################################### # 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 30220 _Assigned_chem_shift_list.ID 1 _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 '3D 1H-15N NOESY' . . . 30220 1 2 '3D 1H-13C NOESY aliphatic' . . . 30220 1 3 '3D 1H-13C NOESY aromatic' . . . 30220 1 4 '3D HNCACB' . . . 30220 1 5 '3D CBCA(CO)NH' . . . 30220 1 6 '3D CCH-TOCSY' . . . 30220 1 7 '3D HNCO' . . . 30220 1 8 '3D HCCH-COSY' . . . 30220 1 9 '3D HCCH-TOCSY' . . . 30220 1 10 '2D 1H-13C HSQC' . . . 30220 1 11 '2D 1H-13C HSQC' . . . 30220 1 12 '2D 1H-15N HSQC' . . . 30220 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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 MET H H 1 8.4310 0.0000 . 1 . . . . A 1 MET H1 . 30220 1 2 . 1 1 1 1 MET HA H 1 4.6920 0.0000 . 1 . . . . A 1 MET HA . 30220 1 3 . 1 1 1 1 MET HB2 H 1 2.0060 0.0000 . 2 . . . . A 1 MET HB2 . 30220 1 4 . 1 1 1 1 MET HB3 H 1 1.8920 0.0000 . 2 . . . . A 1 MET HB3 . 30220 1 5 . 1 1 1 1 MET HG2 H 1 2.4860 0.0000 . 2 . . . . A 1 MET HG2 . 30220 1 6 . 1 1 1 1 MET HG3 H 1 2.3860 0.0000 . 2 . . . . A 1 MET HG3 . 30220 1 7 . 1 1 1 1 MET C C 13 174.3000 0.0000 . 1 . . . . A 1 MET C . 30220 1 8 . 1 1 1 1 MET CA C 13 54.5510 0.0000 . 1 . . . . A 1 MET CA . 30220 1 9 . 1 1 1 1 MET CB C 13 35.3270 0.0000 . 1 . . . . A 1 MET CB . 30220 1 10 . 1 1 1 1 MET CG C 13 31.8910 0.0000 . 1 . . . . A 1 MET CG . 30220 1 11 . 1 1 1 1 MET N N 15 120.2630 0.0000 . 1 . . . . A 1 MET N . 30220 1 12 . 1 1 2 2 THR H H 1 8.1060 0.0000 . 1 . . . . A 2 THR H . 30220 1 13 . 1 1 2 2 THR HA H 1 4.7460 0.0000 . 1 . . . . A 2 THR HA . 30220 1 14 . 1 1 2 2 THR HB H 1 3.8700 0.0000 . 1 . . . . A 2 THR HB . 30220 1 15 . 1 1 2 2 THR HG21 H 1 1.1700 0.0000 . 1 . . . . A 2 THR HG21 . 30220 1 16 . 1 1 2 2 THR HG22 H 1 1.1700 0.0000 . 1 . . . . A 2 THR HG22 . 30220 1 17 . 1 1 2 2 THR HG23 H 1 1.1700 0.0000 . 1 . . . . A 2 THR HG23 . 30220 1 18 . 1 1 2 2 THR C C 13 174.1460 0.0000 . 1 . . . . A 2 THR C . 30220 1 19 . 1 1 2 2 THR CA C 13 63.0740 0.0000 . 1 . . . . A 2 THR CA . 30220 1 20 . 1 1 2 2 THR CB C 13 69.2910 0.0000 . 1 . . . . A 2 THR CB . 30220 1 21 . 1 1 2 2 THR CG2 C 13 21.7050 0.0000 . 1 . . . . A 2 THR CG2 . 30220 1 22 . 1 1 2 2 THR N N 15 117.0980 0.0000 . 1 . . . . A 2 THR N . 30220 1 23 . 1 1 3 3 PHE H H 1 9.4120 0.0000 . 1 . . . . A 3 PHE H . 30220 1 24 . 1 1 3 3 PHE HA H 1 5.3320 0.0000 . 1 . . . . A 3 PHE HA . 30220 1 25 . 1 1 3 3 PHE HB2 H 1 3.0660 0.0000 . 2 . . . . A 3 PHE HB2 . 30220 1 26 . 1 1 3 3 PHE HB3 H 1 2.8400 0.0000 . 2 . . . . A 3 PHE HB3 . 30220 1 27 . 1 1 3 3 PHE HD1 H 1 7.3220 0.0000 . 3 . . . . A 3 PHE HD1 . 30220 1 28 . 1 1 3 3 PHE HE1 H 1 6.3160 0.0000 . 3 . . . . A 3 PHE HE1 . 30220 1 29 . 1 1 3 3 PHE HZ H 1 5.9120 0.0000 . 1 . . . . A 3 PHE HZ . 30220 1 30 . 1 1 3 3 PHE C C 13 174.0930 0.0000 . 1 . . . . A 3 PHE C . 30220 1 31 . 1 1 3 3 PHE CA C 13 56.7690 0.0000 . 1 . . . . A 3 PHE CA . 30220 1 32 . 1 1 3 3 PHE CB C 13 43.2520 0.0000 . 1 . . . . A 3 PHE CB . 30220 1 33 . 1 1 3 3 PHE N N 15 126.5380 0.0000 . 1 . . . . A 3 PHE N . 30220 1 34 . 1 1 4 4 LYS H H 1 8.7130 0.0000 . 1 . . . . A 4 LYS H . 30220 1 35 . 1 1 4 4 LYS HA H 1 5.1430 0.0000 . 1 . . . . A 4 LYS HA . 30220 1 36 . 1 1 4 4 LYS HB2 H 1 2.0500 0.0000 . 2 . . . . A 4 LYS HB2 . 30220 1 37 . 1 1 4 4 LYS HB3 H 1 1.8720 0.0000 . 2 . . . . A 4 LYS HB3 . 30220 1 38 . 1 1 4 4 LYS HG2 H 1 1.5130 0.0000 . 2 . . . . A 4 LYS HG2 . 30220 1 39 . 1 1 4 4 LYS HD2 H 1 1.6440 0.0000 . 2 . . . . A 4 LYS HD2 . 30220 1 40 . 1 1 4 4 LYS HE2 H 1 2.8910 0.0000 . 2 . . . . A 4 LYS HE2 . 30220 1 41 . 1 1 4 4 LYS HE3 H 1 2.7990 0.0000 . 2 . . . . A 4 LYS HE3 . 30220 1 42 . 1 1 4 4 LYS C C 13 173.8040 0.0000 . 1 . . . . A 4 LYS C . 30220 1 43 . 1 1 4 4 LYS CA C 13 54.7130 0.0000 . 1 . . . . A 4 LYS CA . 30220 1 44 . 1 1 4 4 LYS CB C 13 35.7770 0.0000 . 1 . . . . A 4 LYS CB . 30220 1 45 . 1 1 4 4 LYS CG C 13 25.4130 0.0000 . 1 . . . . A 4 LYS CG . 30220 1 46 . 1 1 4 4 LYS CD C 13 29.0750 0.0000 . 1 . . . . A 4 LYS CD . 30220 1 47 . 1 1 4 4 LYS CE C 13 41.8130 0.0000 . 1 . . . . A 4 LYS CE . 30220 1 48 . 1 1 4 4 LYS N N 15 122.3650 0.0000 . 1 . . . . A 4 LYS N . 30220 1 49 . 1 1 5 5 LEU H H 1 9.0000 0.0000 . 1 . . . . A 5 LEU H . 30220 1 50 . 1 1 5 5 LEU HA H 1 5.5270 0.0000 . 1 . . . . A 5 LEU HA . 30220 1 51 . 1 1 5 5 LEU HB2 H 1 1.7370 0.0000 . 2 . . . . A 5 LEU HB2 . 30220 1 52 . 1 1 5 5 LEU HB3 H 1 1.4130 0.0000 . 2 . . . . A 5 LEU HB3 . 30220 1 53 . 1 1 5 5 LEU HG H 1 1.2300 0.0000 . 1 . . . . A 5 LEU HG . 30220 1 54 . 1 1 5 5 LEU HD11 H 1 0.9020 0.0000 . 2 . . . . A 5 LEU HD11 . 30220 1 55 . 1 1 5 5 LEU HD12 H 1 0.9020 0.0000 . 2 . . . . A 5 LEU HD12 . 30220 1 56 . 1 1 5 5 LEU HD13 H 1 0.9020 0.0000 . 2 . . . . A 5 LEU HD13 . 30220 1 57 . 1 1 5 5 LEU HD21 H 1 0.7110 0.0000 . 2 . . . . A 5 LEU HD21 . 30220 1 58 . 1 1 5 5 LEU HD22 H 1 0.7110 0.0000 . 2 . . . . A 5 LEU HD22 . 30220 1 59 . 1 1 5 5 LEU HD23 H 1 0.7110 0.0000 . 2 . . . . A 5 LEU HD23 . 30220 1 60 . 1 1 5 5 LEU C C 13 174.7070 0.0000 . 1 . . . . A 5 LEU C . 30220 1 61 . 1 1 5 5 LEU CA C 13 53.0230 0.0000 . 1 . . . . A 5 LEU CA . 30220 1 62 . 1 1 5 5 LEU CB C 13 46.7030 0.0000 . 1 . . . . A 5 LEU CB . 30220 1 63 . 1 1 5 5 LEU CG C 13 27.4090 0.0000 . 1 . . . . A 5 LEU CG . 30220 1 64 . 1 1 5 5 LEU CD1 C 13 26.5470 0.0000 . 2 . . . . A 5 LEU CD1 . 30220 1 65 . 1 1 5 5 LEU CD2 C 13 25.3800 0.0000 . 2 . . . . A 5 LEU CD2 . 30220 1 66 . 1 1 5 5 LEU N N 15 125.2070 0.0000 . 1 . . . . A 5 LEU N . 30220 1 67 . 1 1 6 6 ILE H H 1 9.3260 0.0000 . 1 . . . . A 6 ILE H . 30220 1 68 . 1 1 6 6 ILE HA H 1 4.3530 0.0000 . 1 . . . . A 6 ILE HA . 30220 1 69 . 1 1 6 6 ILE HB H 1 2.0750 0.0000 . 1 . . . . A 6 ILE HB . 30220 1 70 . 1 1 6 6 ILE HG12 H 1 1.4900 0.0000 . 2 . . . . A 6 ILE HG12 . 30220 1 71 . 1 1 6 6 ILE HG13 H 1 1.1920 0.0000 . 2 . . . . A 6 ILE HG13 . 30220 1 72 . 1 1 6 6 ILE HG21 H 1 0.8600 0.0000 . 1 . . . . A 6 ILE HG21 . 30220 1 73 . 1 1 6 6 ILE HG22 H 1 0.8600 0.0000 . 1 . . . . A 6 ILE HG22 . 30220 1 74 . 1 1 6 6 ILE HG23 H 1 0.8600 0.0000 . 1 . . . . A 6 ILE HG23 . 30220 1 75 . 1 1 6 6 ILE HD11 H 1 0.8310 0.0000 . 1 . . . . A 6 ILE HD11 . 30220 1 76 . 1 1 6 6 ILE HD12 H 1 0.8310 0.0000 . 1 . . . . A 6 ILE HD12 . 30220 1 77 . 1 1 6 6 ILE HD13 H 1 0.8310 0.0000 . 1 . . . . A 6 ILE HD13 . 30220 1 78 . 1 1 6 6 ILE C C 13 174.6520 0.0000 . 1 . . . . A 6 ILE C . 30220 1 79 . 1 1 6 6 ILE CA C 13 60.5530 0.0000 . 1 . . . . A 6 ILE CA . 30220 1 80 . 1 1 6 6 ILE CB C 13 38.0730 0.0000 . 1 . . . . A 6 ILE CB . 30220 1 81 . 1 1 6 6 ILE CG1 C 13 27.5060 0.0000 . 1 . . . . A 6 ILE CG1 . 30220 1 82 . 1 1 6 6 ILE CG2 C 13 17.0460 0.0000 . 1 . . . . A 6 ILE CG2 . 30220 1 83 . 1 1 6 6 ILE CD1 C 13 12.6530 0.0000 . 1 . . . . A 6 ILE CD1 . 30220 1 84 . 1 1 6 6 ILE N N 15 127.1950 0.0000 . 1 . . . . A 6 ILE N . 30220 1 85 . 1 1 7 7 ILE H H 1 8.7770 0.0000 . 1 . . . . A 7 ILE H . 30220 1 86 . 1 1 7 7 ILE HA H 1 4.1220 0.0000 . 1 . . . . A 7 ILE HA . 30220 1 87 . 1 1 7 7 ILE HB H 1 1.5650 0.0000 . 1 . . . . A 7 ILE HB . 30220 1 88 . 1 1 7 7 ILE HG12 H 1 1.4520 0.0000 . 2 . . . . A 7 ILE HG12 . 30220 1 89 . 1 1 7 7 ILE HG13 H 1 0.6630 0.0000 . 2 . . . . A 7 ILE HG13 . 30220 1 90 . 1 1 7 7 ILE HG21 H 1 0.7700 0.0000 . 1 . . . . A 7 ILE HG21 . 30220 1 91 . 1 1 7 7 ILE HG22 H 1 0.7700 0.0000 . 1 . . . . A 7 ILE HG22 . 30220 1 92 . 1 1 7 7 ILE HG23 H 1 0.7700 0.0000 . 1 . . . . A 7 ILE HG23 . 30220 1 93 . 1 1 7 7 ILE HD11 H 1 0.8350 0.0000 . 1 . . . . A 7 ILE HD11 . 30220 1 94 . 1 1 7 7 ILE HD12 H 1 0.8350 0.0000 . 1 . . . . A 7 ILE HD12 . 30220 1 95 . 1 1 7 7 ILE HD13 H 1 0.8350 0.0000 . 1 . . . . A 7 ILE HD13 . 30220 1 96 . 1 1 7 7 ILE C C 13 174.9280 0.0000 . 1 . . . . A 7 ILE C . 30220 1 97 . 1 1 7 7 ILE CA C 13 60.6740 0.0000 . 1 . . . . A 7 ILE CA . 30220 1 98 . 1 1 7 7 ILE CB C 13 39.2690 0.0000 . 1 . . . . A 7 ILE CB . 30220 1 99 . 1 1 7 7 ILE CG1 C 13 27.9800 0.0000 . 1 . . . . A 7 ILE CG1 . 30220 1 100 . 1 1 7 7 ILE CG2 C 13 18.4320 0.0000 . 1 . . . . A 7 ILE CG2 . 30220 1 101 . 1 1 7 7 ILE CD1 C 13 14.4830 0.0000 . 1 . . . . A 7 ILE CD1 . 30220 1 102 . 1 1 7 7 ILE N N 15 126.4110 0.0000 . 1 . . . . A 7 ILE N . 30220 1 103 . 1 1 8 8 ASN H H 1 8.9910 0.0000 . 1 . . . . A 8 ASN H . 30220 1 104 . 1 1 8 8 ASN HA H 1 5.3430 0.0000 . 1 . . . . A 8 ASN HA . 30220 1 105 . 1 1 8 8 ASN HB2 H 1 3.0340 0.0000 . 2 . . . . A 8 ASN HB2 . 30220 1 106 . 1 1 8 8 ASN HB3 H 1 2.5760 0.0000 . 2 . . . . A 8 ASN HB3 . 30220 1 107 . 1 1 8 8 ASN HD21 H 1 7.1740 0.0000 . 2 . . . . A 8 ASN HD21 . 30220 1 108 . 1 1 8 8 ASN HD22 H 1 6.8340 0.0000 . 2 . . . . A 8 ASN HD22 . 30220 1 109 . 1 1 8 8 ASN C C 13 175.7750 0.0000 . 1 . . . . A 8 ASN C . 30220 1 110 . 1 1 8 8 ASN CA C 13 50.8430 0.0000 . 1 . . . . A 8 ASN CA . 30220 1 111 . 1 1 8 8 ASN CB C 13 37.7070 0.0000 . 1 . . . . A 8 ASN CB . 30220 1 112 . 1 1 8 8 ASN N N 15 129.4670 0.0000 . 1 . . . . A 8 ASN N . 30220 1 113 . 1 1 8 8 ASN ND2 N 15 111.5640 0.0000 . 1 . . . . A 8 ASN ND2 . 30220 1 114 . 1 1 9 9 GLY H H 1 7.9510 0.0000 . 1 . . . . A 9 GLY H . 30220 1 115 . 1 1 9 9 GLY HA2 H 1 4.4810 0.0000 . 2 . . . . A 9 GLY HA2 . 30220 1 116 . 1 1 9 9 GLY HA3 H 1 4.1160 0.0000 . 2 . . . . A 9 GLY HA3 . 30220 1 117 . 1 1 9 9 GLY C C 13 173.7300 0.0000 . 1 . . . . A 9 GLY C . 30220 1 118 . 1 1 9 9 GLY CA C 13 44.5810 0.0000 . 1 . . . . A 9 GLY CA . 30220 1 119 . 1 1 9 9 GLY N N 15 110.5110 0.0000 . 1 . . . . A 9 GLY N . 30220 1 120 . 1 1 10 10 LYS H H 1 9.5520 0.0000 . 1 . . . . A 10 LYS H . 30220 1 121 . 1 1 10 10 LYS HA H 1 4.1120 0.0000 . 1 . . . . A 10 LYS HA . 30220 1 122 . 1 1 10 10 LYS HB2 H 1 1.8630 0.0000 . 2 . . . . A 10 LYS HB2 . 30220 1 123 . 1 1 10 10 LYS HG2 H 1 1.5060 0.0000 . 2 . . . . A 10 LYS HG2 . 30220 1 124 . 1 1 10 10 LYS HD2 H 1 1.7230 0.0000 . 2 . . . . A 10 LYS HD2 . 30220 1 125 . 1 1 10 10 LYS HE2 H 1 3.0370 0.0000 . 2 . . . . A 10 LYS HE2 . 30220 1 126 . 1 1 10 10 LYS C C 13 179.0800 0.0000 . 1 . . . . A 10 LYS C . 30220 1 127 . 1 1 10 10 LYS CA C 13 59.3350 0.0000 . 1 . . . . A 10 LYS CA . 30220 1 128 . 1 1 10 10 LYS CB C 13 32.4910 0.0000 . 1 . . . . A 10 LYS CB . 30220 1 129 . 1 1 10 10 LYS CG C 13 25.4040 0.0000 . 1 . . . . A 10 LYS CG . 30220 1 130 . 1 1 10 10 LYS CD C 13 29.0060 0.0000 . 1 . . . . A 10 LYS CD . 30220 1 131 . 1 1 10 10 LYS CE C 13 41.8500 0.0000 . 1 . . . . A 10 LYS CE . 30220 1 132 . 1 1 10 10 LYS N N 15 121.1710 0.0000 . 1 . . . . A 10 LYS N . 30220 1 133 . 1 1 11 11 THR H H 1 8.8650 0.0000 . 1 . . . . A 11 THR H . 30220 1 134 . 1 1 11 11 THR HA H 1 4.4050 0.0000 . 1 . . . . A 11 THR HA . 30220 1 135 . 1 1 11 11 THR HB H 1 4.2320 0.0000 . 1 . . . . A 11 THR HB . 30220 1 136 . 1 1 11 11 THR HG21 H 1 1.1550 0.0000 . 1 . . . . A 11 THR HG21 . 30220 1 137 . 1 1 11 11 THR HG22 H 1 1.1550 0.0000 . 1 . . . . A 11 THR HG22 . 30220 1 138 . 1 1 11 11 THR HG23 H 1 1.1550 0.0000 . 1 . . . . A 11 THR HG23 . 30220 1 139 . 1 1 11 11 THR C C 13 173.7980 0.0000 . 1 . . . . A 11 THR C . 30220 1 140 . 1 1 11 11 THR CA C 13 61.9020 0.0000 . 1 . . . . A 11 THR CA . 30220 1 141 . 1 1 11 11 THR CB C 13 69.8640 0.0000 . 1 . . . . A 11 THR CB . 30220 1 142 . 1 1 11 11 THR CG2 C 13 21.7040 0.0000 . 1 . . . . A 11 THR CG2 . 30220 1 143 . 1 1 11 11 THR N N 15 108.8860 0.0000 . 1 . . . . A 11 THR N . 30220 1 144 . 1 1 12 12 LEU H H 1 7.5920 0.0000 . 1 . . . . A 12 LEU H . 30220 1 145 . 1 1 12 12 LEU HA H 1 4.4820 0.0000 . 1 . . . . A 12 LEU HA . 30220 1 146 . 1 1 12 12 LEU HB2 H 1 1.6770 0.0000 . 2 . . . . A 12 LEU HB2 . 30220 1 147 . 1 1 12 12 LEU HB3 H 1 1.4800 0.0000 . 2 . . . . A 12 LEU HB3 . 30220 1 148 . 1 1 12 12 LEU HG H 1 1.4130 0.0000 . 1 . . . . A 12 LEU HG . 30220 1 149 . 1 1 12 12 LEU HD11 H 1 0.8570 0.0000 . 2 . . . . A 12 LEU HD11 . 30220 1 150 . 1 1 12 12 LEU HD12 H 1 0.8570 0.0000 . 2 . . . . A 12 LEU HD12 . 30220 1 151 . 1 1 12 12 LEU HD13 H 1 0.8570 0.0000 . 2 . . . . A 12 LEU HD13 . 30220 1 152 . 1 1 12 12 LEU HD21 H 1 0.9360 0.0000 . 2 . . . . A 12 LEU HD21 . 30220 1 153 . 1 1 12 12 LEU HD22 H 1 0.9360 0.0000 . 2 . . . . A 12 LEU HD22 . 30220 1 154 . 1 1 12 12 LEU HD23 H 1 0.9360 0.0000 . 2 . . . . A 12 LEU HD23 . 30220 1 155 . 1 1 12 12 LEU C C 13 173.6440 0.0000 . 1 . . . . A 12 LEU C . 30220 1 156 . 1 1 12 12 LEU CA C 13 55.0620 0.0000 . 1 . . . . A 12 LEU CA . 30220 1 157 . 1 1 12 12 LEU CB C 13 43.6340 0.0000 . 1 . . . . A 12 LEU CB . 30220 1 158 . 1 1 12 12 LEU CG C 13 27.4490 0.0000 . 1 . . . . A 12 LEU CG . 30220 1 159 . 1 1 12 12 LEU CD1 C 13 24.9500 0.0000 . 2 . . . . A 12 LEU CD1 . 30220 1 160 . 1 1 12 12 LEU CD2 C 13 23.9520 0.0000 . 2 . . . . A 12 LEU CD2 . 30220 1 161 . 1 1 12 12 LEU N N 15 125.6930 0.0000 . 1 . . . . A 12 LEU N . 30220 1 162 . 1 1 13 13 LYS H H 1 8.1560 0.0000 . 1 . . . . A 13 LYS H . 30220 1 163 . 1 1 13 13 LYS HA H 1 5.1860 0.0000 . 1 . . . . A 13 LYS HA . 30220 1 164 . 1 1 13 13 LYS HB2 H 1 1.9400 0.0000 . 2 . . . . A 13 LYS HB2 . 30220 1 165 . 1 1 13 13 LYS HB3 H 1 1.7930 0.0000 . 2 . . . . A 13 LYS HB3 . 30220 1 166 . 1 1 13 13 LYS HG2 H 1 1.5010 0.0000 . 2 . . . . A 13 LYS HG2 . 30220 1 167 . 1 1 13 13 LYS HD2 H 1 1.7500 0.0000 . 2 . . . . A 13 LYS HD2 . 30220 1 168 . 1 1 13 13 LYS HE2 H 1 3.0440 0.0000 . 2 . . . . A 13 LYS HE2 . 30220 1 169 . 1 1 13 13 LYS HE3 H 1 2.9340 0.0000 . 2 . . . . A 13 LYS HE3 . 30220 1 170 . 1 1 13 13 LYS C C 13 176.5130 0.0000 . 1 . . . . A 13 LYS C . 30220 1 171 . 1 1 13 13 LYS CA C 13 53.7510 0.0000 . 1 . . . . A 13 LYS CA . 30220 1 172 . 1 1 13 13 LYS CB C 13 34.4580 0.0000 . 1 . . . . A 13 LYS CB . 30220 1 173 . 1 1 13 13 LYS CG C 13 25.1930 0.0000 . 1 . . . . A 13 LYS CG . 30220 1 174 . 1 1 13 13 LYS CD C 13 29.2010 0.0000 . 1 . . . . A 13 LYS CD . 30220 1 175 . 1 1 13 13 LYS CE C 13 42.5020 0.0000 . 1 . . . . A 13 LYS CE . 30220 1 176 . 1 1 13 13 LYS N N 15 123.6400 0.0000 . 1 . . . . A 13 LYS N . 30220 1 177 . 1 1 14 14 GLY H H 1 8.3860 0.0000 . 1 . . . . A 14 GLY H . 30220 1 178 . 1 1 14 14 GLY HA2 H 1 4.3400 0.0000 . 2 . . . . A 14 GLY HA2 . 30220 1 179 . 1 1 14 14 GLY HA3 H 1 4.1510 0.0000 . 2 . . . . A 14 GLY HA3 . 30220 1 180 . 1 1 14 14 GLY C C 13 171.4460 0.0000 . 1 . . . . A 14 GLY C . 30220 1 181 . 1 1 14 14 GLY CA C 13 45.2700 0.0000 . 1 . . . . A 14 GLY CA . 30220 1 182 . 1 1 14 14 GLY N N 15 109.3780 0.0000 . 1 . . . . A 14 GLY N . 30220 1 183 . 1 1 15 15 GLU H H 1 8.4910 0.0000 . 1 . . . . A 15 GLU H . 30220 1 184 . 1 1 15 15 GLU HA H 1 5.6710 0.0000 . 1 . . . . A 15 GLU HA . 30220 1 185 . 1 1 15 15 GLU HB2 H 1 2.1260 0.0000 . 2 . . . . A 15 GLU HB2 . 30220 1 186 . 1 1 15 15 GLU HB3 H 1 1.9710 0.0000 . 2 . . . . A 15 GLU HB3 . 30220 1 187 . 1 1 15 15 GLU HG2 H 1 2.2140 0.0000 . 2 . . . . A 15 GLU HG2 . 30220 1 188 . 1 1 15 15 GLU C C 13 175.2860 0.0000 . 1 . . . . A 15 GLU C . 30220 1 189 . 1 1 15 15 GLU CA C 13 54.8930 0.0000 . 1 . . . . A 15 GLU CA . 30220 1 190 . 1 1 15 15 GLU CB C 13 34.1830 0.0000 . 1 . . . . A 15 GLU CB . 30220 1 191 . 1 1 15 15 GLU CG C 13 35.7770 0.0000 . 1 . . . . A 15 GLU CG . 30220 1 192 . 1 1 15 15 GLU N N 15 118.5950 0.0000 . 1 . . . . A 15 GLU N . 30220 1 193 . 1 1 16 16 THR H H 1 8.8050 0.0000 . 1 . . . . A 16 THR H . 30220 1 194 . 1 1 16 16 THR HA H 1 4.7100 0.0000 . 1 . . . . A 16 THR HA . 30220 1 195 . 1 1 16 16 THR HB H 1 3.8020 0.0000 . 1 . . . . A 16 THR HB . 30220 1 196 . 1 1 16 16 THR HG21 H 1 0.3400 0.0000 . 1 . . . . A 16 THR HG21 . 30220 1 197 . 1 1 16 16 THR HG22 H 1 0.3400 0.0000 . 1 . . . . A 16 THR HG22 . 30220 1 198 . 1 1 16 16 THR HG23 H 1 0.3400 0.0000 . 1 . . . . A 16 THR HG23 . 30220 1 199 . 1 1 16 16 THR C C 13 171.9850 0.0000 . 1 . . . . A 16 THR C . 30220 1 200 . 1 1 16 16 THR CA C 13 60.8660 0.0000 . 1 . . . . A 16 THR CA . 30220 1 201 . 1 1 16 16 THR CB C 13 69.2920 0.0000 . 1 . . . . A 16 THR CB . 30220 1 202 . 1 1 16 16 THR CG2 C 13 18.4760 0.0000 . 1 . . . . A 16 THR CG2 . 30220 1 203 . 1 1 16 16 THR N N 15 115.4560 0.0000 . 1 . . . . A 16 THR N . 30220 1 204 . 1 1 17 17 THR H H 1 7.8970 0.0000 . 1 . . . . A 17 THR H . 30220 1 205 . 1 1 17 17 THR HA H 1 5.6300 0.0000 . 1 . . . . A 17 THR HA . 30220 1 206 . 1 1 17 17 THR HB H 1 2.5200 0.0000 . 1 . . . . A 17 THR HB . 30220 1 207 . 1 1 17 17 THR HG21 H 1 1.1410 0.0000 . 1 . . . . A 17 THR HG21 . 30220 1 208 . 1 1 17 17 THR HG22 H 1 1.1410 0.0000 . 1 . . . . A 17 THR HG22 . 30220 1 209 . 1 1 17 17 THR HG23 H 1 1.1410 0.0000 . 1 . . . . A 17 THR HG23 . 30220 1 210 . 1 1 17 17 THR C C 13 173.7650 0.0000 . 1 . . . . A 17 THR C . 30220 1 211 . 1 1 17 17 THR CA C 13 59.4560 0.0000 . 1 . . . . A 17 THR CA . 30220 1 212 . 1 1 17 17 THR CB C 13 71.7780 0.0000 . 1 . . . . A 17 THR CB . 30220 1 213 . 1 1 17 17 THR CG2 C 13 21.4430 0.0000 . 1 . . . . A 17 THR CG2 . 30220 1 214 . 1 1 17 17 THR N N 15 111.7140 0.0000 . 1 . . . . A 17 THR N . 30220 1 215 . 1 1 18 18 THR H H 1 9.0810 0.0000 . 1 . . . . A 18 THR H . 30220 1 216 . 1 1 18 18 THR HA H 1 4.6960 0.0000 . 1 . . . . A 18 THR HA . 30220 1 217 . 1 1 18 18 THR HG21 H 1 1.0280 0.0000 . 1 . . . . A 18 THR HG21 . 30220 1 218 . 1 1 18 18 THR HG22 H 1 1.0280 0.0000 . 1 . . . . A 18 THR HG22 . 30220 1 219 . 1 1 18 18 THR HG23 H 1 1.0280 0.0000 . 1 . . . . A 18 THR HG23 . 30220 1 220 . 1 1 18 18 THR C C 13 171.0260 0.0000 . 1 . . . . A 18 THR C . 30220 1 221 . 1 1 18 18 THR CA C 13 61.6940 0.0000 . 1 . . . . A 18 THR CA . 30220 1 222 . 1 1 18 18 THR CG2 C 13 18.6570 0.0000 . 1 . . . . A 18 THR CG2 . 30220 1 223 . 1 1 18 18 THR N N 15 114.7690 0.0000 . 1 . . . . A 18 THR N . 30220 1 224 . 1 1 19 19 GLU H H 1 8.0770 0.0000 . 1 . . . . A 19 GLU H . 30220 1 225 . 1 1 19 19 GLU HA H 1 5.5600 0.0000 . 1 . . . . A 19 GLU HA . 30220 1 226 . 1 1 19 19 GLU HB2 H 1 1.9410 0.0000 . 2 . . . . A 19 GLU HB2 . 30220 1 227 . 1 1 19 19 GLU HG2 H 1 2.1150 0.0000 . 2 . . . . A 19 GLU HG2 . 30220 1 228 . 1 1 19 19 GLU C C 13 176.4760 0.0000 . 1 . . . . A 19 GLU C . 30220 1 229 . 1 1 19 19 GLU CA C 13 54.7560 0.0000 . 1 . . . . A 19 GLU CA . 30220 1 230 . 1 1 19 19 GLU CB C 13 31.2470 0.0000 . 1 . . . . A 19 GLU CB . 30220 1 231 . 1 1 19 19 GLU CG C 13 36.5250 0.0000 . 1 . . . . A 19 GLU CG . 30220 1 232 . 1 1 19 19 GLU N N 15 125.4000 0.0000 . 1 . . . . A 19 GLU N . 30220 1 233 . 1 1 20 20 ALA H H 1 9.4000 0.0000 . 1 . . . . A 20 ALA H . 30220 1 234 . 1 1 20 20 ALA HA H 1 4.9530 0.0000 . 1 . . . . A 20 ALA HA . 30220 1 235 . 1 1 20 20 ALA HB1 H 1 1.4510 0.0000 . 1 . . . . A 20 ALA HB1 . 30220 1 236 . 1 1 20 20 ALA HB2 H 1 1.4510 0.0000 . 1 . . . . A 20 ALA HB2 . 30220 1 237 . 1 1 20 20 ALA HB3 H 1 1.4510 0.0000 . 1 . . . . A 20 ALA HB3 . 30220 1 238 . 1 1 20 20 ALA C C 13 177.3520 0.0000 . 1 . . . . A 20 ALA C . 30220 1 239 . 1 1 20 20 ALA CA C 13 51.1530 0.0000 . 1 . . . . A 20 ALA CA . 30220 1 240 . 1 1 20 20 ALA CB C 13 23.6830 0.0000 . 1 . . . . A 20 ALA CB . 30220 1 241 . 1 1 20 20 ALA N N 15 125.4350 0.0000 . 1 . . . . A 20 ALA N . 30220 1 242 . 1 1 21 21 VAL H H 1 8.5580 0.0000 . 1 . . . . A 21 VAL H . 30220 1 243 . 1 1 21 21 VAL HA H 1 4.1950 0.0000 . 1 . . . . A 21 VAL HA . 30220 1 244 . 1 1 21 21 VAL HB H 1 2.2250 0.0000 . 1 . . . . A 21 VAL HB . 30220 1 245 . 1 1 21 21 VAL HG11 H 1 1.0100 0.0000 . 2 . . . . A 21 VAL HG11 . 30220 1 246 . 1 1 21 21 VAL HG12 H 1 1.0100 0.0000 . 2 . . . . A 21 VAL HG12 . 30220 1 247 . 1 1 21 21 VAL HG13 H 1 1.0100 0.0000 . 2 . . . . A 21 VAL HG13 . 30220 1 248 . 1 1 21 21 VAL HG21 H 1 1.0130 0.0000 . 2 . . . . A 21 VAL HG21 . 30220 1 249 . 1 1 21 21 VAL HG22 H 1 1.0130 0.0000 . 2 . . . . A 21 VAL HG22 . 30220 1 250 . 1 1 21 21 VAL HG23 H 1 1.0130 0.0000 . 2 . . . . A 21 VAL HG23 . 30220 1 251 . 1 1 21 21 VAL C C 13 174.7640 0.0000 . 1 . . . . A 21 VAL C . 30220 1 252 . 1 1 21 21 VAL CA C 13 63.6020 0.0000 . 1 . . . . A 21 VAL CA . 30220 1 253 . 1 1 21 21 VAL CB C 13 32.1740 0.0000 . 1 . . . . A 21 VAL CB . 30220 1 254 . 1 1 21 21 VAL CG1 C 13 20.9270 0.0000 . 2 . . . . A 21 VAL CG1 . 30220 1 255 . 1 1 21 21 VAL CG2 C 13 19.9660 0.0000 . 2 . . . . A 21 VAL CG2 . 30220 1 256 . 1 1 21 21 VAL N N 15 114.4750 0.0000 . 1 . . . . A 21 VAL N . 30220 1 257 . 1 1 22 22 ASP H H 1 7.3280 0.0000 . 1 . . . . A 22 ASP H . 30220 1 258 . 1 1 22 22 ASP HA H 1 4.7200 0.0000 . 1 . . . . A 22 ASP HA . 30220 1 259 . 1 1 22 22 ASP HB2 H 1 3.0620 0.0000 . 2 . . . . A 22 ASP HB2 . 30220 1 260 . 1 1 22 22 ASP C C 13 174.3420 0.0000 . 1 . . . . A 22 ASP C . 30220 1 261 . 1 1 22 22 ASP CA C 13 52.5550 0.0000 . 1 . . . . A 22 ASP CA . 30220 1 262 . 1 1 22 22 ASP CB C 13 42.4870 0.0000 . 1 . . . . A 22 ASP CB . 30220 1 263 . 1 1 22 22 ASP N N 15 113.6880 0.0000 . 1 . . . . A 22 ASP N . 30220 1 264 . 1 1 23 23 ALA H H 1 8.7270 0.0000 . 1 . . . . A 23 ALA H . 30220 1 265 . 1 1 23 23 ALA HA H 1 4.1900 0.0000 . 1 . . . . A 23 ALA HA . 30220 1 266 . 1 1 23 23 ALA HB1 H 1 1.2220 0.0000 . 1 . . . . A 23 ALA HB1 . 30220 1 267 . 1 1 23 23 ALA HB2 H 1 1.2220 0.0000 . 1 . . . . A 23 ALA HB2 . 30220 1 268 . 1 1 23 23 ALA HB3 H 1 1.2220 0.0000 . 1 . . . . A 23 ALA HB3 . 30220 1 269 . 1 1 23 23 ALA C C 13 179.0280 0.0000 . 1 . . . . A 23 ALA C . 30220 1 270 . 1 1 23 23 ALA CA C 13 54.8260 0.0000 . 1 . . . . A 23 ALA CA . 30220 1 271 . 1 1 23 23 ALA CB C 13 17.5470 0.0000 . 1 . . . . A 23 ALA CB . 30220 1 272 . 1 1 23 23 ALA N N 15 121.8730 0.0000 . 1 . . . . A 23 ALA N . 30220 1 273 . 1 1 24 24 ALA H H 1 8.1630 0.0000 . 1 . . . . A 24 ALA H . 30220 1 274 . 1 1 24 24 ALA HA H 1 4.0010 0.0000 . 1 . . . . A 24 ALA HA . 30220 1 275 . 1 1 24 24 ALA HB1 H 1 1.3300 0.0000 . 1 . . . . A 24 ALA HB1 . 30220 1 276 . 1 1 24 24 ALA HB2 H 1 1.3300 0.0000 . 1 . . . . A 24 ALA HB2 . 30220 1 277 . 1 1 24 24 ALA HB3 H 1 1.3300 0.0000 . 1 . . . . A 24 ALA HB3 . 30220 1 278 . 1 1 24 24 ALA C C 13 181.0180 0.0000 . 1 . . . . A 24 ALA C . 30220 1 279 . 1 1 24 24 ALA CA C 13 54.9140 0.0000 . 1 . . . . A 24 ALA CA . 30220 1 280 . 1 1 24 24 ALA CB C 13 17.8840 0.0000 . 1 . . . . A 24 ALA CB . 30220 1 281 . 1 1 24 24 ALA N N 15 121.1880 0.0000 . 1 . . . . A 24 ALA N . 30220 1 282 . 1 1 25 25 THR H H 1 8.3650 0.0000 . 1 . . . . A 25 THR H . 30220 1 283 . 1 1 25 25 THR HA H 1 3.7750 0.0000 . 1 . . . . A 25 THR HA . 30220 1 284 . 1 1 25 25 THR HB H 1 4.0580 0.0000 . 1 . . . . A 25 THR HB . 30220 1 285 . 1 1 25 25 THR HG21 H 1 1.2950 0.0000 . 1 . . . . A 25 THR HG21 . 30220 1 286 . 1 1 25 25 THR HG22 H 1 1.2950 0.0000 . 1 . . . . A 25 THR HG22 . 30220 1 287 . 1 1 25 25 THR HG23 H 1 1.2950 0.0000 . 1 . . . . A 25 THR HG23 . 30220 1 288 . 1 1 25 25 THR C C 13 176.2260 0.0000 . 1 . . . . A 25 THR C . 30220 1 289 . 1 1 25 25 THR CA C 13 66.6030 0.0000 . 1 . . . . A 25 THR CA . 30220 1 290 . 1 1 25 25 THR CB C 13 68.0230 0.0000 . 1 . . . . A 25 THR CB . 30220 1 291 . 1 1 25 25 THR CG2 C 13 21.2330 0.0000 . 1 . . . . A 25 THR CG2 . 30220 1 292 . 1 1 25 25 THR N N 15 116.4030 0.0000 . 1 . . . . A 25 THR N . 30220 1 293 . 1 1 26 26 ALA H H 1 7.5380 0.0000 . 1 . . . . A 26 ALA H . 30220 1 294 . 1 1 26 26 ALA HA H 1 3.4590 0.0000 . 1 . . . . A 26 ALA HA . 30220 1 295 . 1 1 26 26 ALA HB1 H 1 0.6110 0.0000 . 1 . . . . A 26 ALA HB1 . 30220 1 296 . 1 1 26 26 ALA HB2 H 1 0.6110 0.0000 . 1 . . . . A 26 ALA HB2 . 30220 1 297 . 1 1 26 26 ALA HB3 H 1 0.6110 0.0000 . 1 . . . . A 26 ALA HB3 . 30220 1 298 . 1 1 26 26 ALA C C 13 178.0900 0.0000 . 1 . . . . A 26 ALA C . 30220 1 299 . 1 1 26 26 ALA CA C 13 54.8630 0.0000 . 1 . . . . A 26 ALA CA . 30220 1 300 . 1 1 26 26 ALA CB C 13 18.1530 0.0000 . 1 . . . . A 26 ALA CB . 30220 1 301 . 1 1 26 26 ALA N N 15 123.2760 0.0000 . 1 . . . . A 26 ALA N . 30220 1 302 . 1 1 27 27 GLU H H 1 8.4020 0.0000 . 1 . . . . A 27 GLU H . 30220 1 303 . 1 1 27 27 GLU HA H 1 2.5420 0.0000 . 1 . . . . A 27 GLU HA . 30220 1 304 . 1 1 27 27 GLU HB2 H 1 1.9540 0.0000 . 2 . . . . A 27 GLU HB2 . 30220 1 305 . 1 1 27 27 GLU HB3 H 1 1.7870 0.0000 . 2 . . . . A 27 GLU HB3 . 30220 1 306 . 1 1 27 27 GLU HG2 H 1 1.5540 0.0000 . 2 . . . . A 27 GLU HG2 . 30220 1 307 . 1 1 27 27 GLU C C 13 177.1180 0.0000 . 1 . . . . A 27 GLU C . 30220 1 308 . 1 1 27 27 GLU CA C 13 59.4370 0.0000 . 1 . . . . A 27 GLU CA . 30220 1 309 . 1 1 27 27 GLU CB C 13 29.3060 0.0000 . 1 . . . . A 27 GLU CB . 30220 1 310 . 1 1 27 27 GLU CG C 13 35.6780 0.0000 . 1 . . . . A 27 GLU CG . 30220 1 311 . 1 1 27 27 GLU N N 15 117.1110 0.0000 . 1 . . . . A 27 GLU N . 30220 1 312 . 1 1 28 28 LYS H H 1 6.8610 0.0000 . 1 . . . . A 28 LYS H . 30220 1 313 . 1 1 28 28 LYS HA H 1 3.7250 0.0000 . 1 . . . . A 28 LYS HA . 30220 1 314 . 1 1 28 28 LYS HB2 H 1 1.8720 0.0000 . 2 . . . . A 28 LYS HB2 . 30220 1 315 . 1 1 28 28 LYS HG2 H 1 1.5550 0.0000 . 2 . . . . A 28 LYS HG2 . 30220 1 316 . 1 1 28 28 LYS HD2 H 1 1.6420 0.0000 . 2 . . . . A 28 LYS HD2 . 30220 1 317 . 1 1 28 28 LYS HE2 H 1 2.9430 0.0000 . 2 . . . . A 28 LYS HE2 . 30220 1 318 . 1 1 28 28 LYS C C 13 179.8560 0.0000 . 1 . . . . A 28 LYS C . 30220 1 319 . 1 1 28 28 LYS CA C 13 59.5220 0.0000 . 1 . . . . A 28 LYS CA . 30220 1 320 . 1 1 28 28 LYS CB C 13 32.4070 0.0000 . 1 . . . . A 28 LYS CB . 30220 1 321 . 1 1 28 28 LYS CG C 13 24.7660 0.0000 . 1 . . . . A 28 LYS CG . 30220 1 322 . 1 1 28 28 LYS CD C 13 29.0230 0.0000 . 1 . . . . A 28 LYS CD . 30220 1 323 . 1 1 28 28 LYS CE C 13 41.8570 0.0000 . 1 . . . . A 28 LYS CE . 30220 1 324 . 1 1 28 28 LYS N N 15 116.1900 0.0000 . 1 . . . . A 28 LYS N . 30220 1 325 . 1 1 29 29 VAL H H 1 7.4650 0.0000 . 1 . . . . A 29 VAL H . 30220 1 326 . 1 1 29 29 VAL HA H 1 3.7040 0.0000 . 1 . . . . A 29 VAL HA . 30220 1 327 . 1 1 29 29 VAL HB H 1 2.0270 0.0000 . 1 . . . . A 29 VAL HB . 30220 1 328 . 1 1 29 29 VAL HG11 H 1 1.0750 0.0000 . 2 . . . . A 29 VAL HG11 . 30220 1 329 . 1 1 29 29 VAL HG12 H 1 1.0750 0.0000 . 2 . . . . A 29 VAL HG12 . 30220 1 330 . 1 1 29 29 VAL HG13 H 1 1.0750 0.0000 . 2 . . . . A 29 VAL HG13 . 30220 1 331 . 1 1 29 29 VAL HG21 H 1 0.9910 0.0000 . 2 . . . . A 29 VAL HG21 . 30220 1 332 . 1 1 29 29 VAL HG22 H 1 0.9910 0.0000 . 2 . . . . A 29 VAL HG22 . 30220 1 333 . 1 1 29 29 VAL HG23 H 1 0.9910 0.0000 . 2 . . . . A 29 VAL HG23 . 30220 1 334 . 1 1 29 29 VAL C C 13 179.2770 0.0000 . 1 . . . . A 29 VAL C . 30220 1 335 . 1 1 29 29 VAL CA C 13 65.9060 0.0000 . 1 . . . . A 29 VAL CA . 30220 1 336 . 1 1 29 29 VAL CB C 13 32.5070 0.0000 . 1 . . . . A 29 VAL CB . 30220 1 337 . 1 1 29 29 VAL CG1 C 13 21.8690 0.0000 . 2 . . . . A 29 VAL CG1 . 30220 1 338 . 1 1 29 29 VAL CG2 C 13 20.6950 0.0000 . 2 . . . . A 29 VAL CG2 . 30220 1 339 . 1 1 29 29 VAL N N 15 119.7940 0.0000 . 1 . . . . A 29 VAL N . 30220 1 340 . 1 1 30 30 LEU H H 1 8.7070 0.0000 . 1 . . . . A 30 LEU H . 30220 1 341 . 1 1 30 30 LEU HA H 1 4.1640 0.0000 . 1 . . . . A 30 LEU HA . 30220 1 342 . 1 1 30 30 LEU HB2 H 1 1.5420 0.0000 . 2 . . . . A 30 LEU HB2 . 30220 1 343 . 1 1 30 30 LEU HB3 H 1 1.4710 0.0000 . 2 . . . . A 30 LEU HB3 . 30220 1 344 . 1 1 30 30 LEU HG H 1 1.4700 0.0000 . 1 . . . . A 30 LEU HG . 30220 1 345 . 1 1 30 30 LEU HD11 H 1 0.6120 0.0000 . 2 . . . . A 30 LEU HD11 . 30220 1 346 . 1 1 30 30 LEU HD12 H 1 0.6120 0.0000 . 2 . . . . A 30 LEU HD12 . 30220 1 347 . 1 1 30 30 LEU HD13 H 1 0.6120 0.0000 . 2 . . . . A 30 LEU HD13 . 30220 1 348 . 1 1 30 30 LEU C C 13 179.0310 0.0000 . 1 . . . . A 30 LEU C . 30220 1 349 . 1 1 30 30 LEU CA C 13 57.4960 0.0000 . 1 . . . . A 30 LEU CA . 30220 1 350 . 1 1 30 30 LEU CB C 13 40.5060 0.0000 . 1 . . . . A 30 LEU CB . 30220 1 351 . 1 1 30 30 LEU CG C 13 26.3990 0.0000 . 1 . . . . A 30 LEU CG . 30220 1 352 . 1 1 30 30 LEU CD1 C 13 21.1220 0.0000 . 2 . . . . A 30 LEU CD1 . 30220 1 353 . 1 1 30 30 LEU N N 15 121.9030 0.0000 . 1 . . . . A 30 LEU N . 30220 1 354 . 1 1 31 31 LYS H H 1 8.6790 0.0000 . 1 . . . . A 31 LYS H . 30220 1 355 . 1 1 31 31 LYS HA H 1 4.1010 0.0000 . 1 . . . . A 31 LYS HA . 30220 1 356 . 1 1 31 31 LYS HB2 H 1 1.5030 0.0000 . 2 . . . . A 31 LYS HB2 . 30220 1 357 . 1 1 31 31 LYS HB3 H 1 1.4060 0.0000 . 2 . . . . A 31 LYS HB3 . 30220 1 358 . 1 1 31 31 LYS HG2 H 1 0.5960 0.0000 . 2 . . . . A 31 LYS HG2 . 30220 1 359 . 1 1 31 31 LYS HG3 H 1 0.1100 0.0000 . 2 . . . . A 31 LYS HG3 . 30220 1 360 . 1 1 31 31 LYS HD2 H 1 0.9890 0.0000 . 2 . . . . A 31 LYS HD2 . 30220 1 361 . 1 1 31 31 LYS HD3 H 1 0.9320 0.0000 . 2 . . . . A 31 LYS HD3 . 30220 1 362 . 1 1 31 31 LYS HE2 H 1 1.7910 0.0000 . 2 . . . . A 31 LYS HE2 . 30220 1 363 . 1 1 31 31 LYS HE3 H 1 1.5950 0.0000 . 2 . . . . A 31 LYS HE3 . 30220 1 364 . 1 1 31 31 LYS C C 13 179.4810 0.0000 . 1 . . . . A 31 LYS C . 30220 1 365 . 1 1 31 31 LYS CA C 13 59.8030 0.0000 . 1 . . . . A 31 LYS CA . 30220 1 366 . 1 1 31 31 LYS CB C 13 31.6530 0.0000 . 1 . . . . A 31 LYS CB . 30220 1 367 . 1 1 31 31 LYS CG C 13 25.5770 0.0000 . 1 . . . . A 31 LYS CG . 30220 1 368 . 1 1 31 31 LYS CD C 13 28.9540 0.0000 . 1 . . . . A 31 LYS CD . 30220 1 369 . 1 1 31 31 LYS CE C 13 41.0190 0.0000 . 1 . . . . A 31 LYS CE . 30220 1 370 . 1 1 31 31 LYS N N 15 121.1910 0.0000 . 1 . . . . A 31 LYS N . 30220 1 371 . 1 1 32 32 GLN H H 1 7.4460 0.0000 . 1 . . . . A 32 GLN H . 30220 1 372 . 1 1 32 32 GLN HA H 1 3.9960 0.0000 . 1 . . . . A 32 GLN HA . 30220 1 373 . 1 1 32 32 GLN HB2 H 1 2.2270 0.0000 . 2 . . . . A 32 GLN HB2 . 30220 1 374 . 1 1 32 32 GLN HG2 H 1 2.4190 0.0000 . 2 . . . . A 32 GLN HG2 . 30220 1 375 . 1 1 32 32 GLN HE21 H 1 7.9440 0.0000 . 2 . . . . A 32 GLN HE21 . 30220 1 376 . 1 1 32 32 GLN HE22 H 1 6.8910 0.0000 . 2 . . . . A 32 GLN HE22 . 30220 1 377 . 1 1 32 32 GLN C C 13 177.2440 0.0000 . 1 . . . . A 32 GLN C . 30220 1 378 . 1 1 32 32 GLN CA C 13 58.6970 0.0000 . 1 . . . . A 32 GLN CA . 30220 1 379 . 1 1 32 32 GLN CB C 13 27.8620 0.0000 . 1 . . . . A 32 GLN CB . 30220 1 380 . 1 1 32 32 GLN CG C 13 33.4200 0.0000 . 1 . . . . A 32 GLN CG . 30220 1 381 . 1 1 32 32 GLN N N 15 120.2030 0.0000 . 1 . . . . A 32 GLN N . 30220 1 382 . 1 1 32 32 GLN NE2 N 15 115.7750 0.0000 . 1 . . . . A 32 GLN NE2 . 30220 1 383 . 1 1 33 33 TYR H H 1 7.9930 0.0000 . 1 . . . . A 33 TYR H . 30220 1 384 . 1 1 33 33 TYR HA H 1 4.2250 0.0000 . 1 . . . . A 33 TYR HA . 30220 1 385 . 1 1 33 33 TYR HB2 H 1 3.3690 0.0000 . 2 . . . . A 33 TYR HB2 . 30220 1 386 . 1 1 33 33 TYR HB3 H 1 3.1500 0.0000 . 2 . . . . A 33 TYR HB3 . 30220 1 387 . 1 1 33 33 TYR HD1 H 1 6.9520 0.0000 . 3 . . . . A 33 TYR HD1 . 30220 1 388 . 1 1 33 33 TYR HE1 H 1 6.7100 0.0000 . 3 . . . . A 33 TYR HE1 . 30220 1 389 . 1 1 33 33 TYR C C 13 178.8830 0.0000 . 1 . . . . A 33 TYR C . 30220 1 390 . 1 1 33 33 TYR CA C 13 61.7310 0.0000 . 1 . . . . A 33 TYR CA . 30220 1 391 . 1 1 33 33 TYR CB C 13 37.6820 0.0000 . 1 . . . . A 33 TYR CB . 30220 1 392 . 1 1 33 33 TYR N N 15 120.8130 0.0000 . 1 . . . . A 33 TYR N . 30220 1 393 . 1 1 34 34 ALA H H 1 8.6520 0.0000 . 1 . . . . A 34 ALA H . 30220 1 394 . 1 1 34 34 ALA HA H 1 3.8630 0.0000 . 1 . . . . A 34 ALA HA . 30220 1 395 . 1 1 34 34 ALA HB1 H 1 1.8650 0.0000 . 1 . . . . A 34 ALA HB1 . 30220 1 396 . 1 1 34 34 ALA HB2 H 1 1.8650 0.0000 . 1 . . . . A 34 ALA HB2 . 30220 1 397 . 1 1 34 34 ALA HB3 H 1 1.8650 0.0000 . 1 . . . . A 34 ALA HB3 . 30220 1 398 . 1 1 34 34 ALA C C 13 179.4230 0.0000 . 1 . . . . A 34 ALA C . 30220 1 399 . 1 1 34 34 ALA CA C 13 56.1540 0.0000 . 1 . . . . A 34 ALA CA . 30220 1 400 . 1 1 34 34 ALA CB C 13 17.8560 0.0000 . 1 . . . . A 34 ALA CB . 30220 1 401 . 1 1 34 34 ALA N N 15 122.9320 0.0000 . 1 . . . . A 34 ALA N . 30220 1 402 . 1 1 35 35 ASN H H 1 8.6220 0.0000 . 1 . . . . A 35 ASN H . 30220 1 403 . 1 1 35 35 ASN HA H 1 4.4620 0.0000 . 1 . . . . A 35 ASN HA . 30220 1 404 . 1 1 35 35 ASN HB2 H 1 2.9270 0.0000 . 2 . . . . A 35 ASN HB2 . 30220 1 405 . 1 1 35 35 ASN HD21 H 1 7.5800 0.0000 . 2 . . . . A 35 ASN HD21 . 30220 1 406 . 1 1 35 35 ASN HD22 H 1 6.9370 0.0000 . 2 . . . . A 35 ASN HD22 . 30220 1 407 . 1 1 35 35 ASN C C 13 179.3320 0.0000 . 1 . . . . A 35 ASN C . 30220 1 408 . 1 1 35 35 ASN CA C 13 56.7340 0.0000 . 1 . . . . A 35 ASN CA . 30220 1 409 . 1 1 35 35 ASN CB C 13 38.6230 0.0000 . 1 . . . . A 35 ASN CB . 30220 1 410 . 1 1 35 35 ASN N N 15 118.7540 0.0000 . 1 . . . . A 35 ASN N . 30220 1 411 . 1 1 35 35 ASN ND2 N 15 111.7020 0.0000 . 1 . . . . A 35 ASN ND2 . 30220 1 412 . 1 1 36 36 ASP H H 1 8.9380 0.0000 . 1 . . . . A 36 ASP H . 30220 1 413 . 1 1 36 36 ASP HA H 1 4.3830 0.0000 . 1 . . . . A 36 ASP HA . 30220 1 414 . 1 1 36 36 ASP HB2 H 1 2.7220 0.0000 . 2 . . . . A 36 ASP HB2 . 30220 1 415 . 1 1 36 36 ASP HB3 H 1 2.5830 0.0000 . 2 . . . . A 36 ASP HB3 . 30220 1 416 . 1 1 36 36 ASP C C 13 177.0920 0.0000 . 1 . . . . A 36 ASP C . 30220 1 417 . 1 1 36 36 ASP CA C 13 56.8100 0.0000 . 1 . . . . A 36 ASP CA . 30220 1 418 . 1 1 36 36 ASP CB C 13 40.0360 0.0000 . 1 . . . . A 36 ASP CB . 30220 1 419 . 1 1 36 36 ASP N N 15 121.8720 0.0000 . 1 . . . . A 36 ASP N . 30220 1 420 . 1 1 37 37 ASN H H 1 7.3890 0.0000 . 1 . . . . A 37 ASN H . 30220 1 421 . 1 1 37 37 ASN HA H 1 4.6400 0.0000 . 1 . . . . A 37 ASN HA . 30220 1 422 . 1 1 37 37 ASN HB2 H 1 2.7180 0.0000 . 2 . . . . A 37 ASN HB2 . 30220 1 423 . 1 1 37 37 ASN HB3 H 1 2.1490 0.0000 . 2 . . . . A 37 ASN HB3 . 30220 1 424 . 1 1 37 37 ASN HD21 H 1 6.6360 0.0000 . 2 . . . . A 37 ASN HD21 . 30220 1 425 . 1 1 37 37 ASN HD22 H 1 6.3260 0.0000 . 2 . . . . A 37 ASN HD22 . 30220 1 426 . 1 1 37 37 ASN C C 13 173.9670 0.0000 . 1 . . . . A 37 ASN C . 30220 1 427 . 1 1 37 37 ASN CA C 13 53.6770 0.0000 . 1 . . . . A 37 ASN CA . 30220 1 428 . 1 1 37 37 ASN CB C 13 39.9850 0.0000 . 1 . . . . A 37 ASN CB . 30220 1 429 . 1 1 37 37 ASN N N 15 115.9990 0.0000 . 1 . . . . A 37 ASN N . 30220 1 430 . 1 1 37 37 ASN ND2 N 15 115.2010 0.0000 . 1 . . . . A 37 ASN ND2 . 30220 1 431 . 1 1 38 38 GLY H H 1 7.8490 0.0000 . 1 . . . . A 38 GLY H . 30220 1 432 . 1 1 38 38 GLY HA2 H 1 3.9310 0.0000 . 2 . . . . A 38 GLY HA2 . 30220 1 433 . 1 1 38 38 GLY C C 13 174.2000 0.0000 . 1 . . . . A 38 GLY C . 30220 1 434 . 1 1 38 38 GLY CA C 13 46.8470 0.0000 . 1 . . . . A 38 GLY CA . 30220 1 435 . 1 1 38 38 GLY N N 15 108.2640 0.0000 . 1 . . . . A 38 GLY N . 30220 1 436 . 1 1 39 39 ILE H H 1 8.0940 0.0000 . 1 . . . . A 39 ILE H . 30220 1 437 . 1 1 39 39 ILE HA H 1 4.2590 0.0000 . 1 . . . . A 39 ILE HA . 30220 1 438 . 1 1 39 39 ILE HB H 1 1.7660 0.0000 . 1 . . . . A 39 ILE HB . 30220 1 439 . 1 1 39 39 ILE HG12 H 1 1.2410 0.0000 . 2 . . . . A 39 ILE HG12 . 30220 1 440 . 1 1 39 39 ILE HG21 H 1 0.6990 0.0000 . 1 . . . . A 39 ILE HG21 . 30220 1 441 . 1 1 39 39 ILE HG22 H 1 0.6990 0.0000 . 1 . . . . A 39 ILE HG22 . 30220 1 442 . 1 1 39 39 ILE HG23 H 1 0.6990 0.0000 . 1 . . . . A 39 ILE HG23 . 30220 1 443 . 1 1 39 39 ILE HD11 H 1 0.7650 0.0000 . 1 . . . . A 39 ILE HD11 . 30220 1 444 . 1 1 39 39 ILE HD12 H 1 0.7650 0.0000 . 1 . . . . A 39 ILE HD12 . 30220 1 445 . 1 1 39 39 ILE HD13 H 1 0.7650 0.0000 . 1 . . . . A 39 ILE HD13 . 30220 1 446 . 1 1 39 39 ILE C C 13 174.6620 0.0000 . 1 . . . . A 39 ILE C . 30220 1 447 . 1 1 39 39 ILE CA C 13 59.2160 0.0000 . 1 . . . . A 39 ILE CA . 30220 1 448 . 1 1 39 39 ILE CB C 13 38.1630 0.0000 . 1 . . . . A 39 ILE CB . 30220 1 449 . 1 1 39 39 ILE CG1 C 13 26.7130 0.0000 . 1 . . . . A 39 ILE CG1 . 30220 1 450 . 1 1 39 39 ILE CG2 C 13 17.9770 0.0000 . 1 . . . . A 39 ILE CG2 . 30220 1 451 . 1 1 39 39 ILE CD1 C 13 12.3150 0.0000 . 1 . . . . A 39 ILE CD1 . 30220 1 452 . 1 1 39 39 ILE N N 15 121.1170 0.0000 . 1 . . . . A 39 ILE N . 30220 1 453 . 1 1 40 40 ASP H H 1 8.8530 0.0000 . 1 . . . . A 40 ASP H . 30220 1 454 . 1 1 40 40 ASP HA H 1 4.9380 0.0000 . 1 . . . . A 40 ASP HA . 30220 1 455 . 1 1 40 40 ASP HB2 H 1 2.7740 0.0000 . 2 . . . . A 40 ASP HB2 . 30220 1 456 . 1 1 40 40 ASP HB3 H 1 2.5750 0.0000 . 2 . . . . A 40 ASP HB3 . 30220 1 457 . 1 1 40 40 ASP C C 13 174.3320 0.0000 . 1 . . . . A 40 ASP C . 30220 1 458 . 1 1 40 40 ASP CA C 13 52.8530 0.0000 . 1 . . . . A 40 ASP CA . 30220 1 459 . 1 1 40 40 ASP CB C 13 43.1030 0.0000 . 1 . . . . A 40 ASP CB . 30220 1 460 . 1 1 40 40 ASP N N 15 128.6940 0.0000 . 1 . . . . A 40 ASP N . 30220 1 461 . 1 1 41 41 GLY H H 1 8.0470 0.0000 . 1 . . . . A 41 GLY H . 30220 1 462 . 1 1 41 41 GLY HA2 H 1 4.3400 0.0000 . 2 . . . . A 41 GLY HA2 . 30220 1 463 . 1 1 41 41 GLY HA3 H 1 3.6550 0.0000 . 2 . . . . A 41 GLY HA3 . 30220 1 464 . 1 1 41 41 GLY C C 13 171.9350 0.0000 . 1 . . . . A 41 GLY C . 30220 1 465 . 1 1 41 41 GLY CA C 13 45.2760 0.0000 . 1 . . . . A 41 GLY CA . 30220 1 466 . 1 1 41 41 GLY N N 15 107.5990 0.0000 . 1 . . . . A 41 GLY N . 30220 1 467 . 1 1 42 42 GLU H H 1 8.2340 0.0000 . 1 . . . . A 42 GLU H . 30220 1 468 . 1 1 42 42 GLU HA H 1 4.7460 0.0000 . 1 . . . . A 42 GLU HA . 30220 1 469 . 1 1 42 42 GLU HB2 H 1 2.0830 0.0000 . 2 . . . . A 42 GLU HB2 . 30220 1 470 . 1 1 42 42 GLU HB3 H 1 1.9950 0.0000 . 2 . . . . A 42 GLU HB3 . 30220 1 471 . 1 1 42 42 GLU HG2 H 1 2.3790 0.0000 . 2 . . . . A 42 GLU HG2 . 30220 1 472 . 1 1 42 42 GLU HG3 H 1 2.2760 0.0000 . 2 . . . . A 42 GLU HG3 . 30220 1 473 . 1 1 42 42 GLU C C 13 177.0930 0.0000 . 1 . . . . A 42 GLU C . 30220 1 474 . 1 1 42 42 GLU CA C 13 55.5010 0.0000 . 1 . . . . A 42 GLU CA . 30220 1 475 . 1 1 42 42 GLU CB C 13 31.5700 0.0000 . 1 . . . . A 42 GLU CB . 30220 1 476 . 1 1 42 42 GLU CG C 13 35.7100 0.0000 . 1 . . . . A 42 GLU CG . 30220 1 477 . 1 1 42 42 GLU N N 15 120.4540 0.0000 . 1 . . . . A 42 GLU N . 30220 1 478 . 1 1 43 43 TRP H H 1 9.3550 0.0000 . 1 . . . . A 43 TRP H . 30220 1 479 . 1 1 43 43 TRP HA H 1 5.4090 0.0000 . 1 . . . . A 43 TRP HA . 30220 1 480 . 1 1 43 43 TRP HB2 H 1 3.3450 0.0000 . 2 . . . . A 43 TRP HB2 . 30220 1 481 . 1 1 43 43 TRP HB3 H 1 3.1590 0.0000 . 2 . . . . A 43 TRP HB3 . 30220 1 482 . 1 1 43 43 TRP HD1 H 1 7.5220 0.0000 . 1 . . . . A 43 TRP HD1 . 30220 1 483 . 1 1 43 43 TRP HE1 H 1 10.4880 0.0000 . 1 . . . . A 43 TRP HE1 . 30220 1 484 . 1 1 43 43 TRP HE3 H 1 7.5200 0.0000 . 1 . . . . A 43 TRP HE3 . 30220 1 485 . 1 1 43 43 TRP HZ2 H 1 7.2480 0.0000 . 1 . . . . A 43 TRP HZ2 . 30220 1 486 . 1 1 43 43 TRP HZ3 H 1 6.4950 0.0000 . 1 . . . . A 43 TRP HZ3 . 30220 1 487 . 1 1 43 43 TRP HH2 H 1 6.7000 0.0000 . 1 . . . . A 43 TRP HH2 . 30220 1 488 . 1 1 43 43 TRP C C 13 177.0550 0.0000 . 1 . . . . A 43 TRP C . 30220 1 489 . 1 1 43 43 TRP CA C 13 57.9670 0.0000 . 1 . . . . A 43 TRP CA . 30220 1 490 . 1 1 43 43 TRP CB C 13 30.4320 0.0000 . 1 . . . . A 43 TRP CB . 30220 1 491 . 1 1 43 43 TRP N N 15 128.7910 0.0000 . 1 . . . . A 43 TRP N . 30220 1 492 . 1 1 43 43 TRP NE1 N 15 130.9810 0.0000 . 1 . . . . A 43 TRP NE1 . 30220 1 493 . 1 1 44 44 THR H H 1 9.2690 0.0000 . 1 . . . . A 44 THR H . 30220 1 494 . 1 1 44 44 THR HA H 1 4.8400 0.0000 . 1 . . . . A 44 THR HA . 30220 1 495 . 1 1 44 44 THR HB H 1 4.2690 0.0000 . 1 . . . . A 44 THR HB . 30220 1 496 . 1 1 44 44 THR HG21 H 1 1.2230 0.0000 . 1 . . . . A 44 THR HG21 . 30220 1 497 . 1 1 44 44 THR HG22 H 1 1.2230 0.0000 . 1 . . . . A 44 THR HG22 . 30220 1 498 . 1 1 44 44 THR HG23 H 1 1.2230 0.0000 . 1 . . . . A 44 THR HG23 . 30220 1 499 . 1 1 44 44 THR C C 13 172.7180 0.0000 . 1 . . . . A 44 THR C . 30220 1 500 . 1 1 44 44 THR CA C 13 60.3830 0.0000 . 1 . . . . A 44 THR CA . 30220 1 501 . 1 1 44 44 THR CB C 13 72.2450 0.0000 . 1 . . . . A 44 THR CB . 30220 1 502 . 1 1 44 44 THR CG2 C 13 22.0000 0.0000 . 1 . . . . A 44 THR CG2 . 30220 1 503 . 1 1 44 44 THR N N 15 115.0060 0.0000 . 1 . . . . A 44 THR N . 30220 1 504 . 1 1 45 45 TYR H H 1 8.5710 0.0000 . 1 . . . . A 45 TYR H . 30220 1 505 . 1 1 45 45 TYR HA H 1 4.9890 0.0000 . 1 . . . . A 45 TYR HA . 30220 1 506 . 1 1 45 45 TYR HB2 H 1 2.9710 0.0000 . 2 . . . . A 45 TYR HB2 . 30220 1 507 . 1 1 45 45 TYR HB3 H 1 2.5430 0.0000 . 2 . . . . A 45 TYR HB3 . 30220 1 508 . 1 1 45 45 TYR HD1 H 1 7.5720 0.0000 . 3 . . . . A 45 TYR HD1 . 30220 1 509 . 1 1 45 45 TYR HE1 H 1 6.3420 0.0000 . 3 . . . . A 45 TYR HE1 . 30220 1 510 . 1 1 45 45 TYR C C 13 173.2250 0.0000 . 1 . . . . A 45 TYR C . 30220 1 511 . 1 1 45 45 TYR CA C 13 56.7830 0.0000 . 1 . . . . A 45 TYR CA . 30220 1 512 . 1 1 45 45 TYR CB C 13 41.6620 0.0000 . 1 . . . . A 45 TYR CB . 30220 1 513 . 1 1 45 45 TYR N N 15 120.5830 0.0000 . 1 . . . . A 45 TYR N . 30220 1 514 . 1 1 46 46 ASP H H 1 7.6950 0.0000 . 1 . . . . A 46 ASP H . 30220 1 515 . 1 1 46 46 ASP HA H 1 4.5890 0.0000 . 1 . . . . A 46 ASP HA . 30220 1 516 . 1 1 46 46 ASP HB2 H 1 2.5870 0.0000 . 2 . . . . A 46 ASP HB2 . 30220 1 517 . 1 1 46 46 ASP HB3 H 1 2.2680 0.0000 . 2 . . . . A 46 ASP HB3 . 30220 1 518 . 1 1 46 46 ASP C C 13 174.4850 0.0000 . 1 . . . . A 46 ASP C . 30220 1 519 . 1 1 46 46 ASP CA C 13 51.7830 0.0000 . 1 . . . . A 46 ASP CA . 30220 1 520 . 1 1 46 46 ASP CB C 13 42.9880 0.0000 . 1 . . . . A 46 ASP CB . 30220 1 521 . 1 1 46 46 ASP N N 15 128.6450 0.0000 . 1 . . . . A 46 ASP N . 30220 1 522 . 1 1 47 47 ASP H H 1 8.5160 0.0000 . 1 . . . . A 47 ASP H . 30220 1 523 . 1 1 47 47 ASP HA H 1 4.0870 0.0000 . 1 . . . . A 47 ASP HA . 30220 1 524 . 1 1 47 47 ASP HB2 H 1 2.7960 0.0000 . 2 . . . . A 47 ASP HB2 . 30220 1 525 . 1 1 47 47 ASP HB3 H 1 2.5150 0.0000 . 2 . . . . A 47 ASP HB3 . 30220 1 526 . 1 1 47 47 ASP C C 13 178.1220 0.0000 . 1 . . . . A 47 ASP C . 30220 1 527 . 1 1 47 47 ASP CA C 13 56.2130 0.0000 . 1 . . . . A 47 ASP CA . 30220 1 528 . 1 1 47 47 ASP CB C 13 42.0250 0.0000 . 1 . . . . A 47 ASP CB . 30220 1 529 . 1 1 47 47 ASP N N 15 125.0920 0.0000 . 1 . . . . A 47 ASP N . 30220 1 530 . 1 1 48 48 ALA H H 1 8.2860 0.0000 . 1 . . . . A 48 ALA H . 30220 1 531 . 1 1 48 48 ALA HA H 1 4.0940 0.0000 . 1 . . . . A 48 ALA HA . 30220 1 532 . 1 1 48 48 ALA HB1 H 1 1.5090 0.0000 . 1 . . . . A 48 ALA HB1 . 30220 1 533 . 1 1 48 48 ALA HB2 H 1 1.5090 0.0000 . 1 . . . . A 48 ALA HB2 . 30220 1 534 . 1 1 48 48 ALA HB3 H 1 1.5090 0.0000 . 1 . . . . A 48 ALA HB3 . 30220 1 535 . 1 1 48 48 ALA C C 13 179.8360 0.0000 . 1 . . . . A 48 ALA C . 30220 1 536 . 1 1 48 48 ALA CA C 13 54.9770 0.0000 . 1 . . . . A 48 ALA CA . 30220 1 537 . 1 1 48 48 ALA CB C 13 18.2640 0.0000 . 1 . . . . A 48 ALA CB . 30220 1 538 . 1 1 48 48 ALA N N 15 119.8820 0.0000 . 1 . . . . A 48 ALA N . 30220 1 539 . 1 1 49 49 THR H H 1 6.9670 0.0000 . 1 . . . . A 49 THR H . 30220 1 540 . 1 1 49 49 THR HA H 1 4.3900 0.0000 . 1 . . . . A 49 THR HA . 30220 1 541 . 1 1 49 49 THR HB H 1 4.4070 0.0000 . 1 . . . . A 49 THR HB . 30220 1 542 . 1 1 49 49 THR HG21 H 1 1.0750 0.0000 . 1 . . . . A 49 THR HG21 . 30220 1 543 . 1 1 49 49 THR HG22 H 1 1.0750 0.0000 . 1 . . . . A 49 THR HG22 . 30220 1 544 . 1 1 49 49 THR HG23 H 1 1.0750 0.0000 . 1 . . . . A 49 THR HG23 . 30220 1 545 . 1 1 49 49 THR C C 13 175.1740 0.0000 . 1 . . . . A 49 THR C . 30220 1 546 . 1 1 49 49 THR CA C 13 60.3120 0.0000 . 1 . . . . A 49 THR CA . 30220 1 547 . 1 1 49 49 THR CB C 13 70.0670 0.0000 . 1 . . . . A 49 THR CB . 30220 1 548 . 1 1 49 49 THR CG2 C 13 21.1200 0.0000 . 1 . . . . A 49 THR CG2 . 30220 1 549 . 1 1 49 49 THR N N 15 104.507 0.0000 . 1 . . . . A 49 THR N . 30220 1 550 . 1 1 50 50 LYS H H 1 7.8030 0.0000 . 1 . . . . A 50 LYS H . 30220 1 551 . 1 1 50 50 LYS HA H 1 4.0910 0.0000 . 1 . . . . A 50 LYS HA . 30220 1 552 . 1 1 50 50 LYS HB2 H 1 1.8990 0.0000 . 2 . . . . A 50 LYS HB2 . 30220 1 553 . 1 1 50 50 LYS HB3 H 1 1.7300 0.0000 . 2 . . . . A 50 LYS HB3 . 30220 1 554 . 1 1 50 50 LYS HG2 H 1 1.2570 0.0000 . 2 . . . . A 50 LYS HG2 . 30220 1 555 . 1 1 50 50 LYS HG3 H 1 1.1670 0.0000 . 2 . . . . A 50 LYS HG3 . 30220 1 556 . 1 1 50 50 LYS HD2 H 1 1.4400 0.0000 . 2 . . . . A 50 LYS HD2 . 30220 1 557 . 1 1 50 50 LYS HE2 H 1 3.0160 0.0000 . 2 . . . . A 50 LYS HE2 . 30220 1 558 . 1 1 50 50 LYS HE3 H 1 2.9400 0.0000 . 2 . . . . A 50 LYS HE3 . 30220 1 559 . 1 1 50 50 LYS C C 13 174.8060 0.0000 . 1 . . . . A 50 LYS C . 30220 1 560 . 1 1 50 50 LYS CA C 13 56.6520 0.0000 . 1 . . . . A 50 LYS CA . 30220 1 561 . 1 1 50 50 LYS CB C 13 29.3950 0.0000 . 1 . . . . A 50 LYS CB . 30220 1 562 . 1 1 50 50 LYS CG C 13 24.4910 0.0000 . 1 . . . . A 50 LYS CG . 30220 1 563 . 1 1 50 50 LYS CD C 13 28.1200 0.0000 . 1 . . . . A 50 LYS CD . 30220 1 564 . 1 1 50 50 LYS CE C 13 42.4860 0.0000 . 1 . . . . A 50 LYS CE . 30220 1 565 . 1 1 50 50 LYS N N 15 123.7330 0.0000 . 1 . . . . A 50 LYS N . 30220 1 566 . 1 1 51 51 THR H H 1 7.3650 0.0000 . 1 . . . . A 51 THR H . 30220 1 567 . 1 1 51 51 THR HA H 1 5.3590 0.0000 . 1 . . . . A 51 THR HA . 30220 1 568 . 1 1 51 51 THR HB H 1 3.7800 0.0000 . 1 . . . . A 51 THR HB . 30220 1 569 . 1 1 51 51 THR HG21 H 1 1.0460 0.0000 . 1 . . . . A 51 THR HG21 . 30220 1 570 . 1 1 51 51 THR HG22 H 1 1.0460 0.0000 . 1 . . . . A 51 THR HG22 . 30220 1 571 . 1 1 51 51 THR HG23 H 1 1.0460 0.0000 . 1 . . . . A 51 THR HG23 . 30220 1 572 . 1 1 51 51 THR C C 13 174.7790 0.0000 . 1 . . . . A 51 THR C . 30220 1 573 . 1 1 51 51 THR CA C 13 62.2030 0.0000 . 1 . . . . A 51 THR CA . 30220 1 574 . 1 1 51 51 THR CB C 13 72.0320 0.0000 . 1 . . . . A 51 THR CB . 30220 1 575 . 1 1 51 51 THR CG2 C 13 21.0340 0.0000 . 1 . . . . A 51 THR CG2 . 30220 1 576 . 1 1 51 51 THR N N 15 111.3550 0.0000 . 1 . . . . A 51 THR N . 30220 1 577 . 1 1 52 52 PHE H H 1 10.3660 0.0000 . 1 . . . . A 52 PHE H . 30220 1 578 . 1 1 52 52 PHE HA H 1 5.6740 0.0000 . 1 . . . . A 52 PHE HA . 30220 1 579 . 1 1 52 52 PHE HB2 H 1 3.2880 0.0000 . 2 . . . . A 52 PHE HB2 . 30220 1 580 . 1 1 52 52 PHE HD1 H 1 7.5720 0.0000 . 3 . . . . A 52 PHE HD1 . 30220 1 581 . 1 1 52 52 PHE HE1 H 1 7.0210 0.0000 . 3 . . . . A 52 PHE HE1 . 30220 1 582 . 1 1 52 52 PHE HZ H 1 6.9240 0.0000 . 1 . . . . A 52 PHE HZ . 30220 1 583 . 1 1 52 52 PHE C C 13 174.6370 0.0000 . 1 . . . . A 52 PHE C . 30220 1 584 . 1 1 52 52 PHE CA C 13 57.2430 0.0000 . 1 . . . . A 52 PHE CA . 30220 1 585 . 1 1 52 52 PHE CB C 13 42.6130 0.0000 . 1 . . . . A 52 PHE CB . 30220 1 586 . 1 1 52 52 PHE N N 15 131.2870 0.0000 . 1 . . . . A 52 PHE N . 30220 1 587 . 1 1 53 53 THR H H 1 9.1170 0.0000 . 1 . . . . A 53 THR H . 30220 1 588 . 1 1 53 53 THR HA H 1 5.2510 0.0000 . 1 . . . . A 53 THR HA . 30220 1 589 . 1 1 53 53 THR HB H 1 3.8340 0.0000 . 1 . . . . A 53 THR HB . 30220 1 590 . 1 1 53 53 THR HG21 H 1 0.9890 0.0000 . 1 . . . . A 53 THR HG21 . 30220 1 591 . 1 1 53 53 THR HG22 H 1 0.9890 0.0000 . 1 . . . . A 53 THR HG22 . 30220 1 592 . 1 1 53 53 THR HG23 H 1 0.9890 0.0000 . 1 . . . . A 53 THR HG23 . 30220 1 593 . 1 1 53 53 THR C C 13 172.5270 0.0000 . 1 . . . . A 53 THR C . 30220 1 594 . 1 1 53 53 THR CA C 13 61.6990 0.0000 . 1 . . . . A 53 THR CA . 30220 1 595 . 1 1 53 53 THR CB C 13 70.9030 0.0000 . 1 . . . . A 53 THR CB . 30220 1 596 . 1 1 53 53 THR CG2 C 13 20.6250 0.0000 . 1 . . . . A 53 THR CG2 . 30220 1 597 . 1 1 53 53 THR N N 15 117.8130 0.0000 . 1 . . . . A 53 THR N . 30220 1 598 . 1 1 54 54 VAL H H 1 8.3950 0.0000 . 1 . . . . A 54 VAL H . 30220 1 599 . 1 1 54 54 VAL HA H 1 4.6180 0.0000 . 1 . . . . A 54 VAL HA . 30220 1 600 . 1 1 54 54 VAL HB H 1 -0.1850 0.0000 . 1 . . . . A 54 VAL HB . 30220 1 601 . 1 1 54 54 VAL HG11 H 1 -0.0700 0.0000 . 2 . . . . A 54 VAL HG11 . 30220 1 602 . 1 1 54 54 VAL HG12 H 1 -0.0700 0.0000 . 2 . . . . A 54 VAL HG12 . 30220 1 603 . 1 1 54 54 VAL HG13 H 1 -0.0700 0.0000 . 2 . . . . A 54 VAL HG13 . 30220 1 604 . 1 1 54 54 VAL HG21 H 1 0.5520 0.0000 . 2 . . . . A 54 VAL HG21 . 30220 1 605 . 1 1 54 54 VAL HG22 H 1 0.5520 0.0000 . 2 . . . . A 54 VAL HG22 . 30220 1 606 . 1 1 54 54 VAL HG23 H 1 0.5520 0.0000 . 2 . . . . A 54 VAL HG23 . 30220 1 607 . 1 1 54 54 VAL C C 13 172.8470 0.0000 . 1 . . . . A 54 VAL C . 30220 1 608 . 1 1 54 54 VAL CA C 13 57.5730 0.0000 . 1 . . . . A 54 VAL CA . 30220 1 609 . 1 1 54 54 VAL CB C 13 32.7030 0.0000 . 1 . . . . A 54 VAL CB . 30220 1 610 . 1 1 54 54 VAL CG1 C 13 21.5040 0.0000 . 2 . . . . A 54 VAL CG1 . 30220 1 611 . 1 1 54 54 VAL CG2 C 13 20.5260 0.0000 . 2 . . . . A 54 VAL CG2 . 30220 1 612 . 1 1 54 54 VAL N N 15 123.6550 0.0000 . 1 . . . . A 54 VAL N . 30220 1 613 . 1 1 55 55 THR H H 1 8.4410 0.0000 . 1 . . . . A 55 THR H . 30220 1 614 . 1 1 55 55 THR HA H 1 4.8030 0.0000 . 1 . . . . A 55 THR HA . 30220 1 615 . 1 1 55 55 THR HB H 1 3.8990 0.0000 . 1 . . . . A 55 THR HB . 30220 1 616 . 1 1 55 55 THR HG21 H 1 1.2890 0.0000 . 1 . . . . A 55 THR HG21 . 30220 1 617 . 1 1 55 55 THR HG22 H 1 1.2890 0.0000 . 1 . . . . A 55 THR HG22 . 30220 1 618 . 1 1 55 55 THR HG23 H 1 1.2890 0.0000 . 1 . . . . A 55 THR HG23 . 30220 1 619 . 1 1 55 55 THR C C 13 174.3060 0.0000 . 1 . . . . A 55 THR C . 30220 1 620 . 1 1 55 55 THR CA C 13 61.7860 0.0000 . 1 . . . . A 55 THR CA . 30220 1 621 . 1 1 55 55 THR CB C 13 70.6710 0.0000 . 1 . . . . A 55 THR CB . 30220 1 622 . 1 1 55 55 THR CG2 C 13 21.2330 0.0000 . 1 . . . . A 55 THR CG2 . 30220 1 623 . 1 1 55 55 THR N N 15 124.8430 0.0000 . 1 . . . . A 55 THR N . 30220 1 624 . 1 1 56 56 GLU H H 1 7.8500 0.0000 . 1 . . . . A 56 GLU H . 30220 1 625 . 1 1 56 56 GLU HA H 1 4.2970 0.0000 . 1 . . . . A 56 GLU HA . 30220 1 626 . 1 1 56 56 GLU HB2 H 1 2.2010 0.0000 . 2 . . . . A 56 GLU HB2 . 30220 1 627 . 1 1 56 56 GLU HB3 H 1 2.0010 0.0000 . 2 . . . . A 56 GLU HB3 . 30220 1 628 . 1 1 56 56 GLU HG2 H 1 2.3380 0.0000 . 2 . . . . A 56 GLU HG2 . 30220 1 629 . 1 1 56 56 GLU CA C 13 58.3300 0.0000 . 1 . . . . A 56 GLU CA . 30220 1 630 . 1 1 56 56 GLU CB C 13 32.6910 0.0000 . 1 . . . . A 56 GLU CB . 30220 1 631 . 1 1 56 56 GLU CG C 13 37.5050 0.0000 . 1 . . . . A 56 GLU CG . 30220 1 632 . 1 1 56 56 GLU N N 15 133.7280 0.0000 . 1 . . . . A 56 GLU N . 30220 1 stop_ save_ ################################### # 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_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 30220 _Assigned_chem_shift_list.ID 2 _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 '3D 1H-15N NOESY' . . . 30220 2 2 '3D 1H-13C NOESY aliphatic' . . . 30220 2 3 '3D 1H-13C NOESY aromatic' . . . 30220 2 4 '3D HNCACB' . . . 30220 2 5 '3D CBCA(CO)NH' . . . 30220 2 6 '3D CCH-TOCSY' . . . 30220 2 7 '3D HNCO' . . . 30220 2 8 '3D HCCH-COSY' . . . 30220 2 9 '3D HCCH-TOCSY' . . . 30220 2 10 '2D 1H-13C HSQC' . . . 30220 2 11 '2D 1H-13C HSQC' . . . 30220 2 12 '2D 1H-15N HSQC' . . . 30220 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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 MET HA H 1 4.6920 0.0000 . 1 . . . . A 1 MET HA . 30220 2 2 . 1 1 1 1 MET HB2 H 1 2.0060 0.0000 . 2 . . . . A 1 MET HB2 . 30220 2 3 . 1 1 1 1 MET HB3 H 1 1.8920 0.0000 . 2 . . . . A 1 MET HB3 . 30220 2 4 . 1 1 1 1 MET HG2 H 1 2.4860 0.0000 . 2 . . . . A 1 MET HG2 . 30220 2 5 . 1 1 1 1 MET HG3 H 1 2.3860 0.0000 . 2 . . . . A 1 MET HG3 . 30220 2 6 . 1 1 1 1 MET CA C 13 54.5510 0.0000 . 1 . . . . A 1 MET CA . 30220 2 7 . 1 1 1 1 MET CB C 13 35.3270 0.0000 . 1 . . . . A 1 MET CB . 30220 2 8 . 1 1 1 1 MET CG C 13 31.8910 0.0000 . 1 . . . . A 1 MET CG . 30220 2 9 . 1 1 2 2 THR HA H 1 4.7460 0.0000 . 1 . . . . A 2 THR HA . 30220 2 10 . 1 1 2 2 THR HB H 1 3.8700 0.0000 . 1 . . . . A 2 THR HB . 30220 2 11 . 1 1 2 2 THR HG21 H 1 1.1700 0.0000 . 1 . . . . A 2 THR HG21 . 30220 2 12 . 1 1 2 2 THR HG22 H 1 1.1700 0.0000 . 1 . . . . A 2 THR HG22 . 30220 2 13 . 1 1 2 2 THR HG23 H 1 1.1700 0.0000 . 1 . . . . A 2 THR HG23 . 30220 2 14 . 1 1 2 2 THR CA C 13 63.0740 0.0000 . 1 . . . . A 2 THR CA . 30220 2 15 . 1 1 2 2 THR CB C 13 69.2910 0.0000 . 1 . . . . A 2 THR CB . 30220 2 16 . 1 1 2 2 THR CG2 C 13 21.7050 0.0000 . 1 . . . . A 2 THR CG2 . 30220 2 17 . 1 1 3 3 PHE HA H 1 5.3320 0.0000 . 1 . . . . A 3 PHE HA . 30220 2 18 . 1 1 3 3 PHE HB2 H 1 3.0660 0.0000 . 2 . . . . A 3 PHE HB2 . 30220 2 19 . 1 1 3 3 PHE HB3 H 1 2.8400 0.0000 . 2 . . . . A 3 PHE HB3 . 30220 2 20 . 1 1 3 3 PHE HD1 H 1 7.3220 0.0000 . 3 . . . . A 3 PHE HD1 . 30220 2 21 . 1 1 3 3 PHE HE1 H 1 6.3160 0.0000 . 3 . . . . A 3 PHE HE1 . 30220 2 22 . 1 1 3 3 PHE HZ H 1 5.9120 0.0000 . 1 . . . . A 3 PHE HZ . 30220 2 23 . 1 1 3 3 PHE CA C 13 56.7690 0.0000 . 1 . . . . A 3 PHE CA . 30220 2 24 . 1 1 3 3 PHE CB C 13 43.2520 0.0000 . 1 . . . . A 3 PHE CB . 30220 2 25 . 1 1 4 4 LYS HA H 1 5.1430 0.0000 . 1 . . . . A 4 LYS HA . 30220 2 26 . 1 1 4 4 LYS HB2 H 1 2.0500 0.0000 . 2 . . . . A 4 LYS HB2 . 30220 2 27 . 1 1 4 4 LYS HB3 H 1 1.8720 0.0000 . 2 . . . . A 4 LYS HB3 . 30220 2 28 . 1 1 4 4 LYS HG2 H 1 1.5130 0.0000 . 2 . . . . A 4 LYS HG2 . 30220 2 29 . 1 1 4 4 LYS HD2 H 1 1.6440 0.0000 . 2 . . . . A 4 LYS HD2 . 30220 2 30 . 1 1 4 4 LYS HE2 H 1 2.8910 0.0000 . 2 . . . . A 4 LYS HE2 . 30220 2 31 . 1 1 4 4 LYS HE3 H 1 2.7990 0.0000 . 2 . . . . A 4 LYS HE3 . 30220 2 32 . 1 1 4 4 LYS CA C 13 54.7130 0.0000 . 1 . . . . A 4 LYS CA . 30220 2 33 . 1 1 4 4 LYS CB C 13 35.7770 0.0000 . 1 . . . . A 4 LYS CB . 30220 2 34 . 1 1 4 4 LYS CG C 13 25.4130 0.0000 . 1 . . . . A 4 LYS CG . 30220 2 35 . 1 1 4 4 LYS CD C 13 29.0750 0.0000 . 1 . . . . A 4 LYS CD . 30220 2 36 . 1 1 4 4 LYS CE C 13 41.8130 0.0000 . 1 . . . . A 4 LYS CE . 30220 2 37 . 1 1 5 5 LEU HA H 1 5.5270 0.0000 . 1 . . . . A 5 LEU HA . 30220 2 38 . 1 1 5 5 LEU HB2 H 1 1.7370 0.0000 . 2 . . . . A 5 LEU HB2 . 30220 2 39 . 1 1 5 5 LEU HB3 H 1 1.4130 0.0000 . 2 . . . . A 5 LEU HB3 . 30220 2 40 . 1 1 5 5 LEU HG H 1 1.2300 0.0000 . 1 . . . . A 5 LEU HG . 30220 2 41 . 1 1 5 5 LEU HD11 H 1 0.9020 0.0000 . 2 . . . . A 5 LEU HD11 . 30220 2 42 . 1 1 5 5 LEU HD12 H 1 0.9020 0.0000 . 2 . . . . A 5 LEU HD12 . 30220 2 43 . 1 1 5 5 LEU HD13 H 1 0.9020 0.0000 . 2 . . . . A 5 LEU HD13 . 30220 2 44 . 1 1 5 5 LEU HD21 H 1 0.7110 0.0000 . 2 . . . . A 5 LEU HD21 . 30220 2 45 . 1 1 5 5 LEU HD22 H 1 0.7110 0.0000 . 2 . . . . A 5 LEU HD22 . 30220 2 46 . 1 1 5 5 LEU HD23 H 1 0.7110 0.0000 . 2 . . . . A 5 LEU HD23 . 30220 2 47 . 1 1 5 5 LEU CA C 13 53.0230 0.0000 . 1 . . . . A 5 LEU CA . 30220 2 48 . 1 1 5 5 LEU CB C 13 46.7030 0.0000 . 1 . . . . A 5 LEU CB . 30220 2 49 . 1 1 5 5 LEU CG C 13 27.4090 0.0000 . 1 . . . . A 5 LEU CG . 30220 2 50 . 1 1 5 5 LEU CD1 C 13 26.5470 0.0000 . 2 . . . . A 5 LEU CD1 . 30220 2 51 . 1 1 5 5 LEU CD2 C 13 25.3800 0.0000 . 2 . . . . A 5 LEU CD2 . 30220 2 52 . 1 1 6 6 ILE HA H 1 4.3530 0.0000 . 1 . . . . A 6 ILE HA . 30220 2 53 . 1 1 6 6 ILE HB H 1 2.0750 0.0000 . 1 . . . . A 6 ILE HB . 30220 2 54 . 1 1 6 6 ILE HG12 H 1 1.4900 0.0000 . 2 . . . . A 6 ILE HG12 . 30220 2 55 . 1 1 6 6 ILE HG13 H 1 1.1920 0.0000 . 2 . . . . A 6 ILE HG13 . 30220 2 56 . 1 1 6 6 ILE HG21 H 1 0.8600 0.0000 . 1 . . . . A 6 ILE HG21 . 30220 2 57 . 1 1 6 6 ILE HG22 H 1 0.8600 0.0000 . 1 . . . . A 6 ILE HG22 . 30220 2 58 . 1 1 6 6 ILE HG23 H 1 0.8600 0.0000 . 1 . . . . A 6 ILE HG23 . 30220 2 59 . 1 1 6 6 ILE HD11 H 1 0.8310 0.0000 . 1 . . . . A 6 ILE HD11 . 30220 2 60 . 1 1 6 6 ILE HD12 H 1 0.8310 0.0000 . 1 . . . . A 6 ILE HD12 . 30220 2 61 . 1 1 6 6 ILE HD13 H 1 0.8310 0.0000 . 1 . . . . A 6 ILE HD13 . 30220 2 62 . 1 1 6 6 ILE CA C 13 60.5530 0.0000 . 1 . . . . A 6 ILE CA . 30220 2 63 . 1 1 6 6 ILE CB C 13 38.0730 0.0000 . 1 . . . . A 6 ILE CB . 30220 2 64 . 1 1 6 6 ILE CG1 C 13 27.5060 0.0000 . 1 . . . . A 6 ILE CG1 . 30220 2 65 . 1 1 6 6 ILE CG2 C 13 17.0460 0.0000 . 1 . . . . A 6 ILE CG2 . 30220 2 66 . 1 1 6 6 ILE CD1 C 13 12.6530 0.0000 . 1 . . . . A 6 ILE CD1 . 30220 2 67 . 1 1 7 7 ILE HA H 1 4.1220 0.0000 . 1 . . . . A 7 ILE HA . 30220 2 68 . 1 1 7 7 ILE HB H 1 1.5650 0.0000 . 1 . . . . A 7 ILE HB . 30220 2 69 . 1 1 7 7 ILE HG12 H 1 1.4520 0.0000 . 2 . . . . A 7 ILE HG12 . 30220 2 70 . 1 1 7 7 ILE HG13 H 1 0.6630 0.0000 . 2 . . . . A 7 ILE HG13 . 30220 2 71 . 1 1 7 7 ILE HG21 H 1 0.7700 0.0000 . 1 . . . . A 7 ILE HG21 . 30220 2 72 . 1 1 7 7 ILE HG22 H 1 0.7700 0.0000 . 1 . . . . A 7 ILE HG22 . 30220 2 73 . 1 1 7 7 ILE HG23 H 1 0.7700 0.0000 . 1 . . . . A 7 ILE HG23 . 30220 2 74 . 1 1 7 7 ILE HD11 H 1 0.8350 0.0000 . 1 . . . . A 7 ILE HD11 . 30220 2 75 . 1 1 7 7 ILE HD12 H 1 0.8350 0.0000 . 1 . . . . A 7 ILE HD12 . 30220 2 76 . 1 1 7 7 ILE HD13 H 1 0.8350 0.0000 . 1 . . . . A 7 ILE HD13 . 30220 2 77 . 1 1 7 7 ILE CA C 13 60.6740 0.0000 . 1 . . . . A 7 ILE CA . 30220 2 78 . 1 1 7 7 ILE CB C 13 39.2690 0.0000 . 1 . . . . A 7 ILE CB . 30220 2 79 . 1 1 7 7 ILE CG1 C 13 27.9800 0.0000 . 1 . . . . A 7 ILE CG1 . 30220 2 80 . 1 1 7 7 ILE CG2 C 13 18.4320 0.0000 . 1 . . . . A 7 ILE CG2 . 30220 2 81 . 1 1 7 7 ILE CD1 C 13 14.4830 0.0000 . 1 . . . . A 7 ILE CD1 . 30220 2 82 . 1 1 8 8 ASN HA H 1 5.3430 0.0000 . 1 . . . . A 8 ASN HA . 30220 2 83 . 1 1 8 8 ASN HB2 H 1 3.0340 0.0000 . 2 . . . . A 8 ASN HB2 . 30220 2 84 . 1 1 8 8 ASN HB3 H 1 2.5760 0.0000 . 2 . . . . A 8 ASN HB3 . 30220 2 85 . 1 1 8 8 ASN CA C 13 50.8430 0.0000 . 1 . . . . A 8 ASN CA . 30220 2 86 . 1 1 8 8 ASN CB C 13 37.7070 0.0000 . 1 . . . . A 8 ASN CB . 30220 2 87 . 1 1 9 9 GLY HA2 H 1 4.4810 0.0000 . 2 . . . . A 9 GLY HA2 . 30220 2 88 . 1 1 9 9 GLY HA3 H 1 4.1160 0.0000 . 2 . . . . A 9 GLY HA3 . 30220 2 89 . 1 1 9 9 GLY CA C 13 44.5810 0.0000 . 1 . . . . A 9 GLY CA . 30220 2 90 . 1 1 10 10 LYS HA H 1 4.1120 0.0000 . 1 . . . . A 10 LYS HA . 30220 2 91 . 1 1 10 10 LYS HB2 H 1 1.8630 0.0000 . 2 . . . . A 10 LYS HB2 . 30220 2 92 . 1 1 10 10 LYS HG2 H 1 1.5060 0.0000 . 2 . . . . A 10 LYS HG2 . 30220 2 93 . 1 1 10 10 LYS HD2 H 1 1.7230 0.0000 . 2 . . . . A 10 LYS HD2 . 30220 2 94 . 1 1 10 10 LYS HE2 H 1 3.0370 0.0000 . 2 . . . . A 10 LYS HE2 . 30220 2 95 . 1 1 10 10 LYS CA C 13 59.3350 0.0000 . 1 . . . . A 10 LYS CA . 30220 2 96 . 1 1 10 10 LYS CB C 13 32.4910 0.0000 . 1 . . . . A 10 LYS CB . 30220 2 97 . 1 1 10 10 LYS CG C 13 25.4040 0.0000 . 1 . . . . A 10 LYS CG . 30220 2 98 . 1 1 10 10 LYS CD C 13 29.0060 0.0000 . 1 . . . . A 10 LYS CD . 30220 2 99 . 1 1 10 10 LYS CE C 13 41.8500 0.0000 . 1 . . . . A 10 LYS CE . 30220 2 100 . 1 1 11 11 THR HA H 1 4.4050 0.0000 . 1 . . . . A 11 THR HA . 30220 2 101 . 1 1 11 11 THR HB H 1 4.2320 0.0000 . 1 . . . . A 11 THR HB . 30220 2 102 . 1 1 11 11 THR HG21 H 1 1.1550 0.0000 . 1 . . . . A 11 THR HG21 . 30220 2 103 . 1 1 11 11 THR HG22 H 1 1.1550 0.0000 . 1 . . . . A 11 THR HG22 . 30220 2 104 . 1 1 11 11 THR HG23 H 1 1.1550 0.0000 . 1 . . . . A 11 THR HG23 . 30220 2 105 . 1 1 11 11 THR CA C 13 61.9020 0.0000 . 1 . . . . A 11 THR CA . 30220 2 106 . 1 1 11 11 THR CB C 13 69.8640 0.0000 . 1 . . . . A 11 THR CB . 30220 2 107 . 1 1 11 11 THR CG2 C 13 21.7040 0.0000 . 1 . . . . A 11 THR CG2 . 30220 2 108 . 1 1 12 12 LEU HA H 1 4.4820 0.0000 . 1 . . . . A 12 LEU HA . 30220 2 109 . 1 1 12 12 LEU HB2 H 1 1.6770 0.0000 . 2 . . . . A 12 LEU HB2 . 30220 2 110 . 1 1 12 12 LEU HB3 H 1 1.4800 0.0000 . 2 . . . . A 12 LEU HB3 . 30220 2 111 . 1 1 12 12 LEU HG H 1 1.4130 0.0000 . 1 . . . . A 12 LEU HG . 30220 2 112 . 1 1 12 12 LEU HD11 H 1 0.8570 0.0000 . 2 . . . . A 12 LEU HD11 . 30220 2 113 . 1 1 12 12 LEU HD12 H 1 0.8570 0.0000 . 2 . . . . A 12 LEU HD12 . 30220 2 114 . 1 1 12 12 LEU HD13 H 1 0.8570 0.0000 . 2 . . . . A 12 LEU HD13 . 30220 2 115 . 1 1 12 12 LEU HD21 H 1 0.9360 0.0000 . 2 . . . . A 12 LEU HD21 . 30220 2 116 . 1 1 12 12 LEU HD22 H 1 0.9360 0.0000 . 2 . . . . A 12 LEU HD22 . 30220 2 117 . 1 1 12 12 LEU HD23 H 1 0.9360 0.0000 . 2 . . . . A 12 LEU HD23 . 30220 2 118 . 1 1 12 12 LEU CA C 13 55.0620 0.0000 . 1 . . . . A 12 LEU CA . 30220 2 119 . 1 1 12 12 LEU CB C 13 43.6340 0.0000 . 1 . . . . A 12 LEU CB . 30220 2 120 . 1 1 12 12 LEU CG C 13 27.4490 0.0000 . 1 . . . . A 12 LEU CG . 30220 2 121 . 1 1 12 12 LEU CD1 C 13 24.9500 0.0000 . 2 . . . . A 12 LEU CD1 . 30220 2 122 . 1 1 12 12 LEU CD2 C 13 23.9520 0.0000 . 2 . . . . A 12 LEU CD2 . 30220 2 123 . 1 1 13 13 LYS HA H 1 5.1860 0.0000 . 1 . . . . A 13 LYS HA . 30220 2 124 . 1 1 13 13 LYS HB2 H 1 1.9400 0.0000 . 2 . . . . A 13 LYS HB2 . 30220 2 125 . 1 1 13 13 LYS HB3 H 1 1.7930 0.0000 . 2 . . . . A 13 LYS HB3 . 30220 2 126 . 1 1 13 13 LYS HG2 H 1 1.5010 0.0000 . 2 . . . . A 13 LYS HG2 . 30220 2 127 . 1 1 13 13 LYS HD2 H 1 1.7500 0.0000 . 2 . . . . A 13 LYS HD2 . 30220 2 128 . 1 1 13 13 LYS HE2 H 1 3.0440 0.0000 . 2 . . . . A 13 LYS HE2 . 30220 2 129 . 1 1 13 13 LYS HE3 H 1 2.9340 0.0000 . 2 . . . . A 13 LYS HE3 . 30220 2 130 . 1 1 13 13 LYS CA C 13 53.7510 0.0000 . 1 . . . . A 13 LYS CA . 30220 2 131 . 1 1 13 13 LYS CB C 13 34.4580 0.0000 . 1 . . . . A 13 LYS CB . 30220 2 132 . 1 1 13 13 LYS CG C 13 25.1930 0.0000 . 1 . . . . A 13 LYS CG . 30220 2 133 . 1 1 13 13 LYS CD C 13 29.2010 0.0000 . 1 . . . . A 13 LYS CD . 30220 2 134 . 1 1 13 13 LYS CE C 13 42.5020 0.0000 . 1 . . . . A 13 LYS CE . 30220 2 135 . 1 1 14 14 GLY HA2 H 1 4.3400 0.0000 . 2 . . . . A 14 GLY HA2 . 30220 2 136 . 1 1 14 14 GLY HA3 H 1 4.1510 0.0000 . 2 . . . . A 14 GLY HA3 . 30220 2 137 . 1 1 14 14 GLY CA C 13 45.2700 0.0000 . 1 . . . . A 14 GLY CA . 30220 2 138 . 1 1 15 15 GLU HA H 1 5.6710 0.0000 . 1 . . . . A 15 GLU HA . 30220 2 139 . 1 1 15 15 GLU HB2 H 1 2.1260 0.0000 . 2 . . . . A 15 GLU HB2 . 30220 2 140 . 1 1 15 15 GLU HB3 H 1 1.9710 0.0000 . 2 . . . . A 15 GLU HB3 . 30220 2 141 . 1 1 15 15 GLU HG2 H 1 2.2140 0.0000 . 2 . . . . A 15 GLU HG2 . 30220 2 142 . 1 1 15 15 GLU CA C 13 54.8930 0.0000 . 1 . . . . A 15 GLU CA . 30220 2 143 . 1 1 15 15 GLU CB C 13 34.1830 0.0000 . 1 . . . . A 15 GLU CB . 30220 2 144 . 1 1 15 15 GLU CG C 13 35.7770 0.0000 . 1 . . . . A 15 GLU CG . 30220 2 145 . 1 1 16 16 THR HA H 1 4.7100 0.0000 . 1 . . . . A 16 THR HA . 30220 2 146 . 1 1 16 16 THR HB H 1 3.8020 0.0000 . 1 . . . . A 16 THR HB . 30220 2 147 . 1 1 16 16 THR HG21 H 1 0.3400 0.0000 . 1 . . . . A 16 THR HG21 . 30220 2 148 . 1 1 16 16 THR HG22 H 1 0.3400 0.0000 . 1 . . . . A 16 THR HG22 . 30220 2 149 . 1 1 16 16 THR HG23 H 1 0.3400 0.0000 . 1 . . . . A 16 THR HG23 . 30220 2 150 . 1 1 16 16 THR CA C 13 60.8660 0.0000 . 1 . . . . A 16 THR CA . 30220 2 151 . 1 1 16 16 THR CB C 13 69.2920 0.0000 . 1 . . . . A 16 THR CB . 30220 2 152 . 1 1 16 16 THR CG2 C 13 18.4760 0.0000 . 1 . . . . A 16 THR CG2 . 30220 2 153 . 1 1 17 17 THR HA H 1 5.6300 0.0000 . 1 . . . . A 17 THR HA . 30220 2 154 . 1 1 17 17 THR HB H 1 2.5200 0.0000 . 1 . . . . A 17 THR HB . 30220 2 155 . 1 1 17 17 THR HG21 H 1 1.1410 0.0000 . 1 . . . . A 17 THR HG21 . 30220 2 156 . 1 1 17 17 THR HG22 H 1 1.1410 0.0000 . 1 . . . . A 17 THR HG22 . 30220 2 157 . 1 1 17 17 THR HG23 H 1 1.1410 0.0000 . 1 . . . . A 17 THR HG23 . 30220 2 158 . 1 1 17 17 THR CA C 13 59.4560 0.0000 . 1 . . . . A 17 THR CA . 30220 2 159 . 1 1 17 17 THR CB C 13 71.7780 0.0000 . 1 . . . . A 17 THR CB . 30220 2 160 . 1 1 17 17 THR CG2 C 13 21.4430 0.0000 . 1 . . . . A 17 THR CG2 . 30220 2 161 . 1 1 18 18 THR HA H 1 4.6960 0.0000 . 1 . . . . A 18 THR HA . 30220 2 162 . 1 1 18 18 THR HG21 H 1 1.0280 0.0000 . 1 . . . . A 18 THR HG21 . 30220 2 163 . 1 1 18 18 THR HG22 H 1 1.0280 0.0000 . 1 . . . . A 18 THR HG22 . 30220 2 164 . 1 1 18 18 THR HG23 H 1 1.0280 0.0000 . 1 . . . . A 18 THR HG23 . 30220 2 165 . 1 1 18 18 THR CA C 13 61.6940 0.0000 . 1 . . . . A 18 THR CA . 30220 2 166 . 1 1 18 18 THR CG2 C 13 18.6570 0.0000 . 1 . . . . A 18 THR CG2 . 30220 2 167 . 1 1 19 19 GLU HA H 1 5.5600 0.0000 . 1 . . . . A 19 GLU HA . 30220 2 168 . 1 1 19 19 GLU HB2 H 1 1.9410 0.0000 . 2 . . . . A 19 GLU HB2 . 30220 2 169 . 1 1 19 19 GLU HG2 H 1 2.1150 0.0000 . 2 . . . . A 19 GLU HG2 . 30220 2 170 . 1 1 19 19 GLU CA C 13 54.7560 0.0000 . 1 . . . . A 19 GLU CA . 30220 2 171 . 1 1 19 19 GLU CB C 13 31.2470 0.0000 . 1 . . . . A 19 GLU CB . 30220 2 172 . 1 1 19 19 GLU CG C 13 36.5250 0.0000 . 1 . . . . A 19 GLU CG . 30220 2 173 . 1 1 20 20 ALA HA H 1 4.9530 0.0000 . 1 . . . . A 20 ALA HA . 30220 2 174 . 1 1 20 20 ALA HB1 H 1 1.4510 0.0000 . 1 . . . . A 20 ALA HB1 . 30220 2 175 . 1 1 20 20 ALA HB2 H 1 1.4510 0.0000 . 1 . . . . A 20 ALA HB2 . 30220 2 176 . 1 1 20 20 ALA HB3 H 1 1.4510 0.0000 . 1 . . . . A 20 ALA HB3 . 30220 2 177 . 1 1 20 20 ALA CA C 13 51.1530 0.0000 . 1 . . . . A 20 ALA CA . 30220 2 178 . 1 1 20 20 ALA CB C 13 23.6830 0.0000 . 1 . . . . A 20 ALA CB . 30220 2 179 . 1 1 21 21 VAL HA H 1 4.1950 0.0000 . 1 . . . . A 21 VAL HA . 30220 2 180 . 1 1 21 21 VAL HB H 1 2.2250 0.0000 . 1 . . . . A 21 VAL HB . 30220 2 181 . 1 1 21 21 VAL HG11 H 1 1.0100 0.0000 . 2 . . . . A 21 VAL HG11 . 30220 2 182 . 1 1 21 21 VAL HG12 H 1 1.0100 0.0000 . 2 . . . . A 21 VAL HG12 . 30220 2 183 . 1 1 21 21 VAL HG13 H 1 1.0100 0.0000 . 2 . . . . A 21 VAL HG13 . 30220 2 184 . 1 1 21 21 VAL HG21 H 1 1.0130 0.0000 . 2 . . . . A 21 VAL HG21 . 30220 2 185 . 1 1 21 21 VAL HG22 H 1 1.0130 0.0000 . 2 . . . . A 21 VAL HG22 . 30220 2 186 . 1 1 21 21 VAL HG23 H 1 1.0130 0.0000 . 2 . . . . A 21 VAL HG23 . 30220 2 187 . 1 1 21 21 VAL CA C 13 63.6020 0.0000 . 1 . . . . A 21 VAL CA . 30220 2 188 . 1 1 21 21 VAL CB C 13 32.1740 0.0000 . 1 . . . . A 21 VAL CB . 30220 2 189 . 1 1 21 21 VAL CG1 C 13 20.9270 0.0000 . 2 . . . . A 21 VAL CG1 . 30220 2 190 . 1 1 21 21 VAL CG2 C 13 19.9660 0.0000 . 2 . . . . A 21 VAL CG2 . 30220 2 191 . 1 1 22 22 ASP HA H 1 4.7200 0.0000 . 1 . . . . A 22 ASP HA . 30220 2 192 . 1 1 22 22 ASP HB2 H 1 3.0620 0.0000 . 2 . . . . A 22 ASP HB2 . 30220 2 193 . 1 1 22 22 ASP CA C 13 52.5550 0.0000 . 1 . . . . A 22 ASP CA . 30220 2 194 . 1 1 22 22 ASP CB C 13 42.4870 0.0000 . 1 . . . . A 22 ASP CB . 30220 2 195 . 1 1 23 23 ALA HA H 1 4.1900 0.0000 . 1 . . . . A 23 ALA HA . 30220 2 196 . 1 1 23 23 ALA HB1 H 1 1.2220 0.0000 . 1 . . . . A 23 ALA HB1 . 30220 2 197 . 1 1 23 23 ALA HB2 H 1 1.2220 0.0000 . 1 . . . . A 23 ALA HB2 . 30220 2 198 . 1 1 23 23 ALA HB3 H 1 1.2220 0.0000 . 1 . . . . A 23 ALA HB3 . 30220 2 199 . 1 1 23 23 ALA CA C 13 54.8260 0.0000 . 1 . . . . A 23 ALA CA . 30220 2 200 . 1 1 23 23 ALA CB C 13 17.5470 0.0000 . 1 . . . . A 23 ALA CB . 30220 2 201 . 1 1 24 24 ALA HA H 1 4.0010 0.0000 . 1 . . . . A 24 ALA HA . 30220 2 202 . 1 1 24 24 ALA HB1 H 1 1.3300 0.0000 . 1 . . . . A 24 ALA HB1 . 30220 2 203 . 1 1 24 24 ALA HB2 H 1 1.3300 0.0000 . 1 . . . . A 24 ALA HB2 . 30220 2 204 . 1 1 24 24 ALA HB3 H 1 1.3300 0.0000 . 1 . . . . A 24 ALA HB3 . 30220 2 205 . 1 1 24 24 ALA CA C 13 54.9140 0.0000 . 1 . . . . A 24 ALA CA . 30220 2 206 . 1 1 24 24 ALA CB C 13 17.8840 0.0000 . 1 . . . . A 24 ALA CB . 30220 2 207 . 1 1 25 25 THR HA H 1 3.7750 0.0000 . 1 . . . . A 25 THR HA . 30220 2 208 . 1 1 25 25 THR HB H 1 4.0580 0.0000 . 1 . . . . A 25 THR HB . 30220 2 209 . 1 1 25 25 THR HG21 H 1 1.2950 0.0000 . 1 . . . . A 25 THR HG21 . 30220 2 210 . 1 1 25 25 THR HG22 H 1 1.2950 0.0000 . 1 . . . . A 25 THR HG22 . 30220 2 211 . 1 1 25 25 THR HG23 H 1 1.2950 0.0000 . 1 . . . . A 25 THR HG23 . 30220 2 212 . 1 1 25 25 THR CA C 13 66.6030 0.0000 . 1 . . . . A 25 THR CA . 30220 2 213 . 1 1 25 25 THR CB C 13 68.0230 0.0000 . 1 . . . . A 25 THR CB . 30220 2 214 . 1 1 25 25 THR CG2 C 13 21.2330 0.0000 . 1 . . . . A 25 THR CG2 . 30220 2 215 . 1 1 26 26 ALA HA H 1 3.4590 0.0000 . 1 . . . . A 26 ALA HA . 30220 2 216 . 1 1 26 26 ALA HB1 H 1 0.6110 0.0000 . 1 . . . . A 26 ALA HB1 . 30220 2 217 . 1 1 26 26 ALA HB2 H 1 0.6110 0.0000 . 1 . . . . A 26 ALA HB2 . 30220 2 218 . 1 1 26 26 ALA HB3 H 1 0.6110 0.0000 . 1 . . . . A 26 ALA HB3 . 30220 2 219 . 1 1 26 26 ALA CA C 13 54.8630 0.0000 . 1 . . . . A 26 ALA CA . 30220 2 220 . 1 1 26 26 ALA CB C 13 18.1530 0.0000 . 1 . . . . A 26 ALA CB . 30220 2 221 . 1 1 27 27 GLU HA H 1 2.5420 0.0000 . 1 . . . . A 27 GLU HA . 30220 2 222 . 1 1 27 27 GLU HB2 H 1 1.9540 0.0000 . 2 . . . . A 27 GLU HB2 . 30220 2 223 . 1 1 27 27 GLU HB3 H 1 1.7870 0.0000 . 2 . . . . A 27 GLU HB3 . 30220 2 224 . 1 1 27 27 GLU HG2 H 1 1.5540 0.0000 . 2 . . . . A 27 GLU HG2 . 30220 2 225 . 1 1 27 27 GLU CA C 13 59.4370 0.0000 . 1 . . . . A 27 GLU CA . 30220 2 226 . 1 1 27 27 GLU CB C 13 29.3060 0.0000 . 1 . . . . A 27 GLU CB . 30220 2 227 . 1 1 27 27 GLU CG C 13 35.6780 0.0000 . 1 . . . . A 27 GLU CG . 30220 2 228 . 1 1 28 28 LYS HA H 1 3.7250 0.0000 . 1 . . . . A 28 LYS HA . 30220 2 229 . 1 1 28 28 LYS HB2 H 1 1.8720 0.0000 . 2 . . . . A 28 LYS HB2 . 30220 2 230 . 1 1 28 28 LYS HG2 H 1 1.5550 0.0000 . 2 . . . . A 28 LYS HG2 . 30220 2 231 . 1 1 28 28 LYS HD2 H 1 1.6420 0.0000 . 2 . . . . A 28 LYS HD2 . 30220 2 232 . 1 1 28 28 LYS HE2 H 1 2.9430 0.0000 . 2 . . . . A 28 LYS HE2 . 30220 2 233 . 1 1 28 28 LYS CA C 13 59.5220 0.0000 . 1 . . . . A 28 LYS CA . 30220 2 234 . 1 1 28 28 LYS CB C 13 32.4070 0.0000 . 1 . . . . A 28 LYS CB . 30220 2 235 . 1 1 28 28 LYS CG C 13 24.7660 0.0000 . 1 . . . . A 28 LYS CG . 30220 2 236 . 1 1 28 28 LYS CD C 13 29.0230 0.0000 . 1 . . . . A 28 LYS CD . 30220 2 237 . 1 1 28 28 LYS CE C 13 41.8570 0.0000 . 1 . . . . A 28 LYS CE . 30220 2 238 . 1 1 29 29 VAL HA H 1 3.7040 0.0000 . 1 . . . . A 29 VAL HA . 30220 2 239 . 1 1 29 29 VAL HB H 1 2.0270 0.0000 . 1 . . . . A 29 VAL HB . 30220 2 240 . 1 1 29 29 VAL HG11 H 1 1.0750 0.0000 . 2 . . . . A 29 VAL HG11 . 30220 2 241 . 1 1 29 29 VAL HG12 H 1 1.0750 0.0000 . 2 . . . . A 29 VAL HG12 . 30220 2 242 . 1 1 29 29 VAL HG13 H 1 1.0750 0.0000 . 2 . . . . A 29 VAL HG13 . 30220 2 243 . 1 1 29 29 VAL HG21 H 1 0.9910 0.0000 . 2 . . . . A 29 VAL HG21 . 30220 2 244 . 1 1 29 29 VAL HG22 H 1 0.9910 0.0000 . 2 . . . . A 29 VAL HG22 . 30220 2 245 . 1 1 29 29 VAL HG23 H 1 0.9910 0.0000 . 2 . . . . A 29 VAL HG23 . 30220 2 246 . 1 1 29 29 VAL CA C 13 65.9060 0.0000 . 1 . . . . A 29 VAL CA . 30220 2 247 . 1 1 29 29 VAL CB C 13 32.5070 0.0000 . 1 . . . . A 29 VAL CB . 30220 2 248 . 1 1 29 29 VAL CG1 C 13 21.8690 0.0000 . 2 . . . . A 29 VAL CG1 . 30220 2 249 . 1 1 29 29 VAL CG2 C 13 20.6950 0.0000 . 2 . . . . A 29 VAL CG2 . 30220 2 250 . 1 1 30 30 LEU HA H 1 4.1640 0.0000 . 1 . . . . A 30 LEU HA . 30220 2 251 . 1 1 30 30 LEU HB2 H 1 1.5420 0.0000 . 2 . . . . A 30 LEU HB2 . 30220 2 252 . 1 1 30 30 LEU HB3 H 1 1.4710 0.0000 . 2 . . . . A 30 LEU HB3 . 30220 2 253 . 1 1 30 30 LEU HG H 1 1.4700 0.0000 . 1 . . . . A 30 LEU HG . 30220 2 254 . 1 1 30 30 LEU HD11 H 1 0.6120 0.0000 . 2 . . . . A 30 LEU HD11 . 30220 2 255 . 1 1 30 30 LEU HD12 H 1 0.6120 0.0000 . 2 . . . . A 30 LEU HD12 . 30220 2 256 . 1 1 30 30 LEU HD13 H 1 0.6120 0.0000 . 2 . . . . A 30 LEU HD13 . 30220 2 257 . 1 1 30 30 LEU CA C 13 57.4960 0.0000 . 1 . . . . A 30 LEU CA . 30220 2 258 . 1 1 30 30 LEU CB C 13 40.5060 0.0000 . 1 . . . . A 30 LEU CB . 30220 2 259 . 1 1 30 30 LEU CG C 13 26.3990 0.0000 . 1 . . . . A 30 LEU CG . 30220 2 260 . 1 1 30 30 LEU CD1 C 13 21.1220 0.0000 . 2 . . . . A 30 LEU CD1 . 30220 2 261 . 1 1 31 31 LYS HA H 1 4.1010 0.0000 . 1 . . . . A 31 LYS HA . 30220 2 262 . 1 1 31 31 LYS HB2 H 1 1.5030 0.0000 . 2 . . . . A 31 LYS HB2 . 30220 2 263 . 1 1 31 31 LYS HB3 H 1 1.4060 0.0000 . 2 . . . . A 31 LYS HB3 . 30220 2 264 . 1 1 31 31 LYS HG2 H 1 0.5960 0.0000 . 2 . . . . A 31 LYS HG2 . 30220 2 265 . 1 1 31 31 LYS HG3 H 1 0.1100 0.0000 . 2 . . . . A 31 LYS HG3 . 30220 2 266 . 1 1 31 31 LYS HD2 H 1 0.9890 0.0000 . 2 . . . . A 31 LYS HD2 . 30220 2 267 . 1 1 31 31 LYS HD3 H 1 0.9320 0.0000 . 2 . . . . A 31 LYS HD3 . 30220 2 268 . 1 1 31 31 LYS HE2 H 1 1.7910 0.0000 . 2 . . . . A 31 LYS HE2 . 30220 2 269 . 1 1 31 31 LYS HE3 H 1 1.5950 0.0000 . 2 . . . . A 31 LYS HE3 . 30220 2 270 . 1 1 31 31 LYS CA C 13 59.8030 0.0000 . 1 . . . . A 31 LYS CA . 30220 2 271 . 1 1 31 31 LYS CB C 13 31.6530 0.0000 . 1 . . . . A 31 LYS CB . 30220 2 272 . 1 1 31 31 LYS CG C 13 25.5770 0.0000 . 1 . . . . A 31 LYS CG . 30220 2 273 . 1 1 31 31 LYS CD C 13 28.9540 0.0000 . 1 . . . . A 31 LYS CD . 30220 2 274 . 1 1 31 31 LYS CE C 13 41.0190 0.0000 . 1 . . . . A 31 LYS CE . 30220 2 275 . 1 1 32 32 GLN HA H 1 3.9960 0.0000 . 1 . . . . A 32 GLN HA . 30220 2 276 . 1 1 32 32 GLN HB2 H 1 2.2270 0.0000 . 2 . . . . A 32 GLN HB2 . 30220 2 277 . 1 1 32 32 GLN HG2 H 1 2.4190 0.0000 . 2 . . . . A 32 GLN HG2 . 30220 2 278 . 1 1 32 32 GLN CA C 13 58.6970 0.0000 . 1 . . . . A 32 GLN CA . 30220 2 279 . 1 1 32 32 GLN CB C 13 27.8620 0.0000 . 1 . . . . A 32 GLN CB . 30220 2 280 . 1 1 32 32 GLN CG C 13 33.4200 0.0000 . 1 . . . . A 32 GLN CG . 30220 2 281 . 1 1 33 33 TYR HA H 1 4.2250 0.0000 . 1 . . . . A 33 TYR HA . 30220 2 282 . 1 1 33 33 TYR HB2 H 1 3.3690 0.0000 . 2 . . . . A 33 TYR HB2 . 30220 2 283 . 1 1 33 33 TYR HB3 H 1 3.1500 0.0000 . 2 . . . . A 33 TYR HB3 . 30220 2 284 . 1 1 33 33 TYR HD1 H 1 6.9520 0.0000 . 3 . . . . A 33 TYR HD1 . 30220 2 285 . 1 1 33 33 TYR HE1 H 1 6.7100 0.0000 . 3 . . . . A 33 TYR HE1 . 30220 2 286 . 1 1 33 33 TYR CA C 13 61.7310 0.0000 . 1 . . . . A 33 TYR CA . 30220 2 287 . 1 1 33 33 TYR CB C 13 37.6820 0.0000 . 1 . . . . A 33 TYR CB . 30220 2 288 . 1 1 34 34 ALA HA H 1 3.8630 0.0000 . 1 . . . . A 34 ALA HA . 30220 2 289 . 1 1 34 34 ALA HB1 H 1 1.8650 0.0000 . 1 . . . . A 34 ALA HB1 . 30220 2 290 . 1 1 34 34 ALA HB2 H 1 1.8650 0.0000 . 1 . . . . A 34 ALA HB2 . 30220 2 291 . 1 1 34 34 ALA HB3 H 1 1.8650 0.0000 . 1 . . . . A 34 ALA HB3 . 30220 2 292 . 1 1 34 34 ALA CA C 13 56.1540 0.0000 . 1 . . . . A 34 ALA CA . 30220 2 293 . 1 1 34 34 ALA CB C 13 17.8560 0.0000 . 1 . . . . A 34 ALA CB . 30220 2 294 . 1 1 35 35 ASN HA H 1 4.4620 0.0000 . 1 . . . . A 35 ASN HA . 30220 2 295 . 1 1 35 35 ASN HB2 H 1 2.9270 0.0000 . 2 . . . . A 35 ASN HB2 . 30220 2 296 . 1 1 35 35 ASN CA C 13 56.7340 0.0000 . 1 . . . . A 35 ASN CA . 30220 2 297 . 1 1 35 35 ASN CB C 13 38.6230 0.0000 . 1 . . . . A 35 ASN CB . 30220 2 298 . 1 1 36 36 ASP HA H 1 4.3830 0.0000 . 1 . . . . A 36 ASP HA . 30220 2 299 . 1 1 36 36 ASP HB2 H 1 2.7220 0.0000 . 2 . . . . A 36 ASP HB2 . 30220 2 300 . 1 1 36 36 ASP HB3 H 1 2.5830 0.0000 . 2 . . . . A 36 ASP HB3 . 30220 2 301 . 1 1 36 36 ASP CA C 13 56.8100 0.0000 . 1 . . . . A 36 ASP CA . 30220 2 302 . 1 1 36 36 ASP CB C 13 40.0360 0.0000 . 1 . . . . A 36 ASP CB . 30220 2 303 . 1 1 37 37 ASN HA H 1 4.6400 0.0000 . 1 . . . . A 37 ASN HA . 30220 2 304 . 1 1 37 37 ASN HB2 H 1 2.7180 0.0000 . 2 . . . . A 37 ASN HB2 . 30220 2 305 . 1 1 37 37 ASN HB3 H 1 2.1490 0.0000 . 2 . . . . A 37 ASN HB3 . 30220 2 306 . 1 1 37 37 ASN CA C 13 53.6770 0.0000 . 1 . . . . A 37 ASN CA . 30220 2 307 . 1 1 37 37 ASN CB C 13 39.9850 0.0000 . 1 . . . . A 37 ASN CB . 30220 2 308 . 1 1 38 38 GLY HA2 H 1 3.9310 0.0000 . 2 . . . . A 38 GLY HA2 . 30220 2 309 . 1 1 38 38 GLY CA C 13 46.8470 0.0000 . 1 . . . . A 38 GLY CA . 30220 2 310 . 1 1 39 39 ILE HA H 1 4.2590 0.0000 . 1 . . . . A 39 ILE HA . 30220 2 311 . 1 1 39 39 ILE HB H 1 1.7660 0.0000 . 1 . . . . A 39 ILE HB . 30220 2 312 . 1 1 39 39 ILE HG12 H 1 1.2410 0.0000 . 2 . . . . A 39 ILE HG12 . 30220 2 313 . 1 1 39 39 ILE HG21 H 1 0.6990 0.0000 . 1 . . . . A 39 ILE HG21 . 30220 2 314 . 1 1 39 39 ILE HG22 H 1 0.6990 0.0000 . 1 . . . . A 39 ILE HG22 . 30220 2 315 . 1 1 39 39 ILE HG23 H 1 0.6990 0.0000 . 1 . . . . A 39 ILE HG23 . 30220 2 316 . 1 1 39 39 ILE HD11 H 1 0.7650 0.0000 . 1 . . . . A 39 ILE HD11 . 30220 2 317 . 1 1 39 39 ILE HD12 H 1 0.7650 0.0000 . 1 . . . . A 39 ILE HD12 . 30220 2 318 . 1 1 39 39 ILE HD13 H 1 0.7650 0.0000 . 1 . . . . A 39 ILE HD13 . 30220 2 319 . 1 1 39 39 ILE CA C 13 59.2160 0.0000 . 1 . . . . A 39 ILE CA . 30220 2 320 . 1 1 39 39 ILE CB C 13 38.1630 0.0000 . 1 . . . . A 39 ILE CB . 30220 2 321 . 1 1 39 39 ILE CG1 C 13 26.7130 0.0000 . 1 . . . . A 39 ILE CG1 . 30220 2 322 . 1 1 39 39 ILE CG2 C 13 17.9770 0.0000 . 1 . . . . A 39 ILE CG2 . 30220 2 323 . 1 1 39 39 ILE CD1 C 13 12.3150 0.0000 . 1 . . . . A 39 ILE CD1 . 30220 2 324 . 1 1 40 40 ASP HA H 1 4.9380 0.0000 . 1 . . . . A 40 ASP HA . 30220 2 325 . 1 1 40 40 ASP HB2 H 1 2.7740 0.0000 . 2 . . . . A 40 ASP HB2 . 30220 2 326 . 1 1 40 40 ASP HB3 H 1 2.5750 0.0000 . 2 . . . . A 40 ASP HB3 . 30220 2 327 . 1 1 40 40 ASP CA C 13 52.8530 0.0000 . 1 . . . . A 40 ASP CA . 30220 2 328 . 1 1 40 40 ASP CB C 13 43.1030 0.0000 . 1 . . . . A 40 ASP CB . 30220 2 329 . 1 1 41 41 GLY HA2 H 1 4.3400 0.0000 . 2 . . . . A 41 GLY HA2 . 30220 2 330 . 1 1 41 41 GLY HA3 H 1 3.6550 0.0000 . 2 . . . . A 41 GLY HA3 . 30220 2 331 . 1 1 41 41 GLY CA C 13 45.2760 0.0000 . 1 . . . . A 41 GLY CA . 30220 2 332 . 1 1 42 42 GLU HA H 1 4.7460 0.0000 . 1 . . . . A 42 GLU HA . 30220 2 333 . 1 1 42 42 GLU HB2 H 1 2.0830 0.0000 . 2 . . . . A 42 GLU HB2 . 30220 2 334 . 1 1 42 42 GLU HB3 H 1 1.9950 0.0000 . 2 . . . . A 42 GLU HB3 . 30220 2 335 . 1 1 42 42 GLU HG2 H 1 2.3790 0.0000 . 2 . . . . A 42 GLU HG2 . 30220 2 336 . 1 1 42 42 GLU HG3 H 1 2.2760 0.0000 . 2 . . . . A 42 GLU HG3 . 30220 2 337 . 1 1 42 42 GLU CA C 13 55.5010 0.0000 . 1 . . . . A 42 GLU CA . 30220 2 338 . 1 1 42 42 GLU CB C 13 31.5700 0.0000 . 1 . . . . A 42 GLU CB . 30220 2 339 . 1 1 42 42 GLU CG C 13 35.7100 0.0000 . 1 . . . . A 42 GLU CG . 30220 2 340 . 1 1 43 43 TRP HA H 1 5.4090 0.0000 . 1 . . . . A 43 TRP HA . 30220 2 341 . 1 1 43 43 TRP HB2 H 1 3.3450 0.0000 . 2 . . . . A 43 TRP HB2 . 30220 2 342 . 1 1 43 43 TRP HB3 H 1 3.1590 0.0000 . 2 . . . . A 43 TRP HB3 . 30220 2 343 . 1 1 43 43 TRP HD1 H 1 7.5220 0.0000 . 1 . . . . A 43 TRP HD1 . 30220 2 344 . 1 1 43 43 TRP HE3 H 1 7.5200 0.0000 . 1 . . . . A 43 TRP HE3 . 30220 2 345 . 1 1 43 43 TRP HZ2 H 1 7.2480 0.0000 . 1 . . . . A 43 TRP HZ2 . 30220 2 346 . 1 1 43 43 TRP HZ3 H 1 6.4950 0.0000 . 1 . . . . A 43 TRP HZ3 . 30220 2 347 . 1 1 43 43 TRP HH2 H 1 6.7000 0.0000 . 1 . . . . A 43 TRP HH2 . 30220 2 348 . 1 1 43 43 TRP CA C 13 57.9670 0.0000 . 1 . . . . A 43 TRP CA . 30220 2 349 . 1 1 43 43 TRP CB C 13 30.4320 0.0000 . 1 . . . . A 43 TRP CB . 30220 2 350 . 1 1 44 44 THR HA H 1 4.8400 0.0000 . 1 . . . . A 44 THR HA . 30220 2 351 . 1 1 44 44 THR HB H 1 4.2690 0.0000 . 1 . . . . A 44 THR HB . 30220 2 352 . 1 1 44 44 THR HG21 H 1 1.2230 0.0000 . 1 . . . . A 44 THR HG21 . 30220 2 353 . 1 1 44 44 THR HG22 H 1 1.2230 0.0000 . 1 . . . . A 44 THR HG22 . 30220 2 354 . 1 1 44 44 THR HG23 H 1 1.2230 0.0000 . 1 . . . . A 44 THR HG23 . 30220 2 355 . 1 1 44 44 THR CA C 13 60.3830 0.0000 . 1 . . . . A 44 THR CA . 30220 2 356 . 1 1 44 44 THR CB C 13 72.2450 0.0000 . 1 . . . . A 44 THR CB . 30220 2 357 . 1 1 44 44 THR CG2 C 13 22.0000 0.0000 . 1 . . . . A 44 THR CG2 . 30220 2 358 . 1 1 45 45 TYR HA H 1 4.9890 0.0000 . 1 . . . . A 45 TYR HA . 30220 2 359 . 1 1 45 45 TYR HB2 H 1 2.9710 0.0000 . 2 . . . . A 45 TYR HB2 . 30220 2 360 . 1 1 45 45 TYR HB3 H 1 2.5430 0.0000 . 2 . . . . A 45 TYR HB3 . 30220 2 361 . 1 1 45 45 TYR HD1 H 1 7.5720 0.0000 . 3 . . . . A 45 TYR HD1 . 30220 2 362 . 1 1 45 45 TYR HE1 H 1 6.3420 0.0000 . 3 . . . . A 45 TYR HE1 . 30220 2 363 . 1 1 45 45 TYR CA C 13 56.7830 0.0000 . 1 . . . . A 45 TYR CA . 30220 2 364 . 1 1 45 45 TYR CB C 13 41.6620 0.0000 . 1 . . . . A 45 TYR CB . 30220 2 365 . 1 1 46 46 ASP HA H 1 4.5890 0.0000 . 1 . . . . A 46 ASP HA . 30220 2 366 . 1 1 46 46 ASP HB2 H 1 2.5870 0.0000 . 2 . . . . A 46 ASP HB2 . 30220 2 367 . 1 1 46 46 ASP HB3 H 1 2.2680 0.0000 . 2 . . . . A 46 ASP HB3 . 30220 2 368 . 1 1 46 46 ASP CA C 13 51.7830 0.0000 . 1 . . . . A 46 ASP CA . 30220 2 369 . 1 1 46 46 ASP CB C 13 42.9880 0.0000 . 1 . . . . A 46 ASP CB . 30220 2 370 . 1 1 47 47 ASP HA H 1 4.0870 0.0000 . 1 . . . . A 47 ASP HA . 30220 2 371 . 1 1 47 47 ASP HB2 H 1 2.7960 0.0000 . 2 . . . . A 47 ASP HB2 . 30220 2 372 . 1 1 47 47 ASP HB3 H 1 2.5150 0.0000 . 2 . . . . A 47 ASP HB3 . 30220 2 373 . 1 1 47 47 ASP CA C 13 56.2130 0.0000 . 1 . . . . A 47 ASP CA . 30220 2 374 . 1 1 47 47 ASP CB C 13 42.0250 0.0000 . 1 . . . . A 47 ASP CB . 30220 2 375 . 1 1 48 48 ALA HA H 1 4.0940 0.0000 . 1 . . . . A 48 ALA HA . 30220 2 376 . 1 1 48 48 ALA HB1 H 1 1.5090 0.0000 . 1 . . . . A 48 ALA HB1 . 30220 2 377 . 1 1 48 48 ALA HB2 H 1 1.5090 0.0000 . 1 . . . . A 48 ALA HB2 . 30220 2 378 . 1 1 48 48 ALA HB3 H 1 1.5090 0.0000 . 1 . . . . A 48 ALA HB3 . 30220 2 379 . 1 1 48 48 ALA CA C 13 54.9770 0.0000 . 1 . . . . A 48 ALA CA . 30220 2 380 . 1 1 48 48 ALA CB C 13 18.2640 0.0000 . 1 . . . . A 48 ALA CB . 30220 2 381 . 1 1 49 49 THR HA H 1 4.3900 0.0000 . 1 . . . . A 49 THR HA . 30220 2 382 . 1 1 49 49 THR HB H 1 4.4070 0.0000 . 1 . . . . A 49 THR HB . 30220 2 383 . 1 1 49 49 THR HG21 H 1 1.0750 0.0000 . 1 . . . . A 49 THR HG21 . 30220 2 384 . 1 1 49 49 THR HG22 H 1 1.0750 0.0000 . 1 . . . . A 49 THR HG22 . 30220 2 385 . 1 1 49 49 THR HG23 H 1 1.0750 0.0000 . 1 . . . . A 49 THR HG23 . 30220 2 386 . 1 1 49 49 THR CA C 13 60.3120 0.0000 . 1 . . . . A 49 THR CA . 30220 2 387 . 1 1 49 49 THR CB C 13 70.0670 0.0000 . 1 . . . . A 49 THR CB . 30220 2 388 . 1 1 49 49 THR CG2 C 13 21.1200 0.0000 . 1 . . . . A 49 THR CG2 . 30220 2 389 . 1 1 50 50 LYS HA H 1 4.0910 0.0000 . 1 . . . . A 50 LYS HA . 30220 2 390 . 1 1 50 50 LYS HB2 H 1 1.8990 0.0000 . 2 . . . . A 50 LYS HB2 . 30220 2 391 . 1 1 50 50 LYS HB3 H 1 1.7300 0.0000 . 2 . . . . A 50 LYS HB3 . 30220 2 392 . 1 1 50 50 LYS HG2 H 1 1.2570 0.0000 . 2 . . . . A 50 LYS HG2 . 30220 2 393 . 1 1 50 50 LYS HG3 H 1 1.1670 0.0000 . 2 . . . . A 50 LYS HG3 . 30220 2 394 . 1 1 50 50 LYS HD2 H 1 1.4400 0.0000 . 2 . . . . A 50 LYS HD2 . 30220 2 395 . 1 1 50 50 LYS HE2 H 1 3.0160 0.0000 . 2 . . . . A 50 LYS HE2 . 30220 2 396 . 1 1 50 50 LYS HE3 H 1 2.9400 0.0000 . 2 . . . . A 50 LYS HE3 . 30220 2 397 . 1 1 50 50 LYS CA C 13 56.6520 0.0000 . 1 . . . . A 50 LYS CA . 30220 2 398 . 1 1 50 50 LYS CB C 13 29.3950 0.0000 . 1 . . . . A 50 LYS CB . 30220 2 399 . 1 1 50 50 LYS CG C 13 24.4910 0.0000 . 1 . . . . A 50 LYS CG . 30220 2 400 . 1 1 50 50 LYS CD C 13 28.1200 0.0000 . 1 . . . . A 50 LYS CD . 30220 2 401 . 1 1 50 50 LYS CE C 13 42.4860 0.0000 . 1 . . . . A 50 LYS CE . 30220 2 402 . 1 1 51 51 THR HA H 1 5.3590 0.0000 . 1 . . . . A 51 THR HA . 30220 2 403 . 1 1 51 51 THR HB H 1 3.7800 0.0000 . 1 . . . . A 51 THR HB . 30220 2 404 . 1 1 51 51 THR HG21 H 1 1.0460 0.0000 . 1 . . . . A 51 THR HG21 . 30220 2 405 . 1 1 51 51 THR HG22 H 1 1.0460 0.0000 . 1 . . . . A 51 THR HG22 . 30220 2 406 . 1 1 51 51 THR HG23 H 1 1.0460 0.0000 . 1 . . . . A 51 THR HG23 . 30220 2 407 . 1 1 51 51 THR CA C 13 62.2030 0.0000 . 1 . . . . A 51 THR CA . 30220 2 408 . 1 1 51 51 THR CB C 13 72.0320 0.0000 . 1 . . . . A 51 THR CB . 30220 2 409 . 1 1 51 51 THR CG2 C 13 21.0340 0.0000 . 1 . . . . A 51 THR CG2 . 30220 2 410 . 1 1 52 52 PHE HA H 1 5.6740 0.0000 . 1 . . . . A 52 PHE HA . 30220 2 411 . 1 1 52 52 PHE HB2 H 1 3.2880 0.0000 . 2 . . . . A 52 PHE HB2 . 30220 2 412 . 1 1 52 52 PHE HD1 H 1 7.5720 0.0000 . 3 . . . . A 52 PHE HD1 . 30220 2 413 . 1 1 52 52 PHE HE1 H 1 7.0210 0.0000 . 3 . . . . A 52 PHE HE1 . 30220 2 414 . 1 1 52 52 PHE HZ H 1 6.9240 0.0000 . 1 . . . . A 52 PHE HZ . 30220 2 415 . 1 1 52 52 PHE CA C 13 57.2430 0.0000 . 1 . . . . A 52 PHE CA . 30220 2 416 . 1 1 52 52 PHE CB C 13 42.6130 0.0000 . 1 . . . . A 52 PHE CB . 30220 2 417 . 1 1 53 53 THR HA H 1 5.2510 0.0000 . 1 . . . . A 53 THR HA . 30220 2 418 . 1 1 53 53 THR HB H 1 3.8340 0.0000 . 1 . . . . A 53 THR HB . 30220 2 419 . 1 1 53 53 THR HG21 H 1 0.9890 0.0000 . 1 . . . . A 53 THR HG21 . 30220 2 420 . 1 1 53 53 THR HG22 H 1 0.9890 0.0000 . 1 . . . . A 53 THR HG22 . 30220 2 421 . 1 1 53 53 THR HG23 H 1 0.9890 0.0000 . 1 . . . . A 53 THR HG23 . 30220 2 422 . 1 1 53 53 THR CA C 13 61.6990 0.0000 . 1 . . . . A 53 THR CA . 30220 2 423 . 1 1 53 53 THR CB C 13 70.9030 0.0000 . 1 . . . . A 53 THR CB . 30220 2 424 . 1 1 53 53 THR CG2 C 13 20.6250 0.0000 . 1 . . . . A 53 THR CG2 . 30220 2 425 . 1 1 54 54 VAL HA H 1 4.6180 0.0000 . 1 . . . . A 54 VAL HA . 30220 2 426 . 1 1 54 54 VAL HB H 1 -0.1850 0.0000 . 1 . . . . A 54 VAL HB . 30220 2 427 . 1 1 54 54 VAL HG11 H 1 -0.0700 0.0000 . 2 . . . . A 54 VAL HG11 . 30220 2 428 . 1 1 54 54 VAL HG12 H 1 -0.0700 0.0000 . 2 . . . . A 54 VAL HG12 . 30220 2 429 . 1 1 54 54 VAL HG13 H 1 -0.0700 0.0000 . 2 . . . . A 54 VAL HG13 . 30220 2 430 . 1 1 54 54 VAL HG21 H 1 0.5520 0.0000 . 2 . . . . A 54 VAL HG21 . 30220 2 431 . 1 1 54 54 VAL HG22 H 1 0.5520 0.0000 . 2 . . . . A 54 VAL HG22 . 30220 2 432 . 1 1 54 54 VAL HG23 H 1 0.5520 0.0000 . 2 . . . . A 54 VAL HG23 . 30220 2 433 . 1 1 54 54 VAL CA C 13 57.5730 0.0000 . 1 . . . . A 54 VAL CA . 30220 2 434 . 1 1 54 54 VAL CB C 13 32.7030 0.0000 . 1 . . . . A 54 VAL CB . 30220 2 435 . 1 1 54 54 VAL CG1 C 13 21.5040 0.0000 . 2 . . . . A 54 VAL CG1 . 30220 2 436 . 1 1 54 54 VAL CG2 C 13 20.5260 0.0000 . 2 . . . . A 54 VAL CG2 . 30220 2 437 . 1 1 55 55 THR HA H 1 4.8030 0.0000 . 1 . . . . A 55 THR HA . 30220 2 438 . 1 1 55 55 THR HB H 1 3.8990 0.0000 . 1 . . . . A 55 THR HB . 30220 2 439 . 1 1 55 55 THR HG21 H 1 1.2890 0.0000 . 1 . . . . A 55 THR HG21 . 30220 2 440 . 1 1 55 55 THR HG22 H 1 1.2890 0.0000 . 1 . . . . A 55 THR HG22 . 30220 2 441 . 1 1 55 55 THR HG23 H 1 1.2890 0.0000 . 1 . . . . A 55 THR HG23 . 30220 2 442 . 1 1 55 55 THR CA C 13 61.7860 0.0000 . 1 . . . . A 55 THR CA . 30220 2 443 . 1 1 55 55 THR CB C 13 70.6710 0.0000 . 1 . . . . A 55 THR CB . 30220 2 444 . 1 1 55 55 THR CG2 C 13 21.2330 0.0000 . 1 . . . . A 55 THR CG2 . 30220 2 445 . 1 1 56 56 GLU HA H 1 4.2970 0.0000 . 1 . . . . A 56 GLU HA . 30220 2 446 . 1 1 56 56 GLU HB2 H 1 2.2010 0.0000 . 2 . . . . A 56 GLU HB2 . 30220 2 447 . 1 1 56 56 GLU HB3 H 1 2.0010 0.0000 . 2 . . . . A 56 GLU HB3 . 30220 2 448 . 1 1 56 56 GLU HG2 H 1 2.3380 0.0000 . 2 . . . . A 56 GLU HG2 . 30220 2 449 . 1 1 56 56 GLU CA C 13 58.3300 0.0000 . 1 . . . . A 56 GLU CA . 30220 2 450 . 1 1 56 56 GLU CB C 13 32.6910 0.0000 . 1 . . . . A 56 GLU CB . 30220 2 451 . 1 1 56 56 GLU CG C 13 37.5050 0.0000 . 1 . . . . A 56 GLU CG . 30220 2 stop_ save_