################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25614 _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 $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H TOCSY' 1 $sample_1 isotropic 25614 1 2 '2D 1H-1H NOESY' 1 $sample_1 isotropic 25614 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.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 ILE HA H 1 4.073 0.020 . 1 . . . A 2 ILE HA . 25614 1 2 . 1 1 2 2 ILE HG12 H 1 1.292 0.020 . 2 . . . A 2 ILE HG12 . 25614 1 3 . 1 1 2 2 ILE HG13 H 1 1.016 0.020 . 2 . . . A 2 ILE HG13 . 25614 1 4 . 1 1 2 2 ILE HG21 H 1 0.772 0.020 . 1 . . . A 2 ILE HG21 . 25614 1 5 . 1 1 2 2 ILE HG22 H 1 0.772 0.020 . 1 . . . A 2 ILE HG22 . 25614 1 6 . 1 1 2 2 ILE HG23 H 1 0.772 0.020 . 1 . . . A 2 ILE HG23 . 25614 1 7 . 1 1 2 2 ILE HD11 H 1 0.685 0.020 . 1 . . . A 2 ILE HD11 . 25614 1 8 . 1 1 2 2 ILE HD12 H 1 0.685 0.020 . 1 . . . A 2 ILE HD12 . 25614 1 9 . 1 1 2 2 ILE HD13 H 1 0.685 0.020 . 1 . . . A 2 ILE HD13 . 25614 1 10 . 1 1 2 2 ILE CG1 C 13 28.008 0.200 . 1 . . . A 2 ILE CG1 . 25614 1 11 . 1 1 2 2 ILE CG2 C 13 17.204 0.200 . 1 . . . A 2 ILE CG2 . 25614 1 12 . 1 1 2 2 ILE CD1 C 13 14.043 0.200 . 1 . . . A 2 ILE CD1 . 25614 1 13 . 1 1 3 3 VAL H H 1 8.261 0.020 . 1 . . . A 3 VAL H . 25614 1 14 . 1 1 3 3 VAL HA H 1 3.772 0.020 . 1 . . . A 3 VAL HA . 25614 1 15 . 1 1 3 3 VAL HG11 H 1 0.970 0.020 . 1 . . . A 3 VAL HG11 . 25614 1 16 . 1 1 3 3 VAL HG12 H 1 0.970 0.020 . 1 . . . A 3 VAL HG12 . 25614 1 17 . 1 1 3 3 VAL HG13 H 1 0.970 0.020 . 1 . . . A 3 VAL HG13 . 25614 1 18 . 1 1 3 3 VAL HG21 H 1 0.935 0.020 . 1 . . . A 3 VAL HG21 . 25614 1 19 . 1 1 3 3 VAL HG22 H 1 0.935 0.020 . 1 . . . A 3 VAL HG22 . 25614 1 20 . 1 1 3 3 VAL HG23 H 1 0.935 0.020 . 1 . . . A 3 VAL HG23 . 25614 1 21 . 1 1 7 7 CYS HB2 H 1 3.328 0.020 . 2 . . . A 7 CYS HB2 . 25614 1 22 . 1 1 7 7 CYS HB3 H 1 3.787 0.020 . 2 . . . A 7 CYS HB3 . 25614 1 23 . 1 1 7 7 CYS CB C 13 39.322 0.200 . 1 . . . A 7 CYS CB . 25614 1 24 . 1 1 8 8 THR HA H 1 4.169 0.020 . 1 . . . A 8 THR HA . 25614 1 25 . 1 1 8 8 THR HB H 1 4.469 0.020 . 1 . . . A 8 THR HB . 25614 1 26 . 1 1 8 8 THR HG21 H 1 1.287 0.020 . 1 . . . A 8 THR HG21 . 25614 1 27 . 1 1 8 8 THR HG22 H 1 1.287 0.020 . 1 . . . A 8 THR HG22 . 25614 1 28 . 1 1 8 8 THR HG23 H 1 1.287 0.020 . 1 . . . A 8 THR HG23 . 25614 1 29 . 1 1 8 8 THR CA C 13 63.568 0.200 . 1 . . . A 8 THR CA . 25614 1 30 . 1 1 8 8 THR CB C 13 68.917 0.200 . 1 . . . A 8 THR CB . 25614 1 31 . 1 1 9 9 SER HA H 1 4.758 0.020 . 1 . . . A 9 SER HA . 25614 1 32 . 1 1 9 9 SER HB2 H 1 3.982 0.020 . 2 . . . A 9 SER HB2 . 25614 1 33 . 1 1 9 9 SER HB3 H 1 3.872 0.020 . 2 . . . A 9 SER HB3 . 25614 1 34 . 1 1 9 9 SER CB C 13 64.916 0.200 . 1 . . . A 9 SER CB . 25614 1 35 . 1 1 10 10 ILE H H 1 7.914 0.020 . 1 . . . A 10 ILE H . 25614 1 36 . 1 1 10 10 ILE HA H 1 4.213 0.020 . 1 . . . A 10 ILE HA . 25614 1 37 . 1 1 10 10 ILE HB H 1 1.619 0.020 . 1 . . . A 10 ILE HB . 25614 1 38 . 1 1 10 10 ILE HG12 H 1 1.113 0.020 . 2 . . . A 10 ILE HG12 . 25614 1 39 . 1 1 10 10 ILE HG13 H 1 0.451 0.020 . 2 . . . A 10 ILE HG13 . 25614 1 40 . 1 1 10 10 ILE HG21 H 1 0.697 0.020 . 1 . . . A 10 ILE HG21 . 25614 1 41 . 1 1 10 10 ILE HG22 H 1 0.697 0.020 . 1 . . . A 10 ILE HG22 . 25614 1 42 . 1 1 10 10 ILE HG23 H 1 0.697 0.020 . 1 . . . A 10 ILE HG23 . 25614 1 43 . 1 1 10 10 ILE HD11 H 1 0.510 0.020 . 1 . . . A 10 ILE HD11 . 25614 1 44 . 1 1 10 10 ILE HD12 H 1 0.510 0.020 . 1 . . . A 10 ILE HD12 . 25614 1 45 . 1 1 10 10 ILE HD13 H 1 0.510 0.020 . 1 . . . A 10 ILE HD13 . 25614 1 46 . 1 1 10 10 ILE CA C 13 60.543 0.200 . 1 . . . A 10 ILE CA . 25614 1 47 . 1 1 10 10 ILE CG2 C 13 17.217 0.200 . 1 . . . A 10 ILE CG2 . 25614 1 48 . 1 1 10 10 ILE CD1 C 13 12.213 0.200 . 1 . . . A 10 ILE CD1 . 25614 1 49 . 1 1 12 12 SER HA H 1 4.653 0.020 . 1 . . . A 12 SER HA . 25614 1 50 . 1 1 12 12 SER HB2 H 1 4.226 0.020 . 2 . . . A 12 SER HB2 . 25614 1 51 . 1 1 12 12 SER HB3 H 1 4.066 0.020 . 2 . . . A 12 SER HB3 . 25614 1 52 . 1 1 12 12 SER CB C 13 65.651 0.200 . 1 . . . A 12 SER CB . 25614 1 53 . 1 1 13 13 LEU HA H 1 3.981 0.020 . 1 . . . A 13 LEU HA . 25614 1 54 . 1 1 13 13 LEU HB2 H 1 1.589 0.020 . 2 . . . A 13 LEU HB2 . 25614 1 55 . 1 1 13 13 LEU HB3 H 1 1.528 0.020 . 2 . . . A 13 LEU HB3 . 25614 1 56 . 1 1 13 13 LEU HG H 1 1.610 0.020 . 1 . . . A 13 LEU HG . 25614 1 57 . 1 1 13 13 LEU HD11 H 1 0.935 0.020 . 1 . . . A 13 LEU HD11 . 25614 1 58 . 1 1 13 13 LEU HD12 H 1 0.935 0.020 . 1 . . . A 13 LEU HD12 . 25614 1 59 . 1 1 13 13 LEU HD13 H 1 0.935 0.020 . 1 . . . A 13 LEU HD13 . 25614 1 60 . 1 1 13 13 LEU HD21 H 1 0.875 0.020 . 1 . . . A 13 LEU HD21 . 25614 1 61 . 1 1 13 13 LEU HD22 H 1 0.875 0.020 . 1 . . . A 13 LEU HD22 . 25614 1 62 . 1 1 13 13 LEU HD23 H 1 0.875 0.020 . 1 . . . A 13 LEU HD23 . 25614 1 63 . 1 1 13 13 LEU CA C 13 58.475 0.200 . 1 . . . A 13 LEU CA . 25614 1 64 . 1 1 14 14 TYR H H 1 7.757 0.020 . 1 . . . A 14 TYR H . 25614 1 65 . 1 1 14 14 TYR HA H 1 4.388 0.020 . 1 . . . A 14 TYR HA . 25614 1 66 . 1 1 14 14 TYR HB2 H 1 3.079 0.020 . 2 . . . A 14 TYR HB2 . 25614 1 67 . 1 1 14 14 TYR HB3 H 1 3.042 0.020 . 2 . . . A 14 TYR HB3 . 25614 1 68 . 1 1 14 14 TYR HD1 H 1 7.168 0.020 . 3 . . . A 14 TYR HD1 . 25614 1 69 . 1 1 14 14 TYR HD2 H 1 7.168 0.020 . 3 . . . A 14 TYR HD2 . 25614 1 70 . 1 1 14 14 TYR HE1 H 1 6.906 0.020 . 3 . . . A 14 TYR HE1 . 25614 1 71 . 1 1 14 14 TYR HE2 H 1 6.906 0.020 . 3 . . . A 14 TYR HE2 . 25614 1 72 . 1 1 14 14 TYR CA C 13 59.951 0.200 . 1 . . . A 14 TYR CA . 25614 1 73 . 1 1 14 14 TYR CB C 13 37.678 0.200 . 1 . . . A 14 TYR CB . 25614 1 74 . 1 1 15 15 GLN H H 1 7.543 0.020 . 1 . . . A 15 GLN H . 25614 1 75 . 1 1 15 15 GLN HA H 1 4.001 0.020 . 1 . . . A 15 GLN HA . 25614 1 76 . 1 1 15 15 GLN HB2 H 1 2.253 0.020 . 2 . . . A 15 GLN HB2 . 25614 1 77 . 1 1 15 15 GLN HB3 H 1 2.082 0.020 . 2 . . . A 15 GLN HB3 . 25614 1 78 . 1 1 15 15 GLN HG2 H 1 2.385 0.020 . 2 . . . A 15 GLN HG2 . 25614 1 79 . 1 1 15 15 GLN HG3 H 1 2.437 0.020 . 2 . . . A 15 GLN HG3 . 25614 1 80 . 1 1 15 15 GLN CA C 13 57.646 0.200 . 1 . . . A 15 GLN CA . 25614 1 81 . 1 1 15 15 GLN CB C 13 29.439 0.200 . 1 . . . A 15 GLN CB . 25614 1 82 . 1 1 15 15 GLN CG C 13 36.352 0.200 . 1 . . . A 15 GLN CG . 25614 1 83 . 1 1 16 16 LEU H H 1 7.887 0.020 . 1 . . . A 16 LEU H . 25614 1 84 . 1 1 16 16 LEU HA H 1 4.198 0.020 . 1 . . . A 16 LEU HA . 25614 1 85 . 1 1 16 16 LEU HB2 H 1 2.038 0.020 . 2 . . . A 16 LEU HB2 . 25614 1 86 . 1 1 16 16 LEU HB3 H 1 1.429 0.020 . 2 . . . A 16 LEU HB3 . 25614 1 87 . 1 1 16 16 LEU HG H 1 1.817 0.020 . 1 . . . A 16 LEU HG . 25614 1 88 . 1 1 16 16 LEU HD11 H 1 0.818 0.020 . 1 . . . A 16 LEU HD11 . 25614 1 89 . 1 1 16 16 LEU HD12 H 1 0.818 0.020 . 1 . . . A 16 LEU HD12 . 25614 1 90 . 1 1 16 16 LEU HD13 H 1 0.818 0.020 . 1 . . . A 16 LEU HD13 . 25614 1 91 . 1 1 16 16 LEU HD21 H 1 0.800 0.020 . 1 . . . A 16 LEU HD21 . 25614 1 92 . 1 1 16 16 LEU HD22 H 1 0.800 0.020 . 1 . . . A 16 LEU HD22 . 25614 1 93 . 1 1 16 16 LEU HD23 H 1 0.800 0.020 . 1 . . . A 16 LEU HD23 . 25614 1 94 . 1 1 16 16 LEU CA C 13 57.465 0.200 . 1 . . . A 16 LEU CA . 25614 1 95 . 1 1 16 16 LEU CB C 13 41.977 0.200 . 1 . . . A 16 LEU CB . 25614 1 96 . 1 1 17 17 GLU H H 1 8.255 0.020 . 1 . . . A 17 GLU H . 25614 1 97 . 1 1 17 17 GLU HA H 1 4.239 0.020 . 1 . . . A 17 GLU HA . 25614 1 98 . 1 1 17 17 GLU HB2 H 1 2.032 0.020 . 2 . . . A 17 GLU HB2 . 25614 1 99 . 1 1 17 17 GLU HB3 H 1 2.084 0.020 . 2 . . . A 17 GLU HB3 . 25614 1 100 . 1 1 17 17 GLU HG2 H 1 2.425 0.020 . 2 . . . A 17 GLU HG2 . 25614 1 101 . 1 1 17 17 GLU HG3 H 1 2.237 0.020 . 2 . . . A 17 GLU HG3 . 25614 1 102 . 1 1 17 17 GLU CA C 13 58.770 0.200 . 1 . . . A 17 GLU CA . 25614 1 103 . 1 1 17 17 GLU CG C 13 37.065 0.200 . 1 . . . A 17 GLU CG . 25614 1 104 . 1 1 18 18 ASN H H 1 7.443 0.020 . 1 . . . A 18 ASN H . 25614 1 105 . 1 1 18 18 ASN HA H 1 4.536 0.020 . 1 . . . A 18 ASN HA . 25614 1 106 . 1 1 18 18 ASN HB2 H 1 2.667 0.020 . 2 . . . A 18 ASN HB2 . 25614 1 107 . 1 1 18 18 ASN HB3 H 1 2.635 0.020 . 2 . . . A 18 ASN HB3 . 25614 1 108 . 1 1 18 18 ASN HD21 H 1 6.591 0.020 . 2 . . . A 18 ASN HD21 . 25614 1 109 . 1 1 18 18 ASN HD22 H 1 7.327 0.020 . 2 . . . A 18 ASN HD22 . 25614 1 110 . 1 1 18 18 ASN CA C 13 55.243 0.200 . 1 . . . A 18 ASN CA . 25614 1 111 . 1 1 18 18 ASN CB C 13 38.626 0.200 . 1 . . . A 18 ASN CB . 25614 1 112 . 1 1 19 19 TYR H H 1 8.003 0.020 . 1 . . . A 19 TYR H . 25614 1 113 . 1 1 19 19 TYR HA H 1 4.527 0.020 . 1 . . . A 19 TYR HA . 25614 1 114 . 1 1 19 19 TYR HB2 H 1 3.340 0.020 . 2 . . . A 19 TYR HB2 . 25614 1 115 . 1 1 19 19 TYR HB3 H 1 3.044 0.020 . 2 . . . A 19 TYR HB3 . 25614 1 116 . 1 1 19 19 TYR HD1 H 1 7.410 0.020 . 3 . . . A 19 TYR HD1 . 25614 1 117 . 1 1 19 19 TYR HD2 H 1 7.410 0.020 . 3 . . . A 19 TYR HD2 . 25614 1 118 . 1 1 19 19 TYR HE1 H 1 6.883 0.020 . 3 . . . A 19 TYR HE1 . 25614 1 119 . 1 1 19 19 TYR HE2 H 1 6.883 0.020 . 3 . . . A 19 TYR HE2 . 25614 1 120 . 1 1 19 19 TYR CA C 13 59.188 0.200 . 1 . . . A 19 TYR CA . 25614 1 121 . 1 1 19 19 TYR CB C 13 38.605 0.200 . 1 . . . A 19 TYR CB . 25614 1 122 . 1 1 20 20 CYS H H 1 7.512 0.020 . 1 . . . A 20 CYS H . 25614 1 123 . 1 1 20 20 CYS HA H 1 5.095 0.020 . 1 . . . A 20 CYS HA . 25614 1 124 . 1 1 20 20 CYS HB2 H 1 3.395 0.020 . 2 . . . A 20 CYS HB2 . 25614 1 125 . 1 1 20 20 CYS HB3 H 1 2.915 0.020 . 2 . . . A 20 CYS HB3 . 25614 1 126 . 1 1 20 20 CYS CB C 13 35.453 0.200 . 1 . . . A 20 CYS CB . 25614 1 127 . 1 1 21 21 ASN H H 1 8.188 0.020 . 1 . . . A 21 ASN H . 25614 1 128 . 1 1 21 21 ASN HA H 1 4.497 0.020 . 1 . . . A 21 ASN HA . 25614 1 129 . 1 1 21 21 ASN HB2 H 1 2.833 0.020 . 2 . . . A 21 ASN HB2 . 25614 1 130 . 1 1 21 21 ASN HB3 H 1 2.697 0.020 . 2 . . . A 21 ASN HB3 . 25614 1 131 . 1 1 21 21 ASN HD21 H 1 6.464 0.020 . 2 . . . A 21 ASN HD21 . 25614 1 132 . 1 1 21 21 ASN HD22 H 1 7.527 0.020 . 2 . . . A 21 ASN HD22 . 25614 1 133 . 1 1 21 21 ASN CA C 13 55.386 0.200 . 1 . . . A 21 ASN CA . 25614 1 134 . 1 1 21 21 ASN CB C 13 38.803 0.200 . 1 . . . A 21 ASN CB . 25614 1 135 . 2 2 1 1 PHE HA H 1 3.825 0.020 . 1 . . . B 1 PHE HA . 25614 1 136 . 2 2 1 1 PHE HB2 H 1 3.075 0.020 . 2 . . . B 1 PHE HB2 . 25614 1 137 . 2 2 1 1 PHE HB3 H 1 2.973 0.020 . 2 . . . B 1 PHE HB3 . 25614 1 138 . 2 2 1 1 PHE HD1 H 1 7.187 0.020 . 3 . . . B 1 PHE HD1 . 25614 1 139 . 2 2 1 1 PHE HD2 H 1 7.187 0.020 . 3 . . . B 1 PHE HD2 . 25614 1 140 . 2 2 1 1 PHE HE1 H 1 7.313 0.020 . 3 . . . B 1 PHE HE1 . 25614 1 141 . 2 2 1 1 PHE HE2 H 1 7.313 0.020 . 3 . . . B 1 PHE HE2 . 25614 1 142 . 2 2 1 1 PHE HZ H 1 7.256 0.020 . 1 . . . B 1 PHE HZ . 25614 1 143 . 2 2 1 1 PHE CA C 13 58.427 0.200 . 1 . . . B 1 PHE CA . 25614 1 144 . 2 2 1 1 PHE CB C 13 42.481 0.200 . 1 . . . B 1 PHE CB . 25614 1 145 . 2 2 2 2 VAL HA H 1 4.028 0.020 . 1 . . . B 2 VAL HA . 25614 1 146 . 2 2 2 2 VAL HB H 1 1.950 0.020 . 1 . . . B 2 VAL HB . 25614 1 147 . 2 2 2 2 VAL HG11 H 1 0.842 0.020 . 1 . . . B 2 VAL HG11 . 25614 1 148 . 2 2 2 2 VAL HG12 H 1 0.842 0.020 . 1 . . . B 2 VAL HG12 . 25614 1 149 . 2 2 2 2 VAL HG13 H 1 0.842 0.020 . 1 . . . B 2 VAL HG13 . 25614 1 150 . 2 2 2 2 VAL HG21 H 1 0.826 0.020 . 1 . . . B 2 VAL HG21 . 25614 1 151 . 2 2 2 2 VAL HG22 H 1 0.826 0.020 . 1 . . . B 2 VAL HG22 . 25614 1 152 . 2 2 2 2 VAL HG23 H 1 0.826 0.020 . 1 . . . B 2 VAL HG23 . 25614 1 153 . 2 2 2 2 VAL CA C 13 61.919 0.200 . 1 . . . B 2 VAL CA . 25614 1 154 . 2 2 2 2 VAL CB C 13 32.630 0.200 . 1 . . . B 2 VAL CB . 25614 1 155 . 2 2 3 3 ASN HA H 1 4.575 0.020 . 1 . . . B 3 ASN HA . 25614 1 156 . 2 2 3 3 ASN HB2 H 1 2.865 0.020 . 2 . . . B 3 ASN HB2 . 25614 1 157 . 2 2 3 3 ASN HB3 H 1 2.781 0.020 . 2 . . . B 3 ASN HB3 . 25614 1 158 . 2 2 3 3 ASN CA C 13 53.584 0.200 . 1 . . . B 3 ASN CA . 25614 1 159 . 2 2 3 3 ASN CB C 13 38.168 0.200 . 1 . . . B 3 ASN CB . 25614 1 160 . 2 2 4 4 GLN H H 1 8.125 0.020 . 1 . . . B 4 GLN H . 25614 1 161 . 2 2 4 4 GLN HA H 1 4.549 0.020 . 1 . . . B 4 GLN HA . 25614 1 162 . 2 2 4 4 GLN HB2 H 1 1.986 0.020 . 2 . . . B 4 GLN HB2 . 25614 1 163 . 2 2 4 4 GLN HB3 H 1 2.110 0.020 . 2 . . . B 4 GLN HB3 . 25614 1 164 . 2 2 4 4 GLN HG2 H 1 2.247 0.020 . 2 . . . B 4 GLN HG2 . 25614 1 165 . 2 2 4 4 GLN HG3 H 1 2.160 0.020 . 2 . . . B 4 GLN HG3 . 25614 1 166 . 2 2 4 4 GLN HE21 H 1 6.854 0.020 . 2 . . . B 4 GLN HE21 . 25614 1 167 . 2 2 4 4 GLN HE22 H 1 7.419 0.020 . 2 . . . B 4 GLN HE22 . 25614 1 168 . 2 2 4 4 GLN CA C 13 54.712 0.200 . 1 . . . B 4 GLN CA . 25614 1 169 . 2 2 4 4 GLN CG C 13 32.983 0.200 . 1 . . . B 4 GLN CG . 25614 1 170 . 2 2 5 5 HIS H H 1 8.471 0.020 . 1 . . . B 5 HIS H . 25614 1 171 . 2 2 5 5 HIS HA H 1 4.384 0.020 . 1 . . . B 5 HIS HA . 25614 1 172 . 2 2 5 5 HIS HB2 H 1 3.456 0.020 . 2 . . . B 5 HIS HB2 . 25614 1 173 . 2 2 5 5 HIS HB3 H 1 3.069 0.020 . 2 . . . B 5 HIS HB3 . 25614 1 174 . 2 2 5 5 HIS HD2 H 1 6.874 0.020 . 1 . . . B 5 HIS HD2 . 25614 1 175 . 2 2 5 5 HIS HE1 H 1 7.710 0.020 . 1 . . . B 5 HIS HE1 . 25614 1 176 . 2 2 5 5 HIS CA C 13 58.249 0.200 . 1 . . . B 5 HIS CA . 25614 1 177 . 2 2 6 6 LEU H H 1 9.034 0.020 . 1 . . . B 6 LEU H . 25614 1 178 . 2 2 6 6 LEU HA H 1 4.602 0.020 . 1 . . . B 6 LEU HA . 25614 1 179 . 2 2 6 6 LEU HB2 H 1 1.811 0.020 . 2 . . . B 6 LEU HB2 . 25614 1 180 . 2 2 6 6 LEU HB3 H 1 0.867 0.020 . 2 . . . B 6 LEU HB3 . 25614 1 181 . 2 2 6 6 LEU HG H 1 1.703 0.020 . 1 . . . B 6 LEU HG . 25614 1 182 . 2 2 6 6 LEU HD11 H 1 0.942 0.020 . 1 . . . B 6 LEU HD11 . 25614 1 183 . 2 2 6 6 LEU HD12 H 1 0.942 0.020 . 1 . . . B 6 LEU HD12 . 25614 1 184 . 2 2 6 6 LEU HD13 H 1 0.942 0.020 . 1 . . . B 6 LEU HD13 . 25614 1 185 . 2 2 6 6 LEU HD21 H 1 0.799 0.020 . 1 . . . B 6 LEU HD21 . 25614 1 186 . 2 2 6 6 LEU HD22 H 1 0.799 0.020 . 1 . . . B 6 LEU HD22 . 25614 1 187 . 2 2 6 6 LEU HD23 H 1 0.799 0.020 . 1 . . . B 6 LEU HD23 . 25614 1 188 . 2 2 6 6 LEU CB C 13 44.590 0.200 . 1 . . . B 6 LEU CB . 25614 1 189 . 2 2 7 7 CYS H H 1 8.585 0.020 . 1 . . . B 7 CYS H . 25614 1 190 . 2 2 7 7 CYS HA H 1 5.005 0.020 . 1 . . . B 7 CYS HA . 25614 1 191 . 2 2 7 7 CYS HB2 H 1 3.287 0.020 . 2 . . . B 7 CYS HB2 . 25614 1 192 . 2 2 7 7 CYS HB3 H 1 3.035 0.020 . 2 . . . B 7 CYS HB3 . 25614 1 193 . 2 2 7 7 CYS CB C 13 47.119 0.200 . 1 . . . B 7 CYS CB . 25614 1 194 . 2 2 8 8 GLY HA2 H 1 4.022 0.020 . 2 . . . B 8 GLY HA2 . 25614 1 195 . 2 2 8 8 GLY HA3 H 1 3.842 0.020 . 2 . . . B 8 GLY HA3 . 25614 1 196 . 2 2 8 8 GLY CA C 13 46.629 0.200 . 1 . . . B 8 GLY CA . 25614 1 197 . 2 2 9 9 SER HA H 1 4.141 0.020 . 1 . . . B 9 SER HA . 25614 1 198 . 2 2 9 9 SER HB2 H 1 3.957 0.020 . 2 . . . B 9 SER HB2 . 25614 1 199 . 2 2 9 9 SER HB3 H 1 3.928 0.020 . 2 . . . B 9 SER HB3 . 25614 1 200 . 2 2 9 9 SER CA C 13 61.176 0.200 . 1 . . . B 9 SER CA . 25614 1 201 . 2 2 9 9 SER CB C 13 62.488 0.200 . 1 . . . B 9 SER CB . 25614 1 202 . 2 2 10 10 HIS H H 1 7.872 0.020 . 1 . . . B 10 HIS H . 25614 1 203 . 2 2 10 10 HIS HA H 1 4.494 0.020 . 1 . . . B 10 HIS HA . 25614 1 204 . 2 2 10 10 HIS HB2 H 1 3.390 0.020 . 2 . . . B 10 HIS HB2 . 25614 1 205 . 2 2 10 10 HIS HB3 H 1 3.230 0.020 . 2 . . . B 10 HIS HB3 . 25614 1 206 . 2 2 10 10 HIS HD2 H 1 7.213 0.020 . 1 . . . B 10 HIS HD2 . 25614 1 207 . 2 2 10 10 HIS HE1 H 1 7.838 0.020 . 1 . . . B 10 HIS HE1 . 25614 1 208 . 2 2 10 10 HIS CA C 13 58.287 0.200 . 1 . . . B 10 HIS CA . 25614 1 209 . 2 2 10 10 HIS CB C 13 30.318 0.200 . 1 . . . B 10 HIS CB . 25614 1 210 . 2 2 11 11 LEU H H 1 7.051 0.020 . 1 . . . B 11 LEU H . 25614 1 211 . 2 2 11 11 LEU HA H 1 4.030 0.020 . 1 . . . B 11 LEU HA . 25614 1 212 . 2 2 11 11 LEU HB2 H 1 1.813 0.020 . 2 . . . B 11 LEU HB2 . 25614 1 213 . 2 2 11 11 LEU HB3 H 1 1.284 0.020 . 2 . . . B 11 LEU HB3 . 25614 1 214 . 2 2 11 11 LEU HG H 1 1.286 0.020 . 1 . . . B 11 LEU HG . 25614 1 215 . 2 2 11 11 LEU HD11 H 1 0.778 0.020 . 1 . . . B 11 LEU HD11 . 25614 1 216 . 2 2 11 11 LEU HD12 H 1 0.778 0.020 . 1 . . . B 11 LEU HD12 . 25614 1 217 . 2 2 11 11 LEU HD13 H 1 0.778 0.020 . 1 . . . B 11 LEU HD13 . 25614 1 218 . 2 2 11 11 LEU HD21 H 1 0.721 0.020 . 1 . . . B 11 LEU HD21 . 25614 1 219 . 2 2 11 11 LEU HD22 H 1 0.721 0.020 . 1 . . . B 11 LEU HD22 . 25614 1 220 . 2 2 11 11 LEU HD23 H 1 0.721 0.020 . 1 . . . B 11 LEU HD23 . 25614 1 221 . 2 2 11 11 LEU CA C 13 57.668 0.200 . 1 . . . B 11 LEU CA . 25614 1 222 . 2 2 11 11 LEU CB C 13 40.314 0.200 . 1 . . . B 11 LEU CB . 25614 1 223 . 2 2 11 11 LEU CD1 C 13 22.841 0.200 . 2 . . . B 11 LEU CD1 . 25614 1 224 . 2 2 12 12 VAL H H 1 7.042 0.020 . 1 . . . B 12 VAL H . 25614 1 225 . 2 2 12 12 VAL HA H 1 3.248 0.020 . 1 . . . B 12 VAL HA . 25614 1 226 . 2 2 12 12 VAL HB H 1 2.136 0.020 . 1 . . . B 12 VAL HB . 25614 1 227 . 2 2 12 12 VAL HG11 H 1 1.062 0.020 . 1 . . . B 12 VAL HG11 . 25614 1 228 . 2 2 12 12 VAL HG12 H 1 1.062 0.020 . 1 . . . B 12 VAL HG12 . 25614 1 229 . 2 2 12 12 VAL HG13 H 1 1.062 0.020 . 1 . . . B 12 VAL HG13 . 25614 1 230 . 2 2 12 12 VAL HG21 H 1 0.919 0.020 . 1 . . . B 12 VAL HG21 . 25614 1 231 . 2 2 12 12 VAL HG22 H 1 0.919 0.020 . 1 . . . B 12 VAL HG22 . 25614 1 232 . 2 2 12 12 VAL HG23 H 1 0.919 0.020 . 1 . . . B 12 VAL HG23 . 25614 1 233 . 2 2 12 12 VAL CA C 13 66.708 0.200 . 1 . . . B 12 VAL CA . 25614 1 234 . 2 2 13 13 GLU H H 1 7.948 0.020 . 1 . . . B 13 GLU H . 25614 1 235 . 2 2 13 13 GLU HA H 1 4.132 0.020 . 1 . . . B 13 GLU HA . 25614 1 236 . 2 2 13 13 GLU HB2 H 1 2.142 0.020 . 2 . . . B 13 GLU HB2 . 25614 1 237 . 2 2 13 13 GLU HB3 H 1 2.142 0.020 . 2 . . . B 13 GLU HB3 . 25614 1 238 . 2 2 13 13 GLU HG2 H 1 2.362 0.020 . 2 . . . B 13 GLU HG2 . 25614 1 239 . 2 2 13 13 GLU HG3 H 1 2.507 0.020 . 2 . . . B 13 GLU HG3 . 25614 1 240 . 2 2 13 13 GLU CA C 13 59.442 0.200 . 1 . . . B 13 GLU CA . 25614 1 241 . 2 2 13 13 GLU CG C 13 36.500 0.200 . 1 . . . B 13 GLU CG . 25614 1 242 . 2 2 14 14 ALA H H 1 7.629 0.020 . 1 . . . B 14 ALA H . 25614 1 243 . 2 2 14 14 ALA HA H 1 4.093 0.020 . 1 . . . B 14 ALA HA . 25614 1 244 . 2 2 14 14 ALA HB1 H 1 1.424 0.020 . 1 . . . B 14 ALA HB1 . 25614 1 245 . 2 2 14 14 ALA HB2 H 1 1.424 0.020 . 1 . . . B 14 ALA HB2 . 25614 1 246 . 2 2 14 14 ALA HB3 H 1 1.424 0.020 . 1 . . . B 14 ALA HB3 . 25614 1 247 . 2 2 14 14 ALA CA C 13 55.059 0.200 . 1 . . . B 14 ALA CA . 25614 1 248 . 2 2 15 15 LEU H H 1 8.067 0.020 . 1 . . . B 15 LEU H . 25614 1 249 . 2 2 15 15 LEU HA H 1 3.783 0.020 . 1 . . . B 15 LEU HA . 25614 1 250 . 2 2 15 15 LEU HB2 H 1 1.053 0.020 . 2 . . . B 15 LEU HB2 . 25614 1 251 . 2 2 15 15 LEU HB3 H 1 0.252 0.020 . 2 . . . B 15 LEU HB3 . 25614 1 252 . 2 2 15 15 LEU HG H 1 1.388 0.020 . 1 . . . B 15 LEU HG . 25614 1 253 . 2 2 15 15 LEU HD11 H 1 0.598 0.020 . 1 . . . B 15 LEU HD11 . 25614 1 254 . 2 2 15 15 LEU HD12 H 1 0.598 0.020 . 1 . . . B 15 LEU HD12 . 25614 1 255 . 2 2 15 15 LEU HD13 H 1 0.598 0.020 . 1 . . . B 15 LEU HD13 . 25614 1 256 . 2 2 15 15 LEU HD21 H 1 0.242 0.020 . 1 . . . B 15 LEU HD21 . 25614 1 257 . 2 2 15 15 LEU HD22 H 1 0.242 0.020 . 1 . . . B 15 LEU HD22 . 25614 1 258 . 2 2 15 15 LEU HD23 H 1 0.242 0.020 . 1 . . . B 15 LEU HD23 . 25614 1 259 . 2 2 15 15 LEU CA C 13 57.604 0.200 . 1 . . . B 15 LEU CA . 25614 1 260 . 2 2 15 15 LEU CB C 13 40.215 0.200 . 1 . . . B 15 LEU CB . 25614 1 261 . 2 2 15 15 LEU CD1 C 13 23.981 0.200 . 2 . . . B 15 LEU CD1 . 25614 1 262 . 2 2 16 16 TYR H H 1 8.180 0.020 . 1 . . . B 16 TYR H . 25614 1 263 . 2 2 16 16 TYR HA H 1 4.477 0.020 . 1 . . . B 16 TYR HA . 25614 1 264 . 2 2 16 16 TYR HB2 H 1 3.216 0.020 . 2 . . . B 16 TYR HB2 . 25614 1 265 . 2 2 16 16 TYR HB3 H 1 3.216 0.020 . 2 . . . B 16 TYR HB3 . 25614 1 266 . 2 2 16 16 TYR HD1 H 1 7.351 0.020 . 3 . . . B 16 TYR HD1 . 25614 1 267 . 2 2 16 16 TYR HD2 H 1 7.351 0.020 . 3 . . . B 16 TYR HD2 . 25614 1 268 . 2 2 16 16 TYR HE1 H 1 6.887 0.020 . 3 . . . B 16 TYR HE1 . 25614 1 269 . 2 2 16 16 TYR HE2 H 1 6.887 0.020 . 3 . . . B 16 TYR HE2 . 25614 1 270 . 2 2 16 16 TYR CA C 13 61.890 0.200 . 1 . . . B 16 TYR CA . 25614 1 271 . 2 2 16 16 TYR CB C 13 37.868 0.200 . 1 . . . B 16 TYR CB . 25614 1 272 . 2 2 17 17 LEU H H 1 7.580 0.020 . 1 . . . B 17 LEU H . 25614 1 273 . 2 2 17 17 LEU HA H 1 4.178 0.020 . 1 . . . B 17 LEU HA . 25614 1 274 . 2 2 17 17 LEU HB2 H 1 1.987 0.020 . 2 . . . B 17 LEU HB2 . 25614 1 275 . 2 2 17 17 LEU HB3 H 1 1.787 0.020 . 2 . . . B 17 LEU HB3 . 25614 1 276 . 2 2 17 17 LEU HG H 1 1.849 0.020 . 1 . . . B 17 LEU HG . 25614 1 277 . 2 2 17 17 LEU HD11 H 1 1.000 0.020 . 1 . . . B 17 LEU HD11 . 25614 1 278 . 2 2 17 17 LEU HD12 H 1 1.000 0.020 . 1 . . . B 17 LEU HD12 . 25614 1 279 . 2 2 17 17 LEU HD13 H 1 1.000 0.020 . 1 . . . B 17 LEU HD13 . 25614 1 280 . 2 2 17 17 LEU CA C 13 57.598 0.200 . 1 . . . B 17 LEU CA . 25614 1 281 . 2 2 18 18 VAL H H 1 8.534 0.020 . 1 . . . B 18 VAL H . 25614 1 282 . 2 2 18 18 VAL HA H 1 3.788 0.020 . 1 . . . B 18 VAL HA . 25614 1 283 . 2 2 18 18 VAL HB H 1 2.006 0.020 . 1 . . . B 18 VAL HB . 25614 1 284 . 2 2 18 18 VAL HG11 H 1 1.024 0.020 . 1 . . . B 18 VAL HG11 . 25614 1 285 . 2 2 18 18 VAL HG12 H 1 1.024 0.020 . 1 . . . B 18 VAL HG12 . 25614 1 286 . 2 2 18 18 VAL HG13 H 1 1.024 0.020 . 1 . . . B 18 VAL HG13 . 25614 1 287 . 2 2 18 18 VAL HG21 H 1 0.901 0.020 . 1 . . . B 18 VAL HG21 . 25614 1 288 . 2 2 18 18 VAL HG22 H 1 0.901 0.020 . 1 . . . B 18 VAL HG22 . 25614 1 289 . 2 2 18 18 VAL HG23 H 1 0.901 0.020 . 1 . . . B 18 VAL HG23 . 25614 1 290 . 2 2 18 18 VAL CA C 13 65.608 0.200 . 1 . . . B 18 VAL CA . 25614 1 291 . 2 2 18 18 VAL CB C 13 31.773 0.200 . 1 . . . B 18 VAL CB . 25614 1 292 . 2 2 19 19 CYS H H 1 8.828 0.020 . 1 . . . B 19 CYS H . 25614 1 293 . 2 2 19 19 CYS HA H 1 4.874 0.020 . 1 . . . B 19 CYS HA . 25614 1 294 . 2 2 19 19 CYS HB2 H 1 3.337 0.020 . 2 . . . B 19 CYS HB2 . 25614 1 295 . 2 2 19 19 CYS HB3 H 1 2.957 0.020 . 2 . . . B 19 CYS HB3 . 25614 1 296 . 2 2 19 19 CYS CB C 13 36.357 0.200 . 1 . . . B 19 CYS CB . 25614 1 297 . 2 2 20 20 GLY H H 1 7.738 0.020 . 1 . . . B 20 GLY H . 25614 1 298 . 2 2 20 20 GLY HA2 H 1 4.054 0.020 . 2 . . . B 20 GLY HA2 . 25614 1 299 . 2 2 20 20 GLY HA3 H 1 3.958 0.020 . 2 . . . B 20 GLY HA3 . 25614 1 300 . 2 2 20 20 GLY CA C 13 46.863 0.200 . 1 . . . B 20 GLY CA . 25614 1 301 . 2 2 22 22 ARG H H 1 8.186 0.020 . 1 . . . B 22 ARG H . 25614 1 302 . 2 2 22 22 ARG HA H 1 4.218 0.020 . 1 . . . B 22 ARG HA . 25614 1 303 . 2 2 22 22 ARG HB2 H 1 2.216 0.020 . 2 . . . B 22 ARG HB2 . 25614 1 304 . 2 2 22 22 ARG HB3 H 1 2.122 0.020 . 2 . . . B 22 ARG HB3 . 25614 1 305 . 2 2 22 22 ARG HG2 H 1 1.931 0.020 . 2 . . . B 22 ARG HG2 . 25614 1 306 . 2 2 22 22 ARG HG3 H 1 1.925 0.020 . 2 . . . B 22 ARG HG3 . 25614 1 307 . 2 2 22 22 ARG HD2 H 1 3.375 0.020 . 2 . . . B 22 ARG HD2 . 25614 1 308 . 2 2 22 22 ARG HD3 H 1 3.434 0.020 . 2 . . . B 22 ARG HD3 . 25614 1 309 . 2 2 22 22 ARG CA C 13 58.115 0.200 . 1 . . . B 22 ARG CA . 25614 1 310 . 2 2 22 22 ARG CD C 13 44.199 0.200 . 1 . . . B 22 ARG CD . 25614 1 311 . 2 2 23 23 GLY H H 1 7.362 0.020 . 1 . . . B 23 GLY H . 25614 1 312 . 2 2 23 23 GLY HA2 H 1 4.162 0.020 . 2 . . . B 23 GLY HA2 . 25614 1 313 . 2 2 23 23 GLY HA3 H 1 3.886 0.020 . 2 . . . B 23 GLY HA3 . 25614 1 314 . 2 2 23 23 GLY CA C 13 44.577 0.200 . 1 . . . B 23 GLY CA . 25614 1 315 . 2 2 24 24 PHE H H 1 7.674 0.020 . 1 . . . B 24 PHE H . 25614 1 316 . 2 2 24 24 PHE HA H 1 5.112 0.020 . 1 . . . B 24 PHE HA . 25614 1 317 . 2 2 24 24 PHE HB2 H 1 3.373 0.020 . 2 . . . B 24 PHE HB2 . 25614 1 318 . 2 2 24 24 PHE HB3 H 1 2.974 0.020 . 2 . . . B 24 PHE HB3 . 25614 1 319 . 2 2 24 24 PHE HD1 H 1 6.826 0.020 . 3 . . . B 24 PHE HD1 . 25614 1 320 . 2 2 24 24 PHE HD2 H 1 6.826 0.020 . 3 . . . B 24 PHE HD2 . 25614 1 321 . 2 2 24 24 PHE HE1 H 1 6.963 0.020 . 3 . . . B 24 PHE HE1 . 25614 1 322 . 2 2 24 24 PHE HE2 H 1 6.963 0.020 . 3 . . . B 24 PHE HE2 . 25614 1 323 . 2 2 24 24 PHE CB C 13 41.757 0.200 . 1 . . . B 24 PHE CB . 25614 1 324 . 2 2 25 25 PHE H H 1 8.686 0.020 . 1 . . . B 25 PHE H . 25614 1 325 . 2 2 25 25 PHE HA H 1 4.763 0.020 . 1 . . . B 25 PHE HA . 25614 1 326 . 2 2 25 25 PHE HB2 H 1 3.219 0.020 . 2 . . . B 25 PHE HB2 . 25614 1 327 . 2 2 25 25 PHE HB3 H 1 3.219 0.020 . 2 . . . B 25 PHE HB3 . 25614 1 328 . 2 2 25 25 PHE HD1 H 1 7.329 0.020 . 3 . . . B 25 PHE HD1 . 25614 1 329 . 2 2 25 25 PHE HD2 H 1 7.329 0.020 . 3 . . . B 25 PHE HD2 . 25614 1 330 . 2 2 25 25 PHE HE1 H 1 7.393 0.020 . 3 . . . B 25 PHE HE1 . 25614 1 331 . 2 2 25 25 PHE HE2 H 1 7.393 0.020 . 3 . . . B 25 PHE HE2 . 25614 1 332 . 2 2 25 25 PHE CB C 13 39.920 0.200 . 1 . . . B 25 PHE CB . 25614 1 333 . 2 2 26 26 NVA CB C 13 32.254 0.200 . 1 . . . B 26 NVA CB . 25614 1 334 . 2 2 26 26 NVA CD C 13 52.583 0.200 . 1 . . . B 26 NVA CD . 25614 1 335 . 2 2 26 26 NVA H H 1 8.034 0.020 . 1 . . . B 26 NVA H . 25614 1 336 . 2 2 26 26 NVA HA H 1 4.513 0.020 . 1 . . . B 26 NVA HA . 25614 1 337 . 2 2 26 26 NVA HD2 H 1 4.345 0.020 . 1 . . . B 26 NVA HD2 . 25614 1 338 . 2 2 26 26 NVA HD3 H 1 4.219 0.020 . 1 . . . B 26 NVA HD3 . 25614 1 339 . 2 2 26 26 NVA HG2 H 1 2.230 0.020 . 1 . . . B 26 NVA HG2 . 25614 1 340 . 2 2 26 26 NVA CB C 13 1.872 0.020 . 1 . . . B 26 NVA CB . 25614 1 341 . 2 2 27 27 THR H H 1 7.923 0.020 . 1 . . . B 27 THR H . 25614 1 342 . 2 2 27 27 THR HA H 1 4.355 0.020 . 1 . . . B 27 THR HA . 25614 1 343 . 2 2 27 27 THR HB H 1 4.415 0.020 . 1 . . . B 27 THR HB . 25614 1 344 . 2 2 27 27 THR HG21 H 1 1.335 0.020 . 1 . . . B 27 THR HG21 . 25614 1 345 . 2 2 27 27 THR HG22 H 1 1.335 0.020 . 1 . . . B 27 THR HG22 . 25614 1 346 . 2 2 27 27 THR HG23 H 1 1.335 0.020 . 1 . . . B 27 THR HG23 . 25614 1 347 . 2 2 27 27 THR CA C 13 61.172 0.200 . 1 . . . B 27 THR CA . 25614 1 348 . 2 2 27 27 THR CB C 13 67.072 0.200 . 1 . . . B 27 THR CB . 25614 1 349 . 2 2 28 28 PRO HA H 1 4.130 0.020 . 1 . . . B 28 PRO HA . 25614 1 350 . 2 2 28 28 PRO HB2 H 1 2.331 0.020 . 2 . . . B 28 PRO HB2 . 25614 1 351 . 2 2 28 28 PRO HB3 H 1 1.884 0.020 . 2 . . . B 28 PRO HB3 . 25614 1 352 . 2 2 28 28 PRO HG2 H 1 2.172 0.020 . 2 . . . B 28 PRO HG2 . 25614 1 353 . 2 2 28 28 PRO HG3 H 1 1.988 0.020 . 2 . . . B 28 PRO HG3 . 25614 1 354 . 2 2 28 28 PRO HD2 H 1 3.779 0.020 . 2 . . . B 28 PRO HD2 . 25614 1 355 . 2 2 28 28 PRO HD3 H 1 3.583 0.020 . 2 . . . B 28 PRO HD3 . 25614 1 356 . 2 2 28 28 PRO CA C 13 64.811 0.200 . 1 . . . B 28 PRO CA . 25614 1 357 . 2 2 28 28 PRO CB C 13 31.642 0.200 . 1 . . . B 28 PRO CB . 25614 1 358 . 2 2 28 28 PRO CD C 13 49.932 0.200 . 1 . . . B 28 PRO CD . 25614 1 359 . 2 2 29 29 HIX CB C 13 29.349 0.200 . 1 . . . B 29 HIX CB . 25614 1 360 . 2 2 29 29 HIX HA H 1 4.616 0.020 . 1 . . . B 29 HIX HA . 25614 1 361 . 2 2 29 29 HIX HB2 H 1 3.425 0.020 . 1 . . . B 29 HIX HB2 . 25614 1 362 . 2 2 29 29 HIX HB1 H 1 3.159 0.020 . 1 . . . B 29 HIX HB1 . 25614 1 363 . 2 2 29 29 HIX HD2 H 1 8.093 0.020 . 1 . . . B 29 HIX HD2 . 25614 1 364 . 2 2 30 30 THR H H 1 7.877 0.020 . 1 . . . B 30 THR H . 25614 1 365 . 2 2 30 30 THR HA H 1 4.250 0.020 . 1 . . . B 30 THR HA . 25614 1 366 . 2 2 30 30 THR HB H 1 4.347 0.020 . 1 . . . B 30 THR HB . 25614 1 367 . 2 2 30 30 THR HG21 H 1 1.220 0.020 . 1 . . . B 30 THR HG21 . 25614 1 368 . 2 2 30 30 THR HG22 H 1 1.220 0.020 . 1 . . . B 30 THR HG22 . 25614 1 369 . 2 2 30 30 THR HG23 H 1 1.220 0.020 . 1 . . . B 30 THR HG23 . 25614 1 370 . 2 2 30 30 THR CA C 13 62.875 0.200 . 1 . . . B 30 THR CA . 25614 1 371 . 2 2 30 30 THR CB C 13 70.797 0.200 . 1 . . . B 30 THR CB . 25614 1 stop_ save_