################################### # 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 30592 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H COSY' . . . 30592 1 2 '2D 1H-1H TOCSY' . . . 30592 1 3 '2D 1H-1H NOESY' . . . 30592 1 4 '2D 1H-15N HSQC' . . . 30592 1 5 '2D 1H-13C HSQC' . . . 30592 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 2 2 ASN HD21 H 1 7.5692 0.0000 . 2 . . . . A 2 ASN HD21 . 30592 1 2 . 1 . 1 2 2 ASN HD22 H 1 6.9287 0.0000 . 2 . . . . A 2 ASN HD22 . 30592 1 3 . 1 . 1 2 2 ASN ND2 N 15 112.8035 0.0000 . 1 . . . . A 2 ASN ND2 . 30592 1 4 . 1 . 1 3 3 LYS H H 1 8.9607 0.0000 . 1 . . . . A 3 LYS H . 30592 1 5 . 1 . 1 3 3 LYS HA H 1 3.8063 0.0000 . 1 . . . . A 3 LYS HA . 30592 1 6 . 1 . 1 3 3 LYS HB2 H 1 1.8470 0.0000 . 2 . . . . A 3 LYS HB2 . 30592 1 7 . 1 . 1 3 3 LYS HG2 H 1 1.3888 0.0000 . 2 . . . . A 3 LYS HG2 . 30592 1 8 . 1 . 1 3 3 LYS HG3 H 1 1.3049 0.0000 . 2 . . . . A 3 LYS HG3 . 30592 1 9 . 1 . 1 3 3 LYS HD2 H 1 1.6608 0.0000 . 2 . . . . A 3 LYS HD2 . 30592 1 10 . 1 . 1 3 3 LYS HE2 H 1 2.7658 0.0000 . 2 . . . . A 3 LYS HE2 . 30592 1 11 . 1 . 1 3 3 LYS HE3 H 1 2.8587 0.0000 . 2 . . . . A 3 LYS HE3 . 30592 1 12 . 1 . 1 3 3 LYS CG C 13 25.3570 0.0000 . 1 . . . . A 3 LYS CG . 30592 1 13 . 1 . 1 3 3 LYS CE C 13 41.6256 0.0000 . 1 . . . . A 3 LYS CE . 30592 1 14 . 1 . 1 3 3 LYS N N 15 122.6311 0.0000 . 1 . . . . A 3 LYS N . 30592 1 15 . 1 . 1 4 4 GLU H H 1 9.0454 0.0000 . 1 . . . . A 4 GLU H . 30592 1 16 . 1 . 1 4 4 GLU HA H 1 3.9067 0.0000 . 1 . . . . A 4 GLU HA . 30592 1 17 . 1 . 1 4 4 GLU HB2 H 1 2.0160 0.0000 . 2 . . . . A 4 GLU HB2 . 30592 1 18 . 1 . 1 4 4 GLU HB3 H 1 1.9683 0.0000 . 2 . . . . A 4 GLU HB3 . 30592 1 19 . 1 . 1 4 4 GLU HG2 H 1 2.2905 0.0000 . 2 . . . . A 4 GLU HG2 . 30592 1 20 . 1 . 1 4 4 GLU HG3 H 1 2.2276 0.0000 . 2 . . . . A 4 GLU HG3 . 30592 1 21 . 1 . 1 4 4 GLU CA C 13 60.4325 0.0000 . 1 . . . . A 4 GLU CA . 30592 1 22 . 1 . 1 4 4 GLU CB C 13 32.1108 0.0000 . 1 . . . . A 4 GLU CB . 30592 1 23 . 1 . 1 4 4 GLU CG C 13 36.7596 0.0000 . 1 . . . . A 4 GLU CG . 30592 1 24 . 1 . 1 4 4 GLU N N 15 117.5479 0.0000 . 1 . . . . A 4 GLU N . 30592 1 25 . 1 . 1 5 5 HIS H H 1 7.7314 0.0000 . 1 . . . . A 5 HIS H . 30592 1 26 . 1 . 1 5 5 HIS HA H 1 4.3693 0.0000 . 1 . . . . A 5 HIS HA . 30592 1 27 . 1 . 1 5 5 HIS HB2 H 1 3.2711 0.0000 . 2 . . . . A 5 HIS HB2 . 30592 1 28 . 1 . 1 5 5 HIS HD2 H 1 7.0485 0.0000 . 1 . . . . A 5 HIS HD2 . 30592 1 29 . 1 . 1 5 5 HIS HE1 H 1 7.9077 0.0000 . 1 . . . . A 5 HIS HE1 . 30592 1 30 . 1 . 1 5 5 HIS CA C 13 58.2311 0.0000 . 1 . . . . A 5 HIS CA . 30592 1 31 . 1 . 1 5 5 HIS CB C 13 30.6290 0.0000 . 1 . . . . A 5 HIS CB . 30592 1 32 . 1 . 1 5 5 HIS N N 15 118.7994 0.0000 . 1 . . . . A 5 HIS N . 30592 1 33 . 1 . 1 6 6 ILE H H 1 7.4875 0.0000 . 1 . . . . A 6 ILE H . 30592 1 34 . 1 . 1 6 6 ILE HA H 1 3.8632 0.0000 . 1 . . . . A 6 ILE HA . 30592 1 35 . 1 . 1 6 6 ILE HB H 1 1.9575 0.0000 . 1 . . . . A 6 ILE HB . 30592 1 36 . 1 . 1 6 6 ILE HG12 H 1 0.9445 0.0000 . 2 . . . . A 6 ILE HG12 . 30592 1 37 . 1 . 1 6 6 ILE HG21 H 1 1.0981 0.0000 . 1 . . . . A 6 ILE HG21 . 30592 1 38 . 1 . 1 6 6 ILE HG22 H 1 1.0981 0.0000 . 1 . . . . A 6 ILE HG22 . 30592 1 39 . 1 . 1 6 6 ILE HG23 H 1 1.0981 0.0000 . 1 . . . . A 6 ILE HG23 . 30592 1 40 . 1 . 1 6 6 ILE HD11 H 1 0.6977 0.0000 . 1 . . . . A 6 ILE HD11 . 30592 1 41 . 1 . 1 6 6 ILE HD12 H 1 0.6977 0.0000 . 1 . . . . A 6 ILE HD12 . 30592 1 42 . 1 . 1 6 6 ILE HD13 H 1 0.6977 0.0000 . 1 . . . . A 6 ILE HD13 . 30592 1 43 . 1 . 1 6 6 ILE CA C 13 65.6079 0.0000 . 1 . . . . A 6 ILE CA . 30592 1 44 . 1 . 1 6 6 ILE CB C 13 38.7852 0.0000 . 1 . . . . A 6 ILE CB . 30592 1 45 . 1 . 1 6 6 ILE CG1 C 13 25.5051 0.0000 . 1 . . . . A 6 ILE CG1 . 30592 1 46 . 1 . 1 6 6 ILE CG2 C 13 18.8875 0.0000 . 1 . . . . A 6 ILE CG2 . 30592 1 47 . 1 . 1 6 6 ILE CD1 C 13 15.6558 0.0000 . 1 . . . . A 6 ILE CD1 . 30592 1 48 . 1 . 1 6 6 ILE N N 15 120.6438 0.0000 . 1 . . . . A 6 ILE N . 30592 1 49 . 1 . 1 7 7 LEU H H 1 8.4294 0.0000 . 1 . . . . A 7 LEU H . 30592 1 50 . 1 . 1 7 7 LEU HA H 1 4.1748 0.0000 . 1 . . . . A 7 LEU HA . 30592 1 51 . 1 . 1 7 7 LEU HB2 H 1 1.7706 0.0000 . 2 . . . . A 7 LEU HB2 . 30592 1 52 . 1 . 1 7 7 LEU HB3 H 1 1.4303 0.0000 . 2 . . . . A 7 LEU HB3 . 30592 1 53 . 1 . 1 7 7 LEU HG H 1 1.7225 0.0000 . 1 . . . . A 7 LEU HG . 30592 1 54 . 1 . 1 7 7 LEU HD11 H 1 0.8708 0.0000 . 2 . . . . A 7 LEU HD11 . 30592 1 55 . 1 . 1 7 7 LEU HD12 H 1 0.8708 0.0000 . 2 . . . . A 7 LEU HD12 . 30592 1 56 . 1 . 1 7 7 LEU HD13 H 1 0.8708 0.0000 . 2 . . . . A 7 LEU HD13 . 30592 1 57 . 1 . 1 7 7 LEU HD21 H 1 0.8389 0.0000 . 2 . . . . A 7 LEU HD21 . 30592 1 58 . 1 . 1 7 7 LEU HD22 H 1 0.8389 0.0000 . 2 . . . . A 7 LEU HD22 . 30592 1 59 . 1 . 1 7 7 LEU HD23 H 1 0.8389 0.0000 . 2 . . . . A 7 LEU HD23 . 30592 1 60 . 1 . 1 7 7 LEU CA C 13 57.3347 0.0000 . 1 . . . . A 7 LEU CA . 30592 1 61 . 1 . 1 7 7 LEU CB C 13 41.6463 0.0000 . 1 . . . . A 7 LEU CB . 30592 1 62 . 1 . 1 7 7 LEU CG C 13 27.2094 0.0000 . 1 . . . . A 7 LEU CG . 30592 1 63 . 1 . 1 7 7 LEU CD1 C 13 22.8584 0.0000 . 2 . . . . A 7 LEU CD1 . 30592 1 64 . 1 . 1 7 7 LEU CD2 C 13 21.3277 0.0000 . 2 . . . . A 7 LEU CD2 . 30592 1 65 . 1 . 1 7 7 LEU N N 15 118.4701 0.0000 . 1 . . . . A 7 LEU N . 30592 1 66 . 1 . 1 8 8 ALA H H 1 7.5837 0.0000 . 1 . . . . A 8 ALA H . 30592 1 67 . 1 . 1 8 8 ALA HA H 1 4.1508 0.0000 . 1 . . . . A 8 ALA HA . 30592 1 68 . 1 . 1 8 8 ALA HB1 H 1 1.4474 0.0000 . 1 . . . . A 8 ALA HB1 . 30592 1 69 . 1 . 1 8 8 ALA HB2 H 1 1.4474 0.0000 . 1 . . . . A 8 ALA HB2 . 30592 1 70 . 1 . 1 8 8 ALA HB3 H 1 1.4474 0.0000 . 1 . . . . A 8 ALA HB3 . 30592 1 71 . 1 . 1 8 8 ALA CA C 13 56.4212 0.0000 . 1 . . . . A 8 ALA CA . 30592 1 72 . 1 . 1 8 8 ALA CB C 13 17.6056 0.0000 . 1 . . . . A 8 ALA CB . 30592 1 73 . 1 . 1 8 8 ALA N N 15 121.2693 0.0000 . 1 . . . . A 8 ALA N . 30592 1 74 . 1 . 1 9 9 GLN H H 1 7.8082 0.0000 . 1 . . . . A 9 GLN H . 30592 1 75 . 1 . 1 9 9 GLN HA H 1 4.0744 0.0000 . 1 . . . . A 9 GLN HA . 30592 1 76 . 1 . 1 9 9 GLN HB2 H 1 2.2978 0.0000 . 2 . . . . A 9 GLN HB2 . 30592 1 77 . 1 . 1 9 9 GLN HB3 H 1 2.0403 0.0000 . 2 . . . . A 9 GLN HB3 . 30592 1 78 . 1 . 1 9 9 GLN HG2 H 1 2.1047 0.0000 . 2 . . . . A 9 GLN HG2 . 30592 1 79 . 1 . 1 9 9 GLN HG3 H 1 2.4585 0.0000 . 2 . . . . A 9 GLN HG3 . 30592 1 80 . 1 . 1 9 9 GLN HE21 H 1 6.7256 0.0000 . 2 . . . . A 9 GLN HE21 . 30592 1 81 . 1 . 1 9 9 GLN HE22 H 1 6.5294 0.0000 . 2 . . . . A 9 GLN HE22 . 30592 1 82 . 1 . 1 9 9 GLN CA C 13 56.4569 0.0000 . 1 . . . . A 9 GLN CA . 30592 1 83 . 1 . 1 9 9 GLN CB C 13 27.5375 0.0000 . 1 . . . . A 9 GLN CB . 30592 1 84 . 1 . 1 9 9 GLN CG C 13 33.1622 0.0000 . 1 . . . . A 9 GLN CG . 30592 1 85 . 1 . 1 9 9 GLN N N 15 116.0330 0.0000 . 1 . . . . A 9 GLN N . 30592 1 86 . 1 . 1 9 9 GLN NE2 N 15 111.4263 0.0000 . 1 . . . . A 9 GLN NE2 . 30592 1 87 . 1 . 1 10 10 LYS H H 1 7.6786 0.0000 . 1 . . . . A 10 LYS H . 30592 1 88 . 1 . 1 10 10 LYS HA H 1 3.3315 0.0000 . 1 . . . . A 10 LYS HA . 30592 1 89 . 1 . 1 10 10 LYS HG2 H 1 1.3106 0.0000 . 2 . . . . A 10 LYS HG2 . 30592 1 90 . 1 . 1 10 10 LYS HG3 H 1 1.2875 0.0000 . 2 . . . . A 10 LYS HG3 . 30592 1 91 . 1 . 1 10 10 LYS HD2 H 1 1.6581 0.0000 . 2 . . . . A 10 LYS HD2 . 30592 1 92 . 1 . 1 10 10 LYS HE2 H 1 2.7664 0.0000 . 2 . . . . A 10 LYS HE2 . 30592 1 93 . 1 . 1 10 10 LYS HE3 H 1 2.7222 0.0000 . 2 . . . . A 10 LYS HE3 . 30592 1 94 . 1 . 1 10 10 LYS CA C 13 58.8311 0.0000 . 1 . . . . A 10 LYS CA . 30592 1 95 . 1 . 1 10 10 LYS CE C 13 41.8233 0.0000 . 1 . . . . A 10 LYS CE . 30592 1 96 . 1 . 1 11 11 GLU H H 1 6.9591 0.0000 . 1 . . . . A 11 GLU H . 30592 1 97 . 1 . 1 11 11 GLU HA H 1 4.0874 0.0000 . 1 . . . . A 11 GLU HA . 30592 1 98 . 1 . 1 11 11 GLU HB2 H 1 2.1180 0.0000 . 2 . . . . A 11 GLU HB2 . 30592 1 99 . 1 . 1 11 11 GLU HB3 H 1 1.9159 0.0000 . 2 . . . . A 11 GLU HB3 . 30592 1 100 . 1 . 1 11 11 GLU HG2 H 1 2.2917 0.0000 . 2 . . . . A 11 GLU HG2 . 30592 1 101 . 1 . 1 11 11 GLU HG3 H 1 2.1701 0.0000 . 2 . . . . A 11 GLU HG3 . 30592 1 102 . 1 . 1 11 11 GLU CA C 13 56.6667 0.0000 . 1 . . . . A 11 GLU CA . 30592 1 103 . 1 . 1 11 11 GLU CB C 13 30.1694 0.0000 . 1 . . . . A 11 GLU CB . 30592 1 104 . 1 . 1 11 11 GLU CG C 13 35.9870 0.0000 . 1 . . . . A 11 GLU CG . 30592 1 105 . 1 . 1 11 11 GLU N N 15 111.5223 0.0000 . 1 . . . . A 11 GLU N . 30592 1 106 . 1 . 1 12 12 VAL H H 1 7.0752 0.0000 . 1 . . . . A 12 VAL H . 30592 1 107 . 1 . 1 12 12 VAL HA H 1 4.2710 0.0000 . 1 . . . . A 12 VAL HA . 30592 1 108 . 1 . 1 12 12 VAL HB H 1 2.1340 0.0000 . 1 . . . . A 12 VAL HB . 30592 1 109 . 1 . 1 12 12 VAL HG11 H 1 0.8360 0.0000 . 2 . . . . A 12 VAL HG11 . 30592 1 110 . 1 . 1 12 12 VAL HG12 H 1 0.8360 0.0000 . 2 . . . . A 12 VAL HG12 . 30592 1 111 . 1 . 1 12 12 VAL HG13 H 1 0.8360 0.0000 . 2 . . . . A 12 VAL HG13 . 30592 1 112 . 1 . 1 12 12 VAL CA C 13 61.8955 0.0000 . 1 . . . . A 12 VAL CA . 30592 1 113 . 1 . 1 12 12 VAL CB C 13 32.9933 0.0000 . 1 . . . . A 12 VAL CB . 30592 1 114 . 1 . 1 12 12 VAL CG1 C 13 20.4831 0.0000 . 2 . . . . A 12 VAL CG1 . 30592 1 115 . 1 . 1 12 12 VAL N N 15 112.0557 0.0000 . 1 . . . . A 12 VAL N . 30592 1 116 . 1 . 1 13 13 LEU H H 1 7.4772 0.0000 . 1 . . . . A 13 LEU H . 30592 1 117 . 1 . 1 13 13 LEU HA H 1 4.6605 0.0000 . 1 . . . . A 13 LEU HA . 30592 1 118 . 1 . 1 13 13 LEU HB3 H 1 1.5988 0.0000 . 2 . . . . A 13 LEU HB3 . 30592 1 119 . 1 . 1 13 13 LEU HG H 1 1.8207 0.0000 . 1 . . . . A 13 LEU HG . 30592 1 120 . 1 . 1 13 13 LEU HD11 H 1 0.7461 0.0000 . 2 . . . . A 13 LEU HD11 . 30592 1 121 . 1 . 1 13 13 LEU HD12 H 1 0.7461 0.0000 . 2 . . . . A 13 LEU HD12 . 30592 1 122 . 1 . 1 13 13 LEU HD13 H 1 0.7461 0.0000 . 2 . . . . A 13 LEU HD13 . 30592 1 123 . 1 . 1 13 13 LEU HD21 H 1 0.5998 0.0000 . 2 . . . . A 13 LEU HD21 . 30592 1 124 . 1 . 1 13 13 LEU HD22 H 1 0.5998 0.0000 . 2 . . . . A 13 LEU HD22 . 30592 1 125 . 1 . 1 13 13 LEU HD23 H 1 0.5998 0.0000 . 2 . . . . A 13 LEU HD23 . 30592 1 126 . 1 . 1 13 13 LEU CA C 13 53.8344 0.0000 . 1 . . . . A 13 LEU CA . 30592 1 127 . 1 . 1 13 13 LEU CB C 13 44.1135 0.0000 . 1 . . . . A 13 LEU CB . 30592 1 128 . 1 . 1 13 13 LEU CG C 13 26.3247 0.0000 . 1 . . . . A 13 LEU CG . 30592 1 129 . 1 . 1 13 13 LEU CD1 C 13 21.7499 0.0000 . 2 . . . . A 13 LEU CD1 . 30592 1 130 . 1 . 1 13 13 LEU CD2 C 13 25.9728 0.0000 . 2 . . . . A 13 LEU CD2 . 30592 1 131 . 1 . 1 13 13 LEU N N 15 121.6537 0.0000 . 1 . . . . A 13 LEU N . 30592 1 132 . 1 . 1 14 14 THR H H 1 8.6268 0.0000 . 1 . . . . A 14 THR H . 30592 1 133 . 1 . 1 14 14 THR HA H 1 4.5544 0.0000 . 1 . . . . A 14 THR HA . 30592 1 134 . 1 . 1 14 14 THR HB H 1 4.6635 0.0000 . 1 . . . . A 14 THR HB . 30592 1 135 . 1 . 1 14 14 THR HG21 H 1 1.3478 0.0000 . 1 . . . . A 14 THR HG21 . 30592 1 136 . 1 . 1 14 14 THR HG22 H 1 1.3478 0.0000 . 1 . . . . A 14 THR HG22 . 30592 1 137 . 1 . 1 14 14 THR HG23 H 1 1.3478 0.0000 . 1 . . . . A 14 THR HG23 . 30592 1 138 . 1 . 1 14 14 THR CA C 13 60.9784 0.0000 . 1 . . . . A 14 THR CA . 30592 1 139 . 1 . 1 14 14 THR CB C 13 67.8318 0.0000 . 1 . . . . A 14 THR CB . 30592 1 140 . 1 . 1 14 14 THR CG2 C 13 21.9611 0.0000 . 1 . . . . A 14 THR CG2 . 30592 1 141 . 1 . 1 14 14 THR N N 15 113.7543 0.0000 . 1 . . . . A 14 THR N . 30592 1 142 . 1 . 1 15 15 PRO HA H 1 4.2768 0.0000 . 1 . . . . A 15 PRO HA . 30592 1 143 . 1 . 1 15 15 PRO HB2 H 1 2.4462 0.0000 . 2 . . . . A 15 PRO HB2 . 30592 1 144 . 1 . 1 15 15 PRO HG2 H 1 2.1095 0.0000 . 2 . . . . A 15 PRO HG2 . 30592 1 145 . 1 . 1 15 15 PRO HD2 H 1 3.8795 0.0000 . 2 . . . . A 15 PRO HD2 . 30592 1 146 . 1 . 1 15 15 PRO CA C 13 66.9087 0.0000 . 1 . . . . A 15 PRO CA . 30592 1 147 . 1 . 1 15 15 PRO CB C 13 31.8320 0.0000 . 1 . . . . A 15 PRO CB . 30592 1 148 . 1 . 1 15 15 PRO CD C 13 50.0025 0.0000 . 1 . . . . A 15 PRO CD . 30592 1 149 . 1 . 1 16 16 ILE H H 1 7.8609 0.0000 . 1 . . . . A 16 ILE H . 30592 1 150 . 1 . 1 16 16 ILE HA H 1 3.9956 0.0000 . 1 . . . . A 16 ILE HA . 30592 1 151 . 1 . 1 16 16 ILE HB H 1 1.7204 0.0000 . 1 . . . . A 16 ILE HB . 30592 1 152 . 1 . 1 16 16 ILE HG12 H 1 1.3690 0.0000 . 2 . . . . A 16 ILE HG12 . 30592 1 153 . 1 . 1 16 16 ILE HG13 H 1 1.1389 0.0000 . 2 . . . . A 16 ILE HG13 . 30592 1 154 . 1 . 1 16 16 ILE HG21 H 1 0.8314 0.0000 . 1 . . . . A 16 ILE HG21 . 30592 1 155 . 1 . 1 16 16 ILE HG22 H 1 0.8314 0.0000 . 1 . . . . A 16 ILE HG22 . 30592 1 156 . 1 . 1 16 16 ILE HG23 H 1 0.8314 0.0000 . 1 . . . . A 16 ILE HG23 . 30592 1 157 . 1 . 1 16 16 ILE HD11 H 1 0.7939 0.0000 . 1 . . . . A 16 ILE HD11 . 30592 1 158 . 1 . 1 16 16 ILE HD12 H 1 0.7939 0.0000 . 1 . . . . A 16 ILE HD12 . 30592 1 159 . 1 . 1 16 16 ILE HD13 H 1 0.7939 0.0000 . 1 . . . . A 16 ILE HD13 . 30592 1 160 . 1 . 1 16 16 ILE CA C 13 60.5678 0.0000 . 1 . . . . A 16 ILE CA . 30592 1 161 . 1 . 1 16 16 ILE CB C 13 37.6848 0.0000 . 1 . . . . A 16 ILE CB . 30592 1 162 . 1 . 1 16 16 ILE CG1 C 13 29.0008 0.0000 . 1 . . . . A 16 ILE CG1 . 30592 1 163 . 1 . 1 16 16 ILE CG2 C 13 19.7012 0.0000 . 1 . . . . A 16 ILE CG2 . 30592 1 164 . 1 . 1 16 16 ILE CD1 C 13 14.2509 0.0000 . 1 . . . . A 16 ILE CD1 . 30592 1 165 . 1 . 1 16 16 ILE N N 15 116.4768 0.0000 . 1 . . . . A 16 ILE N . 30592 1 166 . 1 . 1 17 17 GLU H H 1 7.3392 0.0000 . 1 . . . . A 17 GLU H . 30592 1 167 . 1 . 1 17 17 GLU HA H 1 4.0093 0.0000 . 1 . . . . A 17 GLU HA . 30592 1 168 . 1 . 1 17 17 GLU HB2 H 1 2.3434 0.0000 . 2 . . . . A 17 GLU HB2 . 30592 1 169 . 1 . 1 17 17 GLU HB3 H 1 2.3165 0.0000 . 2 . . . . A 17 GLU HB3 . 30592 1 170 . 1 . 1 17 17 GLU HG2 H 1 2.2144 0.0000 . 2 . . . . A 17 GLU HG2 . 30592 1 171 . 1 . 1 17 17 GLU HG3 H 1 1.9888 0.0000 . 2 . . . . A 17 GLU HG3 . 30592 1 172 . 1 . 1 17 17 GLU CA C 13 58.8402 0.0000 . 1 . . . . A 17 GLU CA . 30592 1 173 . 1 . 1 17 17 GLU CB C 13 30.7662 0.0000 . 1 . . . . A 17 GLU CB . 30592 1 174 . 1 . 1 17 17 GLU CG C 13 35.9386 0.0000 . 1 . . . . A 17 GLU CG . 30592 1 175 . 1 . 1 17 17 GLU N N 15 121.5240 0.0000 . 1 . . . . A 17 GLU N . 30592 1 176 . 1 . 1 18 18 TYR H H 1 9.1981 0.0000 . 1 . . . . A 18 TYR H . 30592 1 177 . 1 . 1 18 18 TYR HA H 1 4.1823 0.0000 . 1 . . . . A 18 TYR HA . 30592 1 178 . 1 . 1 18 18 TYR HB2 H 1 3.0382 0.0000 . 2 . . . . A 18 TYR HB2 . 30592 1 179 . 1 . 1 18 18 TYR HB3 H 1 2.9794 0.0000 . 2 . . . . A 18 TYR HB3 . 30592 1 180 . 1 . 1 18 18 TYR HD1 H 1 6.9810 0.0000 . 3 . . . . A 18 TYR HD1 . 30592 1 181 . 1 . 1 18 18 TYR HE1 H 1 6.7499 0.0000 . 3 . . . . A 18 TYR HE1 . 30592 1 182 . 1 . 1 18 18 TYR CA C 13 62.0984 0.0000 . 1 . . . . A 18 TYR CA . 30592 1 183 . 1 . 1 18 18 TYR CB C 13 38.4638 0.0000 . 1 . . . . A 18 TYR CB . 30592 1 184 . 1 . 1 18 18 TYR N N 15 122.7942 0.0000 . 1 . . . . A 18 TYR N . 30592 1 185 . 1 . 1 19 19 GLU H H 1 8.1904 0.0000 . 1 . . . . A 19 GLU H . 30592 1 186 . 1 . 1 19 19 GLU HA H 1 3.7873 0.0000 . 1 . . . . A 19 GLU HA . 30592 1 187 . 1 . 1 19 19 GLU HB2 H 1 2.1720 0.0000 . 2 . . . . A 19 GLU HB2 . 30592 1 188 . 1 . 1 19 19 GLU HG2 H 1 2.4127 0.0000 . 2 . . . . A 19 GLU HG2 . 30592 1 189 . 1 . 1 19 19 GLU CA C 13 59.7241 0.0000 . 1 . . . . A 19 GLU CA . 30592 1 190 . 1 . 1 19 19 GLU CB C 13 29.0173 0.0000 . 1 . . . . A 19 GLU CB . 30592 1 191 . 1 . 1 19 19 GLU CG C 13 35.8377 0.0000 . 1 . . . . A 19 GLU CG . 30592 1 192 . 1 . 1 20 20 HIS H H 1 7.8966 0.0000 . 1 . . . . A 20 HIS H . 30592 1 193 . 1 . 1 20 20 HIS HA H 1 4.3603 0.0000 . 1 . . . . A 20 HIS HA . 30592 1 194 . 1 . 1 20 20 HIS HB2 H 1 3.2771 0.0000 . 2 . . . . A 20 HIS HB2 . 30592 1 195 . 1 . 1 20 20 HIS HB3 H 1 3.2403 0.0000 . 2 . . . . A 20 HIS HB3 . 30592 1 196 . 1 . 1 20 20 HIS HD2 H 1 7.1793 0.0000 . 1 . . . . A 20 HIS HD2 . 30592 1 197 . 1 . 1 20 20 HIS HE1 H 1 8.2098 0.0000 . 1 . . . . A 20 HIS HE1 . 30592 1 198 . 1 . 1 20 20 HIS CA C 13 59.0498 0.0000 . 1 . . . . A 20 HIS CA . 30592 1 199 . 1 . 1 20 20 HIS CB C 13 28.9868 0.0000 . 1 . . . . A 20 HIS CB . 30592 1 200 . 1 . 1 20 20 HIS N N 15 115.9112 0.0000 . 1 . . . . A 20 HIS N . 30592 1 201 . 1 . 1 21 21 TYR H H 1 8.4841 0.0000 . 1 . . . . A 21 TYR H . 30592 1 202 . 1 . 1 21 21 TYR HA H 1 3.7513 0.0000 . 1 . . . . A 21 TYR HA . 30592 1 203 . 1 . 1 21 21 TYR HB2 H 1 2.7139 0.0000 . 2 . . . . A 21 TYR HB2 . 30592 1 204 . 1 . 1 21 21 TYR HB3 H 1 2.5648 0.0000 . 2 . . . . A 21 TYR HB3 . 30592 1 205 . 1 . 1 21 21 TYR CA C 13 61.4351 0.0000 . 1 . . . . A 21 TYR CA . 30592 1 206 . 1 . 1 21 21 TYR CB C 13 37.6083 0.0000 . 1 . . . . A 21 TYR CB . 30592 1 207 . 1 . 1 22 22 VAL H H 1 6.8758 0.0000 . 1 . . . . A 22 VAL H . 30592 1 208 . 1 . 1 22 22 VAL HA H 1 4.8960 0.0000 . 1 . . . . A 22 VAL HA . 30592 1 209 . 1 . 1 22 22 VAL HB H 1 1.9540 0.0000 . 1 . . . . A 22 VAL HB . 30592 1 210 . 1 . 1 22 22 VAL HG21 H 1 0.7840 0.0000 . 2 . . . . A 22 VAL HG21 . 30592 1 211 . 1 . 1 22 22 VAL HG22 H 1 0.7840 0.0000 . 2 . . . . A 22 VAL HG22 . 30592 1 212 . 1 . 1 22 22 VAL HG23 H 1 0.7840 0.0000 . 2 . . . . A 22 VAL HG23 . 30592 1 213 . 1 . 1 22 22 VAL CA C 13 58.4196 0.0000 . 1 . . . . A 22 VAL CA . 30592 1 214 . 1 . 1 22 22 VAL CB C 13 31.1722 0.0000 . 1 . . . . A 22 VAL CB . 30592 1 215 . 1 . 1 22 22 VAL CG2 C 13 23.4303 0.0000 . 2 . . . . A 22 VAL CG2 . 30592 1 216 . 1 . 1 22 22 VAL N N 15 107.2448 0.0000 . 1 . . . . A 22 VAL N . 30592 1 217 . 1 . 1 23 23 LYS H H 1 7.6669 0.0000 . 1 . . . . A 23 LYS H . 30592 1 218 . 1 . 1 23 23 LYS HA H 1 3.9462 0.0000 . 1 . . . . A 23 LYS HA . 30592 1 219 . 1 . 1 23 23 LYS HB2 H 1 2.0210 0.0000 . 2 . . . . A 23 LYS HB2 . 30592 1 220 . 1 . 1 23 23 LYS HB3 H 1 1.9755 0.0000 . 2 . . . . A 23 LYS HB3 . 30592 1 221 . 1 . 1 23 23 LYS HG3 H 1 1.4708 0.0000 . 2 . . . . A 23 LYS HG3 . 30592 1 222 . 1 . 1 23 23 LYS HD2 H 1 1.7973 0.0000 . 2 . . . . A 23 LYS HD2 . 30592 1 223 . 1 . 1 23 23 LYS HD3 H 1 1.5544 0.0000 . 2 . . . . A 23 LYS HD3 . 30592 1 224 . 1 . 1 23 23 LYS HE2 H 1 2.9877 0.0000 . 2 . . . . A 23 LYS HE2 . 30592 1 225 . 1 . 1 23 23 LYS CA C 13 59.1952 0.0000 . 1 . . . . A 23 LYS CA . 30592 1 226 . 1 . 1 23 23 LYS CB C 13 32.0723 0.0000 . 1 . . . . A 23 LYS CB . 30592 1 227 . 1 . 1 23 23 LYS CE C 13 42.1484 0.0000 . 1 . . . . A 23 LYS CE . 30592 1 228 . 1 . 1 23 23 LYS N N 15 118.4985 0.0000 . 1 . . . . A 23 LYS N . 30592 1 229 . 1 . 1 24 24 HIS H H 1 8.2500 0.0000 . 1 . . . . A 24 HIS H . 30592 1 230 . 1 . 1 24 24 HIS HA H 1 4.3345 0.0000 . 1 . . . . A 24 HIS HA . 30592 1 231 . 1 . 1 24 24 HIS HB2 H 1 3.4785 0.0000 . 2 . . . . A 24 HIS HB2 . 30592 1 232 . 1 . 1 24 24 HIS HB3 H 1 3.1238 0.0000 . 2 . . . . A 24 HIS HB3 . 30592 1 233 . 1 . 1 24 24 HIS HD2 H 1 7.0186 0.0000 . 1 . . . . A 24 HIS HD2 . 30592 1 234 . 1 . 1 24 24 HIS HE1 H 1 8.3767 0.0000 . 1 . . . . A 24 HIS HE1 . 30592 1 235 . 1 . 1 24 24 HIS CA C 13 59.3201 0.0000 . 1 . . . . A 24 HIS CA . 30592 1 236 . 1 . 1 24 24 HIS CB C 13 27.8760 0.0000 . 1 . . . . A 24 HIS CB . 30592 1 237 . 1 . 1 24 24 HIS N N 15 118.4129 0.0000 . 1 . . . . A 24 HIS N . 30592 1 238 . 1 . 1 25 25 LEU H H 1 7.8426 0.0000 . 1 . . . . A 25 LEU H . 30592 1 239 . 1 . 1 25 25 LEU HA H 1 3.5834 0.0000 . 1 . . . . A 25 LEU HA . 30592 1 240 . 1 . 1 25 25 LEU HB2 H 1 1.8604 0.0000 . 2 . . . . A 25 LEU HB2 . 30592 1 241 . 1 . 1 25 25 LEU HG H 1 0.9279 0.0000 . 1 . . . . A 25 LEU HG . 30592 1 242 . 1 . 1 25 25 LEU HD11 H 1 0.5752 0.0000 . 2 . . . . A 25 LEU HD11 . 30592 1 243 . 1 . 1 25 25 LEU HD12 H 1 0.5752 0.0000 . 2 . . . . A 25 LEU HD12 . 30592 1 244 . 1 . 1 25 25 LEU HD13 H 1 0.5752 0.0000 . 2 . . . . A 25 LEU HD13 . 30592 1 245 . 1 . 1 25 25 LEU HD21 H 1 0.4110 0.0000 . 2 . . . . A 25 LEU HD21 . 30592 1 246 . 1 . 1 25 25 LEU HD22 H 1 0.4110 0.0000 . 2 . . . . A 25 LEU HD22 . 30592 1 247 . 1 . 1 25 25 LEU HD23 H 1 0.4110 0.0000 . 2 . . . . A 25 LEU HD23 . 30592 1 248 . 1 . 1 25 25 LEU CA C 13 57.3080 0.0000 . 1 . . . . A 25 LEU CA . 30592 1 249 . 1 . 1 25 25 LEU CG C 13 25.5417 0.0000 . 1 . . . . A 25 LEU CG . 30592 1 250 . 1 . 1 25 25 LEU CD1 C 13 21.9523 0.0000 . 2 . . . . A 25 LEU CD1 . 30592 1 251 . 1 . 1 25 25 LEU CD2 C 13 26.6150 0.0000 . 2 . . . . A 25 LEU CD2 . 30592 1 252 . 1 . 1 25 25 LEU N N 15 115.9454 0.0000 . 1 . . . . A 25 LEU N . 30592 1 253 . 1 . 1 26 26 PHE H H 1 7.6004 0.0000 . 1 . . . . A 26 PHE H . 30592 1 254 . 1 . 1 26 26 PHE HA H 1 4.2907 0.0000 . 1 . . . . A 26 PHE HA . 30592 1 255 . 1 . 1 26 26 PHE HB2 H 1 2.7190 0.0000 . 2 . . . . A 26 PHE HB2 . 30592 1 256 . 1 . 1 26 26 PHE HB3 H 1 2.6254 0.0000 . 2 . . . . A 26 PHE HB3 . 30592 1 257 . 1 . 1 26 26 PHE HD1 H 1 7.1342 0.0000 . 3 . . . . A 26 PHE HD1 . 30592 1 258 . 1 . 1 26 26 PHE HD2 H 1 6.4541 0.0000 . 3 . . . . A 26 PHE HD2 . 30592 1 259 . 1 . 1 26 26 PHE HE1 H 1 7.0611 0.0000 . 3 . . . . A 26 PHE HE1 . 30592 1 260 . 1 . 1 26 26 PHE HE2 H 1 6.4024 0.0000 . 3 . . . . A 26 PHE HE2 . 30592 1 261 . 1 . 1 26 26 PHE HZ H 1 6.7151 0.0000 . 1 . . . . A 26 PHE HZ . 30592 1 262 . 1 . 1 26 26 PHE CA C 13 59.4855 0.0000 . 1 . . . . A 26 PHE CA . 30592 1 263 . 1 . 1 26 26 PHE CB C 13 38.9710 0.0000 . 1 . . . . A 26 PHE CB . 30592 1 264 . 1 . 1 26 26 PHE N N 15 119.8004 0.0000 . 1 . . . . A 26 PHE N . 30592 1 265 . 1 . 1 27 27 ASP H H 1 8.7702 0.0000 . 1 . . . . A 27 ASP H . 30592 1 266 . 1 . 1 27 27 ASP HA H 1 3.8331 0.0000 . 1 . . . . A 27 ASP HA . 30592 1 267 . 1 . 1 27 27 ASP HB2 H 1 2.7238 0.0000 . 2 . . . . A 27 ASP HB2 . 30592 1 268 . 1 . 1 27 27 ASP HB3 H 1 2.4501 0.0000 . 2 . . . . A 27 ASP HB3 . 30592 1 269 . 1 . 1 27 27 ASP CA C 13 57.2717 0.0000 . 1 . . . . A 27 ASP CA . 30592 1 270 . 1 . 1 27 27 ASP CB C 13 40.0906 0.0000 . 1 . . . . A 27 ASP CB . 30592 1 271 . 1 . 1 27 27 ASP N N 15 123.3845 0.0000 . 1 . . . . A 27 ASP N . 30592 1 272 . 1 . 1 28 28 ILE H H 1 7.5291 0.0000 . 1 . . . . A 28 ILE H . 30592 1 273 . 1 . 1 28 28 ILE HA H 1 4.3097 0.0000 . 1 . . . . A 28 ILE HA . 30592 1 274 . 1 . 1 28 28 ILE HB H 1 2.0698 0.0000 . 1 . . . . A 28 ILE HB . 30592 1 275 . 1 . 1 28 28 ILE HG21 H 1 0.5491 0.0000 . 1 . . . . A 28 ILE HG21 . 30592 1 276 . 1 . 1 28 28 ILE HG22 H 1 0.5491 0.0000 . 1 . . . . A 28 ILE HG22 . 30592 1 277 . 1 . 1 28 28 ILE HG23 H 1 0.5491 0.0000 . 1 . . . . A 28 ILE HG23 . 30592 1 278 . 1 . 1 28 28 ILE HD11 H 1 0.5954 0.0000 . 1 . . . . A 28 ILE HD11 . 30592 1 279 . 1 . 1 28 28 ILE HD12 H 1 0.5954 0.0000 . 1 . . . . A 28 ILE HD12 . 30592 1 280 . 1 . 1 28 28 ILE HD13 H 1 0.5954 0.0000 . 1 . . . . A 28 ILE HD13 . 30592 1 281 . 1 . 1 28 28 ILE CA C 13 61.1658 0.0000 . 1 . . . . A 28 ILE CA . 30592 1 282 . 1 . 1 28 28 ILE CB C 13 37.4596 0.0000 . 1 . . . . A 28 ILE CB . 30592 1 283 . 1 . 1 28 28 ILE CG2 C 13 16.8071 0.0000 . 1 . . . . A 28 ILE CG2 . 30592 1 284 . 1 . 1 28 28 ILE CD1 C 13 13.9018 0.0000 . 1 . . . . A 28 ILE CD1 . 30592 1 285 . 1 . 1 28 28 ILE N N 15 109.1826 0.0000 . 1 . . . . A 28 ILE N . 30592 1 286 . 1 . 1 29 29 GLY H H 1 7.6109 0.0000 . 1 . . . . A 29 GLY H . 30592 1 287 . 1 . 1 29 29 GLY HA2 H 1 3.9723 0.0000 . 2 . . . . A 29 GLY HA2 . 30592 1 288 . 1 . 1 29 29 GLY HA3 H 1 3.8446 0.0000 . 2 . . . . A 29 GLY HA3 . 30592 1 289 . 1 . 1 29 29 GLY CA C 13 45.7577 0.0000 . 1 . . . . A 29 GLY CA . 30592 1 290 . 1 . 1 29 29 GLY N N 15 110.6082 0.0000 . 1 . . . . A 29 GLY N . 30592 1 291 . 1 . 1 30 30 GLU H H 1 8.2018 0.0000 . 1 . . . . A 30 GLU H . 30592 1 292 . 1 . 1 30 30 GLU HA H 1 4.1336 0.0000 . 1 . . . . A 30 GLU HA . 30592 1 293 . 1 . 1 30 30 GLU HB2 H 1 1.9823 0.0000 . 2 . . . . A 30 GLU HB2 . 30592 1 294 . 1 . 1 30 30 GLU HB3 H 1 1.7445 0.0000 . 2 . . . . A 30 GLU HB3 . 30592 1 295 . 1 . 1 30 30 GLU HG2 H 1 2.1575 0.0000 . 2 . . . . A 30 GLU HG2 . 30592 1 296 . 1 . 1 30 30 GLU HG3 H 1 2.0554 0.0000 . 2 . . . . A 30 GLU HG3 . 30592 1 297 . 1 . 1 30 30 GLU CA C 13 56.5538 0.0000 . 1 . . . . A 30 GLU CA . 30592 1 298 . 1 . 1 30 30 GLU CB C 13 31.2467 0.0000 . 1 . . . . A 30 GLU CB . 30592 1 299 . 1 . 1 30 30 GLU CG C 13 36.1128 0.0000 . 1 . . . . A 30 GLU CG . 30592 1 300 . 1 . 1 30 30 GLU N N 15 119.2584 0.0000 . 1 . . . . A 30 GLU N . 30592 1 301 . 1 . 1 32 32 THR H H 1 7.6098 0.0000 . 1 . . . . A 32 THR H . 30592 1 302 . 1 . 1 32 32 THR HA H 1 4.3874 0.0000 . 1 . . . . A 32 THR HA . 30592 1 303 . 1 . 1 32 32 THR HB H 1 4.8086 0.0000 . 1 . . . . A 32 THR HB . 30592 1 304 . 1 . 1 32 32 THR HG21 H 1 1.3625 0.0000 . 1 . . . . A 32 THR HG21 . 30592 1 305 . 1 . 1 32 32 THR HG22 H 1 1.3625 0.0000 . 1 . . . . A 32 THR HG22 . 30592 1 306 . 1 . 1 32 32 THR HG23 H 1 1.3625 0.0000 . 1 . . . . A 32 THR HG23 . 30592 1 307 . 1 . 1 32 32 THR CA C 13 60.1590 0.0000 . 1 . . . . A 32 THR CA . 30592 1 308 . 1 . 1 32 32 THR CB C 13 71.5967 0.0000 . 1 . . . . A 32 THR CB . 30592 1 309 . 1 . 1 32 32 THR N N 15 127.4048 0.0000 . 1 . . . . A 32 THR N . 30592 1 310 . 1 . 1 33 33 LYS H H 1 9.0669 0.0000 . 1 . . . . A 33 LYS H . 30592 1 311 . 1 . 1 33 33 LYS HA H 1 3.6540 0.0000 . 1 . . . . A 33 LYS HA . 30592 1 312 . 1 . 1 33 33 LYS HB2 H 1 2.0238 0.0000 . 2 . . . . A 33 LYS HB2 . 30592 1 313 . 1 . 1 33 33 LYS HB3 H 1 1.8318 0.0000 . 2 . . . . A 33 LYS HB3 . 30592 1 314 . 1 . 1 33 33 LYS HG2 H 1 1.4055 0.0000 . 2 . . . . A 33 LYS HG2 . 30592 1 315 . 1 . 1 33 33 LYS HG3 H 1 1.2592 0.0000 . 2 . . . . A 33 LYS HG3 . 30592 1 316 . 1 . 1 33 33 LYS HD2 H 1 1.6703 0.0000 . 2 . . . . A 33 LYS HD2 . 30592 1 317 . 1 . 1 33 33 LYS HD3 H 1 1.6114 0.0000 . 2 . . . . A 33 LYS HD3 . 30592 1 318 . 1 . 1 33 33 LYS HE2 H 1 2.9165 0.0000 . 2 . . . . A 33 LYS HE2 . 30592 1 319 . 1 . 1 33 33 LYS CA C 13 62.0986 0.0000 . 1 . . . . A 33 LYS CA . 30592 1 320 . 1 . 1 33 33 LYS CG C 13 24.7147 0.0000 . 1 . . . . A 33 LYS CG . 30592 1 321 . 1 . 1 33 33 LYS CE C 13 41.8096 0.0000 . 1 . . . . A 33 LYS CE . 30592 1 322 . 1 . 1 33 33 LYS N N 15 121.3782 0.0000 . 1 . . . . A 33 LYS N . 30592 1 323 . 1 . 1 34 34 GLU H H 1 8.7090 0.0000 . 1 . . . . A 34 GLU H . 30592 1 324 . 1 . 1 34 34 GLU HA H 1 3.8048 0.0000 . 1 . . . . A 34 GLU HA . 30592 1 325 . 1 . 1 34 34 GLU HB2 H 1 2.0216 0.0000 . 2 . . . . A 34 GLU HB2 . 30592 1 326 . 1 . 1 34 34 GLU HB3 H 1 1.8725 0.0000 . 2 . . . . A 34 GLU HB3 . 30592 1 327 . 1 . 1 34 34 GLU HG2 H 1 2.4266 0.0000 . 2 . . . . A 34 GLU HG2 . 30592 1 328 . 1 . 1 34 34 GLU HG3 H 1 2.1895 0.0000 . 2 . . . . A 34 GLU HG3 . 30592 1 329 . 1 . 1 34 34 GLU CA C 13 60.6317 0.0000 . 1 . . . . A 34 GLU CA . 30592 1 330 . 1 . 1 34 34 GLU CG C 13 37.3904 0.0000 . 1 . . . . A 34 GLU CG . 30592 1 331 . 1 . 1 34 34 GLU N N 15 116.6852 0.0000 . 1 . . . . A 34 GLU N . 30592 1 332 . 1 . 1 35 35 LEU H H 1 7.6820 0.0000 . 1 . . . . A 35 LEU H . 30592 1 333 . 1 . 1 35 35 LEU HA H 1 4.2525 0.0000 . 1 . . . . A 35 LEU HA . 30592 1 334 . 1 . 1 35 35 LEU HB2 H 1 1.7623 0.0000 . 2 . . . . A 35 LEU HB2 . 30592 1 335 . 1 . 1 35 35 LEU HB3 H 1 1.5516 0.0000 . 2 . . . . A 35 LEU HB3 . 30592 1 336 . 1 . 1 35 35 LEU HD11 H 1 0.9607 0.0000 . 2 . . . . A 35 LEU HD11 . 30592 1 337 . 1 . 1 35 35 LEU HD12 H 1 0.9607 0.0000 . 2 . . . . A 35 LEU HD12 . 30592 1 338 . 1 . 1 35 35 LEU HD13 H 1 0.9607 0.0000 . 2 . . . . A 35 LEU HD13 . 30592 1 339 . 1 . 1 35 35 LEU HD21 H 1 0.9333 0.0000 . 2 . . . . A 35 LEU HD21 . 30592 1 340 . 1 . 1 35 35 LEU HD22 H 1 0.9333 0.0000 . 2 . . . . A 35 LEU HD22 . 30592 1 341 . 1 . 1 35 35 LEU HD23 H 1 0.9333 0.0000 . 2 . . . . A 35 LEU HD23 . 30592 1 342 . 1 . 1 35 35 LEU CA C 13 57.1198 0.0000 . 1 . . . . A 35 LEU CA . 30592 1 343 . 1 . 1 35 35 LEU CB C 13 41.0788 0.0000 . 1 . . . . A 35 LEU CB . 30592 1 344 . 1 . 1 36 36 TYR H H 1 8.4815 0.0000 . 1 . . . . A 36 TYR H . 30592 1 345 . 1 . 1 36 36 TYR HA H 1 4.4494 0.0000 . 1 . . . . A 36 TYR HA . 30592 1 346 . 1 . 1 36 36 TYR HB2 H 1 3.2070 0.0000 . 2 . . . . A 36 TYR HB2 . 30592 1 347 . 1 . 1 36 36 TYR HB3 H 1 3.1196 0.0000 . 2 . . . . A 36 TYR HB3 . 30592 1 348 . 1 . 1 36 36 TYR HD1 H 1 7.0262 0.0000 . 3 . . . . A 36 TYR HD1 . 30592 1 349 . 1 . 1 36 36 TYR HE1 H 1 6.7435 0.0000 . 3 . . . . A 36 TYR HE1 . 30592 1 350 . 1 . 1 36 36 TYR CA C 13 60.4501 0.0000 . 1 . . . . A 36 TYR CA . 30592 1 351 . 1 . 1 36 36 TYR CB C 13 38.7341 0.0000 . 1 . . . . A 36 TYR CB . 30592 1 352 . 1 . 1 37 37 ILE H H 1 8.4826 0.0000 . 1 . . . . A 37 ILE H . 30592 1 353 . 1 . 1 37 37 ILE HA H 1 3.0790 0.0000 . 1 . . . . A 37 ILE HA . 30592 1 354 . 1 . 1 37 37 ILE HB H 1 1.7695 0.0000 . 1 . . . . A 37 ILE HB . 30592 1 355 . 1 . 1 37 37 ILE HG12 H 1 1.5407 0.0000 . 2 . . . . A 37 ILE HG12 . 30592 1 356 . 1 . 1 37 37 ILE HG13 H 1 1.0823 0.0000 . 2 . . . . A 37 ILE HG13 . 30592 1 357 . 1 . 1 37 37 ILE HG21 H 1 0.7239 0.0000 . 1 . . . . A 37 ILE HG21 . 30592 1 358 . 1 . 1 37 37 ILE HG22 H 1 0.7239 0.0000 . 1 . . . . A 37 ILE HG22 . 30592 1 359 . 1 . 1 37 37 ILE HG23 H 1 0.7239 0.0000 . 1 . . . . A 37 ILE HG23 . 30592 1 360 . 1 . 1 37 37 ILE HD11 H 1 0.6806 0.0000 . 1 . . . . A 37 ILE HD11 . 30592 1 361 . 1 . 1 37 37 ILE HD12 H 1 0.6806 0.0000 . 1 . . . . A 37 ILE HD12 . 30592 1 362 . 1 . 1 37 37 ILE HD13 H 1 0.6806 0.0000 . 1 . . . . A 37 ILE HD13 . 30592 1 363 . 1 . 1 37 37 ILE CA C 13 64.4066 0.0000 . 1 . . . . A 37 ILE CA . 30592 1 364 . 1 . 1 37 37 ILE CB C 13 37.2232 0.0000 . 1 . . . . A 37 ILE CB . 30592 1 365 . 1 . 1 37 37 ILE CG1 C 13 28.6423 0.0000 . 1 . . . . A 37 ILE CG1 . 30592 1 366 . 1 . 1 37 37 ILE CG2 C 13 16.7050 0.0000 . 1 . . . . A 37 ILE CG2 . 30592 1 367 . 1 . 1 37 37 ILE CD1 C 13 12.4829 0.0000 . 1 . . . . A 37 ILE CD1 . 30592 1 368 . 1 . 1 38 38 GLU H H 1 7.5405 0.0000 . 1 . . . . A 38 GLU H . 30592 1 369 . 1 . 1 38 38 GLU HA H 1 3.8881 0.0000 . 1 . . . . A 38 GLU HA . 30592 1 370 . 1 . 1 38 38 GLU HB2 H 1 2.0886 0.0000 . 2 . . . . A 38 GLU HB2 . 30592 1 371 . 1 . 1 38 38 GLU HB3 H 1 1.9816 0.0000 . 2 . . . . A 38 GLU HB3 . 30592 1 372 . 1 . 1 38 38 GLU HG2 H 1 2.3226 0.0000 . 2 . . . . A 38 GLU HG2 . 30592 1 373 . 1 . 1 38 38 GLU CA C 13 59.5799 0.0000 . 1 . . . . A 38 GLU CA . 30592 1 374 . 1 . 1 38 38 GLU CG C 13 37.1824 0.0000 . 1 . . . . A 38 GLU CG . 30592 1 375 . 1 . 1 38 38 GLU N N 15 121.2608 0.0000 . 1 . . . . A 38 GLU N . 30592 1 376 . 1 . 1 39 39 LEU H H 1 8.4564 0.0000 . 1 . . . . A 39 LEU H . 30592 1 377 . 1 . 1 39 39 LEU HA H 1 4.2024 0.0000 . 1 . . . . A 39 LEU HA . 30592 1 378 . 1 . 1 39 39 LEU HB2 H 1 1.6779 0.0000 . 2 . . . . A 39 LEU HB2 . 30592 1 379 . 1 . 1 39 39 LEU HB3 H 1 1.4345 0.0000 . 2 . . . . A 39 LEU HB3 . 30592 1 380 . 1 . 1 39 39 LEU HG H 1 1.8613 0.0000 . 1 . . . . A 39 LEU HG . 30592 1 381 . 1 . 1 39 39 LEU HD11 H 1 0.8992 0.0000 . 2 . . . . A 39 LEU HD11 . 30592 1 382 . 1 . 1 39 39 LEU HD12 H 1 0.8992 0.0000 . 2 . . . . A 39 LEU HD12 . 30592 1 383 . 1 . 1 39 39 LEU HD13 H 1 0.8992 0.0000 . 2 . . . . A 39 LEU HD13 . 30592 1 384 . 1 . 1 39 39 LEU HD21 H 1 0.8113 0.0000 . 2 . . . . A 39 LEU HD21 . 30592 1 385 . 1 . 1 39 39 LEU HD22 H 1 0.8113 0.0000 . 2 . . . . A 39 LEU HD22 . 30592 1 386 . 1 . 1 39 39 LEU HD23 H 1 0.8113 0.0000 . 2 . . . . A 39 LEU HD23 . 30592 1 387 . 1 . 1 39 39 LEU CA C 13 56.3995 0.0000 . 1 . . . . A 39 LEU CA . 30592 1 388 . 1 . 1 39 39 LEU CB C 13 42.6443 0.0000 . 1 . . . . A 39 LEU CB . 30592 1 389 . 1 . 1 39 39 LEU CG C 13 26.7822 0.0000 . 1 . . . . A 39 LEU CG . 30592 1 390 . 1 . 1 39 39 LEU CD1 C 13 27.5388 0.0000 . 2 . . . . A 39 LEU CD1 . 30592 1 391 . 1 . 1 39 39 LEU CD2 C 13 22.1546 0.0000 . 2 . . . . A 39 LEU CD2 . 30592 1 392 . 1 . 1 39 39 LEU N N 15 116.8014 0.0000 . 1 . . . . A 39 LEU N . 30592 1 393 . 1 . 1 40 40 SER H H 1 7.8822 0.0000 . 1 . . . . A 40 SER H . 30592 1 394 . 1 . 1 40 40 SER HA H 1 4.2817 0.0000 . 1 . . . . A 40 SER HA . 30592 1 395 . 1 . 1 40 40 SER HB2 H 1 3.6604 0.0000 . 2 . . . . A 40 SER HB2 . 30592 1 396 . 1 . 1 40 40 SER HB3 H 1 3.6424 0.0000 . 2 . . . . A 40 SER HB3 . 30592 1 397 . 1 . 1 40 40 SER CA C 13 59.4270 0.0000 . 1 . . . . A 40 SER CA . 30592 1 398 . 1 . 1 40 40 SER CB C 13 63.5757 0.0000 . 1 . . . . A 40 SER CB . 30592 1 399 . 1 . 1 40 40 SER N N 15 113.2066 0.0000 . 1 . . . . A 40 SER N . 30592 1 400 . 1 . 1 41 41 SER H H 1 7.5875 0.0000 . 1 . . . . A 41 SER H . 30592 1 401 . 1 . 1 41 41 SER HA H 1 4.3553 0.0000 . 1 . . . . A 41 SER HA . 30592 1 402 . 1 . 1 41 41 SER HB2 H 1 3.8569 0.0000 . 2 . . . . A 41 SER HB2 . 30592 1 403 . 1 . 1 41 41 SER HB3 H 1 3.8406 0.0000 . 2 . . . . A 41 SER HB3 . 30592 1 404 . 1 . 1 41 41 SER CA C 13 59.3526 0.0000 . 1 . . . . A 41 SER CA . 30592 1 405 . 1 . 1 41 41 SER N N 15 117.1823 0.0000 . 1 . . . . A 41 SER N . 30592 1 406 . 1 . 1 42 42 ASP H H 1 7.8599 0.0000 . 1 . . . . A 42 ASP H . 30592 1 407 . 1 . 1 42 42 ASP HA H 1 4.6806 0.0000 . 1 . . . . A 42 ASP HA . 30592 1 408 . 1 . 1 42 42 ASP HB2 H 1 2.7074 0.0000 . 2 . . . . A 42 ASP HB2 . 30592 1 409 . 1 . 1 42 42 ASP HB3 H 1 2.4874 0.0000 . 2 . . . . A 42 ASP HB3 . 30592 1 410 . 1 . 1 42 42 ASP CA C 13 53.8830 0.0000 . 1 . . . . A 42 ASP CA . 30592 1 411 . 1 . 1 42 42 ASP CB C 13 40.9755 0.0000 . 1 . . . . A 42 ASP CB . 30592 1 412 . 1 . 1 42 42 ASP N N 15 121.7803 0.0000 . 1 . . . . A 42 ASP N . 30592 1 413 . 1 . 1 43 43 LEU H H 1 7.4605 0.0000 . 1 . . . . A 43 LEU H . 30592 1 414 . 1 . 1 43 43 LEU HA H 1 4.1150 0.0000 . 1 . . . . A 43 LEU HA . 30592 1 415 . 1 . 1 43 43 LEU HB2 H 1 1.5772 0.0000 . 2 . . . . A 43 LEU HB2 . 30592 1 416 . 1 . 1 43 43 LEU HB3 H 1 1.5539 0.0000 . 2 . . . . A 43 LEU HB3 . 30592 1 417 . 1 . 1 43 43 LEU HG H 1 1.5272 0.0000 . 1 . . . . A 43 LEU HG . 30592 1 418 . 1 . 1 43 43 LEU HD11 H 1 0.8551 0.0000 . 2 . . . . A 43 LEU HD11 . 30592 1 419 . 1 . 1 43 43 LEU HD12 H 1 0.8551 0.0000 . 2 . . . . A 43 LEU HD12 . 30592 1 420 . 1 . 1 43 43 LEU HD13 H 1 0.8551 0.0000 . 2 . . . . A 43 LEU HD13 . 30592 1 421 . 1 . 1 43 43 LEU CA C 13 54.6441 0.0000 . 1 . . . . A 43 LEU CA . 30592 1 422 . 1 . 1 43 43 LEU CB C 13 43.1193 0.0000 . 1 . . . . A 43 LEU CB . 30592 1 423 . 1 . 1 43 43 LEU CG C 13 28.3569 0.0000 . 1 . . . . A 43 LEU CG . 30592 1 424 . 1 . 1 43 43 LEU CD1 C 13 25.3922 0.0000 . 2 . . . . A 43 LEU CD1 . 30592 1 425 . 1 . 1 43 43 LEU N N 15 126.4617 0.0000 . 1 . . . . A 43 LEU N . 30592 1 stop_ save_