################################### # 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 51210 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'Spikemoss TZF RNA Chemical Shifts' _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' . . . 51210 1 2 '3D HNCO' . . . 51210 1 3 '3D HN(CA)CO' . . . 51210 1 4 '3D HNCA' . . . 51210 1 5 '3D HN(CO)CA' . . . 51210 1 6 '3D HN(CA)CB' . . . 51210 1 7 '3D HN(COCA)CB' . . . 51210 1 8 '3D HA(CA)NH' . . . 51210 1 9 '3D HA(CACO)NH' . . . 51210 1 10 '4D HC(CCO)NH' . . . 51210 1 11 '4D HCCH-TOCSY' . . . 51210 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 4 $software_4 . . 51210 1 5 $software_5 . . 51210 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 ASN HA H 1 4.7500 0.0000 . 1 . . . . . 8 ASN HA . 51210 1 2 . 1 . 1 1 1 ASN HB2 H 1 2.8500 0.0000 . 1 . . . . . 8 ASN HB2 . 51210 1 3 . 1 . 1 1 1 ASN HB3 H 1 2.8500 0.0000 . 1 . . . . . 8 ASN HB3 . 51210 1 4 . 1 . 1 1 1 ASN C C 13 175.9300 0.0000 . 1 . . . . . 8 ASN C . 51210 1 5 . 1 . 1 1 1 ASN CA C 13 52.3300 0.0000 . 1 . . . . . 8 ASN CA . 51210 1 6 . 1 . 1 1 1 ASN CB C 13 38.9100 0.0000 . 1 . . . . . 8 ASN CB . 51210 1 7 . 1 . 1 2 2 ALA H H 1 8.7600 0.0000 . 1 . . . . . 9 ALA H . 51210 1 8 . 1 . 1 2 2 ALA HA H 1 4.0800 0.0000 . 1 . . . . . 9 ALA HA . 51210 1 9 . 1 . 1 2 2 ALA HB1 H 1 1.3813 0.0000 . 1 . . . . . 9 ALA HB1 . 51210 1 10 . 1 . 1 2 2 ALA HB2 H 1 1.3813 0.0000 . 1 . . . . . 9 ALA HB1 . 51210 1 11 . 1 . 1 2 2 ALA HB3 H 1 1.3813 0.0000 . 1 . . . . . 9 ALA HB1 . 51210 1 12 . 1 . 1 2 2 ALA C C 13 178.2000 0.0000 . 1 . . . . . 9 ALA C . 51210 1 13 . 1 . 1 2 2 ALA CA C 13 54.4000 0.0000 . 1 . . . . . 9 ALA CA . 51210 1 14 . 1 . 1 2 2 ALA CB C 13 18.6000 0.0000 . 1 . . . . . 9 ALA CB . 51210 1 15 . 1 . 1 2 2 ALA N N 15 127.0200 0.0000 . 1 . . . . . 9 ALA N . 51210 1 16 . 1 . 1 3 3 LEU H H 1 7.7200 0.0000 . 1 . . . . . 10 LEU H . 51210 1 17 . 1 . 1 3 3 LEU HA H 1 4.2100 0.0000 . 1 . . . . . 10 LEU HA . 51210 1 18 . 1 . 1 3 3 LEU HB2 H 1 1.1870 0.0000 . 1 . . . . . 10 LEU HB2 . 51210 1 19 . 1 . 1 3 3 LEU HB3 H 1 1.1870 0.0000 . 1 . . . . . 10 LEU HB3 . 51210 1 20 . 1 . 1 3 3 LEU HG H 1 1.4530 0.0000 . 1 . . . . . 10 LEU HG . 51210 1 21 . 1 . 1 3 3 LEU HD11 H 1 0.7760 0.0000 . 1 . . . . . 10 LEU HD11 . 51210 1 22 . 1 . 1 3 3 LEU HD12 H 1 0.7760 0.0000 . 1 . . . . . 10 LEU HD11 . 51210 1 23 . 1 . 1 3 3 LEU HD13 H 1 0.7760 0.0000 . 1 . . . . . 10 LEU HD11 . 51210 1 24 . 1 . 1 3 3 LEU HD21 H 1 0.9430 0.0000 . 1 . . . . . 10 LEU HD21 . 51210 1 25 . 1 . 1 3 3 LEU HD22 H 1 0.9430 0.0000 . 1 . . . . . 10 LEU HD21 . 51210 1 26 . 1 . 1 3 3 LEU HD23 H 1 0.9430 0.0000 . 1 . . . . . 10 LEU HD21 . 51210 1 27 . 1 . 1 3 3 LEU C C 13 176.2000 0.0000 . 1 . . . . . 10 LEU C . 51210 1 28 . 1 . 1 3 3 LEU CA C 13 53.4000 0.0000 . 1 . . . . . 10 LEU CA . 51210 1 29 . 1 . 1 3 3 LEU CB C 13 40.6000 0.0000 . 1 . . . . . 10 LEU CB . 51210 1 30 . 1 . 1 3 3 LEU CG C 13 27.0550 0.0000 . 1 . . . . . 10 LEU CG . 51210 1 31 . 1 . 1 3 3 LEU CD1 C 13 22.3470 0.0000 . 1 . . . . . 10 LEU CD1 . 51210 1 32 . 1 . 1 3 3 LEU CD2 C 13 25.9800 0.0000 . 1 . . . . . 10 LEU CD2 . 51210 1 33 . 1 . 1 3 3 LEU N N 15 115.3000 0.0000 . 1 . . . . . 10 LEU N . 51210 1 34 . 1 . 1 4 4 TYR H H 1 6.9100 0.0000 . 1 . . . . . 11 TYR H . 51210 1 35 . 1 . 1 4 4 TYR HA H 1 3.7600 0.0000 . 1 . . . . . 11 TYR HA . 51210 1 36 . 1 . 1 4 4 TYR HB2 H 1 2.5970 0.0000 . 1 . . . . . 11 TYR HB2 . 51210 1 37 . 1 . 1 4 4 TYR HB3 H 1 3.1580 0.0000 . 1 . . . . . 11 TYR HB3 . 51210 1 38 . 1 . 1 4 4 TYR HD1 H 1 6.9200 0.0000 . 1 . . . . . 11 TYR HD1 . 51210 1 39 . 1 . 1 4 4 TYR HD2 H 1 6.9200 0.0000 . 1 . . . . . 11 TYR HD2 . 51210 1 40 . 1 . 1 4 4 TYR HE1 H 1 6.6670 0.0000 . 1 . . . . . 11 TYR HE1 . 51210 1 41 . 1 . 1 4 4 TYR HE2 H 1 6.6670 0.0000 . 1 . . . . . 11 TYR HE2 . 51210 1 42 . 1 . 1 4 4 TYR C C 13 173.5000 0.0000 . 1 . . . . . 11 TYR C . 51210 1 43 . 1 . 1 4 4 TYR CA C 13 59.3000 0.0000 . 1 . . . . . 11 TYR CA . 51210 1 44 . 1 . 1 4 4 TYR CB C 13 39.2000 0.0000 . 1 . . . . . 11 TYR CB . 51210 1 45 . 1 . 1 4 4 TYR CD1 C 13 133.0400 0.0000 . 1 . . . . . 11 TYR CD1 . 51210 1 46 . 1 . 1 4 4 TYR CD2 C 13 133.0400 0.0000 . 1 . . . . . 11 TYR CD2 . 51210 1 47 . 1 . 1 4 4 TYR CE1 C 13 117.5700 0.0000 . 1 . . . . . 11 TYR CE1 . 51210 1 48 . 1 . 1 4 4 TYR CE2 C 13 117.5700 0.0000 . 1 . . . . . 11 TYR CE2 . 51210 1 49 . 1 . 1 4 4 TYR N N 15 122.3000 0.0000 . 1 . . . . . 11 TYR N . 51210 1 50 . 1 . 1 5 5 LYS H H 1 8.0600 0.0000 . 1 . . . . . 12 LYS H . 51210 1 51 . 1 . 1 5 5 LYS HA H 1 3.0600 0.0000 . 1 . . . . . 12 LYS HA . 51210 1 52 . 1 . 1 5 5 LYS HB2 H 1 0.8480 0.0000 . 1 . . . . . 12 LYS HB2 . 51210 1 53 . 1 . 1 5 5 LYS HB3 H 1 1.8590 0.0000 . 1 . . . . . 12 LYS HB3 . 51210 1 54 . 1 . 1 5 5 LYS HG2 H 1 -0.3110 0.0000 . 1 . . . . . 12 LYS HG2 . 51210 1 55 . 1 . 1 5 5 LYS HG3 H 1 -0.5570 0.0000 . 1 . . . . . 12 LYS HG3 . 51210 1 56 . 1 . 1 5 5 LYS HD2 H 1 2.1700 0.0000 . 1 . . . . . 12 LYS HD2 . 51210 1 57 . 1 . 1 5 5 LYS HD3 H 1 2.1700 0.0000 . 1 . . . . . 12 LYS HD3 . 51210 1 58 . 1 . 1 5 5 LYS HE2 H 1 2.6170 0.0000 . 1 . . . . . 12 LYS HE2 . 51210 1 59 . 1 . 1 5 5 LYS HE3 H 1 2.6170 0.0000 . 1 . . . . . 12 LYS HE3 . 51210 1 60 . 1 . 1 5 5 LYS C C 13 173.1000 0.0000 . 1 . . . . . 12 LYS C . 51210 1 61 . 1 . 1 5 5 LYS CA C 13 59.3000 0.0000 . 1 . . . . . 12 LYS CA . 51210 1 62 . 1 . 1 5 5 LYS CB C 13 30.1000 0.0000 . 1 . . . . . 12 LYS CB . 51210 1 63 . 1 . 1 5 5 LYS CG C 13 26.6830 0.0000 . 1 . . . . . 12 LYS CG . 51210 1 64 . 1 . 1 5 5 LYS CD C 13 30.3600 0.0000 . 1 . . . . . 12 LYS CD . 51210 1 65 . 1 . 1 5 5 LYS CE C 13 43.7550 0.0000 . 1 . . . . . 12 LYS CE . 51210 1 66 . 1 . 1 5 5 LYS N N 15 121.9000 0.0000 . 1 . . . . . 12 LYS N . 51210 1 67 . 1 . 1 6 6 THR H H 1 7.4600 0.0000 . 1 . . . . . 13 THR H . 51210 1 68 . 1 . 1 6 6 THR HA H 1 4.5300 0.0000 . 1 . . . . . 13 THR HA . 51210 1 69 . 1 . 1 6 6 THR HB H 1 4.0990 0.0000 . 1 . . . . . 13 THR HB . 51210 1 70 . 1 . 1 6 6 THR HG21 H 1 0.8830 0.0000 . 1 . . . . . 13 THR HG21 . 51210 1 71 . 1 . 1 6 6 THR HG22 H 1 0.8830 0.0000 . 1 . . . . . 13 THR HG21 . 51210 1 72 . 1 . 1 6 6 THR HG23 H 1 0.8830 0.0000 . 1 . . . . . 13 THR HG21 . 51210 1 73 . 1 . 1 6 6 THR C C 13 174.4000 0.0000 . 1 . . . . . 13 THR C . 51210 1 74 . 1 . 1 6 6 THR CA C 13 62.3000 0.0000 . 1 . . . . . 13 THR CA . 51210 1 75 . 1 . 1 6 6 THR CB C 13 70.7000 0.0000 . 1 . . . . . 13 THR CB . 51210 1 76 . 1 . 1 6 6 THR CG2 C 13 21.1130 0.0000 . 1 . . . . . 13 THR CG2 . 51210 1 77 . 1 . 1 6 6 THR N N 15 106.2000 0.0000 . 1 . . . . . 13 THR N . 51210 1 78 . 1 . 1 7 7 GLU H H 1 9.0800 0.0000 . 1 . . . . . 14 GLU H . 51210 1 79 . 1 . 1 7 7 GLU HA H 1 4.6900 0.0000 . 1 . . . . . 14 GLU HA . 51210 1 80 . 1 . 1 7 7 GLU HB2 H 1 2.1540 0.0000 . 1 . . . . . 14 GLU HB2 . 51210 1 81 . 1 . 1 7 7 GLU HB3 H 1 2.1540 0.0000 . 1 . . . . . 14 GLU HB3 . 51210 1 82 . 1 . 1 7 7 GLU HG2 H 1 2.4360 0.0000 . 1 . . . . . 14 GLU HG2 . 51210 1 83 . 1 . 1 7 7 GLU HG3 H 1 2.4360 0.0000 . 1 . . . . . 14 GLU HG3 . 51210 1 84 . 1 . 1 7 7 GLU C C 13 175.0000 0.0000 . 1 . . . . . 14 GLU C . 51210 1 85 . 1 . 1 7 7 GLU CA C 13 54.7000 0.0000 . 1 . . . . . 14 GLU CA . 51210 1 86 . 1 . 1 7 7 GLU CB C 13 35.0000 0.0000 . 1 . . . . . 14 GLU CB . 51210 1 87 . 1 . 1 7 7 GLU CG C 13 37.8280 0.0000 . 1 . . . . . 14 GLU CG . 51210 1 88 . 1 . 1 7 7 GLU N N 15 126.2000 0.0000 . 1 . . . . . 14 GLU N . 51210 1 89 . 1 . 1 8 8 LEU H H 1 8.7600 0.0000 . 1 . . . . . 15 LEU H . 51210 1 90 . 1 . 1 8 8 LEU HA H 1 4.2900 0.0000 . 1 . . . . . 15 LEU HA . 51210 1 91 . 1 . 1 8 8 LEU HB2 H 1 1.4660 0.0000 . 1 . . . . . 15 LEU HB2 . 51210 1 92 . 1 . 1 8 8 LEU HB3 H 1 1.7550 0.0000 . 1 . . . . . 15 LEU HB3 . 51210 1 93 . 1 . 1 8 8 LEU HG H 1 1.8067 0.0000 . 1 . . . . . 15 LEU HG . 51210 1 94 . 1 . 1 8 8 LEU HD11 H 1 0.9680 0.0000 . 1 . . . . . 15 LEU HD11 . 51210 1 95 . 1 . 1 8 8 LEU HD12 H 1 0.9680 0.0000 . 1 . . . . . 15 LEU HD11 . 51210 1 96 . 1 . 1 8 8 LEU HD13 H 1 0.9680 0.0000 . 1 . . . . . 15 LEU HD11 . 51210 1 97 . 1 . 1 8 8 LEU HD21 H 1 0.6820 0.0000 . 1 . . . . . 15 LEU HD21 . 51210 1 98 . 1 . 1 8 8 LEU HD22 H 1 0.6820 0.0000 . 1 . . . . . 15 LEU HD21 . 51210 1 99 . 1 . 1 8 8 LEU HD23 H 1 0.6820 0.0000 . 1 . . . . . 15 LEU HD21 . 51210 1 100 . 1 . 1 8 8 LEU C C 13 177.0000 0.0000 . 1 . . . . . 15 LEU C . 51210 1 101 . 1 . 1 8 8 LEU CA C 13 56.1000 0.0000 . 1 . . . . . 15 LEU CA . 51210 1 102 . 1 . 1 8 8 LEU CB C 13 41.8000 0.0000 . 1 . . . . . 15 LEU CB . 51210 1 103 . 1 . 1 8 8 LEU CG C 13 26.9330 0.0000 . 1 . . . . . 15 LEU CG . 51210 1 104 . 1 . 1 8 8 LEU CD1 C 13 25.4870 0.0000 . 1 . . . . . 15 LEU CD1 . 51210 1 105 . 1 . 1 8 8 LEU CD2 C 13 22.2590 0.0000 . 1 . . . . . 15 LEU CD2 . 51210 1 106 . 1 . 1 8 8 LEU N N 15 125.6000 0.0000 . 1 . . . . . 15 LEU N . 51210 1 107 . 1 . 1 9 9 CYS H H 1 9.9100 0.0000 . 1 . . . . . 16 CYS H . 51210 1 108 . 1 . 1 9 9 CYS HA H 1 4.8300 0.0000 . 1 . . . . . 16 CYS HA . 51210 1 109 . 1 . 1 9 9 CYS HB2 H 1 2.9020 0.0000 . 1 . . . . . 16 CYS HB2 . 51210 1 110 . 1 . 1 9 9 CYS HB3 H 1 3.4370 0.0000 . 1 . . . . . 16 CYS HB3 . 51210 1 111 . 1 . 1 9 9 CYS C C 13 177.1000 0.0000 . 1 . . . . . 16 CYS C . 51210 1 112 . 1 . 1 9 9 CYS CA C 13 59.1000 0.0000 . 1 . . . . . 16 CYS CA . 51210 1 113 . 1 . 1 9 9 CYS CB C 13 31.7000 0.0000 . 1 . . . . . 16 CYS CB . 51210 1 114 . 1 . 1 9 9 CYS N N 15 128.1000 0.0000 . 1 . . . . . 16 CYS N . 51210 1 115 . 1 . 1 10 10 ARG H H 1 11.1700 0.0000 . 1 . . . . . 17 ARG H . 51210 1 116 . 1 . 1 10 10 ARG HA H 1 4.1900 0.0000 . 1 . . . . . 17 ARG HA . 51210 1 117 . 1 . 1 10 10 ARG HB2 H 1 1.6240 0.0000 . 1 . . . . . 17 ARG HB2 . 51210 1 118 . 1 . 1 10 10 ARG HB3 H 1 1.6240 0.0000 . 1 . . . . . 17 ARG HB3 . 51210 1 119 . 1 . 1 10 10 ARG HG2 H 1 1.5410 0.0000 . 1 . . . . . 17 ARG HG2 . 51210 1 120 . 1 . 1 10 10 ARG HG3 H 1 1.4040 0.0000 . 1 . . . . . 17 ARG HG3 . 51210 1 121 . 1 . 1 10 10 ARG HD2 H 1 2.5980 0.0000 . 1 . . . . . 17 ARG HD2 . 51210 1 122 . 1 . 1 10 10 ARG HD3 H 1 3.2140 0.0000 . 1 . . . . . 17 ARG HD3 . 51210 1 123 . 1 . 1 10 10 ARG C C 13 178.9000 0.0000 . 1 . . . . . 17 ARG C . 51210 1 124 . 1 . 1 10 10 ARG CA C 13 59.3000 0.0000 . 1 . . . . . 17 ARG CA . 51210 1 125 . 1 . 1 10 10 ARG CB C 13 30.1000 0.0000 . 1 . . . . . 17 ARG CB . 51210 1 126 . 1 . 1 10 10 ARG CG C 13 26.9230 0.0000 . 1 . . . . . 17 ARG CG . 51210 1 127 . 1 . 1 10 10 ARG CD C 13 43.4600 0.0000 . 1 . . . . . 17 ARG CD . 51210 1 128 . 1 . 1 10 10 ARG N N 15 134.2000 0.0000 . 1 . . . . . 17 ARG N . 51210 1 129 . 1 . 1 11 11 SER H H 1 8.2300 0.0000 . 1 . . . . . 18 SER H . 51210 1 130 . 1 . 1 11 11 SER HA H 1 4.4500 0.0000 . 1 . . . . . 18 SER HA . 51210 1 131 . 1 . 1 11 11 SER HB2 H 1 4.3620 0.0000 . 1 . . . . . 18 SER HB2 . 51210 1 132 . 1 . 1 11 11 SER HB3 H 1 4.3620 0.0000 . 1 . . . . . 18 SER HB3 . 51210 1 133 . 1 . 1 11 11 SER C C 13 177.7000 0.0000 . 1 . . . . . 18 SER C . 51210 1 134 . 1 . 1 11 11 SER CA C 13 61.9000 0.0000 . 1 . . . . . 18 SER CA . 51210 1 135 . 1 . 1 11 11 SER CB C 13 63.4000 0.0000 . 1 . . . . . 18 SER CB . 51210 1 136 . 1 . 1 11 11 SER N N 15 117.7000 0.0000 . 1 . . . . . 18 SER N . 51210 1 137 . 1 . 1 12 12 TRP H H 1 9.2700 0.0000 . 1 . . . . . 19 TRP H . 51210 1 138 . 1 . 1 12 12 TRP HA H 1 3.6610 0.0000 . 1 . . . . . 19 TRP HA . 51210 1 139 . 1 . 1 12 12 TRP HB2 H 1 3.0980 0.0000 . 1 . . . . . 19 TRP HB2 . 51210 1 140 . 1 . 1 12 12 TRP HB3 H 1 3.7350 0.0000 . 1 . . . . . 19 TRP HB3 . 51210 1 141 . 1 . 1 12 12 TRP HD1 H 1 7.1070 0.0000 . 1 . . . . . 19 TRP HD1 . 51210 1 142 . 1 . 1 12 12 TRP C C 13 180.0000 0.0000 . 1 . . . . . 19 TRP C . 51210 1 143 . 1 . 1 12 12 TRP CA C 13 61.2000 0.0000 . 1 . . . . . 19 TRP CA . 51210 1 144 . 1 . 1 12 12 TRP CB C 13 28.3870 0.0000 . 1 . . . . . 19 TRP CB . 51210 1 145 . 1 . 1 12 12 TRP N N 15 129.0000 0.0000 . 1 . . . . . 19 TRP N . 51210 1 146 . 1 . 1 13 13 GLU H H 1 8.7100 0.0000 . 1 . . . . . 20 GLU H . 51210 1 147 . 1 . 1 13 13 GLU HA H 1 4.0100 0.0000 . 1 . . . . . 20 GLU HA . 51210 1 148 . 1 . 1 13 13 GLU HB2 H 1 2.2020 0.0000 . 1 . . . . . 20 GLU HB2 . 51210 1 149 . 1 . 1 13 13 GLU HB3 H 1 2.2020 0.0000 . 1 . . . . . 20 GLU HB3 . 51210 1 150 . 1 . 1 13 13 GLU HG2 H 1 2.4240 0.0000 . 1 . . . . . 20 GLU HG2 . 51210 1 151 . 1 . 1 13 13 GLU HG3 H 1 2.4240 0.0000 . 1 . . . . . 20 GLU HG3 . 51210 1 152 . 1 . 1 13 13 GLU C C 13 178.0000 0.0000 . 1 . . . . . 20 GLU C . 51210 1 153 . 1 . 1 13 13 GLU CA C 13 59.3000 0.0000 . 1 . . . . . 20 GLU CA . 51210 1 154 . 1 . 1 13 13 GLU CB C 13 30.7300 0.0000 . 1 . . . . . 20 GLU CB . 51210 1 155 . 1 . 1 13 13 GLU CG C 13 37.4180 0.0000 . 1 . . . . . 20 GLU CG . 51210 1 156 . 1 . 1 13 13 GLU N N 15 118.1000 0.0000 . 1 . . . . . 20 GLU N . 51210 1 157 . 1 . 1 14 14 GLU H H 1 7.8100 0.0000 . 1 . . . . . 21 GLU H . 51210 1 158 . 1 . 1 14 14 GLU HA H 1 4.2100 0.0000 . 1 . . . . . 21 GLU HA . 51210 1 159 . 1 . 1 14 14 GLU HB2 H 1 2.1560 0.0000 . 1 . . . . . 21 GLU HB2 . 51210 1 160 . 1 . 1 14 14 GLU HB3 H 1 2.1560 0.0000 . 1 . . . . . 21 GLU HB3 . 51210 1 161 . 1 . 1 14 14 GLU HG2 H 1 2.5010 0.0000 . 1 . . . . . 21 GLU HG2 . 51210 1 162 . 1 . 1 14 14 GLU HG3 H 1 2.2700 0.0000 . 1 . . . . . 21 GLU HG3 . 51210 1 163 . 1 . 1 14 14 GLU C C 13 178.6000 0.0000 . 1 . . . . . 21 GLU C . 51210 1 164 . 1 . 1 14 14 GLU CA C 13 58.9000 0.0000 . 1 . . . . . 21 GLU CA . 51210 1 165 . 1 . 1 14 14 GLU CB C 13 30.7000 0.0000 . 1 . . . . . 21 GLU CB . 51210 1 166 . 1 . 1 14 14 GLU CG C 13 36.4690 0.0000 . 1 . . . . . 21 GLU CG . 51210 1 167 . 1 . 1 14 14 GLU N N 15 115.8000 0.0000 . 1 . . . . . 21 GLU N . 51210 1 168 . 1 . 1 15 15 THR H H 1 8.3000 0.0000 . 1 . . . . . 22 THR H . 51210 1 169 . 1 . 1 15 15 THR HA H 1 4.6300 0.0000 . 1 . . . . . 22 THR HA . 51210 1 170 . 1 . 1 15 15 THR HB H 1 4.2630 0.0000 . 1 . . . . . 22 THR HB . 51210 1 171 . 1 . 1 15 15 THR HG21 H 1 1.1770 0.0000 . 1 . . . . . 22 THR HG21 . 51210 1 172 . 1 . 1 15 15 THR HG22 H 1 1.1770 0.0000 . 1 . . . . . 22 THR HG21 . 51210 1 173 . 1 . 1 15 15 THR HG23 H 1 1.1770 0.0000 . 1 . . . . . 22 THR HG21 . 51210 1 174 . 1 . 1 15 15 THR C C 13 175.9000 0.0000 . 1 . . . . . 22 THR C . 51210 1 175 . 1 . 1 15 15 THR CA C 13 61.7000 0.0000 . 1 . . . . . 22 THR CA . 51210 1 176 . 1 . 1 15 15 THR CB C 13 72.8000 0.0000 . 1 . . . . . 22 THR CB . 51210 1 177 . 1 . 1 15 15 THR CG2 C 13 21.2290 0.0000 . 1 . . . . . 22 THR CG2 . 51210 1 178 . 1 . 1 15 15 THR N N 15 105.2000 0.0000 . 1 . . . . . 22 THR N . 51210 1 179 . 1 . 1 16 16 GLY H H 1 8.2800 0.0000 . 1 . . . . . 23 GLY H . 51210 1 180 . 1 . 1 16 16 GLY HA2 H 1 2.4710 0.0000 . 1 . . . . . 23 GLY HA2 . 51210 1 181 . 1 . 1 16 16 GLY HA3 H 1 3.4950 0.0000 . 1 . . . . . 23 GLY HA3 . 51210 1 182 . 1 . 1 16 16 GLY C C 13 171.0000 0.0000 . 1 . . . . . 23 GLY C . 51210 1 183 . 1 . 1 16 16 GLY CA C 13 44.9000 0.0000 . 1 . . . . . 23 GLY CA . 51210 1 184 . 1 . 1 16 16 GLY N N 15 112.9000 0.0000 . 1 . . . . . 23 GLY N . 51210 1 185 . 1 . 1 17 17 SER H H 1 7.3400 0.0000 . 1 . . . . . 24 SER H . 51210 1 186 . 1 . 1 17 17 SER HA H 1 4.1500 0.0000 . 1 . . . . . 24 SER HA . 51210 1 187 . 1 . 1 17 17 SER HB2 H 1 3.4500 0.0000 . 1 . . . . . 24 SER HB2 . 51210 1 188 . 1 . 1 17 17 SER HB3 H 1 3.4500 0.0000 . 1 . . . . . 24 SER HB3 . 51210 1 189 . 1 . 1 17 17 SER C C 13 171.5200 0.0000 . 1 . . . . . 24 SER C . 51210 1 190 . 1 . 1 17 17 SER CA C 13 56.7000 0.0000 . 1 . . . . . 24 SER CA . 51210 1 191 . 1 . 1 17 17 SER CB C 13 65.5000 0.0000 . 1 . . . . . 24 SER CB . 51210 1 192 . 1 . 1 17 17 SER N N 15 111.4000 0.0000 . 1 . . . . . 24 SER N . 51210 1 193 . 1 . 1 18 18 CYS H H 1 8.4300 0.0000 . 1 . . . . . 25 CYS H . 51210 1 194 . 1 . 1 18 18 CYS HA H 1 4.5800 0.0000 . 1 . . . . . 25 CYS HA . 51210 1 195 . 1 . 1 18 18 CYS HB2 H 1 2.7700 0.0000 . 1 . . . . . 25 CYS HB2 . 51210 1 196 . 1 . 1 18 18 CYS HB3 H 1 3.0900 0.0000 . 1 . . . . . 25 CYS HB3 . 51210 1 197 . 1 . 1 18 18 CYS C C 13 177.0000 0.0000 . 1 . . . . . 25 CYS C . 51210 1 198 . 1 . 1 18 18 CYS CA C 13 59.9000 0.0000 . 1 . . . . . 25 CYS CA . 51210 1 199 . 1 . 1 18 18 CYS CB C 13 33.4000 0.0000 . 1 . . . . . 25 CYS CB . 51210 1 200 . 1 . 1 18 18 CYS N N 15 120.8000 0.0000 . 1 . . . . . 25 CYS N . 51210 1 201 . 1 . 1 19 19 ARG H H 1 9.2600 0.0000 . 1 . . . . . 26 ARG H . 51210 1 202 . 1 . 1 19 19 ARG HA H 1 4.2990 0.0000 . 1 . . . . . 26 ARG HA . 51210 1 203 . 1 . 1 19 19 ARG HB2 H 1 1.7900 0.0000 . 1 . . . . . 26 ARG HB2 . 51210 1 204 . 1 . 1 19 19 ARG HB3 H 1 1.7900 0.0000 . 1 . . . . . 26 ARG HB3 . 51210 1 205 . 1 . 1 19 19 ARG HG2 H 1 1.7430 0.0000 . 1 . . . . . 26 ARG HG2 . 51210 1 206 . 1 . 1 19 19 ARG HG3 H 1 1.0880 0.0000 . 1 . . . . . 26 ARG HG3 . 51210 1 207 . 1 . 1 19 19 ARG HD2 H 1 3.0790 0.0000 . 1 . . . . . 26 ARG HD2 . 51210 1 208 . 1 . 1 19 19 ARG HD3 H 1 3.0790 0.0000 . 1 . . . . . 26 ARG HD3 . 51210 1 209 . 1 . 1 19 19 ARG C C 13 177.0000 0.0000 . 1 . . . . . 26 ARG C . 51210 1 210 . 1 . 1 19 19 ARG CA C 13 58.4000 0.0000 . 1 . . . . . 26 ARG CA . 51210 1 211 . 1 . 1 19 19 ARG CB C 13 28.9000 0.0000 . 1 . . . . . 26 ARG CB . 51210 1 212 . 1 . 1 19 19 ARG CG C 13 26.6520 0.0000 . 1 . . . . . 26 ARG CG . 51210 1 213 . 1 . 1 19 19 ARG CD C 13 43.5700 0.0000 . 1 . . . . . 26 ARG CD . 51210 1 214 . 1 . 1 19 19 ARG N N 15 131.1000 0.0000 . 1 . . . . . 26 ARG N . 51210 1 215 . 1 . 1 20 20 TYR H H 1 9.4000 0.0000 . 1 . . . . . 27 TYR H . 51210 1 216 . 1 . 1 20 20 TYR HA H 1 4.3600 0.0000 . 1 . . . . . 27 TYR HA . 51210 1 217 . 1 . 1 20 20 TYR HB2 H 1 2.6330 0.0000 . 1 . . . . . 27 TYR HB2 . 51210 1 218 . 1 . 1 20 20 TYR HB3 H 1 3.3400 0.0000 . 1 . . . . . 27 TYR HB3 . 51210 1 219 . 1 . 1 20 20 TYR HD1 H 1 7.0536 0.0000 . 1 . . . . . 27 TYR HD1 . 51210 1 220 . 1 . 1 20 20 TYR HD2 H 1 7.0536 0.0000 . 1 . . . . . 27 TYR HD2 . 51210 1 221 . 1 . 1 20 20 TYR HE1 H 1 6.7663 0.0000 . 1 . . . . . 27 TYR HE1 . 51210 1 222 . 1 . 1 20 20 TYR HE2 H 1 6.7663 0.0000 . 1 . . . . . 27 TYR HE2 . 51210 1 223 . 1 . 1 20 20 TYR C C 13 177.7000 0.0000 . 1 . . . . . 27 TYR C . 51210 1 224 . 1 . 1 20 20 TYR CA C 13 60.9000 0.0000 . 1 . . . . . 27 TYR CA . 51210 1 225 . 1 . 1 20 20 TYR CB C 13 38.3200 0.0000 . 1 . . . . . 27 TYR CB . 51210 1 226 . 1 . 1 20 20 TYR CD1 C 13 132.7900 0.0000 . 1 . . . . . 27 TYR CD1 . 51210 1 227 . 1 . 1 20 20 TYR CD2 C 13 132.7900 0.0000 . 1 . . . . . 27 TYR CD2 . 51210 1 228 . 1 . 1 20 20 TYR CE1 C 13 117.9300 0.0000 . 1 . . . . . 27 TYR CE1 . 51210 1 229 . 1 . 1 20 20 TYR CE2 C 13 117.9300 0.0000 . 1 . . . . . 27 TYR CE2 . 51210 1 230 . 1 . 1 20 20 TYR N N 15 121.8000 0.0000 . 1 . . . . . 27 TYR N . 51210 1 231 . 1 . 1 21 21 GLY H H 1 7.9600 0.0000 . 1 . . . . . 28 GLY H . 51210 1 232 . 1 . 1 21 21 GLY HA2 H 1 4.1170 0.0000 . 1 . . . . . 28 GLY HA2 . 51210 1 233 . 1 . 1 21 21 GLY HA3 H 1 4.1170 0.0000 . 1 . . . . . 28 GLY HA3 . 51210 1 234 . 1 . 1 21 21 GLY C C 13 176.4000 0.0000 . 1 . . . . . 28 GLY C . 51210 1 235 . 1 . 1 21 21 GLY CA C 13 47.8000 0.0000 . 1 . . . . . 28 GLY CA . 51210 1 236 . 1 . 1 21 21 GLY N N 15 109.3000 0.0000 . 1 . . . . . 28 GLY N . 51210 1 237 . 1 . 1 22 22 ASN HA H 1 4.6720 0.0000 . 1 . . . . . 29 ASN HA . 51210 1 238 . 1 . 1 22 22 ASN HB2 H 1 2.9940 0.0000 . 1 . . . . . 29 ASN HB2 . 51210 1 239 . 1 . 1 22 22 ASN HB3 H 1 2.9940 0.0000 . 1 . . . . . 29 ASN HB3 . 51210 1 240 . 1 . 1 22 22 ASN C C 13 176.3400 0.0000 . 1 . . . . . 29 ASN C . 51210 1 241 . 1 . 1 22 22 ASN CA C 13 54.6600 0.0000 . 1 . . . . . 29 ASN CA . 51210 1 242 . 1 . 1 22 22 ASN CB C 13 37.4600 0.0000 . 1 . . . . . 29 ASN CB . 51210 1 243 . 1 . 1 23 23 LYS H H 1 8.6500 0.0000 . 1 . . . . . 30 LYS H . 51210 1 244 . 1 . 1 23 23 LYS HA H 1 4.4900 0.0000 . 1 . . . . . 30 LYS HA . 51210 1 245 . 1 . 1 23 23 LYS HB2 H 1 2.2190 0.0000 . 1 . . . . . 30 LYS HB2 . 51210 1 246 . 1 . 1 23 23 LYS HB3 H 1 2.2190 0.0000 . 1 . . . . . 30 LYS HB3 . 51210 1 247 . 1 . 1 23 23 LYS HG2 H 1 1.5850 0.0000 . 1 . . . . . 30 LYS HG2 . 51210 1 248 . 1 . 1 23 23 LYS HG3 H 1 1.7150 0.0000 . 1 . . . . . 30 LYS HG3 . 51210 1 249 . 1 . 1 23 23 LYS HD2 H 1 1.8630 0.0000 . 1 . . . . . 30 LYS HD2 . 51210 1 250 . 1 . 1 23 23 LYS HD3 H 1 1.8630 0.0000 . 1 . . . . . 30 LYS HD3 . 51210 1 251 . 1 . 1 23 23 LYS HE2 H 1 3.1230 0.0000 . 1 . . . . . 30 LYS HE2 . 51210 1 252 . 1 . 1 23 23 LYS HE3 H 1 3.1230 0.0000 . 1 . . . . . 30 LYS HE3 . 51210 1 253 . 1 . 1 23 23 LYS C C 13 176.3000 0.0000 . 1 . . . . . 30 LYS C . 51210 1 254 . 1 . 1 23 23 LYS CA C 13 56.1000 0.0000 . 1 . . . . . 30 LYS CA . 51210 1 255 . 1 . 1 23 23 LYS CB C 13 32.3000 0.0000 . 1 . . . . . 30 LYS CB . 51210 1 256 . 1 . 1 23 23 LYS CG C 13 25.4620 0.0000 . 1 . . . . . 30 LYS CG . 51210 1 257 . 1 . 1 23 23 LYS CD C 13 29.1790 0.0000 . 1 . . . . . 30 LYS CD . 51210 1 258 . 1 . 1 23 23 LYS CE C 13 42.1600 0.0000 . 1 . . . . . 30 LYS CE . 51210 1 259 . 1 . 1 23 23 LYS N N 15 119.3000 0.0000 . 1 . . . . . 30 LYS N . 51210 1 260 . 1 . 1 24 24 CYS H H 1 7.3900 0.0000 . 1 . . . . . 31 CYS H . 51210 1 261 . 1 . 1 24 24 CYS HA H 1 4.0700 0.0000 . 1 . . . . . 31 CYS HA . 51210 1 262 . 1 . 1 24 24 CYS HB2 H 1 2.4710 0.0000 . 1 . . . . . 31 CYS HB2 . 51210 1 263 . 1 . 1 24 24 CYS HB3 H 1 3.1600 0.0000 . 1 . . . . . 31 CYS HB3 . 51210 1 264 . 1 . 1 24 24 CYS C C 13 177.0000 0.0000 . 1 . . . . . 31 CYS C . 51210 1 265 . 1 . 1 24 24 CYS CA C 13 61.9000 0.0000 . 1 . . . . . 31 CYS CA . 51210 1 266 . 1 . 1 24 24 CYS CB C 13 31.3000 0.0000 . 1 . . . . . 31 CYS CB . 51210 1 267 . 1 . 1 24 24 CYS N N 15 124.3000 0.0000 . 1 . . . . . 31 CYS N . 51210 1 268 . 1 . 1 25 25 GLN H H 1 8.8900 0.0000 . 1 . . . . . 32 GLN H . 51210 1 269 . 1 . 1 25 25 GLN HA H 1 4.2600 0.0000 . 1 . . . . . 32 GLN HA . 51210 1 270 . 1 . 1 25 25 GLN HB2 H 1 1.3610 0.0000 . 1 . . . . . 32 GLN HB2 . 51210 1 271 . 1 . 1 25 25 GLN HB3 H 1 2.3950 0.0000 . 1 . . . . . 32 GLN HB3 . 51210 1 272 . 1 . 1 25 25 GLN HG2 H 1 2.5510 0.0000 . 1 . . . . . 32 GLN HG2 . 51210 1 273 . 1 . 1 25 25 GLN HG3 H 1 2.5510 0.0000 . 1 . . . . . 32 GLN HG3 . 51210 1 274 . 1 . 1 25 25 GLN C C 13 174.7000 0.0000 . 1 . . . . . 32 GLN C . 51210 1 275 . 1 . 1 25 25 GLN CA C 13 55.1000 0.0000 . 1 . . . . . 32 GLN CA . 51210 1 276 . 1 . 1 25 25 GLN CB C 13 28.7000 0.0000 . 1 . . . . . 32 GLN CB . 51210 1 277 . 1 . 1 25 25 GLN CG C 13 34.4900 0.0000 . 1 . . . . . 32 GLN CG . 51210 1 278 . 1 . 1 25 25 GLN N N 15 124.6000 0.0000 . 1 . . . . . 32 GLN N . 51210 1 279 . 1 . 1 26 26 PHE H H 1 9.2800 0.0000 . 1 . . . . . 33 PHE H . 51210 1 280 . 1 . 1 26 26 PHE HA H 1 4.7200 0.0000 . 1 . . . . . 33 PHE HA . 51210 1 281 . 1 . 1 26 26 PHE HB2 H 1 2.7990 0.0000 . 1 . . . . . 33 PHE HB2 . 51210 1 282 . 1 . 1 26 26 PHE HB3 H 1 2.7990 0.0000 . 1 . . . . . 33 PHE HB3 . 51210 1 283 . 1 . 1 26 26 PHE C C 13 174.4000 0.0000 . 1 . . . . . 33 PHE C . 51210 1 284 . 1 . 1 26 26 PHE CA C 13 57.1000 0.0000 . 1 . . . . . 33 PHE CA . 51210 1 285 . 1 . 1 26 26 PHE CB C 13 39.2000 0.0000 . 1 . . . . . 33 PHE CB . 51210 1 286 . 1 . 1 26 26 PHE N N 15 126.7000 0.0000 . 1 . . . . . 33 PHE N . 51210 1 287 . 1 . 1 27 27 ALA H H 1 8.8600 0.0000 . 1 . . . . . 34 ALA H . 51210 1 288 . 1 . 1 27 27 ALA HA H 1 3.7500 0.0000 . 1 . . . . . 34 ALA HA . 51210 1 289 . 1 . 1 27 27 ALA HB1 H 1 0.9950 0.0000 . 1 . . . . . 34 ALA HB1 . 51210 1 290 . 1 . 1 27 27 ALA HB2 H 1 0.9950 0.0000 . 1 . . . . . 34 ALA HB1 . 51210 1 291 . 1 . 1 27 27 ALA HB3 H 1 0.9950 0.0000 . 1 . . . . . 34 ALA HB1 . 51210 1 292 . 1 . 1 27 27 ALA C C 13 177.2000 0.0000 . 1 . . . . . 34 ALA C . 51210 1 293 . 1 . 1 27 27 ALA CA C 13 52.6000 0.0000 . 1 . . . . . 34 ALA CA . 51210 1 294 . 1 . 1 27 27 ALA CB C 13 19.9000 0.0000 . 1 . . . . . 34 ALA CB . 51210 1 295 . 1 . 1 27 27 ALA N N 15 123.6000 0.0000 . 1 . . . . . 34 ALA N . 51210 1 296 . 1 . 1 28 28 HIS H H 1 10.6600 0.0000 . 1 . . . . . 35 HIS H . 51210 1 297 . 1 . 1 28 28 HIS HA H 1 4.2000 0.0000 . 1 . . . . . 35 HIS HA . 51210 1 298 . 1 . 1 28 28 HIS HB2 H 1 2.1270 0.0000 . 1 . . . . . 35 HIS HB2 . 51210 1 299 . 1 . 1 28 28 HIS HB3 H 1 2.1270 0.0000 . 1 . . . . . 35 HIS HB3 . 51210 1 300 . 1 . 1 28 28 HIS HD2 H 1 6.4750 0.0000 . 1 . . . . . 35 HIS HD2 . 51210 1 301 . 1 . 1 28 28 HIS HE1 H 1 7.8990 0.0000 . 1 . . . . . 35 HIS HE1 . 51210 1 302 . 1 . 1 28 28 HIS C C 13 173.7000 0.0000 . 1 . . . . . 35 HIS C . 51210 1 303 . 1 . 1 28 28 HIS CA C 13 51.9000 0.0000 . 1 . . . . . 35 HIS CA . 51210 1 304 . 1 . 1 28 28 HIS CB C 13 25.6760 0.0000 . 1 . . . . . 35 HIS CB . 51210 1 305 . 1 . 1 28 28 HIS CD2 C 13 123.6700 0.0000 . 1 . . . . . 35 HIS CD2 . 51210 1 306 . 1 . 1 28 28 HIS CE1 C 13 139.4800 0.0000 . 1 . . . . . 35 HIS CE1 . 51210 1 307 . 1 . 1 28 28 HIS N N 15 129.1000 0.0000 . 1 . . . . . 35 HIS N . 51210 1 308 . 1 . 1 29 29 GLY HA2 H 1 4.4190 0.0000 . 1 . . . . . 36 GLY HA2 . 51210 1 309 . 1 . 1 29 29 GLY HA3 H 1 3.8680 0.0000 . 1 . . . . . 36 GLY HA3 . 51210 1 310 . 1 . 1 29 29 GLY C C 13 174.3800 0.0000 . 1 . . . . . 36 GLY C . 51210 1 311 . 1 . 1 29 29 GLY CA C 13 43.2300 0.0000 . 1 . . . . . 36 GLY CA . 51210 1 312 . 1 . 1 30 30 LYS H H 1 8.5500 0.0000 . 1 . . . . . 37 LYS H . 51210 1 313 . 1 . 1 30 30 LYS HA H 1 3.8050 0.0000 . 1 . . . . . 37 LYS HA . 51210 1 314 . 1 . 1 30 30 LYS HB2 H 1 1.8360 0.0000 . 1 . . . . . 37 LYS HB2 . 51210 1 315 . 1 . 1 30 30 LYS HB3 H 1 1.8360 0.0000 . 1 . . . . . 37 LYS HB3 . 51210 1 316 . 1 . 1 30 30 LYS HG2 H 1 1.4740 0.0000 . 1 . . . . . 37 LYS HG2 . 51210 1 317 . 1 . 1 30 30 LYS HG3 H 1 1.4740 0.0000 . 1 . . . . . 37 LYS HG3 . 51210 1 318 . 1 . 1 30 30 LYS HD2 H 1 1.6990 0.0000 . 1 . . . . . 37 LYS HD2 . 51210 1 319 . 1 . 1 30 30 LYS HD3 H 1 1.6990 0.0000 . 1 . . . . . 37 LYS HD3 . 51210 1 320 . 1 . 1 30 30 LYS HE2 H 1 2.3470 0.0000 . 1 . . . . . 37 LYS HE2 . 51210 1 321 . 1 . 1 30 30 LYS HE3 H 1 2.3470 0.0000 . 1 . . . . . 37 LYS HE3 . 51210 1 322 . 1 . 1 30 30 LYS C C 13 179.1000 0.0000 . 1 . . . . . 37 LYS C . 51210 1 323 . 1 . 1 30 30 LYS CA C 13 59.5000 0.0000 . 1 . . . . . 37 LYS CA . 51210 1 324 . 1 . 1 30 30 LYS CB C 13 31.8000 0.0000 . 1 . . . . . 37 LYS CB . 51210 1 325 . 1 . 1 30 30 LYS CG C 13 24.9740 0.0000 . 1 . . . . . 37 LYS CG . 51210 1 326 . 1 . 1 30 30 LYS CD C 13 29.3320 0.0000 . 1 . . . . . 37 LYS CD . 51210 1 327 . 1 . 1 30 30 LYS CE C 13 43.6300 0.0000 . 1 . . . . . 37 LYS CE . 51210 1 328 . 1 . 1 30 30 LYS N N 15 119.0000 0.0000 . 1 . . . . . 37 LYS N . 51210 1 329 . 1 . 1 31 31 GLU H H 1 9.0600 0.0000 . 1 . . . . . 38 GLU H . 51210 1 330 . 1 . 1 31 31 GLU HA H 1 4.1000 0.0000 . 1 . . . . . 38 GLU HA . 51210 1 331 . 1 . 1 31 31 GLU HB2 H 1 2.0300 0.0000 . 1 . . . . . 38 GLU HB2 . 51210 1 332 . 1 . 1 31 31 GLU HB3 H 1 2.0300 0.0000 . 1 . . . . . 38 GLU HB3 . 51210 1 333 . 1 . 1 31 31 GLU HG2 H 1 2.3140 0.0000 . 1 . . . . . 38 GLU HG2 . 51210 1 334 . 1 . 1 31 31 GLU HG3 H 1 2.3140 0.0000 . 1 . . . . . 38 GLU HG3 . 51210 1 335 . 1 . 1 31 31 GLU C C 13 175.7000 0.0000 . 1 . . . . . 38 GLU C . 51210 1 336 . 1 . 1 31 31 GLU CA C 13 58.3000 0.0000 . 1 . . . . . 38 GLU CA . 51210 1 337 . 1 . 1 31 31 GLU CB C 13 28.1000 0.0000 . 1 . . . . . 38 GLU CB . 51210 1 338 . 1 . 1 31 31 GLU CG C 13 36.4810 0.0000 . 1 . . . . . 38 GLU CG . 51210 1 339 . 1 . 1 31 31 GLU N N 15 118.3000 0.0000 . 1 . . . . . 38 GLU N . 51210 1 340 . 1 . 1 32 32 ASP H H 1 7.4500 0.0000 . 1 . . . . . 39 ASP H . 51210 1 341 . 1 . 1 32 32 ASP HA H 1 4.5900 0.0000 . 1 . . . . . 39 ASP HA . 51210 1 342 . 1 . 1 32 32 ASP HB2 H 1 2.0630 0.0000 . 1 . . . . . 39 ASP HB2 . 51210 1 343 . 1 . 1 32 32 ASP HB3 H 1 2.3340 0.0000 . 1 . . . . . 39 ASP HB3 . 51210 1 344 . 1 . 1 32 32 ASP C C 13 175.0000 0.0000 . 1 . . . . . 39 ASP C . 51210 1 345 . 1 . 1 32 32 ASP CA C 13 52.4000 0.0000 . 1 . . . . . 39 ASP CA . 51210 1 346 . 1 . 1 32 32 ASP CB C 13 43.7000 0.0000 . 1 . . . . . 39 ASP CB . 51210 1 347 . 1 . 1 32 32 ASP N N 15 120.0000 0.0000 . 1 . . . . . 39 ASP N . 51210 1 348 . 1 . 1 33 33 LEU H H 1 6.7300 0.0000 . 1 . . . . . 40 LEU H . 51210 1 349 . 1 . 1 33 33 LEU HA H 1 4.2400 0.0000 . 1 . . . . . 40 LEU HA . 51210 1 350 . 1 . 1 33 33 LEU HB2 H 1 1.5590 0.0000 . 1 . . . . . 40 LEU HB2 . 51210 1 351 . 1 . 1 33 33 LEU HB3 H 1 1.3790 0.0000 . 1 . . . . . 40 LEU HB3 . 51210 1 352 . 1 . 1 33 33 LEU HG H 1 1.3500 0.0000 . 1 . . . . . 40 LEU HG . 51210 1 353 . 1 . 1 33 33 LEU HD11 H 1 0.8280 0.0000 . 1 . . . . . 40 LEU HD11 . 51210 1 354 . 1 . 1 33 33 LEU HD12 H 1 0.8280 0.0000 . 1 . . . . . 40 LEU HD11 . 51210 1 355 . 1 . 1 33 33 LEU HD13 H 1 0.8280 0.0000 . 1 . . . . . 40 LEU HD11 . 51210 1 356 . 1 . 1 33 33 LEU HD21 H 1 0.6210 0.0000 . 1 . . . . . 40 LEU HD21 . 51210 1 357 . 1 . 1 33 33 LEU HD22 H 1 0.6210 0.0000 . 1 . . . . . 40 LEU HD21 . 51210 1 358 . 1 . 1 33 33 LEU HD23 H 1 0.6210 0.0000 . 1 . . . . . 40 LEU HD21 . 51210 1 359 . 1 . 1 33 33 LEU C C 13 177.5000 0.0000 . 1 . . . . . 40 LEU C . 51210 1 360 . 1 . 1 33 33 LEU CA C 13 54.9000 0.0000 . 1 . . . . . 40 LEU CA . 51210 1 361 . 1 . 1 33 33 LEU CB C 13 43.5000 0.0000 . 1 . . . . . 40 LEU CB . 51210 1 362 . 1 . 1 33 33 LEU CG C 13 26.8720 0.0000 . 1 . . . . . 40 LEU CG . 51210 1 363 . 1 . 1 33 33 LEU CD1 C 13 25.4660 0.0000 . 1 . . . . . 40 LEU CD1 . 51210 1 364 . 1 . 1 33 33 LEU CD2 C 13 24.4230 0.0000 . 1 . . . . . 40 LEU CD2 . 51210 1 365 . 1 . 1 33 33 LEU N N 15 118.7000 0.0000 . 1 . . . . . 40 LEU N . 51210 1 366 . 1 . 1 34 34 ARG H H 1 8.5400 0.0000 . 1 . . . . . 41 ARG H . 51210 1 367 . 1 . 1 34 34 ARG HA H 1 4.5700 0.0000 . 1 . . . . . 41 ARG HA . 51210 1 368 . 1 . 1 34 34 ARG HB2 H 1 1.3500 0.0000 . 1 . . . . . 41 ARG HB2 . 51210 1 369 . 1 . 1 34 34 ARG HB3 H 1 1.7710 0.0000 . 1 . . . . . 41 ARG HB3 . 51210 1 370 . 1 . 1 34 34 ARG HG2 H 1 1.6330 0.0000 . 1 . . . . . 41 ARG HG2 . 51210 1 371 . 1 . 1 34 34 ARG HG3 H 1 1.6330 0.0000 . 1 . . . . . 41 ARG HG3 . 51210 1 372 . 1 . 1 34 34 ARG HD2 H 1 3.0220 0.0000 . 1 . . . . . 41 ARG HD2 . 51210 1 373 . 1 . 1 34 34 ARG HD3 H 1 3.0220 0.0000 . 1 . . . . . 41 ARG HD3 . 51210 1 374 . 1 . 1 34 34 ARG C C 13 173.7000 0.0000 . 1 . . . . . 41 ARG C . 51210 1 375 . 1 . 1 34 34 ARG CA C 13 52.6000 0.0000 . 1 . . . . . 41 ARG CA . 51210 1 376 . 1 . 1 34 34 ARG CB C 13 29.5700 0.0000 . 1 . . . . . 41 ARG CB . 51210 1 377 . 1 . 1 34 34 ARG CG C 13 28.0320 0.0000 . 1 . . . . . 41 ARG CG . 51210 1 378 . 1 . 1 34 34 ARG CD C 13 43.0790 0.0000 . 1 . . . . . 41 ARG CD . 51210 1 379 . 1 . 1 34 34 ARG N N 15 125.3000 0.0000 . 1 . . . . . 41 ARG N . 51210 1 380 . 1 . 1 35 35 PRO HA H 1 4.3170 0.0000 . 1 . . . . . 42 PRO HA . 51210 1 381 . 1 . 1 35 35 PRO HB2 H 1 1.7580 0.0000 . 1 . . . . . 42 PRO HB2 . 51210 1 382 . 1 . 1 35 35 PRO HB3 H 1 2.1530 0.0000 . 1 . . . . . 42 PRO HB3 . 51210 1 383 . 1 . 1 35 35 PRO HG2 H 1 1.9200 0.0000 . 1 . . . . . 42 PRO HG2 . 51210 1 384 . 1 . 1 35 35 PRO HG3 H 1 1.9200 0.0000 . 1 . . . . . 42 PRO HG3 . 51210 1 385 . 1 . 1 35 35 PRO HD2 H 1 3.5610 0.0000 . 1 . . . . . 42 PRO HD2 . 51210 1 386 . 1 . 1 35 35 PRO HD3 H 1 3.5610 0.0000 . 1 . . . . . 42 PRO HD3 . 51210 1 387 . 1 . 1 35 35 PRO C C 13 175.8670 0.0000 . 1 . . . . . 42 PRO C . 51210 1 388 . 1 . 1 35 35 PRO CA C 13 62.8000 0.0000 . 1 . . . . . 42 PRO CA . 51210 1 389 . 1 . 1 35 35 PRO CB C 13 32.4000 0.0000 . 1 . . . . . 42 PRO CB . 51210 1 390 . 1 . 1 35 35 PRO CG C 13 27.1420 0.0000 . 1 . . . . . 42 PRO CG . 51210 1 391 . 1 . 1 35 35 PRO CD C 13 50.1680 0.0000 . 1 . . . . . 42 PRO CD . 51210 1 392 . 1 . 1 36 36 VAL H H 1 8.0100 0.0000 . 1 . . . . . 43 VAL H . 51210 1 393 . 1 . 1 36 36 VAL HA H 1 4.1600 0.0000 . 1 . . . . . 43 VAL HA . 51210 1 394 . 1 . 1 36 36 VAL HB H 1 1.7570 0.0000 . 1 . . . . . 43 VAL HB . 51210 1 395 . 1 . 1 36 36 VAL HG11 H 1 0.7266 0.0000 . 1 . . . . . 43 VAL HG11 . 51210 1 396 . 1 . 1 36 36 VAL HG12 H 1 0.7266 0.0000 . 1 . . . . . 43 VAL HG11 . 51210 1 397 . 1 . 1 36 36 VAL HG13 H 1 0.7266 0.0000 . 1 . . . . . 43 VAL HG11 . 51210 1 398 . 1 . 1 36 36 VAL HG21 H 1 0.8530 0.0000 . 1 . . . . . 43 VAL HG21 . 51210 1 399 . 1 . 1 36 36 VAL HG22 H 1 0.8530 0.0000 . 1 . . . . . 43 VAL HG21 . 51210 1 400 . 1 . 1 36 36 VAL HG23 H 1 0.8530 0.0000 . 1 . . . . . 43 VAL HG21 . 51210 1 401 . 1 . 1 36 36 VAL C C 13 174.3000 0.0000 . 1 . . . . . 43 VAL C . 51210 1 402 . 1 . 1 36 36 VAL CA C 13 60.2000 0.0000 . 1 . . . . . 43 VAL CA . 51210 1 403 . 1 . 1 36 36 VAL CB C 13 34.6900 0.0000 . 1 . . . . . 43 VAL CB . 51210 1 404 . 1 . 1 36 36 VAL CG1 C 13 20.2440 0.0000 . 1 . . . . . 43 VAL CG1 . 51210 1 405 . 1 . 1 36 36 VAL CG2 C 13 21.2970 0.0000 . 1 . . . . . 43 VAL CG2 . 51210 1 406 . 1 . 1 36 36 VAL N N 15 118.9000 0.0000 . 1 . . . . . 43 VAL N . 51210 1 407 . 1 . 1 37 37 ASN H H 1 8.4900 0.0000 . 1 . . . . . 44 ASN H . 51210 1 408 . 1 . 1 37 37 ASN HA H 1 4.6300 0.0000 . 1 . . . . . 44 ASN HA . 51210 1 409 . 1 . 1 37 37 ASN HB2 H 1 2.6040 0.0000 . 1 . . . . . 44 ASN HB2 . 51210 1 410 . 1 . 1 37 37 ASN HB3 H 1 2.6040 0.0000 . 1 . . . . . 44 ASN HB3 . 51210 1 411 . 1 . 1 37 37 ASN C C 13 174.6000 0.0000 . 1 . . . . . 44 ASN C . 51210 1 412 . 1 . 1 37 37 ASN CA C 13 52.8000 0.0000 . 1 . . . . . 44 ASN CA . 51210 1 413 . 1 . 1 37 37 ASN CB C 13 38.2000 0.0000 . 1 . . . . . 44 ASN CB . 51210 1 414 . 1 . 1 37 37 ASN N N 15 125.0000 0.0000 . 1 . . . . . 44 ASN N . 51210 1 415 . 1 . 1 38 38 ARG H H 1 8.3300 0.0000 . 1 . . . . . 45 ARG H . 51210 1 416 . 1 . 1 38 38 ARG HA H 1 4.1800 0.0000 . 1 . . . . . 45 ARG HA . 51210 1 417 . 1 . 1 38 38 ARG HB2 H 1 1.2480 0.0000 . 1 . . . . . 45 ARG HB2 . 51210 1 418 . 1 . 1 38 38 ARG HB3 H 1 1.4570 0.0000 . 1 . . . . . 45 ARG HB3 . 51210 1 419 . 1 . 1 38 38 ARG HG2 H 1 1.2180 0.0000 . 1 . . . . . 45 ARG HG2 . 51210 1 420 . 1 . 1 38 38 ARG HG3 H 1 1.2180 0.0000 . 1 . . . . . 45 ARG HG3 . 51210 1 421 . 1 . 1 38 38 ARG HD2 H 1 2.1450 0.0000 . 1 . . . . . 45 ARG HD2 . 51210 1 422 . 1 . 1 38 38 ARG HD3 H 1 1.6690 0.0000 . 1 . . . . . 45 ARG HD3 . 51210 1 423 . 1 . 1 38 38 ARG C C 13 175.4000 0.0000 . 1 . . . . . 45 ARG C . 51210 1 424 . 1 . 1 38 38 ARG CA C 13 53.8000 0.0000 . 1 . . . . . 45 ARG CA . 51210 1 425 . 1 . 1 38 38 ARG CB C 13 31.7000 0.0000 . 1 . . . . . 45 ARG CB . 51210 1 426 . 1 . 1 38 38 ARG CG C 13 26.5060 0.0000 . 1 . . . . . 45 ARG CG . 51210 1 427 . 1 . 1 38 38 ARG CD C 13 42.2450 0.0000 . 1 . . . . . 45 ARG CD . 51210 1 428 . 1 . 1 38 38 ARG N N 15 123.4000 0.0000 . 1 . . . . . 45 ARG N . 51210 1 429 . 1 . 1 39 39 HIS H H 1 8.7500 0.0000 . 1 . . . . . 46 HIS H . 51210 1 430 . 1 . 1 39 39 HIS HA H 1 4.2900 0.0000 . 1 . . . . . 46 HIS HA . 51210 1 431 . 1 . 1 39 39 HIS HB2 H 1 3.1730 0.0000 . 1 . . . . . 46 HIS HB2 . 51210 1 432 . 1 . 1 39 39 HIS HB3 H 1 2.6360 0.0000 . 1 . . . . . 46 HIS HB3 . 51210 1 433 . 1 . 1 39 39 HIS HD2 H 1 7.1480 0.0000 . 1 . . . . . 46 HIS HD2 . 51210 1 434 . 1 . 1 39 39 HIS HE1 H 1 7.5560 0.0000 . 1 . . . . . 46 HIS HE1 . 51210 1 435 . 1 . 1 39 39 HIS C C 13 175.8000 0.0000 . 1 . . . . . 46 HIS C . 51210 1 436 . 1 . 1 39 39 HIS CA C 13 56.7000 0.0000 . 1 . . . . . 46 HIS CA . 51210 1 437 . 1 . 1 39 39 HIS CB C 13 31.4000 0.0000 . 1 . . . . . 46 HIS CB . 51210 1 438 . 1 . 1 39 39 HIS CE1 C 13 138.2400 0.0000 . 1 . . . . . 46 HIS CE1 . 51210 1 439 . 1 . 1 39 39 HIS N N 15 124.7000 0.0000 . 1 . . . . . 46 HIS N . 51210 1 440 . 1 . 1 40 40 PRO HA H 1 4.2500 0.0000 . 1 . . . . . 47 PRO HA . 51210 1 441 . 1 . 1 40 40 PRO HB2 H 1 2.2900 0.0000 . 1 . . . . . 47 PRO HB2 . 51210 1 442 . 1 . 1 40 40 PRO HB3 H 1 1.9200 0.0000 . 1 . . . . . 47 PRO HB3 . 51210 1 443 . 1 . 1 40 40 PRO HG2 H 1 2.0200 0.0000 . 1 . . . . . 47 PRO HG2 . 51210 1 444 . 1 . 1 40 40 PRO HG3 H 1 2.0200 0.0000 . 1 . . . . . 47 PRO HG3 . 51210 1 445 . 1 . 1 40 40 PRO HD2 H 1 3.7490 0.0000 . 1 . . . . . 47 PRO HD2 . 51210 1 446 . 1 . 1 40 40 PRO HD3 H 1 3.7490 0.0000 . 1 . . . . . 47 PRO HD3 . 51210 1 447 . 1 . 1 40 40 PRO C C 13 178.2360 0.0000 . 1 . . . . . 47 PRO C . 51210 1 448 . 1 . 1 40 40 PRO CA C 13 65.4180 0.0000 . 1 . . . . . 47 PRO CA . 51210 1 449 . 1 . 1 40 40 PRO CB C 13 31.9900 0.0000 . 1 . . . . . 47 PRO CB . 51210 1 450 . 1 . 1 40 40 PRO CG C 13 27.4530 0.0000 . 1 . . . . . 47 PRO CG . 51210 1 451 . 1 . 1 40 40 PRO CD C 13 51.0030 0.0000 . 1 . . . . . 47 PRO CD . 51210 1 452 . 1 . 1 41 41 LYS H H 1 11.4100 0.0000 . 1 . . . . . 48 LYS H . 51210 1 453 . 1 . 1 41 41 LYS HA H 1 4.2500 0.0000 . 1 . . . . . 48 LYS HA . 51210 1 454 . 1 . 1 41 41 LYS HB2 H 1 1.4740 0.0000 . 1 . . . . . 48 LYS HB2 . 51210 1 455 . 1 . 1 41 41 LYS HB3 H 1 1.4740 0.0000 . 1 . . . . . 48 LYS HB3 . 51210 1 456 . 1 . 1 41 41 LYS C C 13 175.7000 0.0000 . 1 . . . . . 48 LYS C . 51210 1 457 . 1 . 1 41 41 LYS CA C 13 55.1000 0.0000 . 1 . . . . . 48 LYS CA . 51210 1 458 . 1 . 1 41 41 LYS CB C 13 31.4000 0.0000 . 1 . . . . . 48 LYS CB . 51210 1 459 . 1 . 1 41 41 LYS N N 15 119.5200 0.0000 . 1 . . . . . 48 LYS N . 51210 1 460 . 1 . 1 42 42 TYR H H 1 7.9600 0.0000 . 1 . . . . . 49 TYR H . 51210 1 461 . 1 . 1 42 42 TYR HA H 1 3.7200 0.0000 . 1 . . . . . 49 TYR HA . 51210 1 462 . 1 . 1 42 42 TYR HB2 H 1 2.7030 0.0000 . 1 . . . . . 49 TYR HB2 . 51210 1 463 . 1 . 1 42 42 TYR HB3 H 1 3.4090 0.0000 . 1 . . . . . 49 TYR HB3 . 51210 1 464 . 1 . 1 42 42 TYR HD1 H 1 6.9740 0.0000 . 1 . . . . . 49 TYR HD1 . 51210 1 465 . 1 . 1 42 42 TYR HD2 H 1 6.9740 0.0000 . 1 . . . . . 49 TYR HD2 . 51210 1 466 . 1 . 1 42 42 TYR HE1 H 1 6.7570 0.0000 . 1 . . . . . 49 TYR HE1 . 51210 1 467 . 1 . 1 42 42 TYR HE2 H 1 6.7570 0.0000 . 1 . . . . . 49 TYR HE2 . 51210 1 468 . 1 . 1 42 42 TYR C C 13 174.1000 0.0000 . 1 . . . . . 49 TYR C . 51210 1 469 . 1 . 1 42 42 TYR CA C 13 59.9000 0.0000 . 1 . . . . . 49 TYR CA . 51210 1 470 . 1 . 1 42 42 TYR CB C 13 39.8000 0.0000 . 1 . . . . . 49 TYR CB . 51210 1 471 . 1 . 1 42 42 TYR CD1 C 13 133.1500 0.0000 . 1 . . . . . 49 TYR CD1 . 51210 1 472 . 1 . 1 42 42 TYR CD2 C 13 133.1500 0.0000 . 1 . . . . . 49 TYR CD2 . 51210 1 473 . 1 . 1 42 42 TYR CE1 C 13 118.0200 0.0000 . 1 . . . . . 49 TYR CE1 . 51210 1 474 . 1 . 1 42 42 TYR CE2 C 13 118.0200 0.0000 . 1 . . . . . 49 TYR CE2 . 51210 1 475 . 1 . 1 42 42 TYR N N 15 122.2000 0.0000 . 1 . . . . . 49 TYR N . 51210 1 476 . 1 . 1 43 43 LYS H H 1 7.9800 0.0000 . 1 . . . . . 50 LYS H . 51210 1 477 . 1 . 1 43 43 LYS HA H 1 3.1200 0.0000 . 1 . . . . . 50 LYS HA . 51210 1 478 . 1 . 1 43 43 LYS HB2 H 1 1.3080 0.0000 . 1 . . . . . 50 LYS HB2 . 51210 1 479 . 1 . 1 43 43 LYS HB3 H 1 1.3080 0.0000 . 1 . . . . . 50 LYS HB3 . 51210 1 480 . 1 . 1 43 43 LYS HG2 H 1 0.0002 0.0000 . 1 . . . . . 50 LYS HG2 . 51210 1 481 . 1 . 1 43 43 LYS HG3 H 1 -0.5220 0.0000 . 1 . . . . . 50 LYS HG3 . 51210 1 482 . 1 . 1 43 43 LYS HD2 H 1 1.0720 0.0000 . 1 . . . . . 50 LYS HD2 . 51210 1 483 . 1 . 1 43 43 LYS HD3 H 1 0.8940 0.0000 . 1 . . . . . 50 LYS HD3 . 51210 1 484 . 1 . 1 43 43 LYS HE2 H 1 2.8050 0.0000 . 1 . . . . . 50 LYS HE2 . 51210 1 485 . 1 . 1 43 43 LYS HE3 H 1 2.7140 0.0000 . 1 . . . . . 50 LYS HE3 . 51210 1 486 . 1 . 1 43 43 LYS C C 13 173.7000 0.0000 . 1 . . . . . 50 LYS C . 51210 1 487 . 1 . 1 43 43 LYS CA C 13 57.6000 0.0000 . 1 . . . . . 50 LYS CA . 51210 1 488 . 1 . 1 43 43 LYS CB C 13 29.8000 0.0000 . 1 . . . . . 50 LYS CB . 51210 1 489 . 1 . 1 43 43 LYS CG C 13 24.7280 0.0000 . 1 . . . . . 50 LYS CG . 51210 1 490 . 1 . 1 43 43 LYS CD C 13 28.6890 0.0000 . 1 . . . . . 50 LYS CD . 51210 1 491 . 1 . 1 43 43 LYS CE C 13 42.1450 0.0000 . 1 . . . . . 50 LYS CE . 51210 1 492 . 1 . 1 43 43 LYS N N 15 120.7000 0.0000 . 1 . . . . . 50 LYS N . 51210 1 493 . 1 . 1 44 44 THR H H 1 7.7400 0.0000 . 1 . . . . . 51 THR H . 51210 1 494 . 1 . 1 44 44 THR HA H 1 4.5400 0.0000 . 1 . . . . . 51 THR HA . 51210 1 495 . 1 . 1 44 44 THR HB H 1 4.1610 0.0000 . 1 . . . . . 51 THR HB . 51210 1 496 . 1 . 1 44 44 THR HG21 H 1 0.9970 0.0000 . 1 . . . . . 51 THR HG21 . 51210 1 497 . 1 . 1 44 44 THR HG22 H 1 0.9970 0.0000 . 1 . . . . . 51 THR HG21 . 51210 1 498 . 1 . 1 44 44 THR HG23 H 1 0.9970 0.0000 . 1 . . . . . 51 THR HG21 . 51210 1 499 . 1 . 1 44 44 THR C C 13 175.3000 0.0000 . 1 . . . . . 51 THR C . 51210 1 500 . 1 . 1 44 44 THR CA C 13 62.5000 0.0000 . 1 . . . . . 51 THR CA . 51210 1 501 . 1 . 1 44 44 THR CB C 13 71.7000 0.0000 . 1 . . . . . 51 THR CB . 51210 1 502 . 1 . 1 44 44 THR CG2 C 13 21.1490 0.0000 . 1 . . . . . 51 THR CG2 . 51210 1 503 . 1 . 1 44 44 THR N N 15 105.7000 0.0000 . 1 . . . . . 51 THR N . 51210 1 504 . 1 . 1 45 45 GLU H H 1 9.1800 0.0000 . 1 . . . . . 52 GLU H . 51210 1 505 . 1 . 1 45 45 GLU HA H 1 4.8900 0.0000 . 1 . . . . . 52 GLU HA . 51210 1 506 . 1 . 1 45 45 GLU HB2 H 1 2.1960 0.0000 . 1 . . . . . 52 GLU HB2 . 51210 1 507 . 1 . 1 45 45 GLU HB3 H 1 2.0390 0.0000 . 1 . . . . . 52 GLU HB3 . 51210 1 508 . 1 . 1 45 45 GLU HG2 H 1 2.4750 0.0000 . 1 . . . . . 52 GLU HG2 . 51210 1 509 . 1 . 1 45 45 GLU HG3 H 1 2.4750 0.0000 . 1 . . . . . 52 GLU HG3 . 51210 1 510 . 1 . 1 45 45 GLU C C 13 175.5000 0.0000 . 1 . . . . . 52 GLU C . 51210 1 511 . 1 . 1 45 45 GLU CA C 13 54.4000 0.0000 . 1 . . . . . 52 GLU CA . 51210 1 512 . 1 . 1 45 45 GLU CB C 13 33.4000 0.0000 . 1 . . . . . 52 GLU CB . 51210 1 513 . 1 . 1 45 45 GLU CG C 13 36.0530 0.0000 . 1 . . . . . 52 GLU CG . 51210 1 514 . 1 . 1 45 45 GLU N N 15 124.8000 0.0000 . 1 . . . . . 52 GLU N . 51210 1 515 . 1 . 1 46 46 VAL H H 1 8.9000 0.0000 . 1 . . . . . 53 VAL H . 51210 1 516 . 1 . 1 46 46 VAL HA H 1 4.0000 0.0000 . 1 . . . . . 53 VAL HA . 51210 1 517 . 1 . 1 46 46 VAL HB H 1 2.0550 0.0000 . 1 . . . . . 53 VAL HB . 51210 1 518 . 1 . 1 46 46 VAL HG21 H 1 1.0650 0.0000 . 1 . . . . . 53 VAL HG21 . 51210 1 519 . 1 . 1 46 46 VAL HG22 H 1 1.0650 0.0000 . 1 . . . . . 53 VAL HG21 . 51210 1 520 . 1 . 1 46 46 VAL HG23 H 1 1.0650 0.0000 . 1 . . . . . 53 VAL HG21 . 51210 1 521 . 1 . 1 46 46 VAL C C 13 175.9000 0.0000 . 1 . . . . . 53 VAL C . 51210 1 522 . 1 . 1 46 46 VAL CA C 13 64.2000 0.0000 . 1 . . . . . 53 VAL CA . 51210 1 523 . 1 . 1 46 46 VAL CB C 13 32.7000 0.0000 . 1 . . . . . 53 VAL CB . 51210 1 524 . 1 . 1 46 46 VAL CG2 C 13 21.9970 0.0000 . 1 . . . . . 53 VAL CG2 . 51210 1 525 . 1 . 1 46 46 VAL N N 15 123.0000 0.0000 . 1 . . . . . 53 VAL N . 51210 1 526 . 1 . 1 47 47 CYS H H 1 9.2600 0.0000 . 1 . . . . . 54 CYS H . 51210 1 527 . 1 . 1 47 47 CYS HA H 1 4.6900 0.0000 . 1 . . . . . 54 CYS HA . 51210 1 528 . 1 . 1 47 47 CYS HB2 H 1 2.9860 0.0000 . 1 . . . . . 54 CYS HB2 . 51210 1 529 . 1 . 1 47 47 CYS HB3 H 1 3.3710 0.0000 . 1 . . . . . 54 CYS HB3 . 51210 1 530 . 1 . 1 47 47 CYS C C 13 177.2600 0.0000 . 1 . . . . . 54 CYS C . 51210 1 531 . 1 . 1 47 47 CYS CA C 13 59.7000 0.0000 . 1 . . . . . 54 CYS CA . 51210 1 532 . 1 . 1 47 47 CYS CB C 13 31.7000 0.0000 . 1 . . . . . 54 CYS CB . 51210 1 533 . 1 . 1 47 47 CYS N N 15 130.7000 0.0000 . 1 . . . . . 54 CYS N . 51210 1 534 . 1 . 1 48 48 ARG H H 1 11.2800 0.0000 . 1 . . . . . 55 ARG H . 51210 1 535 . 1 . 1 48 48 ARG HA H 1 4.1000 0.0000 . 1 . . . . . 55 ARG HA . 51210 1 536 . 1 . 1 48 48 ARG HB2 H 1 1.6300 0.0000 . 1 . . . . . 55 ARG HB2 . 51210 1 537 . 1 . 1 48 48 ARG HB3 H 1 1.6300 0.0000 . 1 . . . . . 55 ARG HB3 . 51210 1 538 . 1 . 1 48 48 ARG HG2 H 1 1.5500 0.0000 . 1 . . . . . 55 ARG HG2 . 51210 1 539 . 1 . 1 48 48 ARG HG3 H 1 1.3850 0.0000 . 1 . . . . . 55 ARG HG3 . 51210 1 540 . 1 . 1 48 48 ARG HD2 H 1 2.6226 0.0000 . 1 . . . . . 55 ARG HD2 . 51210 1 541 . 1 . 1 48 48 ARG HD3 H 1 2.6226 0.0000 . 1 . . . . . 55 ARG HD3 . 51210 1 542 . 1 . 1 48 48 ARG C C 13 178.2000 0.0000 . 1 . . . . . 55 ARG C . 51210 1 543 . 1 . 1 48 48 ARG CA C 13 59.4000 0.0000 . 1 . . . . . 55 ARG CA . 51210 1 544 . 1 . 1 48 48 ARG CB C 13 30.7000 0.0000 . 1 . . . . . 55 ARG CB . 51210 1 545 . 1 . 1 48 48 ARG CG C 13 27.7270 0.0000 . 1 . . . . . 55 ARG CG . 51210 1 546 . 1 . 1 48 48 ARG CD C 13 43.6060 0.0000 . 1 . . . . . 55 ARG CD . 51210 1 547 . 1 . 1 48 48 ARG N N 15 135.5000 0.0000 . 1 . . . . . 55 ARG N . 51210 1 548 . 1 . 1 49 49 THR H H 1 8.2200 0.0000 . 1 . . . . . 56 THR H . 51210 1 549 . 1 . 1 49 49 THR HA H 1 4.1500 0.0000 . 1 . . . . . 56 THR HA . 51210 1 550 . 1 . 1 49 49 THR HB H 1 4.5818 0.0000 . 1 . . . . . 56 THR HB . 51210 1 551 . 1 . 1 49 49 THR HG21 H 1 1.5580 0.0000 . 1 . . . . . 56 THR HG21 . 51210 1 552 . 1 . 1 49 49 THR HG22 H 1 1.5580 0.0000 . 1 . . . . . 56 THR HG21 . 51210 1 553 . 1 . 1 49 49 THR HG23 H 1 1.5580 0.0000 . 1 . . . . . 56 THR HG21 . 51210 1 554 . 1 . 1 49 49 THR C C 13 175.8300 0.0000 . 1 . . . . . 56 THR C . 51210 1 555 . 1 . 1 49 49 THR CA C 13 65.7000 0.0000 . 1 . . . . . 56 THR CA . 51210 1 556 . 1 . 1 49 49 THR CB C 13 68.7000 0.0000 . 1 . . . . . 56 THR CB . 51210 1 557 . 1 . 1 49 49 THR CG2 C 13 23.5790 0.0000 . 1 . . . . . 56 THR CG2 . 51210 1 558 . 1 . 1 49 49 THR N N 15 120.6000 0.0000 . 1 . . . . . 56 THR N . 51210 1 559 . 1 . 1 50 50 PHE H H 1 9.7300 0.0000 . 1 . . . . . 57 PHE H . 51210 1 560 . 1 . 1 50 50 PHE HA H 1 3.7000 0.0000 . 1 . . . . . 57 PHE HA . 51210 1 561 . 1 . 1 50 50 PHE HB2 H 1 2.8710 0.0000 . 1 . . . . . 57 PHE HB2 . 51210 1 562 . 1 . 1 50 50 PHE HB3 H 1 3.1580 0.0000 . 1 . . . . . 57 PHE HB3 . 51210 1 563 . 1 . 1 50 50 PHE HD1 H 1 6.5799 0.0000 . 1 . . . . . 57 PHE HD1 . 51210 1 564 . 1 . 1 50 50 PHE HD2 H 1 6.5799 0.0000 . 1 . . . . . 57 PHE HD2 . 51210 1 565 . 1 . 1 50 50 PHE HE1 H 1 7.1860 0.0000 . 1 . . . . . 57 PHE HE1 . 51210 1 566 . 1 . 1 50 50 PHE HE2 H 1 7.1860 0.0000 . 1 . . . . . 57 PHE HE2 . 51210 1 567 . 1 . 1 50 50 PHE C C 13 179.0000 0.0000 . 1 . . . . . 57 PHE C . 51210 1 568 . 1 . 1 50 50 PHE CA C 13 61.9000 0.0000 . 1 . . . . . 57 PHE CA . 51210 1 569 . 1 . 1 50 50 PHE CB C 13 39.2000 0.0000 . 1 . . . . . 57 PHE CB . 51210 1 570 . 1 . 1 50 50 PHE CD1 C 13 130.9800 0.0000 . 1 . . . . . 57 PHE CD1 . 51210 1 571 . 1 . 1 50 50 PHE CD2 C 13 130.9800 0.0000 . 1 . . . . . 57 PHE CD2 . 51210 1 572 . 1 . 1 50 50 PHE CE1 C 13 130.9400 0.0000 . 1 . . . . . 57 PHE CE1 . 51210 1 573 . 1 . 1 50 50 PHE CE2 C 13 130.9400 0.0000 . 1 . . . . . 57 PHE CE2 . 51210 1 574 . 1 . 1 50 50 PHE N N 15 126.9000 0.0000 . 1 . . . . . 57 PHE N . 51210 1 575 . 1 . 1 51 51 SER H H 1 8.2700 0.0000 . 1 . . . . . 58 SER H . 51210 1 576 . 1 . 1 51 51 SER HA H 1 4.1800 0.0000 . 1 . . . . . 58 SER HA . 51210 1 577 . 1 . 1 51 51 SER HB2 H 1 3.9960 0.0000 . 1 . . . . . 58 SER HB2 . 51210 1 578 . 1 . 1 51 51 SER HB3 H 1 3.9960 0.0000 . 1 . . . . . 58 SER HB3 . 51210 1 579 . 1 . 1 51 51 SER C C 13 175.1400 0.0000 . 1 . . . . . 58 SER C . 51210 1 580 . 1 . 1 51 51 SER CA C 13 61.3000 0.0000 . 1 . . . . . 58 SER CA . 51210 1 581 . 1 . 1 51 51 SER CB C 13 63.4000 0.0000 . 1 . . . . . 58 SER CB . 51210 1 582 . 1 . 1 51 51 SER N N 15 111.6000 0.0000 . 1 . . . . . 58 SER N . 51210 1 583 . 1 . 1 52 52 ALA H H 1 7.1700 0.0000 . 1 . . . . . 59 ALA H . 51210 1 584 . 1 . 1 52 52 ALA HA H 1 4.3300 0.0000 . 1 . . . . . 59 ALA HA . 51210 1 585 . 1 . 1 52 52 ALA HB1 H 1 1.5070 0.0000 . 1 . . . . . 59 ALA HB1 . 51210 1 586 . 1 . 1 52 52 ALA HB2 H 1 1.5070 0.0000 . 1 . . . . . 59 ALA HB1 . 51210 1 587 . 1 . 1 52 52 ALA HB3 H 1 1.5070 0.0000 . 1 . . . . . 59 ALA HB1 . 51210 1 588 . 1 . 1 52 52 ALA C C 13 178.9000 0.0000 . 1 . . . . . 59 ALA C . 51210 1 589 . 1 . 1 52 52 ALA CA C 13 54.0000 0.0000 . 1 . . . . . 59 ALA CA . 51210 1 590 . 1 . 1 52 52 ALA CB C 13 19.6000 0.0000 . 1 . . . . . 59 ALA CB . 51210 1 591 . 1 . 1 52 52 ALA N N 15 121.0000 0.0000 . 1 . . . . . 59 ALA N . 51210 1 592 . 1 . 1 53 53 ALA H H 1 8.2700 0.0000 . 1 . . . . . 60 ALA H . 51210 1 593 . 1 . 1 53 53 ALA HA H 1 4.5200 0.0000 . 1 . . . . . 60 ALA HA . 51210 1 594 . 1 . 1 53 53 ALA HB1 H 1 1.4290 0.0000 . 1 . . . . . 60 ALA HB1 . 51210 1 595 . 1 . 1 53 53 ALA HB2 H 1 1.4290 0.0000 . 1 . . . . . 60 ALA HB1 . 51210 1 596 . 1 . 1 53 53 ALA HB3 H 1 1.4290 0.0000 . 1 . . . . . 60 ALA HB1 . 51210 1 597 . 1 . 1 53 53 ALA C C 13 178.6000 0.0000 . 1 . . . . . 60 ALA C . 51210 1 598 . 1 . 1 53 53 ALA CA C 13 52.5000 0.0000 . 1 . . . . . 60 ALA CA . 51210 1 599 . 1 . 1 53 53 ALA CB C 13 20.8000 0.0000 . 1 . . . . . 60 ALA CB . 51210 1 600 . 1 . 1 53 53 ALA N N 15 117.3000 0.0000 . 1 . . . . . 60 ALA N . 51210 1 601 . 1 . 1 54 54 GLY H H 1 8.1900 0.0000 . 1 . . . . . 61 GLY H . 51210 1 602 . 1 . 1 54 54 GLY HA2 H 1 2.7660 0.0000 . 1 . . . . . 61 GLY HA2 . 51210 1 603 . 1 . 1 54 54 GLY HA3 H 1 3.7040 0.0000 . 1 . . . . . 61 GLY HA3 . 51210 1 604 . 1 . 1 54 54 GLY C C 13 171.6000 0.0000 . 1 . . . . . 61 GLY C . 51210 1 605 . 1 . 1 54 54 GLY CA C 13 44.9000 0.0000 . 1 . . . . . 61 GLY CA . 51210 1 606 . 1 . 1 54 54 GLY N N 15 108.2000 0.0000 . 1 . . . . . 61 GLY N . 51210 1 607 . 1 . 1 55 55 THR H H 1 6.9200 0.0000 . 1 . . . . . 62 THR H . 51210 1 608 . 1 . 1 55 55 THR HA H 1 4.2400 0.0000 . 1 . . . . . 62 THR HA . 51210 1 609 . 1 . 1 55 55 THR HB H 1 3.9810 0.0000 . 1 . . . . . 62 THR HB . 51210 1 610 . 1 . 1 55 55 THR HG21 H 1 0.9070 0.0000 . 1 . . . . . 62 THR HG21 . 51210 1 611 . 1 . 1 55 55 THR HG22 H 1 0.9070 0.0000 . 1 . . . . . 62 THR HG21 . 51210 1 612 . 1 . 1 55 55 THR HG23 H 1 0.9070 0.0000 . 1 . . . . . 62 THR HG21 . 51210 1 613 . 1 . 1 55 55 THR C C 13 170.7000 0.0000 . 1 . . . . . 62 THR C . 51210 1 614 . 1 . 1 55 55 THR CA C 13 59.6000 0.0000 . 1 . . . . . 62 THR CA . 51210 1 615 . 1 . 1 55 55 THR CB C 13 70.1000 0.0000 . 1 . . . . . 62 THR CB . 51210 1 616 . 1 . 1 55 55 THR CG2 C 13 19.7120 0.0000 . 1 . . . . . 62 THR CG2 . 51210 1 617 . 1 . 1 55 55 THR N N 15 109.6000 0.0000 . 1 . . . . . 62 THR N . 51210 1 618 . 1 . 1 56 56 CYS H H 1 8.1800 0.0000 . 1 . . . . . 63 CYS H . 51210 1 619 . 1 . 1 56 56 CYS HA H 1 5.0400 0.0000 . 1 . . . . . 63 CYS HA . 51210 1 620 . 1 . 1 56 56 CYS HB2 H 1 2.7590 0.0000 . 1 . . . . . 63 CYS HB2 . 51210 1 621 . 1 . 1 56 56 CYS HB3 H 1 3.0700 0.0000 . 1 . . . . . 63 CYS HB3 . 51210 1 622 . 1 . 1 56 56 CYS C C 13 175.6000 0.0000 . 1 . . . . . 63 CYS C . 51210 1 623 . 1 . 1 56 56 CYS CA C 13 56.0000 0.0000 . 1 . . . . . 63 CYS CA . 51210 1 624 . 1 . 1 56 56 CYS CB C 13 33.7000 0.0000 . 1 . . . . . 63 CYS CB . 51210 1 625 . 1 . 1 56 56 CYS N N 15 124.5000 0.0000 . 1 . . . . . 63 CYS N . 51210 1 626 . 1 . 1 57 57 PRO HA H 1 4.5500 0.0000 . 1 . . . . . 64 PRO HA . 51210 1 627 . 1 . 1 57 57 PRO HB2 H 1 2.3410 0.0000 . 1 . . . . . 64 PRO HB2 . 51210 1 628 . 1 . 1 57 57 PRO HB3 H 1 2.2340 0.0000 . 1 . . . . . 64 PRO HB3 . 51210 1 629 . 1 . 1 57 57 PRO HG2 H 1 2.1550 0.0000 . 1 . . . . . 64 PRO HG2 . 51210 1 630 . 1 . 1 57 57 PRO HG3 H 1 1.8940 0.0000 . 1 . . . . . 64 PRO HG3 . 51210 1 631 . 1 . 1 57 57 PRO HD2 H 1 4.4420 0.0000 . 1 . . . . . 64 PRO HD2 . 51210 1 632 . 1 . 1 57 57 PRO HD3 H 1 3.9050 0.0000 . 1 . . . . . 64 PRO HD3 . 51210 1 633 . 1 . 1 57 57 PRO C C 13 178.0610 0.0000 . 1 . . . . . 64 PRO C . 51210 1 634 . 1 . 1 57 57 PRO CA C 13 64.8400 0.0000 . 1 . . . . . 64 PRO CA . 51210 1 635 . 1 . 1 57 57 PRO CB C 13 31.4000 0.0000 . 1 . . . . . 64 PRO CB . 51210 1 636 . 1 . 1 57 57 PRO CG C 13 26.6500 0.0000 . 1 . . . . . 64 PRO CG . 51210 1 637 . 1 . 1 57 57 PRO CD C 13 52.3540 0.0000 . 1 . . . . . 64 PRO CD . 51210 1 638 . 1 . 1 58 58 TYR H H 1 9.1600 0.0000 . 1 . . . . . 65 TYR H . 51210 1 639 . 1 . 1 58 58 TYR HA H 1 4.4600 0.0000 . 1 . . . . . 65 TYR HA . 51210 1 640 . 1 . 1 58 58 TYR HB2 H 1 2.5780 0.0000 . 1 . . . . . 65 TYR HB2 . 51210 1 641 . 1 . 1 58 58 TYR HB3 H 1 3.3080 0.0000 . 1 . . . . . 65 TYR HB3 . 51210 1 642 . 1 . 1 58 58 TYR HD1 H 1 6.9280 0.0000 . 1 . . . . . 65 TYR HD1 . 51210 1 643 . 1 . 1 58 58 TYR HD2 H 1 6.9280 0.0000 . 1 . . . . . 65 TYR HD2 . 51210 1 644 . 1 . 1 58 58 TYR HE1 H 1 6.8995 0.0000 . 1 . . . . . 65 TYR HE1 . 51210 1 645 . 1 . 1 58 58 TYR HE2 H 1 6.8995 0.0000 . 1 . . . . . 65 TYR HE2 . 51210 1 646 . 1 . 1 58 58 TYR C C 13 177.5000 0.0000 . 1 . . . . . 65 TYR C . 51210 1 647 . 1 . 1 58 58 TYR CA C 13 60.7000 0.0000 . 1 . . . . . 65 TYR CA . 51210 1 648 . 1 . 1 58 58 TYR CB C 13 37.9000 0.0000 . 1 . . . . . 65 TYR CB . 51210 1 649 . 1 . 1 58 58 TYR CD1 C 13 132.5100 0.0000 . 1 . . . . . 65 TYR CD1 . 51210 1 650 . 1 . 1 58 58 TYR CD2 C 13 132.5100 0.0000 . 1 . . . . . 65 TYR CD2 . 51210 1 651 . 1 . 1 58 58 TYR CE1 C 13 118.1500 0.0000 . 1 . . . . . 65 TYR CE1 . 51210 1 652 . 1 . 1 58 58 TYR CE2 C 13 118.1500 0.0000 . 1 . . . . . 65 TYR CE2 . 51210 1 653 . 1 . 1 58 58 TYR N N 15 121.2000 0.0000 . 1 . . . . . 65 TYR N . 51210 1 654 . 1 . 1 59 59 GLY H H 1 7.9300 0.0000 . 1 . . . . . 66 GLY H . 51210 1 655 . 1 . 1 59 59 GLY HA2 H 1 4.1130 0.0000 . 1 . . . . . 66 GLY HA2 . 51210 1 656 . 1 . 1 59 59 GLY HA3 H 1 4.1130 0.0000 . 1 . . . . . 66 GLY HA3 . 51210 1 657 . 1 . 1 59 59 GLY C C 13 176.5000 0.0000 . 1 . . . . . 66 GLY C . 51210 1 658 . 1 . 1 59 59 GLY CA C 13 47.8000 0.0000 . 1 . . . . . 66 GLY CA . 51210 1 659 . 1 . 1 59 59 GLY N N 15 107.8000 0.0000 . 1 . . . . . 66 GLY N . 51210 1 660 . 1 . 1 60 60 LYS H H 1 9.1300 0.0000 . 1 . . . . . 67 LYS H . 51210 1 661 . 1 . 1 60 60 LYS HA H 1 4.2900 0.0000 . 1 . . . . . 67 LYS HA . 51210 1 662 . 1 . 1 60 60 LYS HB2 H 1 2.0320 0.0000 . 1 . . . . . 67 LYS HB2 . 51210 1 663 . 1 . 1 60 60 LYS HB3 H 1 2.0320 0.0000 . 1 . . . . . 67 LYS HB3 . 51210 1 664 . 1 . 1 60 60 LYS HG2 H 1 1.5990 0.0000 . 1 . . . . . 67 LYS HG2 . 51210 1 665 . 1 . 1 60 60 LYS HG3 H 1 1.5990 0.0000 . 1 . . . . . 67 LYS HG3 . 51210 1 666 . 1 . 1 60 60 LYS HD2 H 1 1.7870 0.0000 . 1 . . . . . 67 LYS HD2 . 51210 1 667 . 1 . 1 60 60 LYS HD3 H 1 1.9780 0.0000 . 1 . . . . . 67 LYS HD3 . 51210 1 668 . 1 . 1 60 60 LYS HE2 H 1 3.1220 0.0000 . 1 . . . . . 67 LYS HE2 . 51210 1 669 . 1 . 1 60 60 LYS HE3 H 1 3.1220 0.0000 . 1 . . . . . 67 LYS HE3 . 51210 1 670 . 1 . 1 60 60 LYS C C 13 177.3000 0.0000 . 1 . . . . . 67 LYS C . 51210 1 671 . 1 . 1 60 60 LYS CA C 13 58.2000 0.0000 . 1 . . . . . 67 LYS CA . 51210 1 672 . 1 . 1 60 60 LYS CB C 13 31.7600 0.0000 . 1 . . . . . 67 LYS CB . 51210 1 673 . 1 . 1 60 60 LYS CG C 13 24.9320 0.0000 . 1 . . . . . 67 LYS CG . 51210 1 674 . 1 . 1 60 60 LYS CD C 13 29.2620 0.0000 . 1 . . . . . 67 LYS CD . 51210 1 675 . 1 . 1 60 60 LYS CE C 13 42.0110 0.0000 . 1 . . . . . 67 LYS CE . 51210 1 676 . 1 . 1 60 60 LYS N N 15 126.8000 0.0000 . 1 . . . . . 67 LYS N . 51210 1 677 . 1 . 1 61 61 ARG H H 1 8.7300 0.0000 . 1 . . . . . 68 ARG H . 51210 1 678 . 1 . 1 61 61 ARG HA H 1 4.5800 0.0000 . 1 . . . . . 68 ARG HA . 51210 1 679 . 1 . 1 61 61 ARG HB2 H 1 2.3380 0.0000 . 1 . . . . . 68 ARG HB2 . 51210 1 680 . 1 . 1 61 61 ARG HB3 H 1 2.3380 0.0000 . 1 . . . . . 68 ARG HB3 . 51210 1 681 . 1 . 1 61 61 ARG HG2 H 1 1.8780 0.0000 . 1 . . . . . 68 ARG HG2 . 51210 1 682 . 1 . 1 61 61 ARG HG3 H 1 1.8780 0.0000 . 1 . . . . . 68 ARG HG3 . 51210 1 683 . 1 . 1 61 61 ARG C C 13 175.5000 0.0000 . 1 . . . . . 68 ARG C . 51210 1 684 . 1 . 1 61 61 ARG CA C 13 56.6000 0.0000 . 1 . . . . . 68 ARG CA . 51210 1 685 . 1 . 1 61 61 ARG CB C 13 30.1000 0.0000 . 1 . . . . . 68 ARG CB . 51210 1 686 . 1 . 1 61 61 ARG CG C 13 27.9780 0.0000 . 1 . . . . . 68 ARG CG . 51210 1 687 . 1 . 1 61 61 ARG N N 15 118.9000 0.0000 . 1 . . . . . 68 ARG N . 51210 1 688 . 1 . 1 62 62 CYS H H 1 7.3400 0.0000 . 1 . . . . . 69 CYS H . 51210 1 689 . 1 . 1 62 62 CYS HA H 1 4.0600 0.0000 . 1 . . . . . 69 CYS HA . 51210 1 690 . 1 . 1 62 62 CYS HB2 H 1 2.3130 0.0000 . 1 . . . . . 69 CYS HB2 . 51210 1 691 . 1 . 1 62 62 CYS HB3 H 1 2.9560 0.0000 . 1 . . . . . 69 CYS HB3 . 51210 1 692 . 1 . 1 62 62 CYS C C 13 177.2000 0.0000 . 1 . . . . . 69 CYS C . 51210 1 693 . 1 . 1 62 62 CYS CA C 13 61.6000 0.0000 . 1 . . . . . 69 CYS CA . 51210 1 694 . 1 . 1 62 62 CYS CB C 13 31.1000 0.0000 . 1 . . . . . 69 CYS CB . 51210 1 695 . 1 . 1 62 62 CYS N N 15 124.2000 0.0000 . 1 . . . . . 69 CYS N . 51210 1 696 . 1 . 1 63 63 ARG H H 1 8.5100 0.0000 . 1 . . . . . 70 ARG H . 51210 1 697 . 1 . 1 63 63 ARG HA H 1 4.1390 0.0000 . 1 . . . . . 70 ARG HA . 51210 1 698 . 1 . 1 63 63 ARG HB2 H 1 0.8410 0.0000 . 1 . . . . . 70 ARG HB2 . 51210 1 699 . 1 . 1 63 63 ARG HB3 H 1 2.1190 0.0000 . 1 . . . . . 70 ARG HB3 . 51210 1 700 . 1 . 1 63 63 ARG HG2 H 1 1.9350 0.0000 . 1 . . . . . 70 ARG HG2 . 51210 1 701 . 1 . 1 63 63 ARG HG3 H 1 1.7370 0.0000 . 1 . . . . . 70 ARG HG3 . 51210 1 702 . 1 . 1 63 63 ARG HD2 H 1 3.4920 0.0000 . 1 . . . . . 70 ARG HD2 . 51210 1 703 . 1 . 1 63 63 ARG HD3 H 1 2.8270 0.0000 . 1 . . . . . 70 ARG HD3 . 51210 1 704 . 1 . 1 63 63 ARG C C 13 174.9000 0.0000 . 1 . . . . . 70 ARG C . 51210 1 705 . 1 . 1 63 63 ARG CA C 13 57.4000 0.0000 . 1 . . . . . 70 ARG CA . 51210 1 706 . 1 . 1 63 63 ARG CB C 13 30.1910 0.0000 . 1 . . . . . 70 ARG CB . 51210 1 707 . 1 . 1 63 63 ARG CG C 13 28.2920 0.0000 . 1 . . . . . 70 ARG CG . 51210 1 708 . 1 . 1 63 63 ARG CD C 13 44.6230 0.0000 . 1 . . . . . 70 ARG CD . 51210 1 709 . 1 . 1 63 63 ARG N N 15 125.8000 0.0000 . 1 . . . . . 70 ARG N . 51210 1 710 . 1 . 1 64 64 PHE H H 1 8.8200 0.0000 . 1 . . . . . 71 PHE H . 51210 1 711 . 1 . 1 64 64 PHE HA H 1 4.7100 0.0000 . 1 . . . . . 71 PHE HA . 51210 1 712 . 1 . 1 64 64 PHE HB2 H 1 2.8820 0.0000 . 1 . . . . . 71 PHE HB2 . 51210 1 713 . 1 . 1 64 64 PHE HB3 H 1 2.8820 0.0000 . 1 . . . . . 71 PHE HB3 . 51210 1 714 . 1 . 1 64 64 PHE HE1 H 1 6.6080 0.0000 . 1 . . . . . 71 PHE HE1 . 51210 1 715 . 1 . 1 64 64 PHE HE2 H 1 6.6080 0.0000 . 1 . . . . . 71 PHE HE2 . 51210 1 716 . 1 . 1 64 64 PHE C C 13 174.5000 0.0000 . 1 . . . . . 71 PHE C . 51210 1 717 . 1 . 1 64 64 PHE CA C 13 57.2000 0.0000 . 1 . . . . . 71 PHE CA . 51210 1 718 . 1 . 1 64 64 PHE CB C 13 39.2000 0.0000 . 1 . . . . . 71 PHE CB . 51210 1 719 . 1 . 1 64 64 PHE CE1 C 13 131.2400 0.0000 . 1 . . . . . 71 PHE CE1 . 51210 1 720 . 1 . 1 64 64 PHE CE2 C 13 131.2400 0.0000 . 1 . . . . . 71 PHE CE2 . 51210 1 721 . 1 . 1 64 64 PHE N N 15 124.9000 0.0000 . 1 . . . . . 71 PHE N . 51210 1 722 . 1 . 1 65 65 ILE H H 1 9.1700 0.0000 . 1 . . . . . 72 ILE H . 51210 1 723 . 1 . 1 65 65 ILE HA H 1 3.2600 0.0000 . 1 . . . . . 72 ILE HA . 51210 1 724 . 1 . 1 65 65 ILE HB H 1 1.4040 0.0000 . 1 . . . . . 72 ILE HB . 51210 1 725 . 1 . 1 65 65 ILE HG12 H 1 1.1000 0.0000 . 1 . . . . . 72 ILE HG12 . 51210 1 726 . 1 . 1 65 65 ILE HG13 H 1 0.5380 0.0000 . 1 . . . . . 72 ILE HG13 . 51210 1 727 . 1 . 1 65 65 ILE HG21 H 1 0.7350 0.0000 . 1 . . . . . 72 ILE HG21 . 51210 1 728 . 1 . 1 65 65 ILE HG22 H 1 0.7350 0.0000 . 1 . . . . . 72 ILE HG21 . 51210 1 729 . 1 . 1 65 65 ILE HG23 H 1 0.7350 0.0000 . 1 . . . . . 72 ILE HG21 . 51210 1 730 . 1 . 1 65 65 ILE HD11 H 1 0.4930 0.0000 . 1 . . . . . 72 ILE HD11 . 51210 1 731 . 1 . 1 65 65 ILE HD12 H 1 0.4930 0.0000 . 1 . . . . . 72 ILE HD11 . 51210 1 732 . 1 . 1 65 65 ILE HD13 H 1 0.4930 0.0000 . 1 . . . . . 72 ILE HD11 . 51210 1 733 . 1 . 1 65 65 ILE C C 13 177.1000 0.0000 . 1 . . . . . 72 ILE C . 51210 1 734 . 1 . 1 65 65 ILE CA C 13 63.9000 0.0000 . 1 . . . . . 72 ILE CA . 51210 1 735 . 1 . 1 65 65 ILE CB C 13 39.7000 0.0000 . 1 . . . . . 72 ILE CB . 51210 1 736 . 1 . 1 65 65 ILE CG1 C 13 28.4400 0.0000 . 1 . . . . . 72 ILE CG1 . 51210 1 737 . 1 . 1 65 65 ILE CG2 C 13 16.6300 0.0000 . 1 . . . . . 72 ILE CG2 . 51210 1 738 . 1 . 1 65 65 ILE CD1 C 13 14.0650 0.0000 . 1 . . . . . 72 ILE CD1 . 51210 1 739 . 1 . 1 65 65 ILE N N 15 119.9000 0.0000 . 1 . . . . . 72 ILE N . 51210 1 740 . 1 . 1 66 66 HIS H H 1 8.7400 0.0000 . 1 . . . . . 73 HIS H . 51210 1 741 . 1 . 1 66 66 HIS HA H 1 4.3200 0.0000 . 1 . . . . . 73 HIS HA . 51210 1 742 . 1 . 1 66 66 HIS HB2 H 1 1.0380 0.0000 . 1 . . . . . 73 HIS HB2 . 51210 1 743 . 1 . 1 66 66 HIS HB3 H 1 2.5630 0.0000 . 1 . . . . . 73 HIS HB3 . 51210 1 744 . 1 . 1 66 66 HIS HD2 H 1 6.4750 0.0000 . 1 . . . . . 73 HIS HD2 . 51210 1 745 . 1 . 1 66 66 HIS HE1 H 1 7.9640 0.0000 . 1 . . . . . 73 HIS HE1 . 51210 1 746 . 1 . 1 66 66 HIS C C 13 172.6000 0.0000 . 1 . . . . . 73 HIS C . 51210 1 747 . 1 . 1 66 66 HIS CA C 13 52.6000 0.0000 . 1 . . . . . 73 HIS CA . 51210 1 748 . 1 . 1 66 66 HIS CB C 13 27.3000 0.0000 . 1 . . . . . 73 HIS CB . 51210 1 749 . 1 . 1 66 66 HIS CD2 C 13 123.2600 0.0000 . 1 . . . . . 73 HIS CD2 . 51210 1 750 . 1 . 1 66 66 HIS CE1 C 13 139.2400 0.0000 . 1 . . . . . 73 HIS CE1 . 51210 1 751 . 1 . 1 66 66 HIS N N 15 129.5000 0.0000 . 1 . . . . . 73 HIS N . 51210 1 752 . 1 . 1 67 67 ALA H H 1 7.8900 0.0000 . 1 . . . . . 74 ALA H . 51210 1 753 . 1 . 1 67 67 ALA HA H 1 4.4400 0.0000 . 1 . . . . . 74 ALA HA . 51210 1 754 . 1 . 1 67 67 ALA HB1 H 1 1.3180 0.0000 . 1 . . . . . 74 ALA HB1 . 51210 1 755 . 1 . 1 67 67 ALA HB2 H 1 1.3180 0.0000 . 1 . . . . . 74 ALA HB1 . 51210 1 756 . 1 . 1 67 67 ALA HB3 H 1 1.3180 0.0000 . 1 . . . . . 74 ALA HB1 . 51210 1 757 . 1 . 1 67 67 ALA C C 13 176.1000 0.0000 . 1 . . . . . 74 ALA C . 51210 1 758 . 1 . 1 67 67 ALA CA C 13 51.9000 0.0000 . 1 . . . . . 74 ALA CA . 51210 1 759 . 1 . 1 67 67 ALA CB C 13 20.3000 0.0000 . 1 . . . . . 74 ALA CB . 51210 1 760 . 1 . 1 67 67 ALA N N 15 127.4000 0.0000 . 1 . . . . . 74 ALA N . 51210 1 761 . 1 . 1 68 68 THR H H 1 8.2300 0.0000 . 1 . . . . . 75 THR H . 51210 1 762 . 1 . 1 68 68 THR HA H 1 4.6800 0.0000 . 1 . . . . . 75 THR HA . 51210 1 763 . 1 . 1 68 68 THR HB H 1 4.2570 0.0000 . 1 . . . . . 75 THR HB . 51210 1 764 . 1 . 1 68 68 THR HG21 H 1 1.3540 0.0000 . 1 . . . . . 75 THR HG21 . 51210 1 765 . 1 . 1 68 68 THR HG22 H 1 1.3540 0.0000 . 1 . . . . . 75 THR HG21 . 51210 1 766 . 1 . 1 68 68 THR HG23 H 1 1.3540 0.0000 . 1 . . . . . 75 THR HG21 . 51210 1 767 . 1 . 1 68 68 THR C C 13 172.4000 0.0000 . 1 . . . . . 75 THR C . 51210 1 768 . 1 . 1 68 68 THR CA C 13 59.6000 0.0000 . 1 . . . . . 75 THR CA . 51210 1 769 . 1 . 1 68 68 THR CB C 13 69.8000 0.0000 . 1 . . . . . 75 THR CB . 51210 1 770 . 1 . 1 68 68 THR CG2 C 13 21.3660 0.0000 . 1 . . . . . 75 THR CG2 . 51210 1 771 . 1 . 1 68 68 THR N N 15 116.2000 0.0000 . 1 . . . . . 75 THR N . 51210 1 stop_ save_