################################### # 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 31288 _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 $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 1 '2D 1H-15N HSQC' . . . 31288 1 2 '2D 1H-1H NOESY' . . . 31288 1 3 '2D 1H-1H TOCSY' . . . 31288 1 4 '2D 1H-13C HSQC aliphatic' . . . 31288 1 5 '2D 1H-13C HSQC aromatic' . . . 31288 1 6 '2D 1H-1H NOESY' . . . 31288 1 7 '2D 1H-1H TOCSY' . . . 31288 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 4.027 0.001 . 2 . . . . A 1 GLY HA2 . 31288 1 2 . 1 . 1 1 1 GLY HA3 H 1 4.027 0.001 . 2 . . . . A 1 GLY HA3 . 31288 1 3 . 1 . 1 1 1 GLY CA C 13 43.147 0.000 . 1 . . . . A 1 GLY CA . 31288 1 4 . 1 . 1 2 2 ILE H H 1 8.566 0.002 . 1 . . . . A 2 ILE H . 31288 1 5 . 1 . 1 2 2 ILE HA H 1 3.985 0.003 . 1 . . . . A 2 ILE HA . 31288 1 6 . 1 . 1 2 2 ILE HB H 1 1.324 0.030 . 1 . . . . A 2 ILE HB . 31288 1 7 . 1 . 1 2 2 ILE HG12 H 1 0.963 0.006 . . . . . . A 2 ILE HG12 . 31288 1 8 . 1 . 1 2 2 ILE HG13 H 1 1.198 0.004 . . . . . . A 2 ILE HG13 . 31288 1 9 . 1 . 1 2 2 ILE HG21 H 1 0.796 0.005 . 1 . . . . A 2 ILE HG21 . 31288 1 10 . 1 . 1 2 2 ILE HG22 H 1 0.796 0.005 . 1 . . . . A 2 ILE HG22 . 31288 1 11 . 1 . 1 2 2 ILE HG23 H 1 0.796 0.005 . 1 . . . . A 2 ILE HG23 . 31288 1 12 . 1 . 1 2 2 ILE HD11 H 1 0.619 0.003 . 1 . . . . A 2 ILE HD11 . 31288 1 13 . 1 . 1 2 2 ILE HD12 H 1 0.619 0.003 . 1 . . . . A 2 ILE HD12 . 31288 1 14 . 1 . 1 2 2 ILE HD13 H 1 0.619 0.003 . 1 . . . . A 2 ILE HD13 . 31288 1 15 . 1 . 1 2 2 ILE CA C 13 62.021 0.000 . 1 . . . . A 2 ILE CA . 31288 1 16 . 1 . 1 2 2 ILE CG1 C 13 27.900 0.004 . 1 . . . . A 2 ILE CG1 . 31288 1 17 . 1 . 1 2 2 ILE CG2 C 13 16.756 0.000 . 1 . . . . A 2 ILE CG2 . 31288 1 18 . 1 . 1 2 2 ILE CD1 C 13 14.067 0.000 . 1 . . . . A 2 ILE CD1 . 31288 1 19 . 1 . 1 2 2 ILE N N 15 121.271 0.000 . 1 . . . . A 2 ILE N . 31288 1 20 . 1 . 1 3 3 VAL H H 1 8.167 0.001 . 1 . . . . A 3 VAL H . 31288 1 21 . 1 . 1 3 3 VAL HA H 1 3.682 0.003 . 1 . . . . A 3 VAL HA . 31288 1 22 . 1 . 1 3 3 VAL HB H 1 1.950 0.004 . 1 . . . . A 3 VAL HB . 31288 1 23 . 1 . 1 3 3 VAL HG11 H 1 0.915 0.004 . . . . . . A 3 VAL HG11 . 31288 1 24 . 1 . 1 3 3 VAL HG12 H 1 0.915 0.004 . . . . . . A 3 VAL HG12 . 31288 1 25 . 1 . 1 3 3 VAL HG13 H 1 0.915 0.004 . . . . . . A 3 VAL HG13 . 31288 1 26 . 1 . 1 3 3 VAL HG21 H 1 0.960 0.003 . . . . . . A 3 VAL HG21 . 31288 1 27 . 1 . 1 3 3 VAL HG22 H 1 0.960 0.003 . . . . . . A 3 VAL HG22 . 31288 1 28 . 1 . 1 3 3 VAL HG23 H 1 0.960 0.003 . . . . . . A 3 VAL HG23 . 31288 1 29 . 1 . 1 3 3 VAL CA C 13 64.923 0.000 . 1 . . . . A 3 VAL CA . 31288 1 30 . 1 . 1 3 3 VAL CB C 13 31.558 0.000 . 1 . . . . A 3 VAL CB . 31288 1 31 . 1 . 1 3 3 VAL CG1 C 13 20.990 0.000 . . . . . . A 3 VAL CG1 . 31288 1 32 . 1 . 1 3 3 VAL CG2 C 13 22.155 0.000 . . . . . . A 3 VAL CG2 . 31288 1 33 . 1 . 1 3 3 VAL N N 15 123.211 0.000 . 1 . . . . A 3 VAL N . 31288 1 34 . 1 . 1 4 4 GLU H H 1 8.183 0.002 . 1 . . . . A 4 GLU H . 31288 1 35 . 1 . 1 4 4 GLU HA H 1 4.267 0.003 . 1 . . . . A 4 GLU HA . 31288 1 36 . 1 . 1 4 4 GLU HB2 H 1 2.126 0.002 . . . . . . A 4 GLU HB2 . 31288 1 37 . 1 . 1 4 4 GLU HG2 H 1 2.519 0.007 . . . . . . A 4 GLU HG2 . 31288 1 38 . 1 . 1 4 4 GLU CA C 13 57.636 0.000 . 1 . . . . A 4 GLU CA . 31288 1 39 . 1 . 1 4 4 GLU CB C 13 29.054 0.000 . 1 . . . . A 4 GLU CB . 31288 1 40 . 1 . 1 4 4 GLU CG C 13 33.550 0.002 . 1 . . . . A 4 GLU CG . 31288 1 41 . 1 . 1 4 4 GLU N N 15 121.517 0.000 . 1 . . . . A 4 GLU N . 31288 1 42 . 1 . 1 5 5 GLN H H 1 8.325 0.003 . 1 . . . . A 5 GLN H . 31288 1 43 . 1 . 1 5 5 GLN HA H 1 4.094 0.002 . 1 . . . . A 5 GLN HA . 31288 1 44 . 1 . 1 5 5 GLN HB2 H 1 2.148 0.007 . . . . . . A 5 GLN HB2 . 31288 1 45 . 1 . 1 5 5 GLN HB3 H 1 2.086 0.003 . . . . . . A 5 GLN HB3 . 31288 1 46 . 1 . 1 5 5 GLN HG2 H 1 2.501 0.003 . . . . . . A 5 GLN HG2 . 31288 1 47 . 1 . 1 5 5 GLN HG3 H 1 2.419 0.004 . . . . . . A 5 GLN HG3 . 31288 1 48 . 1 . 1 5 5 GLN HE21 H 1 7.532 0.033 . . . . . . A 5 GLN HE21 . 31288 1 49 . 1 . 1 5 5 GLN HE22 H 1 6.925 0.004 . . . . . . A 5 GLN HE22 . 31288 1 50 . 1 . 1 5 5 GLN CA C 13 58.777 0.000 . 1 . . . . A 5 GLN CA . 31288 1 51 . 1 . 1 5 5 GLN CB C 13 29.116 0.007 . 1 . . . . A 5 GLN CB . 31288 1 52 . 1 . 1 5 5 GLN CG C 13 33.800 0.001 . 1 . . . . A 5 GLN CG . 31288 1 53 . 1 . 1 5 5 GLN NE2 N 15 111.522 0.004 . 1 . . . . A 5 GLN NE2 . 31288 1 54 . 1 . 1 6 6 CYS H H 1 8.371 0.002 . 1 . . . . A 6 CYS H . 31288 1 55 . 1 . 1 6 6 CYS HA H 1 4.966 0.004 . 1 . . . . A 6 CYS HA . 31288 1 56 . 1 . 1 6 6 CYS HB2 H 1 2.875 0.003 . . . . . . A 6 CYS HB2 . 31288 1 57 . 1 . 1 6 6 CYS HB3 H 1 3.387 0.005 . . . . . . A 6 CYS HB3 . 31288 1 58 . 1 . 1 6 6 CYS CA C 13 54.121 0.000 . 1 . . . . A 6 CYS CA . 31288 1 59 . 1 . 1 6 6 CYS N N 15 110.954 0.000 . 1 . . . . A 6 CYS N . 31288 1 60 . 1 . 1 7 7 CYS H H 1 8.283 0.004 . 1 . . . . A 7 CYS H . 31288 1 61 . 1 . 1 7 7 CYS HA H 1 4.878 0.002 . 1 . . . . A 7 CYS HA . 31288 1 62 . 1 . 1 7 7 CYS HB2 H 1 3.821 0.004 . . . . . . A 7 CYS HB2 . 31288 1 63 . 1 . 1 7 7 CYS HB3 H 1 3.335 0.003 . . . . . . A 7 CYS HB3 . 31288 1 64 . 1 . 1 7 7 CYS CA C 13 57.118 0.000 . 1 . . . . A 7 CYS CA . 31288 1 65 . 1 . 1 7 7 CYS CB C 13 38.691 0.017 . 1 . . . . A 7 CYS CB . 31288 1 66 . 1 . 1 7 7 CYS N N 15 118.437 0.000 . 1 . . . . A 7 CYS N . 31288 1 67 . 1 . 1 8 8 THR H H 1 8.302 0.004 . 1 . . . . A 8 THR H . 31288 1 68 . 1 . 1 8 8 THR HA H 1 4.049 0.002 . 1 . . . . A 8 THR HA . 31288 1 69 . 1 . 1 8 8 THR HB H 1 4.410 0.002 . 1 . . . . A 8 THR HB . 31288 1 70 . 1 . 1 8 8 THR HG21 H 1 1.278 0.004 . 1 . . . . A 8 THR HG21 . 31288 1 71 . 1 . 1 8 8 THR HG22 H 1 1.278 0.004 . 1 . . . . A 8 THR HG22 . 31288 1 72 . 1 . 1 8 8 THR HG23 H 1 1.278 0.004 . 1 . . . . A 8 THR HG23 . 31288 1 73 . 1 . 1 8 8 THR CA C 13 65.190 0.000 . 1 . . . . A 8 THR CA . 31288 1 74 . 1 . 1 8 8 THR CB C 13 68.444 0.000 . 1 . . . . A 8 THR CB . 31288 1 75 . 1 . 1 8 8 THR CG2 C 13 22.154 0.000 . 1 . . . . A 8 THR CG2 . 31288 1 76 . 1 . 1 9 9 SER H H 1 7.472 0.002 . 1 . . . . A 9 SER H . 31288 1 77 . 1 . 1 9 9 SER HA H 1 4.822 0.002 . 1 . . . . A 9 SER HA . 31288 1 78 . 1 . 1 9 9 SER HB2 H 1 3.914 0.003 . . . . . . A 9 SER HB2 . 31288 1 79 . 1 . 1 9 9 SER HB3 H 1 4.065 0.003 . . . . . . A 9 SER HB3 . 31288 1 80 . 1 . 1 9 9 SER CA C 13 55.954 0.000 . 1 . . . . A 9 SER CA . 31288 1 81 . 1 . 1 9 9 SER CB C 13 64.019 0.017 . 1 . . . . A 9 SER CB . 31288 1 82 . 1 . 1 10 10 ILE H H 1 7.887 0.005 . 1 . . . . A 10 ILE H . 31288 1 83 . 1 . 1 10 10 ILE HA H 1 4.355 0.002 . 1 . . . . A 10 ILE HA . 31288 1 84 . 1 . 1 10 10 ILE HB H 1 1.585 0.003 . 1 . . . . A 10 ILE HB . 31288 1 85 . 1 . 1 10 10 ILE HG12 H 1 0.418 0.006 . . . . . . A 10 ILE HG12 . 31288 1 86 . 1 . 1 10 10 ILE HG13 H 1 1.086 0.003 . . . . . . A 10 ILE HG13 . 31288 1 87 . 1 . 1 10 10 ILE HG21 H 1 0.652 0.002 . 1 . . . . A 10 ILE HG21 . 31288 1 88 . 1 . 1 10 10 ILE HG22 H 1 0.652 0.002 . 1 . . . . A 10 ILE HG22 . 31288 1 89 . 1 . 1 10 10 ILE HG23 H 1 0.652 0.002 . 1 . . . . A 10 ILE HG23 . 31288 1 90 . 1 . 1 10 10 ILE HD11 H 1 0.510 0.006 . 1 . . . . A 10 ILE HD11 . 31288 1 91 . 1 . 1 10 10 ILE HD12 H 1 0.510 0.006 . 1 . . . . A 10 ILE HD12 . 31288 1 92 . 1 . 1 10 10 ILE HD13 H 1 0.510 0.006 . 1 . . . . A 10 ILE HD13 . 31288 1 93 . 1 . 1 10 10 ILE CA C 13 59.988 0.000 . 1 . . . . A 10 ILE CA . 31288 1 94 . 1 . 1 10 10 ILE CB C 13 39.045 0.000 . 1 . . . . A 10 ILE CB . 31288 1 95 . 1 . 1 10 10 ILE CG1 C 13 26.958 0.005 . 1 . . . . A 10 ILE CG1 . 31288 1 96 . 1 . 1 10 10 ILE CG2 C 13 17.341 0.000 . 1 . . . . A 10 ILE CG2 . 31288 1 97 . 1 . 1 10 10 ILE CD1 C 13 12.362 0.000 . 1 . . . . A 10 ILE CD1 . 31288 1 98 . 1 . 1 10 10 ILE N N 15 117.385 0.000 . 1 . . . . A 10 ILE N . 31288 1 99 . 1 . 1 11 11 CYS H H 1 9.829 0.003 . 1 . . . . A 11 CYS H . 31288 1 100 . 1 . 1 11 11 CYS HA H 1 4.998 0.003 . 1 . . . . A 11 CYS HA . 31288 1 101 . 1 . 1 11 11 CYS HB2 H 1 3.243 0.002 . . . . . . A 11 CYS HB2 . 31288 1 102 . 1 . 1 11 11 CYS CA C 13 53.969 0.000 . 1 . . . . A 11 CYS CA . 31288 1 103 . 1 . 1 12 12 SER H H 1 8.763 0.002 . 1 . . . . A 12 SER H . 31288 1 104 . 1 . 1 12 12 SER HA H 1 4.612 0.004 . 1 . . . . A 12 SER HA . 31288 1 105 . 1 . 1 12 12 SER HB2 H 1 4.318 0.002 . . . . . . A 12 SER HB2 . 31288 1 106 . 1 . 1 12 12 SER HB3 H 1 4.024 0.003 . . . . . . A 12 SER HB3 . 31288 1 107 . 1 . 1 12 12 SER CA C 13 56.393 0.000 . 1 . . . . A 12 SER CA . 31288 1 108 . 1 . 1 12 12 SER CB C 13 65.558 0.003 . 1 . . . . A 12 SER CB . 31288 1 109 . 1 . 1 12 12 SER N N 15 117.245 0.000 . 1 . . . . A 12 SER N . 31288 1 110 . 1 . 1 13 13 LEU H H 1 8.660 0.001 . 1 . . . . A 13 LEU H . 31288 1 111 . 1 . 1 13 13 LEU HA H 1 3.817 0.003 . 1 . . . . A 13 LEU HA . 31288 1 112 . 1 . 1 13 13 LEU HB2 H 1 1.273 0.005 . . . . . . A 13 LEU HB2 . 31288 1 113 . 1 . 1 13 13 LEU HB3 H 1 1.366 0.005 . . . . . . A 13 LEU HB3 . 31288 1 114 . 1 . 1 13 13 LEU HG H 1 1.383 0.004 . 1 . . . . A 13 LEU HG . 31288 1 115 . 1 . 1 13 13 LEU HD11 H 1 0.796 0.004 . . . . . . A 13 LEU HD11 . 31288 1 116 . 1 . 1 13 13 LEU HD12 H 1 0.796 0.004 . . . . . . A 13 LEU HD12 . 31288 1 117 . 1 . 1 13 13 LEU HD13 H 1 0.796 0.004 . . . . . . A 13 LEU HD13 . 31288 1 118 . 1 . 1 13 13 LEU HD21 H 1 0.751 0.002 . . . . . . A 13 LEU HD21 . 31288 1 119 . 1 . 1 13 13 LEU HD22 H 1 0.751 0.002 . . . . . . A 13 LEU HD22 . 31288 1 120 . 1 . 1 13 13 LEU HD23 H 1 0.751 0.002 . . . . . . A 13 LEU HD23 . 31288 1 121 . 1 . 1 13 13 LEU CA C 13 58.368 0.000 . 1 . . . . A 13 LEU CA . 31288 1 122 . 1 . 1 13 13 LEU CB C 13 41.137 0.006 . 1 . . . . A 13 LEU CB . 31288 1 123 . 1 . 1 13 13 LEU CG C 13 26.911 0.000 . 1 . . . . A 13 LEU CG . 31288 1 124 . 1 . 1 13 13 LEU CD1 C 13 23.842 0.000 . . . . . . A 13 LEU CD1 . 31288 1 125 . 1 . 1 13 13 LEU CD2 C 13 24.740 0.000 . . . . . . A 13 LEU CD2 . 31288 1 126 . 1 . 1 13 13 LEU N N 15 121.781 0.000 . 1 . . . . A 13 LEU N . 31288 1 127 . 1 . 1 14 14 TYR H H 1 7.546 0.001 . 1 . . . . A 14 TYR H . 31288 1 128 . 1 . 1 14 14 TYR HA H 1 4.163 0.002 . 1 . . . . A 14 TYR HA . 31288 1 129 . 1 . 1 14 14 TYR HB2 H 1 3.008 0.004 . . . . . . A 14 TYR HB2 . 31288 1 130 . 1 . 1 14 14 TYR HB3 H 1 2.945 0.004 . . . . . . A 14 TYR HB3 . 31288 1 131 . 1 . 1 14 14 TYR HD1 H 1 7.083 0.003 . . . . . . A 14 TYR HD1 . 31288 1 132 . 1 . 1 14 14 TYR HD2 H 1 7.083 0.003 . . . . . . A 14 TYR HD2 . 31288 1 133 . 1 . 1 14 14 TYR HE1 H 1 6.860 0.004 . . . . . . A 14 TYR HE1 . 31288 1 134 . 1 . 1 14 14 TYR HE2 H 1 6.860 0.002 . . . . . . A 14 TYR HE2 . 31288 1 135 . 1 . 1 14 14 TYR CA C 13 60.143 0.000 . 1 . . . . A 14 TYR CA . 31288 1 136 . 1 . 1 14 14 TYR CB C 13 37.710 0.025 . 1 . . . . A 14 TYR CB . 31288 1 137 . 1 . 1 14 14 TYR CD1 C 13 132.751 0.000 . . . . . . A 14 TYR CD1 . 31288 1 138 . 1 . 1 14 14 TYR CD2 C 13 132.751 0.000 . . . . . . A 14 TYR CD2 . 31288 1 139 . 1 . 1 14 14 TYR CE1 C 13 118.303 0.000 . . . . . . A 14 TYR CE1 . 31288 1 140 . 1 . 1 14 14 TYR CE2 C 13 118.303 0.000 . . . . . . A 14 TYR CE2 . 31288 1 141 . 1 . 1 14 14 TYR N N 15 115.342 0.000 . 1 . . . . A 14 TYR N . 31288 1 142 . 1 . 1 15 15 GLN H H 1 7.580 0.003 . 1 . . . . A 15 GLN H . 31288 1 143 . 1 . 1 15 15 GLN HA H 1 4.010 0.003 . 1 . . . . A 15 GLN HA . 31288 1 144 . 1 . 1 15 15 GLN HB2 H 1 2.410 0.010 . . . . . . A 15 GLN HB2 . 31288 1 145 . 1 . 1 15 15 GLN HB3 H 1 2.064 0.010 . . . . . . A 15 GLN HB3 . 31288 1 146 . 1 . 1 15 15 GLN HG2 H 1 2.397 0.002 . . . . . . A 15 GLN HG2 . 31288 1 147 . 1 . 1 15 15 GLN HG3 H 1 2.460 0.004 . . . . . . A 15 GLN HG3 . 31288 1 148 . 1 . 1 15 15 GLN HE21 H 1 6.980 0.003 . . . . . . A 15 GLN HE21 . 31288 1 149 . 1 . 1 15 15 GLN HE22 H 1 7.525 0.003 . . . . . . A 15 GLN HE22 . 31288 1 150 . 1 . 1 15 15 GLN CA C 13 58.470 0.000 . 1 . . . . A 15 GLN CA . 31288 1 151 . 1 . 1 15 15 GLN CB C 13 28.990 0.001 . 1 . . . . A 15 GLN CB . 31288 1 152 . 1 . 1 15 15 GLN CG C 13 35.088 0.002 . 1 . . . . A 15 GLN CG . 31288 1 153 . 1 . 1 15 15 GLN N N 15 117.805 0.000 . 1 . . . . A 15 GLN N . 31288 1 154 . 1 . 1 15 15 GLN NE2 N 15 111.556 0.014 . 1 . . . . A 15 GLN NE2 . 31288 1 155 . 1 . 1 16 16 LEU H H 1 8.141 0.001 . 1 . . . . A 16 LEU H . 31288 1 156 . 1 . 1 16 16 LEU HA H 1 4.194 0.003 . 1 . . . . A 16 LEU HA . 31288 1 157 . 1 . 1 16 16 LEU HB2 H 1 1.582 0.003 . . . . . . A 16 LEU HB2 . 31288 1 158 . 1 . 1 16 16 LEU HB3 H 1 1.953 0.006 . . . . . . A 16 LEU HB3 . 31288 1 159 . 1 . 1 16 16 LEU HG H 1 1.763 0.004 . 1 . . . . A 16 LEU HG . 31288 1 160 . 1 . 1 16 16 LEU HD11 H 1 0.856 0.004 . . . . . . A 16 LEU HD11 . 31288 1 161 . 1 . 1 16 16 LEU HD12 H 1 0.856 0.004 . . . . . . A 16 LEU HD12 . 31288 1 162 . 1 . 1 16 16 LEU HD13 H 1 0.856 0.004 . . . . . . A 16 LEU HD13 . 31288 1 163 . 1 . 1 16 16 LEU HD21 H 1 0.814 0.003 . . . . . . A 16 LEU HD21 . 31288 1 164 . 1 . 1 16 16 LEU HD22 H 1 0.814 0.003 . . . . . . A 16 LEU HD22 . 31288 1 165 . 1 . 1 16 16 LEU HD23 H 1 0.814 0.003 . . . . . . A 16 LEU HD23 . 31288 1 166 . 1 . 1 16 16 LEU CA C 13 58.078 0.000 . 1 . . . . A 16 LEU CA . 31288 1 167 . 1 . 1 16 16 LEU CB C 13 41.968 0.007 . 1 . . . . A 16 LEU CB . 31288 1 168 . 1 . 1 16 16 LEU CG C 13 26.957 0.000 . 1 . . . . A 16 LEU CG . 31288 1 169 . 1 . 1 16 16 LEU CD1 C 13 25.782 0.000 . . . . . . A 16 LEU CD1 . 31288 1 170 . 1 . 1 16 16 LEU CD2 C 13 25.256 0.000 . . . . . . A 16 LEU CD2 . 31288 1 171 . 1 . 1 16 16 LEU N N 15 120.054 0.000 . 1 . . . . A 16 LEU N . 31288 1 172 . 1 . 1 17 17 GLU H H 1 8.116 0.001 . 1 . . . . A 17 GLU H . 31288 1 173 . 1 . 1 17 17 GLU HA H 1 4.256 0.002 . 1 . . . . A 17 GLU HA . 31288 1 174 . 1 . 1 17 17 GLU HB2 H 1 2.132 0.003 . . . . . . A 17 GLU HB2 . 31288 1 175 . 1 . 1 17 17 GLU HG2 H 1 2.614 0.005 . . . . . . A 17 GLU HG2 . 31288 1 176 . 1 . 1 17 17 GLU CA C 13 57.982 0.000 . 1 . . . . A 17 GLU CA . 31288 1 177 . 1 . 1 17 17 GLU CB C 13 27.712 0.003 . 1 . . . . A 17 GLU CB . 31288 1 178 . 1 . 1 17 17 GLU CG C 13 33.594 0.003 . 1 . . . . A 17 GLU CG . 31288 1 179 . 1 . 1 17 17 GLU N N 15 113.941 0.000 . 1 . . . . A 17 GLU N . 31288 1 180 . 1 . 1 18 18 ASN H H 1 7.441 0.002 . 1 . . . . A 18 ASN H . 31288 1 181 . 1 . 1 18 18 ASN HA H 1 4.522 0.004 . 1 . . . . A 18 ASN HA . 31288 1 182 . 1 . 1 18 18 ASN HB2 H 1 2.668 0.005 . . . . . . A 18 ASN HB2 . 31288 1 183 . 1 . 1 18 18 ASN HB3 H 1 2.563 0.003 . . . . . . A 18 ASN HB3 . 31288 1 184 . 1 . 1 18 18 ASN HD21 H 1 6.589 0.003 . . . . . . A 18 ASN HD21 . 31288 1 185 . 1 . 1 18 18 ASN HD22 H 1 7.217 0.002 . . . . . . A 18 ASN HD22 . 31288 1 186 . 1 . 1 18 18 ASN CA C 13 54.641 0.000 . 1 . . . . A 18 ASN CA . 31288 1 187 . 1 . 1 18 18 ASN CB C 13 38.307 0.011 . 1 . . . . A 18 ASN CB . 31288 1 188 . 1 . 1 18 18 ASN N N 15 117.002 0.000 . 1 . . . . A 18 ASN N . 31288 1 189 . 1 . 1 18 18 ASN ND2 N 15 111.729 0.000 . 1 . . . . A 18 ASN ND2 . 31288 1 190 . 1 . 1 19 19 TYR H H 1 8.004 0.002 . 1 . . . . A 19 TYR H . 31288 1 191 . 1 . 1 19 19 TYR HA H 1 4.477 0.004 . 1 . . . . A 19 TYR HA . 31288 1 192 . 1 . 1 19 19 TYR HB2 H 1 3.010 0.004 . . . . . . A 19 TYR HB2 . 31288 1 193 . 1 . 1 19 19 TYR HB3 H 1 3.480 0.006 . . . . . . A 19 TYR HB3 . 31288 1 194 . 1 . 1 19 19 TYR HD1 H 1 7.409 0.006 . . . . . . A 19 TYR HD1 . 31288 1 195 . 1 . 1 19 19 TYR HD2 H 1 7.409 0.004 . . . . . . A 19 TYR HD2 . 31288 1 196 . 1 . 1 19 19 TYR HE1 H 1 6.776 0.003 . . . . . . A 19 TYR HE1 . 31288 1 197 . 1 . 1 19 19 TYR HE2 H 1 6.778 0.003 . . . . . . A 19 TYR HE2 . 31288 1 198 . 1 . 1 19 19 TYR CA C 13 58.988 0.000 . 1 . . . . A 19 TYR CA . 31288 1 199 . 1 . 1 19 19 TYR CB C 13 37.958 0.001 . 1 . . . . A 19 TYR CB . 31288 1 200 . 1 . 1 19 19 TYR CD1 C 13 133.742 0.000 . . . . . . A 19 TYR CD1 . 31288 1 201 . 1 . 1 19 19 TYR CD2 C 13 133.742 0.000 . . . . . . A 19 TYR CD2 . 31288 1 202 . 1 . 1 19 19 TYR CE1 C 13 117.925 0.000 . . . . . . A 19 TYR CE1 . 31288 1 203 . 1 . 1 19 19 TYR CE2 C 13 117.925 0.000 . . . . . . A 19 TYR CE2 . 31288 1 204 . 1 . 1 19 19 TYR N N 15 117.015 0.000 . 1 . . . . A 19 TYR N . 31288 1 205 . 1 . 1 20 20 CYS H H 1 7.431 0.003 . 1 . . . . A 20 CYS H . 31288 1 206 . 1 . 1 20 20 CYS HA H 1 5.113 0.006 . 1 . . . . A 20 CYS HA . 31288 1 207 . 1 . 1 20 20 CYS HB2 H 1 2.884 0.005 . . . . . . A 20 CYS HB2 . 31288 1 208 . 1 . 1 20 20 CYS HB3 H 1 3.208 0.003 . . . . . . A 20 CYS HB3 . 31288 1 209 . 1 . 1 20 20 CYS CA C 13 53.317 0.000 . 1 . . . . A 20 CYS CA . 31288 1 210 . 1 . 1 20 20 CYS CB C 13 35.816 0.005 . 1 . . . . A 20 CYS CB . 31288 1 211 . 1 . 1 20 20 CYS N N 15 115.671 0.000 . 1 . . . . A 20 CYS N . 31288 1 212 . 1 . 1 21 21 GLY H H 1 8.246 0.003 . 1 . . . . A 21 GLY H . 31288 1 213 . 1 . 1 21 21 GLY HA2 H 1 4.035 0.004 . . . . . . A 21 GLY HA2 . 31288 1 214 . 1 . 1 21 21 GLY CA C 13 43.883 0.002 . 1 . . . . A 21 GLY CA . 31288 1 215 . 1 . 1 21 21 GLY N N 15 109.807 0.000 . 1 . . . . A 21 GLY N . 31288 1 216 . 2 . 2 1 1 PHE HA H 1 4.261 0.005 . 1 . . . . B 22 PHE HA . 31288 1 217 . 2 . 2 1 1 PHE HB2 H 1 3.175 0.004 . 2 . . . . B 22 PHE HB2 . 31288 1 218 . 2 . 2 1 1 PHE HB3 H 1 3.175 0.004 . 2 . . . . B 22 PHE HB3 . 31288 1 219 . 2 . 2 1 1 PHE HD1 H 1 7.230 0.005 . . . . . . B 22 PHE HD1 . 31288 1 220 . 2 . 2 1 1 PHE HD2 H 1 7.230 0.003 . . . . . . B 22 PHE HD2 . 31288 1 221 . 2 . 2 1 1 PHE HE1 H 1 7.377 0.004 . . . . . . B 22 PHE HE1 . 31288 1 222 . 2 . 2 1 1 PHE HE2 H 1 7.377 0.004 . . . . . . B 22 PHE HE2 . 31288 1 223 . 2 . 2 1 1 PHE HZ H 1 7.291 0.002 . 1 . . . . B 22 PHE HZ . 31288 1 224 . 2 . 2 1 1 PHE CA C 13 56.937 0.000 . 1 . . . . B 22 PHE CA . 31288 1 225 . 2 . 2 1 1 PHE CB C 13 39.740 0.000 . 1 . . . . B 22 PHE CB . 31288 1 226 . 2 . 2 1 1 PHE CD1 C 13 132.038 0.000 . . . . . . B 22 PHE CD1 . 31288 1 227 . 2 . 2 1 1 PHE CD2 C 13 132.038 0.000 . . . . . . B 22 PHE CD2 . 31288 1 228 . 2 . 2 1 1 PHE CE1 C 13 131.696 0.000 . . . . . . B 22 PHE CE1 . 31288 1 229 . 2 . 2 1 1 PHE CE2 C 13 131.696 0.000 . . . . . . B 22 PHE CE2 . 31288 1 230 . 2 . 2 1 1 PHE CZ C 13 130.436 0.000 . 1 . . . . B 22 PHE CZ . 31288 1 231 . 2 . 2 2 2 VAL H H 1 8.130 0.003 . 1 . . . . B 23 VAL H . 31288 1 232 . 2 . 2 2 2 VAL HA H 1 4.128 0.004 . 1 . . . . B 23 VAL HA . 31288 1 233 . 2 . 2 2 2 VAL HB H 1 1.887 0.003 . 1 . . . . B 23 VAL HB . 31288 1 234 . 2 . 2 2 2 VAL HG11 H 1 0.867 0.004 . . . . . . B 23 VAL HG11 . 31288 1 235 . 2 . 2 2 2 VAL HG12 H 1 0.867 0.004 . . . . . . B 23 VAL HG12 . 31288 1 236 . 2 . 2 2 2 VAL HG13 H 1 0.867 0.004 . . . . . . B 23 VAL HG13 . 31288 1 237 . 2 . 2 2 2 VAL HG21 H 1 0.848 0.004 . . . . . . B 23 VAL HG21 . 31288 1 238 . 2 . 2 2 2 VAL HG22 H 1 0.848 0.004 . . . . . . B 23 VAL HG22 . 31288 1 239 . 2 . 2 2 2 VAL HG23 H 1 0.848 0.004 . . . . . . B 23 VAL HG23 . 31288 1 240 . 2 . 2 2 2 VAL CA C 13 61.515 0.000 . 1 . . . . B 23 VAL CA . 31288 1 241 . 2 . 2 2 2 VAL CB C 13 33.219 0.000 . 1 . . . . B 23 VAL CB . 31288 1 242 . 2 . 2 2 2 VAL CG1 C 13 20.366 0.000 . . . . . . B 23 VAL CG1 . 31288 1 243 . 2 . 2 2 2 VAL CG2 C 13 20.832 0.000 . . . . . . B 23 VAL CG2 . 31288 1 244 . 2 . 2 2 2 VAL N N 15 124.270 0.000 . 1 . . . . B 23 VAL N . 31288 1 245 . 2 . 2 3 3 ASN H H 1 8.546 0.003 . 1 . . . . B 24 ASN H . 31288 1 246 . 2 . 2 3 3 ASN HA H 1 4.734 0.003 . 1 . . . . B 24 ASN HA . 31288 1 247 . 2 . 2 3 3 ASN HB2 H 1 2.720 0.002 . 2 . . . . B 24 ASN HB2 . 31288 1 248 . 2 . 2 3 3 ASN HB3 H 1 2.720 0.002 . 2 . . . . B 24 ASN HB3 . 31288 1 249 . 2 . 2 3 3 ASN HD21 H 1 7.554 0.004 . . . . . . B 24 ASN HD21 . 31288 1 250 . 2 . 2 3 3 ASN HD22 H 1 6.917 0.004 . . . . . . B 24 ASN HD22 . 31288 1 251 . 2 . 2 3 3 ASN CA C 13 53.078 0.000 . 1 . . . . B 24 ASN CA . 31288 1 252 . 2 . 2 3 3 ASN CB C 13 38.216 0.000 . 1 . . . . B 24 ASN CB . 31288 1 253 . 2 . 2 3 3 ASN N N 15 124.054 0.000 . 1 . . . . B 24 ASN N . 31288 1 254 . 2 . 2 3 3 ASN ND2 N 15 111.304 0.002 . 1 . . . . B 24 ASN ND2 . 31288 1 255 . 2 . 2 4 4 GLN H H 1 8.484 0.002 . 1 . . . . B 25 GLN H . 31288 1 256 . 2 . 2 4 4 GLN HA H 1 4.525 0.003 . 1 . . . . B 25 GLN HA . 31288 1 257 . 2 . 2 4 4 GLN HB2 H 1 1.953 0.006 . . . . . . B 25 GLN HB2 . 31288 1 258 . 2 . 2 4 4 GLN HB3 H 1 2.113 0.003 . . . . . . B 25 GLN HB3 . 31288 1 259 . 2 . 2 4 4 GLN HG2 H 1 2.268 0.005 . . . . . . B 25 GLN HG2 . 31288 1 260 . 2 . 2 4 4 GLN HG3 H 1 2.116 0.004 . . . . . . B 25 GLN HG3 . 31288 1 261 . 2 . 2 4 4 GLN HE21 H 1 7.358 0.003 . . . . . . B 25 GLN HE21 . 31288 1 262 . 2 . 2 4 4 GLN HE22 H 1 6.823 0.003 . . . . . . B 25 GLN HE22 . 31288 1 263 . 2 . 2 4 4 GLN CA C 13 54.073 0.000 . 1 . . . . B 25 GLN CA . 31288 1 264 . 2 . 2 4 4 GLN CB C 13 31.179 0.005 . 1 . . . . B 25 GLN CB . 31288 1 265 . 2 . 2 4 4 GLN CG C 13 32.953 0.007 . 1 . . . . B 25 GLN CG . 31288 1 266 . 2 . 2 4 4 GLN N N 15 119.752 0.000 . 1 . . . . B 25 GLN N . 31288 1 267 . 2 . 2 4 4 GLN NE2 N 15 111.412 0.013 . 1 . . . . B 25 GLN NE2 . 31288 1 268 . 2 . 2 5 5 HIS H H 1 8.734 0.002 . 1 . . . . B 26 HIS H . 31288 1 269 . 2 . 2 5 5 HIS HA H 1 4.458 0.005 . 1 . . . . B 26 HIS HA . 31288 1 270 . 2 . 2 5 5 HIS HB2 H 1 3.279 0.007 . . . . . . B 26 HIS HB2 . 31288 1 271 . 2 . 2 5 5 HIS HB3 H 1 3.588 0.006 . . . . . . B 26 HIS HB3 . 31288 1 272 . 2 . 2 5 5 HIS HD2 H 1 7.407 0.004 . 1 . . . . B 26 HIS HD2 . 31288 1 273 . 2 . 2 5 5 HIS HE1 H 1 8.636 0.002 . 1 . . . . B 26 HIS HE1 . 31288 1 274 . 2 . 2 5 5 HIS CA C 13 56.971 0.000 . 1 . . . . B 26 HIS CA . 31288 1 275 . 2 . 2 5 5 HIS CB C 13 28.029 0.002 . 1 . . . . B 26 HIS CB . 31288 1 276 . 2 . 2 5 5 HIS CD2 C 13 120.759 0.000 . 1 . . . . B 26 HIS CD2 . 31288 1 277 . 2 . 2 5 5 HIS CE1 C 13 135.871 0.000 . 1 . . . . B 26 HIS CE1 . 31288 1 278 . 2 . 2 5 5 HIS N N 15 119.319 0.000 . 1 . . . . B 26 HIS N . 31288 1 279 . 2 . 2 6 6 LEU H H 1 9.071 0.003 . 1 . . . . B 27 LEU H . 31288 1 280 . 2 . 2 6 6 LEU HA H 1 4.534 0.004 . 1 . . . . B 27 LEU HA . 31288 1 281 . 2 . 2 6 6 LEU HB2 H 1 1.804 0.007 . . . . . . B 27 LEU HB2 . 31288 1 282 . 2 . 2 6 6 LEU HB3 H 1 0.849 0.004 . . . . . . B 27 LEU HB3 . 31288 1 283 . 2 . 2 6 6 LEU HG H 1 1.644 0.005 . 1 . . . . B 27 LEU HG . 31288 1 284 . 2 . 2 6 6 LEU HD11 H 1 0.924 0.005 . . . . . . B 27 LEU HD11 . 31288 1 285 . 2 . 2 6 6 LEU HD12 H 1 0.924 0.005 . . . . . . B 27 LEU HD12 . 31288 1 286 . 2 . 2 6 6 LEU HD13 H 1 0.924 0.005 . . . . . . B 27 LEU HD13 . 31288 1 287 . 2 . 2 6 6 LEU HD21 H 1 0.739 0.005 . . . . . . B 27 LEU HD21 . 31288 1 288 . 2 . 2 6 6 LEU HD22 H 1 0.739 0.005 . . . . . . B 27 LEU HD22 . 31288 1 289 . 2 . 2 6 6 LEU HD23 H 1 0.739 0.005 . . . . . . B 27 LEU HD23 . 31288 1 290 . 2 . 2 6 6 LEU CA C 13 54.748 0.000 . 1 . . . . B 27 LEU CA . 31288 1 291 . 2 . 2 6 6 LEU CB C 13 45.037 0.000 . 1 . . . . B 27 LEU CB . 31288 1 292 . 2 . 2 6 6 LEU CG C 13 25.729 0.000 . 1 . . . . B 27 LEU CG . 31288 1 293 . 2 . 2 6 6 LEU CD1 C 13 26.337 0.000 . . . . . . B 27 LEU CD1 . 31288 1 294 . 2 . 2 6 6 LEU CD2 C 13 23.462 0.000 . . . . . . B 27 LEU CD2 . 31288 1 295 . 2 . 2 6 6 LEU N N 15 126.899 0.000 . 1 . . . . B 27 LEU N . 31288 1 296 . 2 . 2 7 7 CYS H H 1 8.422 0.003 . 1 . . . . B 28 CYS H . 31288 1 297 . 2 . 2 7 7 CYS HA H 1 5.030 0.003 . 1 . . . . B 28 CYS HA . 31288 1 298 . 2 . 2 7 7 CYS HB2 H 1 2.978 0.004 . . . . . . B 28 CYS HB2 . 31288 1 299 . 2 . 2 7 7 CYS HB3 H 1 3.266 0.003 . . . . . . B 28 CYS HB3 . 31288 1 300 . 2 . 2 7 7 CYS CA C 13 53.917 0.000 . 1 . . . . B 28 CYS CA . 31288 1 301 . 2 . 2 7 7 CYS CB C 13 47.579 0.011 . 1 . . . . B 28 CYS CB . 31288 1 302 . 2 . 2 7 7 CYS N N 15 118.947 0.000 . 1 . . . . B 28 CYS N . 31288 1 303 . 2 . 2 8 8 GLY H H 1 9.389 0.003 . 1 . . . . B 29 GLY H . 31288 1 304 . 2 . 2 8 8 GLY HA2 H 1 4.033 0.003 . . . . . . B 29 GLY HA2 . 31288 1 305 . 2 . 2 8 8 GLY CA C 13 46.593 0.009 . 1 . . . . B 29 GLY CA . 31288 1 306 . 2 . 2 9 9 SER H H 1 9.202 0.004 . 1 . . . . B 30 SER H . 31288 1 307 . 2 . 2 9 9 SER HA H 1 4.167 0.003 . 1 . . . . B 30 SER HA . 31288 1 308 . 2 . 2 9 9 SER HB2 H 1 3.918 0.004 . 2 . . . . B 30 SER HB2 . 31288 1 309 . 2 . 2 9 9 SER HB3 H 1 3.918 0.004 . 2 . . . . B 30 SER HB3 . 31288 1 310 . 2 . 2 9 9 SER CA C 13 60.752 0.000 . 1 . . . . B 30 SER CA . 31288 1 311 . 2 . 2 9 9 SER CB C 13 62.224 0.000 . 1 . . . . B 30 SER CB . 31288 1 312 . 2 . 2 9 9 SER N N 15 122.633 0.000 . 1 . . . . B 30 SER N . 31288 1 313 . 2 . 2 10 10 HIS H H 1 8.044 0.002 . 1 . . . . B 31 HIS H . 31288 1 314 . 2 . 2 10 10 HIS HA H 1 4.540 0.004 . 1 . . . . B 31 HIS HA . 31288 1 315 . 2 . 2 10 10 HIS HB2 H 1 3.324 0.007 . . . . . . B 31 HIS HB2 . 31288 1 316 . 2 . 2 10 10 HIS HB3 H 1 3.602 0.002 . . . . . . B 31 HIS HB3 . 31288 1 317 . 2 . 2 10 10 HIS HD2 H 1 7.503 0.007 . 1 . . . . B 31 HIS HD2 . 31288 1 318 . 2 . 2 10 10 HIS HE1 H 1 8.718 0.002 . 1 . . . . B 31 HIS HE1 . 31288 1 319 . 2 . 2 10 10 HIS CA C 13 57.373 0.000 . 1 . . . . B 31 HIS CA . 31288 1 320 . 2 . 2 10 10 HIS CB C 13 27.864 0.017 . 1 . . . . B 31 HIS CB . 31288 1 321 . 2 . 2 10 10 HIS CD2 C 13 120.021 0.000 . 1 . . . . B 31 HIS CD2 . 31288 1 322 . 2 . 2 10 10 HIS CE1 C 13 136.532 0.000 . 1 . . . . B 31 HIS CE1 . 31288 1 323 . 2 . 2 10 10 HIS N N 15 118.948 0.000 . 1 . . . . B 31 HIS N . 31288 1 324 . 2 . 2 11 11 LEU H H 1 7.084 0.005 . 1 . . . . B 32 LEU H . 31288 1 325 . 2 . 2 11 11 LEU HA H 1 4.040 0.003 . 1 . . . . B 32 LEU HA . 31288 1 326 . 2 . 2 11 11 LEU HB2 H 1 1.253 0.006 . . . . . . B 32 LEU HB2 . 31288 1 327 . 2 . 2 11 11 LEU HB3 H 1 1.921 0.003 . . . . . . B 32 LEU HB3 . 31288 1 328 . 2 . 2 11 11 LEU HG H 1 1.334 0.004 . 1 . . . . B 32 LEU HG . 31288 1 329 . 2 . 2 11 11 LEU HD11 H 1 0.746 0.004 . . . . . . B 32 LEU HD11 . 31288 1 330 . 2 . 2 11 11 LEU HD12 H 1 0.746 0.004 . . . . . . B 32 LEU HD12 . 31288 1 331 . 2 . 2 11 11 LEU HD13 H 1 0.746 0.004 . . . . . . B 32 LEU HD13 . 31288 1 332 . 2 . 2 11 11 LEU HD21 H 1 0.813 0.005 . . . . . . B 32 LEU HD21 . 31288 1 333 . 2 . 2 11 11 LEU HD22 H 1 0.813 0.005 . . . . . . B 32 LEU HD22 . 31288 1 334 . 2 . 2 11 11 LEU HD23 H 1 0.813 0.005 . . . . . . B 32 LEU HD23 . 31288 1 335 . 2 . 2 11 11 LEU CA C 13 57.741 0.000 . 1 . . . . B 32 LEU CA . 31288 1 336 . 2 . 2 11 11 LEU CB C 13 40.074 0.002 . 1 . . . . B 32 LEU CB . 31288 1 337 . 2 . 2 11 11 LEU CG C 13 27.155 0.000 . 1 . . . . B 32 LEU CG . 31288 1 338 . 2 . 2 11 11 LEU CD1 C 13 22.342 0.000 . . . . . . B 32 LEU CD1 . 31288 1 339 . 2 . 2 11 11 LEU CD2 C 13 25.079 0.000 . . . . . . B 32 LEU CD2 . 31288 1 340 . 2 . 2 11 11 LEU N N 15 121.400 0.000 . 1 . . . . B 32 LEU N . 31288 1 341 . 2 . 2 12 12 VAL H H 1 7.131 0.003 . 1 . . . . B 33 VAL H . 31288 1 342 . 2 . 2 12 12 VAL HA H 1 3.316 0.006 . 1 . . . . B 33 VAL HA . 31288 1 343 . 2 . 2 12 12 VAL HB H 1 2.080 0.006 . 1 . . . . B 33 VAL HB . 31288 1 344 . 2 . 2 12 12 VAL HG11 H 1 1.004 0.003 . . . . . . B 33 VAL HG11 . 31288 1 345 . 2 . 2 12 12 VAL HG12 H 1 1.004 0.003 . . . . . . B 33 VAL HG12 . 31288 1 346 . 2 . 2 12 12 VAL HG13 H 1 1.004 0.003 . . . . . . B 33 VAL HG13 . 31288 1 347 . 2 . 2 12 12 VAL HG21 H 1 0.989 0.006 . . . . . . B 33 VAL HG21 . 31288 1 348 . 2 . 2 12 12 VAL HG22 H 1 0.989 0.006 . . . . . . B 33 VAL HG22 . 31288 1 349 . 2 . 2 12 12 VAL HG23 H 1 0.989 0.006 . . . . . . B 33 VAL HG23 . 31288 1 350 . 2 . 2 12 12 VAL CA C 13 66.623 0.000 . 1 . . . . B 33 VAL CA . 31288 1 351 . 2 . 2 12 12 VAL CB C 13 31.507 0.000 . 1 . . . . B 33 VAL CB . 31288 1 352 . 2 . 2 12 12 VAL CG1 C 13 22.234 0.000 . . . . . . B 33 VAL CG1 . 31288 1 353 . 2 . 2 12 12 VAL CG2 C 13 21.286 0.000 . . . . . . B 33 VAL CG2 . 31288 1 354 . 2 . 2 12 12 VAL N N 15 117.236 0.000 . 1 . . . . B 33 VAL N . 31288 1 355 . 2 . 2 13 13 GLU H H 1 7.912 0.002 . 1 . . . . B 34 GLU H . 31288 1 356 . 2 . 2 13 13 GLU HA H 1 4.140 0.003 . 1 . . . . B 34 GLU HA . 31288 1 357 . 2 . 2 13 13 GLU HB2 H 1 2.186 0.003 . . . . . . B 34 GLU HB2 . 31288 1 358 . 2 . 2 13 13 GLU HG2 H 1 2.582 0.004 . 2 . . . . B 34 GLU HG2 . 31288 1 359 . 2 . 2 13 13 GLU HG3 H 1 2.582 0.004 . 2 . . . . B 34 GLU HG3 . 31288 1 360 . 2 . 2 13 13 GLU CA C 13 58.570 0.000 . 1 . . . . B 34 GLU CA . 31288 1 361 . 2 . 2 13 13 GLU CB C 13 27.783 0.012 . 1 . . . . B 34 GLU CB . 31288 1 362 . 2 . 2 13 13 GLU CG C 13 32.597 0.000 . 1 . . . . B 34 GLU CG . 31288 1 363 . 2 . 2 13 13 GLU N N 15 116.619 0.000 . 1 . . . . B 34 GLU N . 31288 1 364 . 2 . 2 14 14 ALA H H 1 7.712 0.003 . 1 . . . . B 35 ALA H . 31288 1 365 . 2 . 2 14 14 ALA HA H 1 4.138 0.004 . 1 . . . . B 35 ALA HA . 31288 1 366 . 2 . 2 14 14 ALA HB1 H 1 1.513 0.005 . 1 . . . . B 35 ALA HB1 . 31288 1 367 . 2 . 2 14 14 ALA HB2 H 1 1.513 0.005 . 1 . . . . B 35 ALA HB2 . 31288 1 368 . 2 . 2 14 14 ALA HB3 H 1 1.513 0.005 . 1 . . . . B 35 ALA HB3 . 31288 1 369 . 2 . 2 14 14 ALA CA C 13 55.182 0.000 . 1 . . . . B 35 ALA CA . 31288 1 370 . 2 . 2 14 14 ALA CB C 13 19.067 0.000 . 1 . . . . B 35 ALA CB . 31288 1 371 . 2 . 2 14 14 ALA N N 15 121.013 0.000 . 1 . . . . B 35 ALA N . 31288 1 372 . 2 . 2 15 15 LEU H H 1 8.063 0.002 . 1 . . . . B 36 LEU H . 31288 1 373 . 2 . 2 15 15 LEU HA H 1 3.880 0.005 . 1 . . . . B 36 LEU HA . 31288 1 374 . 2 . 2 15 15 LEU HB2 H 1 1.275 0.004 . . . . . . B 36 LEU HB2 . 31288 1 375 . 2 . 2 15 15 LEU HB3 H 1 0.752 0.010 . . . . . . B 36 LEU HB3 . 31288 1 376 . 2 . 2 15 15 LEU HG H 1 1.477 0.005 . 1 . . . . B 36 LEU HG . 31288 1 377 . 2 . 2 15 15 LEU HD11 H 1 0.445 0.007 . . . . . . B 36 LEU HD11 . 31288 1 378 . 2 . 2 15 15 LEU HD12 H 1 0.445 0.007 . . . . . . B 36 LEU HD12 . 31288 1 379 . 2 . 2 15 15 LEU HD13 H 1 0.445 0.007 . . . . . . B 36 LEU HD13 . 31288 1 380 . 2 . 2 15 15 LEU HD21 H 1 0.685 0.002 . . . . . . B 36 LEU HD21 . 31288 1 381 . 2 . 2 15 15 LEU HD22 H 1 0.685 0.002 . . . . . . B 36 LEU HD22 . 31288 1 382 . 2 . 2 15 15 LEU HD23 H 1 0.685 0.002 . . . . . . B 36 LEU HD23 . 31288 1 383 . 2 . 2 15 15 LEU CA C 13 57.619 0.000 . 1 . . . . B 36 LEU CA . 31288 1 384 . 2 . 2 15 15 LEU CB C 13 40.585 0.003 . 1 . . . . B 36 LEU CB . 31288 1 385 . 2 . 2 15 15 LEU CG C 13 26.850 0.000 . 1 . . . . B 36 LEU CG . 31288 1 386 . 2 . 2 15 15 LEU CD1 C 13 25.627 0.000 . . . . . . B 36 LEU CD1 . 31288 1 387 . 2 . 2 15 15 LEU CD2 C 13 23.963 0.000 . . . . . . B 36 LEU CD2 . 31288 1 388 . 2 . 2 15 15 LEU N N 15 117.725 0.000 . 1 . . . . B 36 LEU N . 31288 1 389 . 2 . 2 16 16 TYR H H 1 8.151 0.002 . 1 . . . . B 37 TYR H . 31288 1 390 . 2 . 2 16 16 TYR HA H 1 4.297 0.006 . 1 . . . . B 37 TYR HA . 31288 1 391 . 2 . 2 16 16 TYR HB2 H 1 3.161 0.006 . 2 . . . . B 37 TYR HB2 . 31288 1 392 . 2 . 2 16 16 TYR HB3 H 1 3.161 0.006 . 2 . . . . B 37 TYR HB3 . 31288 1 393 . 2 . 2 16 16 TYR HD1 H 1 7.190 0.002 . . . . . . B 37 TYR HD1 . 31288 1 394 . 2 . 2 16 16 TYR HD2 H 1 7.190 0.007 . . . . . . B 37 TYR HD2 . 31288 1 395 . 2 . 2 16 16 TYR HE1 H 1 6.816 0.006 . . . . . . B 37 TYR HE1 . 31288 1 396 . 2 . 2 16 16 TYR HE2 H 1 6.817 0.004 . . . . . . B 37 TYR HE2 . 31288 1 397 . 2 . 2 16 16 TYR CA C 13 61.341 0.000 . 1 . . . . B 37 TYR CA . 31288 1 398 . 2 . 2 16 16 TYR CB C 13 37.828 0.000 . 1 . . . . B 37 TYR CB . 31288 1 399 . 2 . 2 16 16 TYR CD1 C 13 132.946 0.000 . . . . . . B 37 TYR CD1 . 31288 1 400 . 2 . 2 16 16 TYR CD2 C 13 132.946 0.000 . . . . . . B 37 TYR CD2 . 31288 1 401 . 2 . 2 16 16 TYR CE1 C 13 118.084 0.000 . . . . . . B 37 TYR CE1 . 31288 1 402 . 2 . 2 16 16 TYR CE2 C 13 118.084 0.000 . . . . . . B 37 TYR CE2 . 31288 1 403 . 2 . 2 16 16 TYR N N 15 119.247 0.000 . 1 . . . . B 37 TYR N . 31288 1 404 . 2 . 2 17 17 LEU H H 1 7.824 0.002 . 1 . . . . B 38 LEU H . 31288 1 405 . 2 . 2 17 17 LEU HA H 1 4.102 0.003 . 1 . . . . B 38 LEU HA . 31288 1 406 . 2 . 2 17 17 LEU HB2 H 1 1.704 0.006 . . . . . . B 38 LEU HB2 . 31288 1 407 . 2 . 2 17 17 LEU HB3 H 1 1.955 0.005 . . . . . . B 38 LEU HB3 . 31288 1 408 . 2 . 2 17 17 LEU HG H 1 1.856 0.006 . 1 . . . . B 38 LEU HG . 31288 1 409 . 2 . 2 17 17 LEU HD11 H 1 0.974 0.004 . . . . . . B 38 LEU HD11 . 31288 1 410 . 2 . 2 17 17 LEU HD12 H 1 0.974 0.004 . . . . . . B 38 LEU HD12 . 31288 1 411 . 2 . 2 17 17 LEU HD13 H 1 0.974 0.004 . . . . . . B 38 LEU HD13 . 31288 1 412 . 2 . 2 17 17 LEU HD21 H 1 0.948 0.004 . . . . . . B 38 LEU HD21 . 31288 1 413 . 2 . 2 17 17 LEU HD22 H 1 0.948 0.004 . . . . . . B 38 LEU HD22 . 31288 1 414 . 2 . 2 17 17 LEU HD23 H 1 0.948 0.004 . . . . . . B 38 LEU HD23 . 31288 1 415 . 2 . 2 17 17 LEU CA C 13 57.511 0.000 . 1 . . . . B 38 LEU CA . 31288 1 416 . 2 . 2 17 17 LEU CB C 13 42.177 0.005 . 1 . . . . B 38 LEU CB . 31288 1 417 . 2 . 2 17 17 LEU CG C 13 27.021 0.000 . 1 . . . . B 38 LEU CG . 31288 1 418 . 2 . 2 17 17 LEU CD1 C 13 24.820 0.000 . . . . . . B 38 LEU CD1 . 31288 1 419 . 2 . 2 17 17 LEU CD2 C 13 23.420 0.000 . . . . . . B 38 LEU CD2 . 31288 1 420 . 2 . 2 17 17 LEU N N 15 119.159 0.000 . 1 . . . . B 38 LEU N . 31288 1 421 . 2 . 2 18 18 VAL H H 1 8.532 0.002 . 1 . . . . B 39 VAL H . 31288 1 422 . 2 . 2 18 18 VAL HA H 1 3.862 0.004 . 1 . . . . B 39 VAL HA . 31288 1 423 . 2 . 2 18 18 VAL HB H 1 2.111 0.004 . 1 . . . . B 39 VAL HB . 31288 1 424 . 2 . 2 18 18 VAL HG11 H 1 0.887 0.003 . . . . . . B 39 VAL HG11 . 31288 1 425 . 2 . 2 18 18 VAL HG12 H 1 0.887 0.003 . . . . . . B 39 VAL HG12 . 31288 1 426 . 2 . 2 18 18 VAL HG13 H 1 0.887 0.003 . . . . . . B 39 VAL HG13 . 31288 1 427 . 2 . 2 18 18 VAL HG21 H 1 1.033 0.006 . . . . . . B 39 VAL HG21 . 31288 1 428 . 2 . 2 18 18 VAL HG22 H 1 1.033 0.006 . . . . . . B 39 VAL HG22 . 31288 1 429 . 2 . 2 18 18 VAL HG23 H 1 1.033 0.006 . . . . . . B 39 VAL HG23 . 31288 1 430 . 2 . 2 18 18 VAL CA C 13 65.136 0.000 . 1 . . . . B 39 VAL CA . 31288 1 431 . 2 . 2 18 18 VAL CB C 13 32.766 0.000 . 1 . . . . B 39 VAL CB . 31288 1 432 . 2 . 2 18 18 VAL CG1 C 13 21.514 0.000 . . . . . . B 39 VAL CG1 . 31288 1 433 . 2 . 2 18 18 VAL CG2 C 13 22.395 0.000 . . . . . . B 39 VAL CG2 . 31288 1 434 . 2 . 2 18 18 VAL N N 15 117.009 0.000 . 1 . . . . B 39 VAL N . 31288 1 435 . 2 . 2 19 19 CYS H H 1 8.737 0.002 . 1 . . . . B 40 CYS H . 31288 1 436 . 2 . 2 19 19 CYS HA H 1 4.787 0.005 . 1 . . . . B 40 CYS HA . 31288 1 437 . 2 . 2 19 19 CYS HB2 H 1 2.926 0.003 . . . . . . B 40 CYS HB2 . 31288 1 438 . 2 . 2 19 19 CYS HB3 H 1 3.330 0.004 . . . . . . B 40 CYS HB3 . 31288 1 439 . 2 . 2 19 19 CYS CA C 13 54.251 0.000 . 1 . . . . B 40 CYS CA . 31288 1 440 . 2 . 2 19 19 CYS CB C 13 36.435 0.012 . 1 . . . . B 40 CYS CB . 31288 1 441 . 2 . 2 19 19 CYS N N 15 116.130 0.000 . 1 . . . . B 40 CYS N . 31288 1 442 . 2 . 2 20 20 GLY H H 1 7.765 0.002 . 1 . . . . B 41 GLY H . 31288 1 443 . 2 . 2 20 20 GLY HA2 H 1 3.964 0.005 . . . . . . B 41 GLY HA2 . 31288 1 444 . 2 . 2 20 20 GLY CA C 13 46.486 0.001 . 1 . . . . B 41 GLY CA . 31288 1 445 . 2 . 2 20 20 GLY N N 15 108.524 0.000 . 1 . . . . B 41 GLY N . 31288 1 446 . 2 . 2 21 21 GLU H H 1 8.630 0.002 . 1 . . . . B 42 GLU H . 31288 1 447 . 2 . 2 21 21 GLU HA H 1 4.256 0.001 . 1 . . . . B 42 GLU HA . 31288 1 448 . 2 . 2 21 21 GLU HB2 H 1 2.242 0.005 . . . . . . B 42 GLU HB2 . 31288 1 449 . 2 . 2 21 21 GLU HG2 H 1 2.567 0.004 . 2 . . . . B 42 GLU HG2 . 31288 1 450 . 2 . 2 21 21 GLU HG3 H 1 2.567 0.004 . 2 . . . . B 42 GLU HG3 . 31288 1 451 . 2 . 2 21 21 GLU CA C 13 57.251 0.000 . 1 . . . . B 42 GLU CA . 31288 1 452 . 2 . 2 21 21 GLU CB C 13 27.811 0.011 . 1 . . . . B 42 GLU CB . 31288 1 453 . 2 . 2 21 21 GLU CG C 13 32.812 0.000 . 1 . . . . B 42 GLU CG . 31288 1 454 . 2 . 2 21 21 GLU N N 15 122.350 0.000 . 1 . . . . B 42 GLU N . 31288 1 455 . 2 . 2 22 22 ARG H H 1 7.995 0.002 . 1 . . . . B 43 ARG H . 31288 1 456 . 2 . 2 22 22 ARG HA H 1 4.195 0.003 . 1 . . . . B 43 ARG HA . 31288 1 457 . 2 . 2 22 22 ARG HB2 H 1 1.977 0.006 . 2 . . . . B 43 ARG HB2 . 31288 1 458 . 2 . 2 22 22 ARG HB3 H 1 1.977 0.006 . 2 . . . . B 43 ARG HB3 . 31288 1 459 . 2 . 2 22 22 ARG HG2 H 1 1.751 0.003 . . . . . . B 43 ARG HG2 . 31288 1 460 . 2 . 2 22 22 ARG HG3 H 1 1.828 0.003 . . . . . . B 43 ARG HG3 . 31288 1 461 . 2 . 2 22 22 ARG HD2 H 1 3.286 0.005 . 2 . . . . B 43 ARG HD2 . 31288 1 462 . 2 . 2 22 22 ARG HD3 H 1 3.286 0.005 . 2 . . . . B 43 ARG HD3 . 31288 1 463 . 2 . 2 22 22 ARG HE H 1 7.160 0.003 . 1 . . . . B 43 ARG HE . 31288 1 464 . 2 . 2 22 22 ARG CA C 13 57.290 0.000 . 1 . . . . B 43 ARG CA . 31288 1 465 . 2 . 2 22 22 ARG CB C 13 30.839 0.000 . 1 . . . . B 43 ARG CB . 31288 1 466 . 2 . 2 22 22 ARG CG C 13 27.301 0.013 . 1 . . . . B 43 ARG CG . 31288 1 467 . 2 . 2 22 22 ARG CD C 13 43.663 0.000 . 1 . . . . B 43 ARG CD . 31288 1 468 . 2 . 2 22 22 ARG N N 15 118.069 0.000 . 1 . . . . B 43 ARG N . 31288 1 469 . 2 . 2 22 22 ARG NE N 15 84.345 0.000 . 1 . . . . B 43 ARG NE . 31288 1 470 . 2 . 2 23 23 GLY H H 1 7.699 0.003 . 1 . . . . B 44 GLY H . 31288 1 471 . 2 . 2 23 23 GLY HA2 H 1 4.005 0.006 . . . . . . B 44 GLY HA2 . 31288 1 472 . 2 . 2 23 23 GLY CA C 13 44.631 0.009 . 1 . . . . B 44 GLY CA . 31288 1 473 . 2 . 2 23 23 GLY N N 15 104.867 0.000 . 1 . . . . B 44 GLY N . 31288 1 474 . 2 . 2 24 24 PHE H H 1 7.691 0.003 . 1 . . . . B 45 PHE H . 31288 1 475 . 2 . 2 24 24 PHE HA H 1 5.051 0.006 . 1 . . . . B 45 PHE HA . 31288 1 476 . 2 . 2 24 24 PHE HB2 H 1 2.890 0.005 . . . . . . B 45 PHE HB2 . 31288 1 477 . 2 . 2 24 24 PHE HB3 H 1 3.154 0.007 . . . . . . B 45 PHE HB3 . 31288 1 478 . 2 . 2 24 24 PHE HD1 H 1 6.854 0.007 . . . . . . B 45 PHE HD1 . 31288 1 479 . 2 . 2 24 24 PHE HD2 H 1 6.854 0.006 . . . . . . B 45 PHE HD2 . 31288 1 480 . 2 . 2 24 24 PHE HE1 H 1 7.052 0.004 . . . . . . B 45 PHE HE1 . 31288 1 481 . 2 . 2 24 24 PHE HE2 H 1 7.053 0.004 . . . . . . B 45 PHE HE2 . 31288 1 482 . 2 . 2 24 24 PHE HZ H 1 7.098 0.004 . 1 . . . . B 45 PHE HZ . 31288 1 483 . 2 . 2 24 24 PHE CA C 13 56.772 0.000 . 1 . . . . B 45 PHE CA . 31288 1 484 . 2 . 2 24 24 PHE CB C 13 40.820 0.003 . 1 . . . . B 45 PHE CB . 31288 1 485 . 2 . 2 24 24 PHE CD1 C 13 132.287 0.000 . . . . . . B 45 PHE CD1 . 31288 1 486 . 2 . 2 24 24 PHE CD2 C 13 132.287 0.000 . . . . . . B 45 PHE CD2 . 31288 1 487 . 2 . 2 24 24 PHE CE1 C 13 130.900 0.000 . . . . . . B 45 PHE CE1 . 31288 1 488 . 2 . 2 24 24 PHE CE2 C 13 130.900 0.000 . . . . . . B 45 PHE CE2 . 31288 1 489 . 2 . 2 24 24 PHE CZ C 13 129.811 0.000 . 1 . . . . B 45 PHE CZ . 31288 1 490 . 2 . 2 24 24 PHE N N 15 115.880 0.000 . 1 . . . . B 45 PHE N . 31288 1 491 . 2 . 2 25 25 PHE H H 1 8.381 0.002 . 1 . . . . B 46 PHE H . 31288 1 492 . 2 . 2 25 25 PHE HA H 1 4.676 0.005 . 1 . . . . B 46 PHE HA . 31288 1 493 . 2 . 2 25 25 PHE HB2 H 1 3.046 0.008 . . . . . . B 46 PHE HB2 . 31288 1 494 . 2 . 2 25 25 PHE HB3 H 1 3.195 0.005 . . . . . . B 46 PHE HB3 . 31288 1 495 . 2 . 2 25 25 PHE HD1 H 1 7.214 0.006 . . . . . . B 46 PHE HD1 . 31288 1 496 . 2 . 2 25 25 PHE HD2 H 1 7.214 0.005 . . . . . . B 46 PHE HD2 . 31288 1 497 . 2 . 2 25 25 PHE HE1 H 1 7.293 0.003 . . . . . . B 46 PHE HE1 . 31288 1 498 . 2 . 2 25 25 PHE HE2 H 1 7.294 0.002 . . . . . . B 46 PHE HE2 . 31288 1 499 . 2 . 2 25 25 PHE HZ H 1 7.257 0.001 . 1 . . . . B 46 PHE HZ . 31288 1 500 . 2 . 2 25 25 PHE CA C 13 56.839 0.000 . 1 . . . . B 46 PHE CA . 31288 1 501 . 2 . 2 25 25 PHE CB C 13 40.182 0.001 . 1 . . . . B 46 PHE CB . 31288 1 502 . 2 . 2 25 25 PHE CD1 C 13 131.960 0.000 . . . . . . B 46 PHE CD1 . 31288 1 503 . 2 . 2 25 25 PHE CD2 C 13 131.960 0.000 . . . . . . B 46 PHE CD2 . 31288 1 504 . 2 . 2 25 25 PHE CE1 C 13 131.227 0.000 . . . . . . B 46 PHE CE1 . 31288 1 505 . 2 . 2 25 25 PHE CE2 C 13 131.227 0.000 . . . . . . B 46 PHE CE2 . 31288 1 506 . 2 . 2 25 25 PHE CZ C 13 129.670 0.000 . 1 . . . . B 46 PHE CZ . 31288 1 507 . 2 . 2 25 25 PHE N N 15 119.291 0.000 . 1 . . . . B 46 PHE N . 31288 1 508 . 2 . 2 26 26 TYR H H 1 8.128 0.002 . 1 . . . . B 47 TYR H . 31288 1 509 . 2 . 2 26 26 TYR HA H 1 4.676 0.005 . 1 . . . . B 47 TYR HA . 31288 1 510 . 2 . 2 26 26 TYR HB2 H 1 3.003 0.005 . 2 . . . . B 47 TYR HB2 . 31288 1 511 . 2 . 2 26 26 TYR HB3 H 1 3.003 0.005 . 2 . . . . B 47 TYR HB3 . 31288 1 512 . 2 . 2 26 26 TYR HD1 H 1 7.057 0.003 . . . . . . B 47 TYR HD1 . 31288 1 513 . 2 . 2 26 26 TYR HD2 H 1 7.057 0.004 . . . . . . B 47 TYR HD2 . 31288 1 514 . 2 . 2 26 26 TYR HE1 H 1 6.773 0.003 . . . . . . B 47 TYR HE1 . 31288 1 515 . 2 . 2 26 26 TYR HE2 H 1 6.775 0.002 . . . . . . B 47 TYR HE2 . 31288 1 516 . 2 . 2 26 26 TYR CA C 13 58.120 0.000 . 1 . . . . B 47 TYR CA . 31288 1 517 . 2 . 2 26 26 TYR CB C 13 39.131 0.000 . 1 . . . . B 47 TYR CB . 31288 1 518 . 2 . 2 26 26 TYR CD1 C 13 132.839 0.000 . . . . . . B 47 TYR CD1 . 31288 1 519 . 2 . 2 26 26 TYR CD2 C 13 132.839 0.000 . . . . . . B 47 TYR CD2 . 31288 1 520 . 2 . 2 26 26 TYR CE1 C 13 117.986 0.000 . . . . . . B 47 TYR CE1 . 31288 1 521 . 2 . 2 26 26 TYR CE2 C 13 117.986 0.000 . . . . . . B 47 TYR CE2 . 31288 1 522 . 2 . 2 26 26 TYR N N 15 119.824 0.000 . 1 . . . . B 47 TYR N . 31288 1 523 . 2 . 2 27 27 THR H H 1 7.853 0.002 . 1 . . . . B 48 THR H . 31288 1 524 . 2 . 2 27 27 THR HA H 1 4.658 0.005 . 1 . . . . B 48 THR HA . 31288 1 525 . 2 . 2 27 27 THR HB H 1 4.129 0.003 . 1 . . . . B 48 THR HB . 31288 1 526 . 2 . 2 27 27 THR HG21 H 1 1.233 0.004 . 1 . . . . B 48 THR HG21 . 31288 1 527 . 2 . 2 27 27 THR HG22 H 1 1.233 0.004 . 1 . . . . B 48 THR HG22 . 31288 1 528 . 2 . 2 27 27 THR HG23 H 1 1.233 0.004 . 1 . . . . B 48 THR HG23 . 31288 1 529 . 2 . 2 27 27 THR CA C 13 58.829 0.000 . 1 . . . . B 48 THR CA . 31288 1 530 . 2 . 2 27 27 THR CB C 13 69.972 0.000 . 1 . . . . B 48 THR CB . 31288 1 531 . 2 . 2 27 27 THR CG2 C 13 21.196 0.000 . 1 . . . . B 48 THR CG2 . 31288 1 532 . 2 . 2 27 27 THR N N 15 117.691 0.000 . 1 . . . . B 48 THR N . 31288 1 533 . 2 . 2 28 28 PRO HA H 1 4.299 0.005 . 1 . . . . B 49 PRO HA . 31288 1 534 . 2 . 2 28 28 PRO HB2 H 1 1.945 0.009 . . . . . . B 49 PRO HB2 . 31288 1 535 . 2 . 2 28 28 PRO HB3 H 1 2.191 0.006 . . . . . . B 49 PRO HB3 . 31288 1 536 . 2 . 2 28 28 PRO HG2 H 1 1.912 0.004 . . . . . . B 49 PRO HG2 . 31288 1 537 . 2 . 2 28 28 PRO HG3 H 1 2.011 0.001 . . . . . . B 49 PRO HG3 . 31288 1 538 . 2 . 2 28 28 PRO HD2 H 1 3.696 0.006 . 2 . . . . B 49 PRO HD2 . 31288 1 539 . 2 . 2 28 28 PRO HD3 H 1 3.696 0.006 . 2 . . . . B 49 PRO HD3 . 31288 1 540 . 2 . 2 28 28 PRO CA C 13 62.986 0.000 . 1 . . . . B 49 PRO CA . 31288 1 541 . 2 . 2 28 28 PRO CB C 13 32.046 0.000 . 1 . . . . B 49 PRO CB . 31288 1 542 . 2 . 2 28 28 PRO CG C 13 27.281 0.017 . 1 . . . . B 49 PRO CG . 31288 1 543 . 2 . 2 28 28 PRO CD C 13 50.839 0.000 . 1 . . . . B 49 PRO CD . 31288 1 544 . 2 . 2 29 29 LYS H H 1 8.321 0.002 . 1 . . . . B 50 LYS H . 31288 1 545 . 2 . 2 29 29 LYS HA H 1 4.318 0.004 . 1 . . . . B 50 LYS HA . 31288 1 546 . 2 . 2 29 29 LYS HB2 H 1 1.764 0.003 . . . . . . B 50 LYS HB2 . 31288 1 547 . 2 . 2 29 29 LYS HB3 H 1 1.851 0.003 . . . . . . B 50 LYS HB3 . 31288 1 548 . 2 . 2 29 29 LYS HG2 H 1 1.429 0.004 . . . . . . B 50 LYS HG2 . 31288 1 549 . 2 . 2 29 29 LYS HG3 H 1 1.469 0.003 . . . . . . B 50 LYS HG3 . 31288 1 550 . 2 . 2 29 29 LYS HD2 H 1 1.678 0.006 . 2 . . . . B 50 LYS HD2 . 31288 1 551 . 2 . 2 29 29 LYS HD3 H 1 1.678 0.006 . 2 . . . . B 50 LYS HD3 . 31288 1 552 . 2 . 2 29 29 LYS HE2 H 1 2.969 0.005 . 2 . . . . B 50 LYS HE2 . 31288 1 553 . 2 . 2 29 29 LYS HE3 H 1 2.969 0.005 . 2 . . . . B 50 LYS HE3 . 31288 1 554 . 2 . 2 29 29 LYS CA C 13 56.294 0.000 . 1 . . . . B 50 LYS CA . 31288 1 555 . 2 . 2 29 29 LYS CB C 13 32.871 0.016 . 1 . . . . B 50 LYS CB . 31288 1 556 . 2 . 2 29 29 LYS CG C 13 24.849 0.000 . 1 . . . . B 50 LYS CG . 31288 1 557 . 2 . 2 29 29 LYS CD C 13 28.876 0.000 . 1 . . . . B 50 LYS CD . 31288 1 558 . 2 . 2 29 29 LYS CE C 13 41.840 0.000 . 1 . . . . B 50 LYS CE . 31288 1 559 . 2 . 2 29 29 LYS N N 15 120.916 0.000 . 1 . . . . B 50 LYS N . 31288 1 560 . 2 . 2 30 30 THR H H 1 8.042 0.002 . 1 . . . . B 51 THR H . 31288 1 561 . 2 . 2 30 30 THR HA H 1 4.325 0.002 . 1 . . . . B 51 THR HA . 31288 1 562 . 2 . 2 30 30 THR HB H 1 4.196 0.005 . 1 . . . . B 51 THR HB . 31288 1 563 . 2 . 2 30 30 THR HG21 H 1 1.210 0.003 . 1 . . . . B 51 THR HG21 . 31288 1 564 . 2 . 2 30 30 THR HG22 H 1 1.210 0.003 . 1 . . . . B 51 THR HG22 . 31288 1 565 . 2 . 2 30 30 THR HG23 H 1 1.210 0.003 . 1 . . . . B 51 THR HG23 . 31288 1 566 . 2 . 2 30 30 THR CA C 13 61.635 0.000 . 1 . . . . B 51 THR CA . 31288 1 567 . 2 . 2 30 30 THR CB C 13 69.778 0.000 . 1 . . . . B 51 THR CB . 31288 1 568 . 2 . 2 30 30 THR CG2 C 13 21.482 0.000 . 1 . . . . B 51 THR CG2 . 31288 1 569 . 2 . 2 30 30 THR N N 15 114.698 0.000 . 1 . . . . B 51 THR N . 31288 1 570 . 2 . 2 31 31 ARG H H 1 8.314 0.003 . 1 . . . . B 52 ARG H . 31288 1 571 . 2 . 2 31 31 ARG HA H 1 4.401 0.002 . 1 . . . . B 52 ARG HA . 31288 1 572 . 2 . 2 31 31 ARG HB2 H 1 1.779 0.002 . . . . . . B 52 ARG HB2 . 31288 1 573 . 2 . 2 31 31 ARG HB3 H 1 1.901 0.000 . . . . . . B 52 ARG HB3 . 31288 1 574 . 2 . 2 31 31 ARG HG2 H 1 1.771 0.002 . . . . . . B 52 ARG HG2 . 31288 1 575 . 2 . 2 31 31 ARG HG3 H 1 1.661 0.005 . . . . . . B 52 ARG HG3 . 31288 1 576 . 2 . 2 31 31 ARG HD2 H 1 3.211 0.002 . 2 . . . . B 52 ARG HD2 . 31288 1 577 . 2 . 2 31 31 ARG HD3 H 1 3.211 0.002 . 2 . . . . B 52 ARG HD3 . 31288 1 578 . 2 . 2 31 31 ARG HE H 1 7.200 0.002 . 1 . . . . B 52 ARG HE . 31288 1 579 . 2 . 2 31 31 ARG CA C 13 55.813 0.000 . 1 . . . . B 52 ARG CA . 31288 1 580 . 2 . 2 31 31 ARG CB C 13 30.900 0.014 . 1 . . . . B 52 ARG CB . 31288 1 581 . 2 . 2 31 31 ARG CG C 13 26.984 0.000 . 1 . . . . B 52 ARG CG . 31288 1 582 . 2 . 2 31 31 ARG CD C 13 43.077 0.000 . 1 . . . . B 52 ARG CD . 31288 1 583 . 2 . 2 31 31 ARG N N 15 123.502 0.000 . 1 . . . . B 52 ARG N . 31288 1 584 . 2 . 2 31 31 ARG NE N 15 84.469 0.000 . 1 . . . . B 52 ARG NE . 31288 1 585 . 2 . 2 32 32 ARG H H 1 8.351 0.002 . 1 . . . . B 53 ARG H . 31288 1 586 . 2 . 2 32 32 ARG HA H 1 4.368 0.005 . 1 . . . . B 53 ARG HA . 31288 1 587 . 2 . 2 32 32 ARG HB2 H 1 1.777 0.000 . . . . . . B 53 ARG HB2 . 31288 1 588 . 2 . 2 32 32 ARG HB3 H 1 1.937 0.002 . . . . . . B 53 ARG HB3 . 31288 1 589 . 2 . 2 32 32 ARG HG2 H 1 1.772 0.002 . . . . . . B 53 ARG HG2 . 31288 1 590 . 2 . 2 32 32 ARG HG3 H 1 1.651 0.003 . . . . . . B 53 ARG HG3 . 31288 1 591 . 2 . 2 32 32 ARG HD2 H 1 3.205 0.001 . 2 . . . . B 53 ARG HD2 . 31288 1 592 . 2 . 2 32 32 ARG HD3 H 1 3.205 0.001 . 2 . . . . B 53 ARG HD3 . 31288 1 593 . 2 . 2 32 32 ARG HE H 1 7.179 0.001 . 1 . . . . B 53 ARG HE . 31288 1 594 . 2 . 2 32 32 ARG CA C 13 55.465 0.000 . 1 . . . . B 53 ARG CA . 31288 1 595 . 2 . 2 32 32 ARG CB C 13 30.782 0.007 . 1 . . . . B 53 ARG CB . 31288 1 596 . 2 . 2 32 32 ARG CG C 13 27.106 0.000 . 1 . . . . B 53 ARG CG . 31288 1 597 . 2 . 2 32 32 ARG CD C 13 43.259 0.000 . 1 . . . . B 53 ARG CD . 31288 1 598 . 2 . 2 32 32 ARG N N 15 124.219 0.000 . 1 . . . . B 53 ARG N . 31288 1 599 . 2 . 2 32 32 ARG NE N 15 84.469 0.000 . 1 . . . . B 53 ARG NE . 31288 1 stop_ save_