################################### # 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25774 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 $chemical_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 1 '2D 1H-15N HSQC' . . . 25774 1 2 '3D CBCA(CO)NH' . . . 25774 1 3 '3D HNCACB' . . . 25774 1 4 '2D 1H-13C HSQC' . . . 25774 1 5 '3D 1H-15N NOESY' . . . 25774 1 6 '3D 1H-13C NOESY aromatic' . . . 25774 1 7 '3D 1H-13C NOESY aliphatic' . . . 25774 1 8 '3D HNCO' . . . 25774 1 9 '4D HCC(CO)NH-TOCSY' . . . 25774 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 1 1 GLY HA2 H 1 3.845 0.02 . 2 . . . . A 1 GLY HA2 . 25774 1 2 . 1 . 1 1 1 GLY HA3 H 1 3.794 0.02 . 2 . . . . A 1 GLY HA3 . 25774 1 3 . 1 . 1 1 1 GLY CA C 13 43.323 0.3 . 1 . . . . A 1 GLY CA . 25774 1 4 . 1 . 1 2 2 TYR HA H 1 4.663 0.02 . 1 . . . . A 2 TYR HA . 25774 1 5 . 1 . 1 2 2 TYR HB2 H 1 3.000 0.02 . 2 . . . . A 2 TYR HB2 . 25774 1 6 . 1 . 1 2 2 TYR HB3 H 1 3.000 0.02 . 2 . . . . A 2 TYR HB3 . 25774 1 7 . 1 . 1 2 2 TYR HD1 H 1 7.116 0.02 . 3 . . . . A 2 TYR HD1 . 25774 1 8 . 1 . 1 2 2 TYR HD2 H 1 7.116 0.02 . 3 . . . . A 2 TYR HD2 . 25774 1 9 . 1 . 1 2 2 TYR HE1 H 1 6.819 0.02 . 3 . . . . A 2 TYR HE1 . 25774 1 10 . 1 . 1 2 2 TYR HE2 H 1 6.819 0.02 . 3 . . . . A 2 TYR HE2 . 25774 1 11 . 1 . 1 2 2 TYR C C 13 174.244 0.3 . 1 . . . . A 2 TYR C . 25774 1 12 . 1 . 1 2 2 TYR CA C 13 58.213 0.3 . 1 . . . . A 2 TYR CA . 25774 1 13 . 1 . 1 2 2 TYR CB C 13 38.908 0.3 . 1 . . . . A 2 TYR CB . 25774 1 14 . 1 . 1 2 2 TYR CD1 C 13 133.206 0.3 . 1 . . . . A 2 TYR CD1 . 25774 1 15 . 1 . 1 2 2 TYR CD2 C 13 133.206 0.3 . 1 . . . . A 2 TYR CD2 . 25774 1 16 . 1 . 1 2 2 TYR CE1 C 13 118.415 0.3 . 1 . . . . A 2 TYR CE1 . 25774 1 17 . 1 . 1 2 2 TYR CE2 C 13 118.415 0.3 . 1 . . . . A 2 TYR CE2 . 25774 1 18 . 1 . 1 3 3 CYS H H 1 7.731 0.02 . 1 . . . . A 3 CYS H . 25774 1 19 . 1 . 1 3 3 CYS HA H 1 4.654 0.02 . 1 . . . . A 3 CYS HA . 25774 1 20 . 1 . 1 3 3 CYS HB2 H 1 2.894 0.02 . 2 . . . . A 3 CYS HB2 . 25774 1 21 . 1 . 1 3 3 CYS HB3 H 1 2.788 0.02 . 2 . . . . A 3 CYS HB3 . 25774 1 22 . 1 . 1 3 3 CYS C C 13 171.612 0.3 . 1 . . . . A 3 CYS C . 25774 1 23 . 1 . 1 3 3 CYS CA C 13 53.192 0.3 . 1 . . . . A 3 CYS CA . 25774 1 24 . 1 . 1 3 3 CYS CB C 13 43.550 0.3 . 1 . . . . A 3 CYS CB . 25774 1 25 . 1 . 1 3 3 CYS N N 15 117.243 0.2 . 1 . . . . A 3 CYS N . 25774 1 26 . 1 . 1 4 4 ALA H H 1 8.741 0.02 . 1 . . . . A 4 ALA H . 25774 1 27 . 1 . 1 4 4 ALA HA H 1 4.350 0.02 . 1 . . . . A 4 ALA HA . 25774 1 28 . 1 . 1 4 4 ALA HB1 H 1 1.209 0.02 . 1 . . . . A 4 ALA HB1 . 25774 1 29 . 1 . 1 4 4 ALA HB2 H 1 1.209 0.02 . 1 . . . . A 4 ALA HB2 . 25774 1 30 . 1 . 1 4 4 ALA HB3 H 1 1.209 0.02 . 1 . . . . A 4 ALA HB3 . 25774 1 31 . 1 . 1 4 4 ALA C C 13 174.551 0.3 . 1 . . . . A 4 ALA C . 25774 1 32 . 1 . 1 4 4 ALA CA C 13 51.686 0.3 . 1 . . . . A 4 ALA CA . 25774 1 33 . 1 . 1 4 4 ALA CB C 13 20.708 0.3 . 1 . . . . A 4 ALA CB . 25774 1 34 . 1 . 1 4 4 ALA N N 15 124.308 0.2 . 1 . . . . A 4 ALA N . 25774 1 35 . 1 . 1 5 5 GLU H H 1 7.485 0.02 . 1 . . . . A 5 GLU H . 25774 1 36 . 1 . 1 5 5 GLU HA H 1 4.059 0.02 . 1 . . . . A 5 GLU HA . 25774 1 37 . 1 . 1 5 5 GLU HB2 H 1 2.232 0.02 . 2 . . . . A 5 GLU HB2 . 25774 1 38 . 1 . 1 5 5 GLU HB3 H 1 1.751 0.02 . 2 . . . . A 5 GLU HB3 . 25774 1 39 . 1 . 1 5 5 GLU HG2 H 1 2.383 0.02 . 2 . . . . A 5 GLU HG2 . 25774 1 40 . 1 . 1 5 5 GLU HG3 H 1 2.300 0.02 . 2 . . . . A 5 GLU HG3 . 25774 1 41 . 1 . 1 5 5 GLU C C 13 174.552 0.3 . 1 . . . . A 5 GLU C . 25774 1 42 . 1 . 1 5 5 GLU CA C 13 55.118 0.3 . 1 . . . . A 5 GLU CA . 25774 1 43 . 1 . 1 5 5 GLU CB C 13 30.822 0.3 . 1 . . . . A 5 GLU CB . 25774 1 44 . 1 . 1 5 5 GLU CG C 13 36.918 0.3 . 1 . . . . A 5 GLU CG . 25774 1 45 . 1 . 1 5 5 GLU N N 15 122.139 0.2 . 1 . . . . A 5 GLU N . 25774 1 46 . 1 . 1 6 6 LYS H H 1 8.305 0.02 . 1 . . . . A 6 LYS H . 25774 1 47 . 1 . 1 6 6 LYS HA H 1 3.579 0.02 . 1 . . . . A 6 LYS HA . 25774 1 48 . 1 . 1 6 6 LYS HB2 H 1 1.746 0.02 . 2 . . . . A 6 LYS HB2 . 25774 1 49 . 1 . 1 6 6 LYS HB3 H 1 1.746 0.02 . 2 . . . . A 6 LYS HB3 . 25774 1 50 . 1 . 1 6 6 LYS HG2 H 1 1.422 0.02 . 2 . . . . A 6 LYS HG2 . 25774 1 51 . 1 . 1 6 6 LYS HG3 H 1 1.422 0.02 . 2 . . . . A 6 LYS HG3 . 25774 1 52 . 1 . 1 6 6 LYS HD2 H 1 1.768 0.02 . 2 . . . . A 6 LYS HD2 . 25774 1 53 . 1 . 1 6 6 LYS HD3 H 1 1.650 0.02 . 2 . . . . A 6 LYS HD3 . 25774 1 54 . 1 . 1 6 6 LYS HE2 H 1 2.980 0.02 . 2 . . . . A 6 LYS HE2 . 25774 1 55 . 1 . 1 6 6 LYS HE3 H 1 2.980 0.02 . 2 . . . . A 6 LYS HE3 . 25774 1 56 . 1 . 1 6 6 LYS C C 13 177.718 0.3 . 1 . . . . A 6 LYS C . 25774 1 57 . 1 . 1 6 6 LYS CA C 13 58.722 0.3 . 1 . . . . A 6 LYS CA . 25774 1 58 . 1 . 1 6 6 LYS CB C 13 32.151 0.3 . 1 . . . . A 6 LYS CB . 25774 1 59 . 1 . 1 6 6 LYS CG C 13 24.616 0.3 . 1 . . . . A 6 LYS CG . 25774 1 60 . 1 . 1 6 6 LYS CD C 13 29.599 0.3 . 1 . . . . A 6 LYS CD . 25774 1 61 . 1 . 1 6 6 LYS CE C 13 41.865 0.3 . 1 . . . . A 6 LYS CE . 25774 1 62 . 1 . 1 6 6 LYS N N 15 118.547 0.2 . 1 . . . . A 6 LYS N . 25774 1 63 . 1 . 1 7 7 GLY H H 1 9.325 0.02 . 1 . . . . A 7 GLY H . 25774 1 64 . 1 . 1 7 7 GLY HA2 H 1 4.230 0.02 . 2 . . . . A 7 GLY HA2 . 25774 1 65 . 1 . 1 7 7 GLY HA3 H 1 3.436 0.02 . 2 . . . . A 7 GLY HA3 . 25774 1 66 . 1 . 1 7 7 GLY C C 13 173.076 0.3 . 1 . . . . A 7 GLY C . 25774 1 67 . 1 . 1 7 7 GLY CA C 13 45.337 0.3 . 1 . . . . A 7 GLY CA . 25774 1 68 . 1 . 1 7 7 GLY N N 15 112.594 0.2 . 1 . . . . A 7 GLY N . 25774 1 69 . 1 . 1 8 8 ILE H H 1 7.891 0.02 . 1 . . . . A 8 ILE H . 25774 1 70 . 1 . 1 8 8 ILE HA H 1 4.273 0.02 . 1 . . . . A 8 ILE HA . 25774 1 71 . 1 . 1 8 8 ILE HB H 1 2.357 0.02 . 1 . . . . A 8 ILE HB . 25774 1 72 . 1 . 1 8 8 ILE HG12 H 1 1.324 0.02 . 2 . . . . A 8 ILE HG12 . 25774 1 73 . 1 . 1 8 8 ILE HG13 H 1 1.206 0.02 . 2 . . . . A 8 ILE HG13 . 25774 1 74 . 1 . 1 8 8 ILE HG21 H 1 1.170 0.02 . 1 . . . . A 8 ILE HG21 . 25774 1 75 . 1 . 1 8 8 ILE HG22 H 1 1.170 0.02 . 1 . . . . A 8 ILE HG22 . 25774 1 76 . 1 . 1 8 8 ILE HG23 H 1 1.170 0.02 . 1 . . . . A 8 ILE HG23 . 25774 1 77 . 1 . 1 8 8 ILE HD11 H 1 0.741 0.02 . 1 . . . . A 8 ILE HD11 . 25774 1 78 . 1 . 1 8 8 ILE HD12 H 1 0.741 0.02 . 1 . . . . A 8 ILE HD12 . 25774 1 79 . 1 . 1 8 8 ILE HD13 H 1 0.741 0.02 . 1 . . . . A 8 ILE HD13 . 25774 1 80 . 1 . 1 8 8 ILE C C 13 175.536 0.3 . 1 . . . . A 8 ILE C . 25774 1 81 . 1 . 1 8 8 ILE CA C 13 57.706 0.3 . 1 . . . . A 8 ILE CA . 25774 1 82 . 1 . 1 8 8 ILE CB C 13 35.159 0.3 . 1 . . . . A 8 ILE CB . 25774 1 83 . 1 . 1 8 8 ILE CG1 C 13 27.171 0.3 . 1 . . . . A 8 ILE CG1 . 25774 1 84 . 1 . 1 8 8 ILE CG2 C 13 17.152 0.3 . 1 . . . . A 8 ILE CG2 . 25774 1 85 . 1 . 1 8 8 ILE CD1 C 13 9.168 0.3 . 1 . . . . A 8 ILE CD1 . 25774 1 86 . 1 . 1 8 8 ILE N N 15 123.445 0.2 . 1 . . . . A 8 ILE N . 25774 1 87 . 1 . 1 9 9 LYS H H 1 8.048 0.02 . 1 . . . . A 9 LYS H . 25774 1 88 . 1 . 1 9 9 LYS HA H 1 4.893 0.02 . 1 . . . . A 9 LYS HA . 25774 1 89 . 1 . 1 9 9 LYS HB2 H 1 2.298 0.02 . 2 . . . . A 9 LYS HB2 . 25774 1 90 . 1 . 1 9 9 LYS HB3 H 1 1.963 0.02 . 2 . . . . A 9 LYS HB3 . 25774 1 91 . 1 . 1 9 9 LYS HG2 H 1 1.801 0.02 . 2 . . . . A 9 LYS HG2 . 25774 1 92 . 1 . 1 9 9 LYS HG3 H 1 1.596 0.02 . 2 . . . . A 9 LYS HG3 . 25774 1 93 . 1 . 1 9 9 LYS HD2 H 1 1.838 0.02 . 2 . . . . A 9 LYS HD2 . 25774 1 94 . 1 . 1 9 9 LYS HD3 H 1 1.809 0.02 . 2 . . . . A 9 LYS HD3 . 25774 1 95 . 1 . 1 9 9 LYS HE2 H 1 3.043 0.02 . 2 . . . . A 9 LYS HE2 . 25774 1 96 . 1 . 1 9 9 LYS HE3 H 1 3.043 0.02 . 2 . . . . A 9 LYS HE3 . 25774 1 97 . 1 . 1 9 9 LYS C C 13 177.569 0.3 . 1 . . . . A 9 LYS C . 25774 1 98 . 1 . 1 9 9 LYS CA C 13 57.835 0.3 . 1 . . . . A 9 LYS CA . 25774 1 99 . 1 . 1 9 9 LYS CB C 13 33.578 0.3 . 1 . . . . A 9 LYS CB . 25774 1 100 . 1 . 1 9 9 LYS CG C 13 25.964 0.3 . 1 . . . . A 9 LYS CG . 25774 1 101 . 1 . 1 9 9 LYS CD C 13 29.699 0.3 . 1 . . . . A 9 LYS CD . 25774 1 102 . 1 . 1 9 9 LYS CE C 13 42.220 0.3 . 1 . . . . A 9 LYS CE . 25774 1 103 . 1 . 1 9 9 LYS N N 15 124.612 0.2 . 1 . . . . A 9 LYS N . 25774 1 104 . 1 . 1 10 10 CYS H H 1 7.932 0.02 . 1 . . . . A 10 CYS H . 25774 1 105 . 1 . 1 10 10 CYS HA H 1 5.239 0.02 . 1 . . . . A 10 CYS HA . 25774 1 106 . 1 . 1 10 10 CYS HB2 H 1 3.741 0.02 . 2 . . . . A 10 CYS HB2 . 25774 1 107 . 1 . 1 10 10 CYS HB3 H 1 3.058 0.02 . 2 . . . . A 10 CYS HB3 . 25774 1 108 . 1 . 1 10 10 CYS C C 13 173.923 0.3 . 1 . . . . A 10 CYS C . 25774 1 109 . 1 . 1 10 10 CYS CA C 13 55.007 0.3 . 1 . . . . A 10 CYS CA . 25774 1 110 . 1 . 1 10 10 CYS CB C 13 44.349 0.3 . 1 . . . . A 10 CYS CB . 25774 1 111 . 1 . 1 10 10 CYS N N 15 113.935 0.2 . 1 . . . . A 10 CYS N . 25774 1 112 . 1 . 1 11 11 HIS H H 1 8.308 0.02 . 1 . . . . A 11 HIS H . 25774 1 113 . 1 . 1 11 11 HIS HA H 1 4.377 0.02 . 1 . . . . A 11 HIS HA . 25774 1 114 . 1 . 1 11 11 HIS HB2 H 1 3.104 0.02 . 2 . . . . A 11 HIS HB2 . 25774 1 115 . 1 . 1 11 11 HIS HB3 H 1 3.061 0.02 . 2 . . . . A 11 HIS HB3 . 25774 1 116 . 1 . 1 11 11 HIS HD2 H 1 7.041 0.02 . 1 . . . . A 11 HIS HD2 . 25774 1 117 . 1 . 1 11 11 HIS HE1 H 1 7.823 0.02 . 1 . . . . A 11 HIS HE1 . 25774 1 118 . 1 . 1 11 11 HIS C C 13 176.326 0.3 . 1 . . . . A 11 HIS C . 25774 1 119 . 1 . 1 11 11 HIS CA C 13 58.730 0.3 . 1 . . . . A 11 HIS CA . 25774 1 120 . 1 . 1 11 11 HIS CB C 13 29.516 0.3 . 1 . . . . A 11 HIS CB . 25774 1 121 . 1 . 1 11 11 HIS CD2 C 13 120.512 0.3 . 1 . . . . A 11 HIS CD2 . 25774 1 122 . 1 . 1 11 11 HIS CE1 C 13 139.454 0.3 . 1 . . . . A 11 HIS CE1 . 25774 1 123 . 1 . 1 11 11 HIS N N 15 119.702 0.2 . 1 . . . . A 11 HIS N . 25774 1 124 . 1 . 1 12 12 ASN H H 1 7.848 0.02 . 1 . . . . A 12 ASN H . 25774 1 125 . 1 . 1 12 12 ASN HA H 1 4.695 0.02 . 1 . . . . A 12 ASN HA . 25774 1 126 . 1 . 1 12 12 ASN HB2 H 1 2.760 0.02 . 2 . . . . A 12 ASN HB2 . 25774 1 127 . 1 . 1 12 12 ASN HB3 H 1 2.628 0.02 . 2 . . . . A 12 ASN HB3 . 25774 1 128 . 1 . 1 12 12 ASN HD21 H 1 7.460 0.02 . 2 . . . . A 12 ASN HD21 . 25774 1 129 . 1 . 1 12 12 ASN HD22 H 1 6.701 0.02 . 2 . . . . A 12 ASN HD22 . 25774 1 130 . 1 . 1 12 12 ASN C C 13 173.674 0.3 . 1 . . . . A 12 ASN C . 25774 1 131 . 1 . 1 12 12 ASN CA C 13 52.527 0.3 . 1 . . . . A 12 ASN CA . 25774 1 132 . 1 . 1 12 12 ASN CB C 13 38.942 0.3 . 1 . . . . A 12 ASN CB . 25774 1 133 . 1 . 1 12 12 ASN N N 15 115.611 0.2 . 1 . . . . A 12 ASN N . 25774 1 134 . 1 . 1 12 12 ASN ND2 N 15 110.848 0.2 . 1 . . . . A 12 ASN ND2 . 25774 1 135 . 1 . 1 13 13 ILE H H 1 7.054 0.02 . 1 . . . . A 13 ILE H . 25774 1 136 . 1 . 1 13 13 ILE HA H 1 4.261 0.02 . 1 . . . . A 13 ILE HA . 25774 1 137 . 1 . 1 13 13 ILE HB H 1 1.708 0.02 . 1 . . . . A 13 ILE HB . 25774 1 138 . 1 . 1 13 13 ILE HG12 H 1 1.416 0.02 . 2 . . . . A 13 ILE HG12 . 25774 1 139 . 1 . 1 13 13 ILE HG13 H 1 1.140 0.02 . 2 . . . . A 13 ILE HG13 . 25774 1 140 . 1 . 1 13 13 ILE HG21 H 1 0.800 0.02 . 1 . . . . A 13 ILE HG21 . 25774 1 141 . 1 . 1 13 13 ILE HG22 H 1 0.800 0.02 . 1 . . . . A 13 ILE HG22 . 25774 1 142 . 1 . 1 13 13 ILE HG23 H 1 0.800 0.02 . 1 . . . . A 13 ILE HG23 . 25774 1 143 . 1 . 1 13 13 ILE HD11 H 1 0.729 0.02 . 1 . . . . A 13 ILE HD11 . 25774 1 144 . 1 . 1 13 13 ILE HD12 H 1 0.729 0.02 . 1 . . . . A 13 ILE HD12 . 25774 1 145 . 1 . 1 13 13 ILE HD13 H 1 0.729 0.02 . 1 . . . . A 13 ILE HD13 . 25774 1 146 . 1 . 1 13 13 ILE C C 13 172.744 0.3 . 1 . . . . A 13 ILE C . 25774 1 147 . 1 . 1 13 13 ILE CA C 13 59.618 0.3 . 1 . . . . A 13 ILE CA . 25774 1 148 . 1 . 1 13 13 ILE CB C 13 40.504 0.3 . 1 . . . . A 13 ILE CB . 25774 1 149 . 1 . 1 13 13 ILE CG1 C 13 27.375 0.3 . 1 . . . . A 13 ILE CG1 . 25774 1 150 . 1 . 1 13 13 ILE CG2 C 13 17.263 0.3 . 1 . . . . A 13 ILE CG2 . 25774 1 151 . 1 . 1 13 13 ILE CD1 C 13 13.771 0.3 . 1 . . . . A 13 ILE CD1 . 25774 1 152 . 1 . 1 13 13 ILE N N 15 118.184 0.2 . 1 . . . . A 13 ILE N . 25774 1 153 . 1 . 1 14 14 HIS H H 1 8.013 0.02 . 1 . . . . A 14 HIS H . 25774 1 154 . 1 . 1 14 14 HIS HA H 1 4.717 0.02 . 1 . . . . A 14 HIS HA . 25774 1 155 . 1 . 1 14 14 HIS HB2 H 1 3.193 0.02 . 2 . . . . A 14 HIS HB2 . 25774 1 156 . 1 . 1 14 14 HIS HB3 H 1 3.193 0.02 . 2 . . . . A 14 HIS HB3 . 25774 1 157 . 1 . 1 14 14 HIS HD2 H 1 7.230 0.02 . 1 . . . . A 14 HIS HD2 . 25774 1 158 . 1 . 1 14 14 HIS HE1 H 1 8.332 0.02 . 1 . . . . A 14 HIS HE1 . 25774 1 159 . 1 . 1 14 14 HIS C C 13 175.954 0.3 . 1 . . . . A 14 HIS C . 25774 1 160 . 1 . 1 14 14 HIS CA C 13 54.895 0.3 . 1 . . . . A 14 HIS CA . 25774 1 161 . 1 . 1 14 14 HIS CB C 13 29.829 0.3 . 1 . . . . A 14 HIS CB . 25774 1 162 . 1 . 1 14 14 HIS CD2 C 13 119.802 0.3 . 1 . . . . A 14 HIS CD2 . 25774 1 163 . 1 . 1 14 14 HIS CE1 C 13 137.186 0.3 . 1 . . . . A 14 HIS CE1 . 25774 1 164 . 1 . 1 14 14 HIS N N 15 120.609 0.2 . 1 . . . . A 14 HIS N . 25774 1 165 . 1 . 1 15 15 CYS H H 1 9.081 0.02 . 1 . . . . A 15 CYS H . 25774 1 166 . 1 . 1 15 15 CYS HA H 1 5.127 0.02 . 1 . . . . A 15 CYS HA . 25774 1 167 . 1 . 1 15 15 CYS HB2 H 1 3.113 0.02 . 2 . . . . A 15 CYS HB2 . 25774 1 168 . 1 . 1 15 15 CYS HB3 H 1 2.524 0.02 . 2 . . . . A 15 CYS HB3 . 25774 1 169 . 1 . 1 15 15 CYS C C 13 176.395 0.3 . 1 . . . . A 15 CYS C . 25774 1 170 . 1 . 1 15 15 CYS CA C 13 55.568 0.3 . 1 . . . . A 15 CYS CA . 25774 1 171 . 1 . 1 15 15 CYS CB C 13 40.338 0.3 . 1 . . . . A 15 CYS CB . 25774 1 172 . 1 . 1 15 15 CYS N N 15 119.563 0.2 . 1 . . . . A 15 CYS N . 25774 1 173 . 1 . 1 16 16 CYS H H 1 9.281 0.02 . 1 . . . . A 16 CYS H . 25774 1 174 . 1 . 1 16 16 CYS HA H 1 4.522 0.02 . 1 . . . . A 16 CYS HA . 25774 1 175 . 1 . 1 16 16 CYS HB2 H 1 3.386 0.02 . 2 . . . . A 16 CYS HB2 . 25774 1 176 . 1 . 1 16 16 CYS HB3 H 1 2.423 0.02 . 2 . . . . A 16 CYS HB3 . 25774 1 177 . 1 . 1 16 16 CYS C C 13 172.736 0.3 . 1 . . . . A 16 CYS C . 25774 1 178 . 1 . 1 16 16 CYS CA C 13 54.177 0.3 . 1 . . . . A 16 CYS CA . 25774 1 179 . 1 . 1 16 16 CYS CB C 13 40.089 0.3 . 1 . . . . A 16 CYS CB . 25774 1 180 . 1 . 1 16 16 CYS N N 15 121.881 0.2 . 1 . . . . A 16 CYS N . 25774 1 181 . 1 . 1 17 17 SER H H 1 8.285 0.02 . 1 . . . . A 17 SER H . 25774 1 182 . 1 . 1 17 17 SER HA H 1 4.172 0.02 . 1 . . . . A 17 SER HA . 25774 1 183 . 1 . 1 17 17 SER HB2 H 1 3.838 0.02 . 2 . . . . A 17 SER HB2 . 25774 1 184 . 1 . 1 17 17 SER HB3 H 1 3.838 0.02 . 2 . . . . A 17 SER HB3 . 25774 1 185 . 1 . 1 17 17 SER C C 13 175.157 0.3 . 1 . . . . A 17 SER C . 25774 1 186 . 1 . 1 17 17 SER CA C 13 60.333 0.3 . 1 . . . . A 17 SER CA . 25774 1 187 . 1 . 1 17 17 SER CB C 13 63.147 0.3 . 1 . . . . A 17 SER CB . 25774 1 188 . 1 . 1 17 17 SER N N 15 113.412 0.2 . 1 . . . . A 17 SER N . 25774 1 189 . 1 . 1 18 18 GLY H H 1 8.859 0.02 . 1 . . . . A 18 GLY H . 25774 1 190 . 1 . 1 18 18 GLY HA2 H 1 4.267 0.02 . 2 . . . . A 18 GLY HA2 . 25774 1 191 . 1 . 1 18 18 GLY HA3 H 1 3.676 0.02 . 2 . . . . A 18 GLY HA3 . 25774 1 192 . 1 . 1 18 18 GLY C C 13 173.845 0.3 . 1 . . . . A 18 GLY C . 25774 1 193 . 1 . 1 18 18 GLY CA C 13 44.973 0.3 . 1 . . . . A 18 GLY CA . 25774 1 194 . 1 . 1 18 18 GLY N N 15 113.633 0.2 . 1 . . . . A 18 GLY N . 25774 1 195 . 1 . 1 19 19 LEU H H 1 7.740 0.02 . 1 . . . . A 19 LEU H . 25774 1 196 . 1 . 1 19 19 LEU HA H 1 4.835 0.02 . 1 . . . . A 19 LEU HA . 25774 1 197 . 1 . 1 19 19 LEU HB2 H 1 2.099 0.02 . 2 . . . . A 19 LEU HB2 . 25774 1 198 . 1 . 1 19 19 LEU HB3 H 1 1.156 0.02 . 2 . . . . A 19 LEU HB3 . 25774 1 199 . 1 . 1 19 19 LEU HG H 1 1.402 0.02 . 1 . . . . A 19 LEU HG . 25774 1 200 . 1 . 1 19 19 LEU HD11 H 1 0.789 0.02 . 2 . . . . A 19 LEU HD11 . 25774 1 201 . 1 . 1 19 19 LEU HD12 H 1 0.789 0.02 . 2 . . . . A 19 LEU HD12 . 25774 1 202 . 1 . 1 19 19 LEU HD13 H 1 0.789 0.02 . 2 . . . . A 19 LEU HD13 . 25774 1 203 . 1 . 1 19 19 LEU HD21 H 1 0.680 0.02 . 2 . . . . A 19 LEU HD21 . 25774 1 204 . 1 . 1 19 19 LEU HD22 H 1 0.680 0.02 . 2 . . . . A 19 LEU HD22 . 25774 1 205 . 1 . 1 19 19 LEU HD23 H 1 0.680 0.02 . 2 . . . . A 19 LEU HD23 . 25774 1 206 . 1 . 1 19 19 LEU C C 13 175.853 0.3 . 1 . . . . A 19 LEU C . 25774 1 207 . 1 . 1 19 19 LEU CA C 13 53.244 0.3 . 1 . . . . A 19 LEU CA . 25774 1 208 . 1 . 1 19 19 LEU CB C 13 44.962 0.3 . 1 . . . . A 19 LEU CB . 25774 1 209 . 1 . 1 19 19 LEU CG C 13 26.728 0.3 . 1 . . . . A 19 LEU CG . 25774 1 210 . 1 . 1 19 19 LEU CD1 C 13 26.600 0.3 . 2 . . . . A 19 LEU CD1 . 25774 1 211 . 1 . 1 19 19 LEU CD2 C 13 23.218 0.3 . 2 . . . . A 19 LEU CD2 . 25774 1 212 . 1 . 1 19 19 LEU N N 15 120.281 0.2 . 1 . . . . A 19 LEU N . 25774 1 213 . 1 . 1 20 20 THR H H 1 9.200 0.02 . 1 . . . . A 20 THR H . 25774 1 214 . 1 . 1 20 20 THR HA H 1 4.466 0.02 . 1 . . . . A 20 THR HA . 25774 1 215 . 1 . 1 20 20 THR HB H 1 3.850 0.02 . 1 . . . . A 20 THR HB . 25774 1 216 . 1 . 1 20 20 THR HG21 H 1 1.133 0.02 . 1 . . . . A 20 THR HG21 . 25774 1 217 . 1 . 1 20 20 THR HG22 H 1 1.133 0.02 . 1 . . . . A 20 THR HG22 . 25774 1 218 . 1 . 1 20 20 THR HG23 H 1 1.133 0.02 . 1 . . . . A 20 THR HG23 . 25774 1 219 . 1 . 1 20 20 THR C C 13 172.641 0.3 . 1 . . . . A 20 THR C . 25774 1 220 . 1 . 1 20 20 THR CA C 13 61.354 0.3 . 1 . . . . A 20 THR CA . 25774 1 221 . 1 . 1 20 20 THR CB C 13 71.582 0.3 . 1 . . . . A 20 THR CB . 25774 1 222 . 1 . 1 20 20 THR CG2 C 13 21.438 0.3 . 1 . . . . A 20 THR CG2 . 25774 1 223 . 1 . 1 20 20 THR N N 15 115.828 0.2 . 1 . . . . A 20 THR N . 25774 1 224 . 1 . 1 21 21 CYS H H 1 9.090 0.02 . 1 . . . . A 21 CYS H . 25774 1 225 . 1 . 1 21 21 CYS HA H 1 4.649 0.02 . 1 . . . . A 21 CYS HA . 25774 1 226 . 1 . 1 21 21 CYS HB2 H 1 3.378 0.02 . 2 . . . . A 21 CYS HB2 . 25774 1 227 . 1 . 1 21 21 CYS HB3 H 1 2.988 0.02 . 2 . . . . A 21 CYS HB3 . 25774 1 228 . 1 . 1 21 21 CYS C C 13 173.243 0.3 . 1 . . . . A 21 CYS C . 25774 1 229 . 1 . 1 21 21 CYS CA C 13 55.419 0.3 . 1 . . . . A 21 CYS CA . 25774 1 230 . 1 . 1 21 21 CYS CB C 13 38.426 0.3 . 1 . . . . A 21 CYS CB . 25774 1 231 . 1 . 1 21 21 CYS N N 15 126.487 0.2 . 1 . . . . A 21 CYS N . 25774 1 232 . 1 . 1 22 22 LYS H H 1 8.597 0.02 . 1 . . . . A 22 LYS H . 25774 1 233 . 1 . 1 22 22 LYS HA H 1 4.690 0.02 . 1 . . . . A 22 LYS HA . 25774 1 234 . 1 . 1 22 22 LYS HB2 H 1 1.823 0.02 . 2 . . . . A 22 LYS HB2 . 25774 1 235 . 1 . 1 22 22 LYS HB3 H 1 1.737 0.02 . 2 . . . . A 22 LYS HB3 . 25774 1 236 . 1 . 1 22 22 LYS HG2 H 1 1.410 0.02 . 2 . . . . A 22 LYS HG2 . 25774 1 237 . 1 . 1 22 22 LYS HG3 H 1 1.316 0.02 . 2 . . . . A 22 LYS HG3 . 25774 1 238 . 1 . 1 22 22 LYS HD2 H 1 1.673 0.02 . 2 . . . . A 22 LYS HD2 . 25774 1 239 . 1 . 1 22 22 LYS HD3 H 1 1.581 0.02 . 2 . . . . A 22 LYS HD3 . 25774 1 240 . 1 . 1 22 22 LYS HE2 H 1 2.896 0.02 . 2 . . . . A 22 LYS HE2 . 25774 1 241 . 1 . 1 22 22 LYS HE3 H 1 2.857 0.02 . 2 . . . . A 22 LYS HE3 . 25774 1 242 . 1 . 1 22 22 LYS C C 13 176.568 0.3 . 1 . . . . A 22 LYS C . 25774 1 243 . 1 . 1 22 22 LYS CA C 13 55.210 0.3 . 1 . . . . A 22 LYS CA . 25774 1 244 . 1 . 1 22 22 LYS CB C 13 34.223 0.3 . 1 . . . . A 22 LYS CB . 25774 1 245 . 1 . 1 22 22 LYS CG C 13 25.007 0.3 . 1 . . . . A 22 LYS CG . 25774 1 246 . 1 . 1 22 22 LYS CD C 13 29.219 0.3 . 1 . . . . A 22 LYS CD . 25774 1 247 . 1 . 1 22 22 LYS CE C 13 42.042 0.3 . 1 . . . . A 22 LYS CE . 25774 1 248 . 1 . 1 22 22 LYS N N 15 131.945 0.2 . 1 . . . . A 22 LYS N . 25774 1 249 . 1 . 1 23 23 CYS H H 1 9.120 0.02 . 1 . . . . A 23 CYS H . 25774 1 250 . 1 . 1 23 23 CYS HA H 1 5.535 0.02 . 1 . . . . A 23 CYS HA . 25774 1 251 . 1 . 1 23 23 CYS HB2 H 1 2.978 0.02 . 2 . . . . A 23 CYS HB2 . 25774 1 252 . 1 . 1 23 23 CYS HB3 H 1 2.917 0.02 . 2 . . . . A 23 CYS HB3 . 25774 1 253 . 1 . 1 23 23 CYS C C 13 174.228 0.3 . 1 . . . . A 23 CYS C . 25774 1 254 . 1 . 1 23 23 CYS CA C 13 55.640 0.3 . 1 . . . . A 23 CYS CA . 25774 1 255 . 1 . 1 23 23 CYS CB C 13 46.201 0.3 . 1 . . . . A 23 CYS CB . 25774 1 256 . 1 . 1 23 23 CYS N N 15 125.050 0.2 . 1 . . . . A 23 CYS N . 25774 1 257 . 1 . 1 24 24 LYS H H 1 8.648 0.02 . 1 . . . . A 24 LYS H . 25774 1 258 . 1 . 1 24 24 LYS HA H 1 4.431 0.02 . 1 . . . . A 24 LYS HA . 25774 1 259 . 1 . 1 24 24 LYS HB2 H 1 1.850 0.02 . 2 . . . . A 24 LYS HB2 . 25774 1 260 . 1 . 1 24 24 LYS HB3 H 1 1.730 0.02 . 2 . . . . A 24 LYS HB3 . 25774 1 261 . 1 . 1 24 24 LYS HG2 H 1 1.415 0.02 . 2 . . . . A 24 LYS HG2 . 25774 1 262 . 1 . 1 24 24 LYS HG3 H 1 1.330 0.02 . 2 . . . . A 24 LYS HG3 . 25774 1 263 . 1 . 1 24 24 LYS C C 13 176.675 0.3 . 1 . . . . A 24 LYS C . 25774 1 264 . 1 . 1 24 24 LYS CA C 13 55.898 0.3 . 1 . . . . A 24 LYS CA . 25774 1 265 . 1 . 1 24 24 LYS CB C 13 33.498 0.3 . 1 . . . . A 24 LYS CB . 25774 1 266 . 1 . 1 24 24 LYS CG C 13 24.660 0.3 . 1 . . . . A 24 LYS CG . 25774 1 267 . 1 . 1 24 24 LYS N N 15 126.053 0.2 . 1 . . . . A 24 LYS N . 25774 1 268 . 1 . 1 25 25 GLY H H 1 9.088 0.02 . 1 . . . . A 25 GLY H . 25774 1 269 . 1 . 1 25 25 GLY HA2 H 1 4.042 0.02 . 2 . . . . A 25 GLY HA2 . 25774 1 270 . 1 . 1 25 25 GLY HA3 H 1 3.683 0.02 . 2 . . . . A 25 GLY HA3 . 25774 1 271 . 1 . 1 25 25 GLY C C 13 175.184 0.3 . 1 . . . . A 25 GLY C . 25774 1 272 . 1 . 1 25 25 GLY CA C 13 46.929 0.3 . 1 . . . . A 25 GLY CA . 25774 1 273 . 1 . 1 25 25 GLY N N 15 117.994 0.2 . 1 . . . . A 25 GLY N . 25774 1 274 . 1 . 1 26 26 SER H H 1 8.861 0.02 . 1 . . . . A 26 SER H . 25774 1 275 . 1 . 1 26 26 SER HA H 1 4.450 0.02 . 1 . . . . A 26 SER HA . 25774 1 276 . 1 . 1 26 26 SER HB2 H 1 4.045 0.02 . 2 . . . . A 26 SER HB2 . 25774 1 277 . 1 . 1 26 26 SER HB3 H 1 3.890 0.02 . 2 . . . . A 26 SER HB3 . 25774 1 278 . 1 . 1 26 26 SER C C 13 174.020 0.3 . 1 . . . . A 26 SER C . 25774 1 279 . 1 . 1 26 26 SER CA C 13 58.716 0.3 . 1 . . . . A 26 SER CA . 25774 1 280 . 1 . 1 26 26 SER CB C 13 63.592 0.3 . 1 . . . . A 26 SER CB . 25774 1 281 . 1 . 1 26 26 SER N N 15 120.829 0.2 . 1 . . . . A 26 SER N . 25774 1 282 . 1 . 1 27 27 SER H H 1 7.768 0.02 . 1 . . . . A 27 SER H . 25774 1 283 . 1 . 1 27 27 SER HA H 1 4.776 0.02 . 1 . . . . A 27 SER HA . 25774 1 284 . 1 . 1 27 27 SER HB2 H 1 3.973 0.02 . 2 . . . . A 27 SER HB2 . 25774 1 285 . 1 . 1 27 27 SER HB3 H 1 3.813 0.02 . 2 . . . . A 27 SER HB3 . 25774 1 286 . 1 . 1 27 27 SER C C 13 173.631 0.3 . 1 . . . . A 27 SER C . 25774 1 287 . 1 . 1 27 27 SER CA C 13 57.139 0.3 . 1 . . . . A 27 SER CA . 25774 1 288 . 1 . 1 27 27 SER CB C 13 63.868 0.3 . 1 . . . . A 27 SER CB . 25774 1 289 . 1 . 1 27 27 SER N N 15 116.445 0.2 . 1 . . . . A 27 SER N . 25774 1 290 . 1 . 1 28 28 CYS H H 1 8.526 0.02 . 1 . . . . A 28 CYS H . 25774 1 291 . 1 . 1 28 28 CYS HA H 1 5.358 0.02 . 1 . . . . A 28 CYS HA . 25774 1 292 . 1 . 1 28 28 CYS HB2 H 1 2.782 0.02 . 2 . . . . A 28 CYS HB2 . 25774 1 293 . 1 . 1 28 28 CYS HB3 H 1 2.534 0.02 . 2 . . . . A 28 CYS HB3 . 25774 1 294 . 1 . 1 28 28 CYS C C 13 174.356 0.3 . 1 . . . . A 28 CYS C . 25774 1 295 . 1 . 1 28 28 CYS CA C 13 55.348 0.3 . 1 . . . . A 28 CYS CA . 25774 1 296 . 1 . 1 28 28 CYS CB C 13 46.564 0.3 . 1 . . . . A 28 CYS CB . 25774 1 297 . 1 . 1 28 28 CYS N N 15 127.587 0.2 . 1 . . . . A 28 CYS N . 25774 1 298 . 1 . 1 29 29 VAL H H 1 8.506 0.02 . 1 . . . . A 29 VAL H . 25774 1 299 . 1 . 1 29 29 VAL HA H 1 4.695 0.02 . 1 . . . . A 29 VAL HA . 25774 1 300 . 1 . 1 29 29 VAL HB H 1 1.688 0.02 . 1 . . . . A 29 VAL HB . 25774 1 301 . 1 . 1 29 29 VAL HG11 H 1 0.758 0.02 . 2 . . . . A 29 VAL HG11 . 25774 1 302 . 1 . 1 29 29 VAL HG12 H 1 0.758 0.02 . 2 . . . . A 29 VAL HG12 . 25774 1 303 . 1 . 1 29 29 VAL HG13 H 1 0.758 0.02 . 2 . . . . A 29 VAL HG13 . 25774 1 304 . 1 . 1 29 29 VAL HG21 H 1 0.785 0.02 . 2 . . . . A 29 VAL HG21 . 25774 1 305 . 1 . 1 29 29 VAL HG22 H 1 0.785 0.02 . 2 . . . . A 29 VAL HG22 . 25774 1 306 . 1 . 1 29 29 VAL HG23 H 1 0.785 0.02 . 2 . . . . A 29 VAL HG23 . 25774 1 307 . 1 . 1 29 29 VAL C C 13 175.385 0.3 . 1 . . . . A 29 VAL C . 25774 1 308 . 1 . 1 29 29 VAL CA C 13 60.263 0.3 . 1 . . . . A 29 VAL CA . 25774 1 309 . 1 . 1 29 29 VAL CB C 13 37.251 0.3 . 1 . . . . A 29 VAL CB . 25774 1 310 . 1 . 1 29 29 VAL CG1 C 13 21.478 0.3 . 2 . . . . A 29 VAL CG1 . 25774 1 311 . 1 . 1 29 29 VAL CG2 C 13 20.219 0.3 . 2 . . . . A 29 VAL CG2 . 25774 1 312 . 1 . 1 29 29 VAL N N 15 121.407 0.2 . 1 . . . . A 29 VAL N . 25774 1 313 . 1 . 1 30 30 CYS H H 1 8.074 0.02 . 1 . . . . A 30 CYS H . 25774 1 314 . 1 . 1 30 30 CYS HA H 1 5.017 0.02 . 1 . . . . A 30 CYS HA . 25774 1 315 . 1 . 1 30 30 CYS HB2 H 1 3.245 0.02 . 2 . . . . A 30 CYS HB2 . 25774 1 316 . 1 . 1 30 30 CYS HB3 H 1 2.613 0.02 . 2 . . . . A 30 CYS HB3 . 25774 1 317 . 1 . 1 30 30 CYS C C 13 175.349 0.3 . 1 . . . . A 30 CYS C . 25774 1 318 . 1 . 1 30 30 CYS CA C 13 55.851 0.3 . 1 . . . . A 30 CYS CA . 25774 1 319 . 1 . 1 30 30 CYS CB C 13 40.564 0.3 . 1 . . . . A 30 CYS CB . 25774 1 320 . 1 . 1 30 30 CYS N N 15 122.386 0.2 . 1 . . . . A 30 CYS N . 25774 1 321 . 1 . 1 31 31 ARG H H 1 9.523 0.02 . 1 . . . . A 31 ARG H . 25774 1 322 . 1 . 1 31 31 ARG HA H 1 4.734 0.02 . 1 . . . . A 31 ARG HA . 25774 1 323 . 1 . 1 31 31 ARG HB2 H 1 2.077 0.02 . 2 . . . . A 31 ARG HB2 . 25774 1 324 . 1 . 1 31 31 ARG HB3 H 1 1.687 0.02 . 2 . . . . A 31 ARG HB3 . 25774 1 325 . 1 . 1 31 31 ARG HG2 H 1 1.777 0.02 . 2 . . . . A 31 ARG HG2 . 25774 1 326 . 1 . 1 31 31 ARG HG3 H 1 1.688 0.02 . 2 . . . . A 31 ARG HG3 . 25774 1 327 . 1 . 1 31 31 ARG HD2 H 1 3.259 0.02 . 2 . . . . A 31 ARG HD2 . 25774 1 328 . 1 . 1 31 31 ARG HD3 H 1 3.100 0.02 . 2 . . . . A 31 ARG HD3 . 25774 1 329 . 1 . 1 31 31 ARG C C 13 174.392 0.3 . 1 . . . . A 31 ARG C . 25774 1 330 . 1 . 1 31 31 ARG CA C 13 54.271 0.3 . 1 . . . . A 31 ARG CA . 25774 1 331 . 1 . 1 31 31 ARG CB C 13 34.450 0.3 . 1 . . . . A 31 ARG CB . 25774 1 332 . 1 . 1 31 31 ARG CG C 13 26.525 0.3 . 1 . . . . A 31 ARG CG . 25774 1 333 . 1 . 1 31 31 ARG CD C 13 43.502 0.3 . 1 . . . . A 31 ARG CD . 25774 1 334 . 1 . 1 31 31 ARG N N 15 124.994 0.2 . 1 . . . . A 31 ARG N . 25774 1 335 . 1 . 1 32 32 LYS H H 1 8.360 0.02 . 1 . . . . A 32 LYS H . 25774 1 336 . 1 . 1 32 32 LYS HA H 1 4.274 0.02 . 1 . . . . A 32 LYS HA . 25774 1 337 . 1 . 1 32 32 LYS HB2 H 1 1.816 0.02 . 2 . . . . A 32 LYS HB2 . 25774 1 338 . 1 . 1 32 32 LYS HB3 H 1 1.638 0.02 . 2 . . . . A 32 LYS HB3 . 25774 1 339 . 1 . 1 32 32 LYS HG2 H 1 1.454 0.02 . 2 . . . . A 32 LYS HG2 . 25774 1 340 . 1 . 1 32 32 LYS HG3 H 1 1.454 0.02 . 2 . . . . A 32 LYS HG3 . 25774 1 341 . 1 . 1 32 32 LYS HE2 H 1 2.990 0.02 . 2 . . . . A 32 LYS HE2 . 25774 1 342 . 1 . 1 32 32 LYS HE3 H 1 2.990 0.02 . 2 . . . . A 32 LYS HE3 . 25774 1 343 . 1 . 1 32 32 LYS CA C 13 58.562 0.3 . 1 . . . . A 32 LYS CA . 25774 1 344 . 1 . 1 32 32 LYS CB C 13 33.313 0.3 . 1 . . . . A 32 LYS CB . 25774 1 345 . 1 . 1 32 32 LYS CG C 13 25.309 0.3 . 1 . . . . A 32 LYS CG . 25774 1 346 . 1 . 1 32 32 LYS N N 15 126.503 0.2 . 1 . . . . A 32 LYS N . 25774 1 stop_ save_