################################### # 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 34406 _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 NOESY' . . . 34406 1 2 '2D 1H-1H TOCSY' . . . 34406 1 3 '2D 1H-15N HSQC' . . . 34406 1 4 '2D 1H-13C HSQC aliphatic' . . . 34406 1 5 '2D 1H-13C HSQC aromatic' . . . 34406 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 LYS HA H 1 4.023 0.020 . 1 . . . . A 1 LYS HA . 34406 1 2 . 1 1 1 1 LYS HB2 H 1 1.882 0.020 . 1 . . . . A 1 LYS HB2 . 34406 1 3 . 1 1 1 1 LYS HB3 H 1 1.882 0.020 . 1 . . . . A 1 LYS HB3 . 34406 1 4 . 1 1 1 1 LYS HG2 H 1 1.415 0.020 . 1 . . . . A 1 LYS HG2 . 34406 1 5 . 1 1 1 1 LYS HG3 H 1 1.415 0.020 . 1 . . . . A 1 LYS HG3 . 34406 1 6 . 1 1 1 1 LYS HD2 H 1 1.728 0.020 . 1 . . . . A 1 LYS HD2 . 34406 1 7 . 1 1 1 1 LYS HD3 H 1 1.728 0.020 . 1 . . . . A 1 LYS HD3 . 34406 1 8 . 1 1 1 1 LYS HE2 H 1 3.022 0.020 . 1 . . . . A 1 LYS HE2 . 34406 1 9 . 1 1 1 1 LYS HE3 H 1 3.022 0.020 . 1 . . . . A 1 LYS HE3 . 34406 1 10 . 1 1 1 1 LYS CA C 13 55.497 0.3 . 1 . . . . A 1 LYS CA . 34406 1 11 . 1 1 1 1 LYS CB C 13 32.361 0.3 . 1 . . . . A 1 LYS CB . 34406 1 12 . 1 1 2 2 PHE H H 1 9.026 0.020 . 1 . . . . A 2 PHE H . 34406 1 13 . 1 1 2 2 PHE HA H 1 4.639 0.020 . 1 . . . . A 2 PHE HA . 34406 1 14 . 1 1 2 2 PHE HB2 H 1 3.119 0.020 . 2 . . . . A 2 PHE HB2 . 34406 1 15 . 1 1 2 2 PHE HB3 H 1 3.155 0.020 . 2 . . . . A 2 PHE HB3 . 34406 1 16 . 1 1 2 2 PHE HD1 H 1 7.324 0.020 . 1 . . . . A 2 PHE HD1 . 34406 1 17 . 1 1 2 2 PHE HD2 H 1 7.324 0.020 . 1 . . . . A 2 PHE HD2 . 34406 1 18 . 1 1 2 2 PHE HE1 H 1 7.289 0.020 . 1 . . . . A 2 PHE HE1 . 34406 1 19 . 1 1 2 2 PHE HE2 H 1 7.289 0.020 . 1 . . . . A 2 PHE HE2 . 34406 1 20 . 1 1 2 2 PHE HZ H 1 7.211 0.020 . 1 . . . . A 2 PHE HZ . 34406 1 21 . 1 1 2 2 PHE CA C 13 58.903 0.3 . 1 . . . . A 2 PHE CA . 34406 1 22 . 1 1 2 2 PHE CB C 13 39.580 0.3 . 1 . . . . A 2 PHE CB . 34406 1 23 . 1 1 2 2 PHE CD1 C 13 131.527 0.3 . 1 . . . . A 2 PHE CD1 . 34406 1 24 . 1 1 2 2 PHE CE1 C 13 130.754 0.3 . 1 . . . . A 2 PHE CE1 . 34406 1 25 . 1 1 2 2 PHE CZ C 13 129.091 0.3 . 1 . . . . A 2 PHE CZ . 34406 1 26 . 1 1 2 2 PHE N N 15 123.415 0.3 . 1 . . . . A 2 PHE N . 34406 1 27 . 1 1 3 3 LYS H H 1 8.358 0.020 . 1 . . . . A 3 LYS H . 34406 1 28 . 1 1 3 3 LYS HA H 1 4.240 0.020 . 1 . . . . A 3 LYS HA . 34406 1 29 . 1 1 3 3 LYS HB2 H 1 1.792 0.020 . 2 . . . . A 3 LYS HB2 . 34406 1 30 . 1 1 3 3 LYS HB3 H 1 1.739 0.020 . 2 . . . . A 3 LYS HB3 . 34406 1 31 . 1 1 3 3 LYS HG2 H 1 1.363 0.020 . 2 . . . . A 3 LYS HG2 . 34406 1 32 . 1 1 3 3 LYS HG3 H 1 1.431 0.020 . 2 . . . . A 3 LYS HG3 . 34406 1 33 . 1 1 3 3 LYS HD2 H 1 1.727 0.020 . 1 . . . . A 3 LYS HD2 . 34406 1 34 . 1 1 3 3 LYS HD3 H 1 1.727 0.020 . 1 . . . . A 3 LYS HD3 . 34406 1 35 . 1 1 3 3 LYS HE2 H 1 3.161 0.020 . 1 . . . . A 3 LYS HE2 . 34406 1 36 . 1 1 3 3 LYS HE3 H 1 3.161 0.020 . 1 . . . . A 3 LYS HE3 . 34406 1 37 . 1 1 3 3 LYS HZ1 H 1 7.701 0.020 . 1 . . . . A 3 LYS HZ1 . 34406 1 38 . 1 1 3 3 LYS HZ2 H 1 7.701 0.020 . 1 . . . . A 3 LYS HZ2 . 34406 1 39 . 1 1 3 3 LYS HZ3 H 1 7.701 0.020 . 1 . . . . A 3 LYS HZ3 . 34406 1 40 . 1 1 3 3 LYS CA C 13 56.457 0.3 . 1 . . . . A 3 LYS CA . 34406 1 41 . 1 1 3 3 LYS CB C 13 32.724 0.3 . 1 . . . . A 3 LYS CB . 34406 1 42 . 1 1 3 3 LYS CG C 13 23.780 0.3 . 1 . . . . A 3 LYS CG . 34406 1 43 . 1 1 3 3 LYS CD C 13 28.990 0.3 . 1 . . . . A 3 LYS CD . 34406 1 44 . 1 1 3 3 LYS CE C 13 41.807 0.3 . 1 . . . . A 3 LYS CE . 34406 1 45 . 1 1 3 3 LYS N N 15 123.503 0.3 . 1 . . . . A 3 LYS N . 34406 1 46 . 1 1 4 4 LYS H H 1 8.097 0.020 . 1 . . . . A 4 LYS H . 34406 1 47 . 1 1 4 4 LYS HA H 1 4.175 0.020 . 1 . . . . A 4 LYS HA . 34406 1 48 . 1 1 4 4 LYS HB2 H 1 1.787 0.020 . 1 . . . . A 4 LYS HB2 . 34406 1 49 . 1 1 4 4 LYS HB3 H 1 1.787 0.020 . 1 . . . . A 4 LYS HB3 . 34406 1 50 . 1 1 4 4 LYS HG2 H 1 1.374 0.020 . 2 . . . . A 4 LYS HG2 . 34406 1 51 . 1 1 4 4 LYS HG3 H 1 1.448 0.020 . 2 . . . . A 4 LYS HG3 . 34406 1 52 . 1 1 4 4 LYS HD2 H 1 1.714 0.020 . 1 . . . . A 4 LYS HD2 . 34406 1 53 . 1 1 4 4 LYS HD3 H 1 1.714 0.020 . 1 . . . . A 4 LYS HD3 . 34406 1 54 . 1 1 4 4 LYS HE2 H 1 2.989 0.020 . 1 . . . . A 4 LYS HE2 . 34406 1 55 . 1 1 4 4 LYS HE3 H 1 2.989 0.020 . 1 . . . . A 4 LYS HE3 . 34406 1 56 . 1 1 4 4 LYS HZ1 H 1 7.685 0.020 . 1 . . . . A 4 LYS HZ1 . 34406 1 57 . 1 1 4 4 LYS HZ2 H 1 7.685 0.020 . 1 . . . . A 4 LYS HZ2 . 34406 1 58 . 1 1 4 4 LYS HZ3 H 1 7.685 0.020 . 1 . . . . A 4 LYS HZ3 . 34406 1 59 . 1 1 4 4 LYS CA C 13 56.844 0.3 . 1 . . . . A 4 LYS CA . 34406 1 60 . 1 1 4 4 LYS CB C 13 33.177 0.3 . 1 . . . . A 4 LYS CB . 34406 1 61 . 1 1 4 4 LYS CG C 13 24.734 0.3 . 1 . . . . A 4 LYS CG . 34406 1 62 . 1 1 4 4 LYS CD C 13 29.029 0.3 . 1 . . . . A 4 LYS CD . 34406 1 63 . 1 1 4 4 LYS CE C 13 41.812 0.3 . 1 . . . . A 4 LYS CE . 34406 1 64 . 1 1 4 4 LYS N N 15 121.117 0.3 . 1 . . . . A 4 LYS N . 34406 1 65 . 1 1 5 5 VAL H H 1 8.033 0.020 . 1 . . . . A 5 VAL H . 34406 1 66 . 1 1 5 5 VAL HA H 1 3.960 0.020 . 1 . . . . A 5 VAL HA . 34406 1 67 . 1 1 5 5 VAL HB H 1 1.876 0.020 . 1 . . . . A 5 VAL HB . 34406 1 68 . 1 1 5 5 VAL HG11 H 1 0.863 0.020 . 2 . . . . A 5 VAL HG11 . 34406 1 69 . 1 1 5 5 VAL HG12 H 1 0.863 0.020 . 2 . . . . A 5 VAL HG12 . 34406 1 70 . 1 1 5 5 VAL HG13 H 1 0.863 0.020 . 2 . . . . A 5 VAL HG13 . 34406 1 71 . 1 1 5 5 VAL HG21 H 1 0.637 0.020 . 2 . . . . A 5 VAL HG21 . 34406 1 72 . 1 1 5 5 VAL HG22 H 1 0.637 0.020 . 2 . . . . A 5 VAL HG22 . 34406 1 73 . 1 1 5 5 VAL HG23 H 1 0.637 0.020 . 2 . . . . A 5 VAL HG23 . 34406 1 74 . 1 1 5 5 VAL CA C 13 62.453 0.3 . 1 . . . . A 5 VAL CA . 34406 1 75 . 1 1 5 5 VAL CB C 13 33.007 0.3 . 1 . . . . A 5 VAL CB . 34406 1 76 . 1 1 5 5 VAL CG1 C 13 20.741 0.3 . 1 . . . . A 5 VAL CG1 . 34406 1 77 . 1 1 5 5 VAL CG2 C 13 20.817 0.3 . 1 . . . . A 5 VAL CG2 . 34406 1 78 . 1 1 5 5 VAL N N 15 120.607 0.3 . 1 . . . . A 5 VAL N . 34406 1 79 . 1 1 6 6 ILE H H 1 8.170 0.020 . 1 . . . . A 6 ILE H . 34406 1 80 . 1 1 6 6 ILE HA H 1 4.152 0.020 . 1 . . . . A 6 ILE HA . 34406 1 81 . 1 1 6 6 ILE HB H 1 1.938 0.020 . 1 . . . . A 6 ILE HB . 34406 1 82 . 1 1 6 6 ILE HG12 H 1 1.454 0.020 . 2 . . . . A 6 ILE HG12 . 34406 1 83 . 1 1 6 6 ILE HG13 H 1 1.189 0.020 . 2 . . . . A 6 ILE HG13 . 34406 1 84 . 1 1 6 6 ILE HG21 H 1 0.873 0.020 . 1 . . . . A 6 ILE HG21 . 34406 1 85 . 1 1 6 6 ILE HG22 H 1 0.873 0.020 . 1 . . . . A 6 ILE HG22 . 34406 1 86 . 1 1 6 6 ILE HG23 H 1 0.873 0.020 . 1 . . . . A 6 ILE HG23 . 34406 1 87 . 1 1 6 6 ILE HD11 H 1 0.838 0.020 . 1 . . . . A 6 ILE HD11 . 34406 1 88 . 1 1 6 6 ILE HD12 H 1 0.838 0.020 . 1 . . . . A 6 ILE HD12 . 34406 1 89 . 1 1 6 6 ILE HD13 H 1 0.838 0.020 . 1 . . . . A 6 ILE HD13 . 34406 1 90 . 1 1 6 6 ILE CA C 13 61.123 0.3 . 1 . . . . A 6 ILE CA . 34406 1 91 . 1 1 6 6 ILE CB C 13 37.469 0.3 . 1 . . . . A 6 ILE CB . 34406 1 92 . 1 1 6 6 ILE CG1 C 13 27.143 0.3 . 1 . . . . A 6 ILE CG1 . 34406 1 93 . 1 1 6 6 ILE CG2 C 13 17.614 0.3 . 1 . . . . A 6 ILE CG2 . 34406 1 94 . 1 1 6 6 ILE CD1 C 13 12.546 0.3 . 1 . . . . A 6 ILE CD1 . 34406 1 95 . 1 1 6 6 ILE N N 15 123.761 0.3 . 1 . . . . A 6 ILE N . 34406 1 96 . 1 1 7 7 TRP H H 1 7.947 0.020 . 1 . . . . A 7 TRP H . 34406 1 97 . 1 1 7 7 TRP HA H 1 4.454 0.020 . 1 . . . . A 7 TRP HA . 34406 1 98 . 1 1 7 7 TRP HB2 H 1 3.305 0.020 . 1 . . . . A 7 TRP HB2 . 34406 1 99 . 1 1 7 7 TRP HB3 H 1 3.305 0.020 . 1 . . . . A 7 TRP HB3 . 34406 1 100 . 1 1 7 7 TRP HD1 H 1 7.366 0.020 . 1 . . . . A 7 TRP HD1 . 34406 1 101 . 1 1 7 7 TRP HE1 H 1 10.610 0.020 . 1 . . . . A 7 TRP HE1 . 34406 1 102 . 1 1 7 7 TRP HE3 H 1 7.517 0.020 . 1 . . . . A 7 TRP HE3 . 34406 1 103 . 1 1 7 7 TRP HZ2 H 1 7.485 0.020 . 1 . . . . A 7 TRP HZ2 . 34406 1 104 . 1 1 7 7 TRP HZ3 H 1 6.981 0.020 . 1 . . . . A 7 TRP HZ3 . 34406 1 105 . 1 1 7 7 TRP HH2 H 1 7.136 0.020 . 1 . . . . A 7 TRP HH2 . 34406 1 106 . 1 1 7 7 TRP CA C 13 58.826 0.3 . 1 . . . . A 7 TRP CA . 34406 1 107 . 1 1 7 7 TRP CB C 13 29.256 0.3 . 1 . . . . A 7 TRP CB . 34406 1 108 . 1 1 7 7 TRP CD1 C 13 127.048 0.3 . 1 . . . . A 7 TRP CD1 . 34406 1 109 . 1 1 7 7 TRP CE3 C 13 120.072 0.3 . 1 . . . . A 7 TRP CE3 . 34406 1 110 . 1 1 7 7 TRP CZ2 C 13 114.336 0.3 . 1 . . . . A 7 TRP CZ2 . 34406 1 111 . 1 1 7 7 TRP CZ3 C 13 121.184 0.3 . 1 . . . . A 7 TRP CZ3 . 34406 1 112 . 1 1 7 7 TRP CH2 C 13 123.728 0.3 . 1 . . . . A 7 TRP CH2 . 34406 1 113 . 1 1 7 7 TRP N N 15 123.696 0.3 . 1 . . . . A 7 TRP N . 34406 1 114 . 1 1 7 7 TRP NE1 N 15 130.513 0.3 . 1 . . . . A 7 TRP NE1 . 34406 1 115 . 1 1 8 8 LYS H H 1 7.989 0.020 . 1 . . . . A 8 LYS H . 34406 1 116 . 1 1 8 8 LYS HA H 1 4.017 0.020 . 1 . . . . A 8 LYS HA . 34406 1 117 . 1 1 8 8 LYS HB2 H 1 1.749 0.020 . 1 . . . . A 8 LYS HB2 . 34406 1 118 . 1 1 8 8 LYS HB3 H 1 1.749 0.020 . 1 . . . . A 8 LYS HB3 . 34406 1 119 . 1 1 8 8 LYS HG2 H 1 1.198 0.020 . 1 . . . . A 8 LYS HG2 . 34406 1 120 . 1 1 8 8 LYS HG3 H 1 1.198 0.020 . 1 . . . . A 8 LYS HG3 . 34406 1 121 . 1 1 8 8 LYS HD2 H 1 1.667 0.020 . 1 . . . . A 8 LYS HD2 . 34406 1 122 . 1 1 8 8 LYS HD3 H 1 1.667 0.020 . 1 . . . . A 8 LYS HD3 . 34406 1 123 . 1 1 8 8 LYS HE2 H 1 2.922 0.020 . 1 . . . . A 8 LYS HE2 . 34406 1 124 . 1 1 8 8 LYS HE3 H 1 2.922 0.020 . 1 . . . . A 8 LYS HE3 . 34406 1 125 . 1 1 8 8 LYS HZ1 H 1 7.687 0.020 . 1 . . . . A 8 LYS HZ1 . 34406 1 126 . 1 1 8 8 LYS HZ2 H 1 7.687 0.020 . 1 . . . . A 8 LYS HZ2 . 34406 1 127 . 1 1 8 8 LYS HZ3 H 1 7.687 0.020 . 1 . . . . A 8 LYS HZ3 . 34406 1 128 . 1 1 8 8 LYS CA C 13 58.089 0.3 . 1 . . . . A 8 LYS CA . 34406 1 129 . 1 1 8 8 LYS CB C 13 32.266 0.3 . 1 . . . . A 8 LYS CB . 34406 1 130 . 1 1 8 8 LYS CG C 13 24.729 0.3 . 1 . . . . A 8 LYS CG . 34406 1 131 . 1 1 8 8 LYS CD C 13 29.005 0.3 . 1 . . . . A 8 LYS CD . 34406 1 132 . 1 1 8 8 LYS CE C 13 41.818 0.3 . 1 . . . . A 8 LYS CE . 34406 1 133 . 1 1 8 8 LYS N N 15 118.542 0.3 . 1 . . . . A 8 LYS N . 34406 1 134 . 1 1 9 9 SER H H 1 7.915 0.020 . 1 . . . . A 9 SER H . 34406 1 135 . 1 1 9 9 SER HA H 1 4.266 0.020 . 1 . . . . A 9 SER HA . 34406 1 136 . 1 1 9 9 SER HB2 H 1 3.812 0.020 . 1 . . . . A 9 SER HB2 . 34406 1 137 . 1 1 9 9 SER HB3 H 1 3.812 0.020 . 1 . . . . A 9 SER HB3 . 34406 1 138 . 1 1 9 9 SER CA C 13 59.989 0.3 . 1 . . . . A 9 SER CA . 34406 1 139 . 1 1 9 9 SER CB C 13 63.053 0.3 . 1 . . . . A 9 SER CB . 34406 1 140 . 1 1 9 9 SER N N 15 114.268 0.3 . 1 . . . . A 9 SER N . 34406 1 141 . 1 1 10 10 PHE H H 1 7.825 0.020 . 1 . . . . A 10 PHE H . 34406 1 142 . 1 1 10 10 PHE HA H 1 4.530 0.020 . 1 . . . . A 10 PHE HA . 34406 1 143 . 1 1 10 10 PHE HB2 H 1 3.154 0.020 . 1 . . . . A 10 PHE HB2 . 34406 1 144 . 1 1 10 10 PHE HB3 H 1 3.154 0.020 . 1 . . . . A 10 PHE HB3 . 34406 1 145 . 1 1 10 10 PHE HD1 H 1 7.349 0.020 . 1 . . . . A 10 PHE HD1 . 34406 1 146 . 1 1 10 10 PHE HD2 H 1 7.349 0.020 . 1 . . . . A 10 PHE HD2 . 34406 1 147 . 1 1 10 10 PHE HE1 H 1 7.347 0.020 . 1 . . . . A 10 PHE HE1 . 34406 1 148 . 1 1 10 10 PHE HE2 H 1 7.347 0.020 . 1 . . . . A 10 PHE HE2 . 34406 1 149 . 1 1 10 10 PHE HZ H 1 7.246 0.020 . 1 . . . . A 10 PHE HZ . 34406 1 150 . 1 1 10 10 PHE CA C 13 58.856 0.3 . 1 . . . . A 10 PHE CA . 34406 1 151 . 1 1 10 10 PHE CB C 13 39.571 0.3 . 1 . . . . A 10 PHE CB . 34406 1 152 . 1 1 10 10 PHE CD1 C 13 131.633 0.3 . 1 . . . . A 10 PHE CD1 . 34406 1 153 . 1 1 10 10 PHE CE1 C 13 130.939 0.3 . 1 . . . . A 10 PHE CE1 . 34406 1 154 . 1 1 10 10 PHE CZ C 13 129.173 0.3 . 1 . . . . A 10 PHE CZ . 34406 1 155 . 1 1 10 10 PHE N N 15 119.674 0.3 . 1 . . . . A 10 PHE N . 34406 1 156 . 1 1 11 11 LEU H H 1 7.672 0.020 . 1 . . . . A 11 LEU H . 34406 1 157 . 1 1 11 11 LEU HA H 1 4.282 0.020 . 1 . . . . A 11 LEU HA . 34406 1 158 . 1 1 11 11 LEU HB2 H 1 1.718 0.020 . 2 . . . . A 11 LEU HB2 . 34406 1 159 . 1 1 11 11 LEU HB3 H 1 1.682 0.020 . 2 . . . . A 11 LEU HB3 . 34406 1 160 . 1 1 11 11 LEU HG H 1 1.642 0.020 . 1 . . . . A 11 LEU HG . 34406 1 161 . 1 1 11 11 LEU HD11 H 1 0.963 0.020 . 2 . . . . A 11 LEU HD11 . 34406 1 162 . 1 1 11 11 LEU HD12 H 1 0.963 0.020 . 2 . . . . A 11 LEU HD12 . 34406 1 163 . 1 1 11 11 LEU HD13 H 1 0.963 0.020 . 2 . . . . A 11 LEU HD13 . 34406 1 164 . 1 1 11 11 LEU HD21 H 1 0.916 0.020 . 2 . . . . A 11 LEU HD21 . 34406 1 165 . 1 1 11 11 LEU HD22 H 1 0.916 0.020 . 2 . . . . A 11 LEU HD22 . 34406 1 166 . 1 1 11 11 LEU HD23 H 1 0.916 0.020 . 2 . . . . A 11 LEU HD23 . 34406 1 167 . 1 1 11 11 LEU CA C 13 54.643 0.3 . 1 . . . . A 11 LEU CA . 34406 1 168 . 1 1 11 11 LEU CB C 13 42.386 0.3 . 1 . . . . A 11 LEU CB . 34406 1 169 . 1 1 11 11 LEU CG C 13 26.965 0.3 . 1 . . . . A 11 LEU CG . 34406 1 170 . 1 1 11 11 LEU CD1 C 13 25.511 0.3 . 1 . . . . A 11 LEU CD1 . 34406 1 171 . 1 1 11 11 LEU CD2 C 13 25.504 0.3 . 1 . . . . A 11 LEU CD2 . 34406 1 172 . 1 1 11 11 LEU N N 15 117.985 0.3 . 1 . . . . A 11 LEU N . 34406 1 stop_ save_