67 . 1 . 1 17 17 GLN CB C 13 29.21989967 0 . 1 . . . . . 17 GLN CB . 51534 1 68 . 1 . 1 17 17 GLN N N 15 121.8376739 0.008065995945 . 1 . . . . . 17 GLN N . 51534 1 69 . 1 . 1 18 18 THR H H 1 8.126868215 0.001360592222 . 1 . . . . . 18 THR H . 51534 1 70 . 1 . 1 18 18 THR C C 13 174.4917115 0 . 1 . . . . . 18 THR C . 51534 1 71 . 1 . 1 18 18 THR CA C 13 61.61285673 0 . 1 . . . . . 18 THR CA . 51534 1 72 . 1 . 1 18 18 THR CB C 13 69.59382135 0 . 1 . . . . . 18 THR CB . 51534 1 73 . 1 . 1 18 18 THR N N 15 115.2639866 0.01028132392 . 1 . . . . . 18 THR N . 51534 1 74 . 1 . 1 19 19 SER H H 1 8.254162834 0.001773122892 . 1 . . . . . 19 SER H . 51534 1 75 . 1 . 1 19 19 SER C C 13 174.939363 0 . 1 . . . . . 19 SER C . 51534 1 76 . 1 . 1 19 19 SER CA C 13 58.19858883 0 . 1 . . . . . 19 SER CA . 51534 1 77 . 1 . 1 19 19 SER CB C 13 63.61071468 0 . 1 . . . . . 19 SER CB . 51534 1 78 . 1 . 1 19 19 SER N N 15 117.9184328 0.003178766597 . 1 . . . . . 19 SER N . 51534 1 79 . 1 . 1 20 20 GLY H H 1 8.345988911 0.0007082621078 . 1 . . . . . 20 GLY H . 51534 1 80 . 1 . 1 20 20 GLY C C 13 174.6411446 0 . 1 . . . . . 20 GLY C . 51534 1 81 . 1 . 1 20 20 GLY CA C 13 45.20836736 0 . 1 . . . . . 20 GLY CA . 51534 1 82 . 1 . 1 20 20 GLY N N 15 110.8568755 0.009963082824 . 1 . . . . . 20 GLY N . 51534 1 83 . 1 . 1 21 21 GLY H H 1 8.166802291 0.0006659356246 . 1 . . . . . 21 GLY H . 51534 1 84 . 1 . 1 21 21 GLY C C 13 174.677542 0 . 1 . . . . . 21 GLY C . 51534 1 85 . 1 . 1 21 21 GLY CA C 13 45.14469529 0 . 1 . . . . . 21 GLY CA . 51534 1 86 . 1 . 1 21 21 GLY N N 15 108.5664269 0.01977220414 . 1 . . . . . 21 GLY N . 51534 1 87 . 1 . 1 22 22 GLY H H 1 8.232959527 0.003924004081 . 1 . . . . . 22 GLY H . 51534 1 88 . 1 . 1 22 22 GLY C C 13 174.7007825 0 . 1 . . . . . 22 GLY C . 51534 1 89 . 1 . 1 22 22 GLY CA C 13 45.05389237 0 . 1 . . . . . 22 GLY CA . 51534 1 90 . 1 . 1 22 22 GLY N N 15 108.7217809 0.00714580026 . 1 . . . . . 22 GLY N . 51534 1 91 . 1 . 1 23 23 GLY H H 1 8.224073727 0.003539579268 . 1 . . . . . 23 GLY H . 51534 1 92 . 1 . 1 23 23 GLY C C 13 174.7146643 0 . 1 . . . . . 23 GLY C . 51534 1 93 . 1 . 1 23 23 GLY CA C 13 45.05389237 0 . 1 . . . . . 23 GLY CA . 51534 1 94 . 1 . 1 23 23 GLY N N 15 108.7083066 0.01190966746 . 1 . . . . . 23 GLY N . 51534 1 95 . 1 . 1 24 24 GLY H H 1 8.193850903 0.0009059749307 . 1 . . . . . 24 GLY H . 51534 1 96 . 1 . 1 24 24 GLY C C 13 173.8680915 0 . 1 . . . . . 24 GLY C . 51534 1 97 . 1 . 1 24 24 GLY CA C 13 45.05216465 0 . 1 . . . . . 24 GLY CA . 51534 1 98 . 1 . 1 24 24 GLY N N 15 108.7083335 0.03761501062 . 1 . . . . . 24 GLY N . 51534 1 99 . 1 . 1 25 25 ASN H H 1 8.217393391 0.001209501306 . 1 . . . . . 25 ASN H . 51534 1 100 . 1 . 1 25 25 ASN C C 13 175.3789817 0 . 1 . . . . . 25 ASN C . 51534 1 101 . 1 . 1 25 25 ASN CA C 13 52.98682513 0 . 1 . . . . . 25 ASN CA . 51534 1 102 . 1 . 1 25 25 ASN CB C 13 38.57837546 0 . 1 . . . . . 25 ASN CB . 51534 1 103 . 1 . 1 25 25 ASN N N 15 118.5417904 0.00000190735 . 1 . . . . . 25 ASN N . 51534 1 104 . 1 . 1 26 26 SER H H 1 8.22272288 0.002428914111 . 1 . . . . . 26 SER H . 51534 1 105 . 1 . 1 26 26 SER C C 13 174.8420489 0 . 1 . . . . . 26 SER C . 51534 1 106 . 1 . 1 26 26 SER CA C 13 58.64282693 0 . 1 . . . . . 26 SER CA . 51534 1 107 . 1 . 1 26 26 SER CB C 13 63.49961109 0 . 1 . . . . . 26 SER CB . 51534 1 108 . 1 . 1 26 26 SER N N 15 116.3259207 0 . 1 . . . . . 26 SER N . 51534 1 109 . 1 . 1 27 27 THR H H 1 8.048591324 0.0003447994085 . 1 . . . . . 27 THR H . 51534 1 110 . 1 . 1 27 27 THR C C 13 174.3784494 0 . 1 . . . . . 27 THR C . 51534 1 111 . 1 . 1 27 27 THR CA C 13 62.01081889 0 . 1 . . . . . 27 THR CA . 51534 1 112 . 1 . 1 27 27 THR CB C 13 69.34344919 0 . 1 . . . . . 27 THR CB . 51534 1 113 . 1 . 1 27 27 THR N N 15 115.9514328 0 . 1 . . . . . 27 THR N . 51534 1 114 . 1 . 1 28 28 ALA H H 1 8.06619799 0.001469040738 . 1 . . . . . 28 ALA H . 51534 1 115 . 1 . 1 28 28 ALA C C 13 177.5646223 0 . 1 . . . . . 28 ALA C . 51534 1 116 . 1 . 1 28 28 ALA CA C 13 52.62470696 0 . 1 . . . . . 28 ALA CA . 51534 1 117 . 1 . 1 28 28 ALA CB C 13 18.79165046 0 . 1 . . . . . 28 ALA CB . 51534 1 118 . 1 . 1 28 28 ALA N N 15 126.2483305 0.01097581562 . 1 . . . . . 28 ALA N . 51534 1 119 . 1 . 1 29 29 ALA H H 1 8.064422003 0.002561135657 . 1 . . . . . 29 ALA H . 51534 1 120 . 1 . 1 29 29 ALA C C 13 177.650099 0 . 1 . . . . . 29 ALA C . 51534 1 121 . 1 . 1 29 29 ALA CA C 13 52.67650675 0 . 1 . . . . . 29 ALA CA . 51534 1 122 . 1 . 1 29 29 ALA CB C 13 18.75231749 0 . 1 . . . . . 29 ALA CB . 51534 1 123 . 1 . 1 29 29 ALA N N 15 123.124491 0.0437696228 . 1 . . . . . 29 ALA N . 51534 1 124 . 1 . 1 30 30 ALA H H 1 8.019732832 0.001280463104 . 1 . . . . . 30 ALA H . 51534 1 125 . 1 . 1 30 30 ALA C C 13 177.5834772 0 . 1 . . . . . 30 ALA C . 51534 1 126 . 1 . 1 30 30 ALA CA C 13 52.35536928 0 . 1 . . . . . 30 ALA CA . 51534 1 127 . 1 . 1 30 30 ALA CB C 13 18.8540232 0 . 1 . . . . . 30 ALA CB . 51534 1 128 . 1 . 1 30 30 ALA N N 15 123.1182374 0.05460112336 . 1 . . . . . 30 ALA N . 51534 1 129 . 1 . 1 31 31 ALA H H 1 8.07326487 0.002477413197 . 1 . . . . . 31 ALA H . 51534 1 130 . 1 . 1 31 31 ALA C C 13 178.1934863 0 . 1 . . . . . 31 ALA C . 51534 1 131 . 1 . 1 31 31 ALA CA C 13 52.56110879 0 . 1 . . . . . 31 ALA CA . 51534 1 132 . 1 . 1 31 31 ALA CB C 13 18.89394457 0 . 1 . . . . . 31 ALA CB . 51534 1 133 . 1 . 1 31 31 ALA N N 15 123.2159539 0.06619249532 . 1 . . . . . 31 ALA N . 51534 1 134 . 1 . 1 32 32 GLY H H 1 8.165644735 0.001581677659 . 1 . . . . . 32 GLY H . 51534 1 135 . 1 . 1 32 32 GLY C C 13 174.6523498 0 . 1 . . . . . 32 GLY C . 51534 1 136 . 1 . 1 32 32 GLY CA C 13 45.097346 0 . 1 . . . . . 32 GLY CA . 51534 1 137 . 1 . 1 32 32 GLY N N 15 107.909943 0.001912343637 . 1 . . . . . 32 GLY N . 51534 1 138 . 1 . 1 33 33 GLY H H 1 8.070640195 0.0006501872238 . 1 . . . . . 33 GLY H . 51534 1 139 . 1 . 1 33 33 GLY C C 13 173.8927879 0 . 1 . . . . . 33 GLY C . 51534 1 140 . 1 . 1 33 33 GLY CA C 13 45.00183308 0 . 1 . . . . . 33 GLY CA . 51534 1 141 . 1 . 1 33 33 GLY N N 15 108.2784044 0.02561151395 . 1 . . . . . 33 GLY N . 51534 1 142 . 1 . 1 34 34 ASN H H 1 8.235195178 0.002155053202 . 1 . . . . . 34 ASN H . 51534 1 143 . 1 . 1 34 34 ASN C C 13 175.2249609 0 . 1 . . . . . 34 ASN C . 51534 1 144 . 1 . 1 34 34 ASN CA C 13 53.16419916 0 . 1 . . . . . 34 ASN CA . 51534 1 145 . 1 . 1 34 34 ASN CB C 13 38.48576239 0 . 1 . . . . . 34 ASN CB . 51534 1 146 . 1 . 1 34 34 ASN N N 15 118.3718728 0.006502480189 . 1 . . . . . 34 ASN N . 51534 1 147 . 1 . 1 35 35 GLN H H 1 8.253515641 0.002831855821 . 1 . . . . . 35 GLN H . 51534 1 148 . 1 . 1 35 35 GLN C C 13 175.8922377 0 . 1 . . . . . 35 GLN C . 51534 1 149 . 1 . 1 35 35 GLN CA C 13 55.85539356 0 . 1 . . . . . 35 GLN CA . 51534 1 150 . 1 . 1 35 35 GLN CB C 13 28.91919643 0 . 1 . . . . . 35 GLN CB . 51534 1 151 . 1 . 1 35 35 GLN N N 15 120.5082047 0.005517537298 . 1 . . . . . 35 GLN N . 51534 1 152 . 1 . 1 36 36 LYS H H 1 8.189143824 0.001420007617 . 1 . . . . . 36 LYS H . 51534 1 153 . 1 . 1 36 36 LYS C C 13 176.1455522 0 . 1 . . . . . 36 LYS C . 51534 1 154 . 1 . 1 36 36 LYS CA C 13 56.25083817 0 . 1 . . . . . 36 LYS CA . 51534 1 155 . 1 . 1 36 36 LYS CB C 13 32.54335137 0 . 1 . . . . . 36 LYS CB . 51534 1 156 . 1 . 1 36 36 LYS N N 15 121.9979398 0.005517537628 . 1 . . . . . 36 LYS N . 51534 1 157 . 1 . 1 37 37 ASN H H 1 8.257239574 0.0009925209169 . 1 . . . . . 37 ASN H . 51534 1 158 . 1 . 1 37 37 ASN C C 13 174.6510963 0 . 1 . . . . . 37 ASN C . 51534 1 159 . 1 . 1 37 37 ASN CA C 13 53.01945404 0 . 1 . . . . . 37 ASN CA . 51534 1 160 . 1 . 1 37 37 ASN CB C 13 38.6768316 0 . 1 . . . . . 37 ASN CB . 51534 1 161 . 1 . 1 37 37 ASN N N 15 119.2900908 0 . 1 . . . . . 37 ASN N . 51534 1 162 . 1 . 1 38 38 SER H H 1 8.046792656 0.001192768823 . 1 . . . . . 38 SER H . 51534 1 163 . 1 . 1 38 38 SER C C 13 172.7667824 0 . 1 . . . . . 38 SER C . 51534 1 164 . 1 . 1 38 38 SER CA C 13 56.29351095 0 . 1 . . . . . 38 SER CA . 51534 1 165 . 1 . 1 38 38 SER CB C 13 63.16613348 0 . 1 . . . . . 38 SER CB . 51534 1 166 . 1 . 1 38 38 SER N N 15 116.9727251 0.00000190735 . 1 . . . . . 38 SER N . 51534 1 167 . 1 . 1 39 39 PRO C C 13 176.4006596 0 . 1 . . . . . 39 PRO C . 51534 1 168 . 1 . 1 39 39 PRO CA C 13 63.27557998 0 . 1 . . . . . 39 PRO CA . 51534 1 169 . 1 . 1 39 39 PRO CB C 13 31.71525231 0 . 1 . . . . . 39 PRO CB . 51534 1 170 . 1 . 1 40 40 ASP H H 1 8.142741892 0.001232625345 . 1 . . . . . 40 ASP H . 51534 1 171 . 1 . 1 40 40 ASP C C 13 175.8428681 0 . 1 . . . . . 40 ASP C . 51534 1 172 . 1 . 1 40 40 ASP CA C 13 54.22786313 0 . 1 . . . . . 40 ASP CA . 51534 1 173 . 1 . 1 40 40 ASP CB C 13 40.67974236 0 . 1 . . . . . 40 ASP CB . 51534 1 174 . 1 . 1 40 40 ASP N N 15 119.6174524 0.006131032072 . 1 . . . . . 40 ASP N . 51534 1 175 . 1 . 1 41 41 ARG H H 1 7.935413506 0.001029205923 . 1 . . . . . 41 ARG H . 51534 1 176 . 1 . 1 41 41 ARG C C 13 175.8507243 0 . 1 . . . . . 41 ARG C . 51534 1 177 . 1 . 1 41 41 ARG CA C 13 55.65798612 0 . 1 . . . . . 41 ARG CA . 51534 1 178 . 1 . 1 41 41 ARG CB C 13 30.64849072 0 . 1 . . . . . 41 ARG CB . 51534 1 179 . 1 . 1 41 41 ARG N N 15 120.890743 0.01813526157 . 1 . . . . . 41 ARG N . 51534 1 180 . 1 . 1 42 42 VAL H H 1 8.04457101 0.001700214045 . 1 . . . . . 42 VAL H . 51534 1 181 . 1 . 1 42 42 VAL C C 13 175.1475927 0 . 1 . . . . . 42 VAL C . 51534 1 182 . 1 . 1 42 42 VAL CA C 13 62.3708083 0 . 1 . . . . . 42 VAL CA . 51534 1 183 . 1 . 1 42 42 VAL CB C 13 32.19535843 0 . 1 . . . . . 42 VAL CB . 51534 1 184 . 1 . 1 42 42 VAL N N 15 122.1509933 0.01307907677 . 1 . . . . . 42 VAL N . 51534 1 185 . 1 . 1 43 43 LYS H H 1 7.806118272 0.002505073866 . 1 . . . . . 43 LYS H . 51534 1 186 . 1 . 1 43 43 LYS C C 13 172.9832043 0 . 1 . . . . . 43 LYS C . 51534 1 187 . 1 . 1 43 43 LYS CA C 13 57.55508804 0 . 1 . . . . . 43 LYS CA . 51534 1 188 . 1 . 1 43 43 LYS CB C 13 33.39199195 0 . 1 . . . . . 43 LYS CB . 51534 1 189 . 1 . 1 43 43 LYS N N 15 129.9597978 0.003269307392 . 1 . . . . . 43 LYS N . 51534 1 stop_ save_