################################### # 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 51170 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name chem_shifts_list_1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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 '1D 1H' . . . 51170 1 2 '2D DQF-COSY' . . . 51170 1 5 '2D 1H-15N HSQC' . . . 51170 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 3 $software_3 . . 51170 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 BMT C C 13 172.64 0.10 . 1 . . . . . 1 BMT C . 51170 1 2 . 1 . 1 1 1 BMT CA C 13 53.38 0.10 . 1 . . . . . 1 BMT CA . 51170 1 3 . 1 . 1 1 1 BMT CB C 13 75.08 0.10 . 1 . . . . . 1 BMT CB . 51170 1 4 . 1 . 1 1 1 BMT CG2 C 13 34.69 0.10 . 1 . . . . . 1 BMT CG2 . 51170 1 5 . 1 . 1 1 1 BMT CD1 C 13 15.74 0.10 . 1 . . . . . 1 BMT CD1 . 51170 1 6 . 1 . 1 1 1 BMT CD2 C 13 35.44 0.10 . 1 . . . . . 1 BMT CD2 . 51170 1 7 . 1 . 1 1 1 BMT CE C 13 129.44 0.10 . 1 . . . . . 1 BMT CE . 51170 1 8 . 1 . 1 1 1 BMT CZ C 13 126.46 0.10 . 1 . . . . . 1 BMT CZ . 51170 1 9 . 1 . 1 1 1 BMT CH C 13 17.95 0.10 . 1 . . . . . 1 BMT CH . 51170 1 10 . 1 . 1 1 1 BMT H H 1 6.781 0.01 . 1 . . . . . 1 BMT H . 51170 1 11 . 1 . 1 1 1 BMT HA H 1 4.696 0.01 . 1 . . . . . 1 BMT HA . 51170 1 12 . 1 . 1 1 1 BMT HB H 1 3.821 0.01 . 1 . . . . . 1 BMT HB . 51170 1 13 . 1 . 1 1 1 BMT HG2 H 1 1.545 0.02 . 1 . . . . . 1 BMT HG2 . 51170 1 14 . 1 . 1 1 1 BMT HD1 H 1 0.655 0.01 . 1 . . . . . 1 BMT HD1 . 51170 1 15 . 1 . 1 1 1 BMT HD22 H 1 2.429 0.01 . 2 . . . . . 1 BMT HD22 . 51170 1 16 . 1 . 1 1 1 BMT HD23 H 1 1.772 0.01 . 2 . . . . . 1 BMT HD23 . 51170 1 17 . 1 . 1 1 1 BMT HE H 1 5.375 0.02 . 1 . . . . . 1 BMT HE . 51170 1 18 . 1 . 1 1 1 BMT HZ H 1 5.486 0.02 . 1 . . . . . 1 BMT HZ . 51170 1 19 . 1 . 1 1 1 BMT HH H 1 1.632 0.01 . 1 . . . . . 1 BMT HH . 51170 1 20 . 1 . 1 1 1 BMT N N 15 116.68 0.10 . 1 . . . . . 1 BMT N . 51170 1 21 . 1 . 1 2 2 ABU C C 13 172.73 0.10 . 1 . . . . . 2 ABU C . 51170 1 22 . 1 . 1 2 2 ABU CA C 13 49.02 0.10 . 1 . . . . . 2 ABU CA . 51170 1 23 . 1 . 1 2 2 ABU CB C 13 24.27 0.10 . 1 . . . . . 2 ABU CB . 51170 1 24 . 1 . 1 2 2 ABU CG C 13 9.91 0.10 . 1 . . . . . 2 ABU CG . 51170 1 25 . 1 . 1 2 2 ABU H H 1 8.625 0.01 . 1 . . . . . 2 ABU H . 51170 1 26 . 1 . 1 2 2 ABU HA H 1 4.987 0.01 . 1 . . . . . 2 ABU HA . 51170 1 27 . 1 . 1 2 2 ABU HB2 H 1 1.682 0.02 . 1 . . . . . 2 ABU HB2 . 51170 1 28 . 1 . 1 2 2 ABU HB3 H 1 1.682 0.02 . 1 . . . . . 2 ABU HB3 . 51170 1 29 . 1 . 1 2 2 ABU HG H 1 0.892 0.01 . 1 . . . . . 2 ABU HG . 51170 1 30 . 1 . 1 2 2 ABU N N 15 124.27 0.10 . 1 . . . . . 2 ABU N . 51170 1 31 . 1 . 1 3 3 SAR C C 13 170.74 0.10 . 1 . . . . . 3 SAR C . 51170 1 32 . 1 . 1 3 3 SAR CA C 13 50.17 0.10 . 1 . . . . . 3 SAR CA . 51170 1 33 . 1 . 1 3 3 SAR NC C 13 39.36 0.10 . 1 . . . . . 3 SAR NC . 51170 1 34 . 1 . 1 3 3 SAR HN H 1 3.362 0.01 . 1 . . . . . 3 SAR HN . 51170 1 35 . 1 . 1 3 3 SAR HA2 H 1 4.754 0.01 . 2 . . . . . 3 SAR HA2 . 51170 1 36 . 1 . 1 3 3 SAR HA3 H 1 3.160 0.01 . 2 . . . . . 3 SAR HA3 . 51170 1 37 . 1 . 1 3 3 SAR NC N 15 112.80 0.10 . 1 . . . . . 3 SAR NC . 51170 1 38 . 1 . 1 4 4 MLE C C 13 170.46 0.10 . 1 . . . . . 4 MLE C . 51170 1 39 . 1 . 1 4 4 MLE CA C 13 55.13 0.10 . 1 . . . . . 4 MLE CA . 51170 1 40 . 1 . 1 4 4 MLE CB C 13 35.93 0.10 . 1 . . . . . 4 MLE CB . 51170 1 41 . 1 . 1 4 4 MLE CG C 13 24.99 0.10 . 1 . . . . . 4 MLE CG . 51170 1 42 . 1 . 1 4 4 MLE CD1 C 13 23.45 0.10 . 1 . . . . . 4 MLE CD1 . 51170 1 43 . 1 . 1 4 4 MLE CD2 C 13 21.21 0.10 . 1 . . . . . 4 MLE CD2 . 51170 1 44 . 1 . 1 4 4 MLE NC C 13 31.08 0.10 . 1 . . . . . 4 MLE NC . 51170 1 45 . 1 . 1 4 4 MLE HN H 1 3.061 0.01 . 1 . . . . . 4 MLE HN . 51170 1 46 . 1 . 1 4 4 MLE HA H 1 5.288 0.01 . 1 . . . . . 4 MLE HA . 51170 1 47 . 1 . 1 4 4 MLE HB2 H 1 1.980 0.02 . 2 . . . . . 4 MLE HB2 . 51170 1 48 . 1 . 1 4 4 MLE HB3 H 1 1.575 0.02 . 2 . . . . . 4 MLE HB3 . 51170 1 49 . 1 . 1 4 4 MLE HG H 1 1.456 0.02 . 1 . . . . . 4 MLE HG . 51170 1 50 . 1 . 1 4 4 MLE HD11 H 1 0.947 0.01 . 1 . . . . . 4 MLE HD1 . 51170 1 51 . 1 . 1 4 4 MLE HD12 H 1 0.947 0.01 . 1 . . . . . 4 MLE HD1 . 51170 1 52 . 1 . 1 4 4 MLE HD13 H 1 0.947 0.01 . 1 . . . . . 4 MLE HD1 . 51170 1 53 . 1 . 1 4 4 MLE HD21 H 1 0.893 0.01 . 1 . . . . . 4 MLE HD2 . 51170 1 54 . 1 . 1 4 4 MLE HD22 H 1 0.893 0.01 . 1 . . . . . 4 MLE HD2 . 51170 1 55 . 1 . 1 4 4 MLE HD23 H 1 0.893 0.01 . 1 . . . . . 4 MLE HD2 . 51170 1 56 . 1 . 1 5 5 VAL C C 13 173.43 0.10 . 1 . . . . . 5 VAL C . 51170 1 57 . 1 . 1 5 5 VAL CA C 13 55.06 0.10 . 1 . . . . . 5 VAL CA . 51170 1 58 . 1 . 1 5 5 VAL CB C 13 31.29 0.10 . 1 . . . . . 5 VAL CB . 51170 1 59 . 1 . 1 5 5 VAL CG1 C 13 19.61 0.10 . 1 . . . . . 5 VAL CG1 . 51170 1 60 . 1 . 1 5 5 VAL CG2 C 13 18.26 0.10 . 1 . . . . . 5 VAL CG2 . 51170 1 61 . 1 . 1 5 5 VAL H H 1 7.341 0.01 . 1 . . . . . 5 VAL H . 51170 1 62 . 1 . 1 5 5 VAL HA H 1 4.668 0.01 . 1 . . . . . 5 VAL HA . 51170 1 63 . 1 . 1 5 5 VAL HB H 1 2.424 0.01 . 1 . . . . . 5 VAL HB . 51170 1 64 . 1 . 1 5 5 VAL HG11 H 1 1.055 0.01 . 1 . . . . . 5 VAL HG1 . 51170 1 65 . 1 . 1 5 5 VAL HG12 H 1 1.055 0.01 . 1 . . . . . 5 VAL HG1 . 51170 1 66 . 1 . 1 5 5 VAL HG13 H 1 1.055 0.01 . 1 . . . . . 5 VAL HG1 . 51170 1 67 . 1 . 1 5 5 VAL HG21 H 1 0.874 0.02 . 1 . . . . . 5 VAL HG2 . 51170 1 68 . 1 . 1 5 5 VAL HG22 H 1 0.874 0.02 . 1 . . . . . 5 VAL HG2 . 51170 1 69 . 1 . 1 5 5 VAL HG23 H 1 0.874 0.02 . 1 . . . . . 5 VAL HG2 . 51170 1 70 . 1 . 1 5 5 VAL N N 15 117.31 0.10 . 1 . . . . . 5 VAL N . 51170 1 71 . 1 . 1 6 6 MLE C C 13 171.37 0.10 . 1 . . . . . 6 MLE C . 51170 1 72 . 1 . 1 6 6 MLE CA C 13 54.29 0.10 . 1 . . . . . 6 MLE CA . 51170 1 73 . 1 . 1 6 6 MLE CB C 13 37.56 0.10 . 1 . . . . . 6 MLE CB . 51170 1 74 . 1 . 1 6 6 MLE CG C 13 24.49 0.10 . 1 . . . . . 6 MLE CG . 51170 1 75 . 1 . 1 6 6 MLE CD1 C 13 23.60 0.10 . 1 . . . . . 6 MLE CD1 . 51170 1 76 . 1 . 1 6 6 MLE CD2 C 13 21.51 0.10 . 1 . . . . . 6 MLE CD2 . 51170 1 77 . 1 . 1 6 6 MLE NC C 13 31.00 0.10 . 1 . . . . . 6 MLE NC . 51170 1 78 . 1 . 1 6 6 MLE HN H 1 3.263 0.01 . 1 . . . . . 6 MLE HN . 51170 1 79 . 1 . 1 6 6 MLE HA H 1 5.064 0.01 . 1 . . . . . 6 MLE HA . 51170 1 80 . 1 . 1 6 6 MLE HB2 H 1 2.041 0.02 . 2 . . . . . 6 MLE HB2 . 51170 1 81 . 1 . 1 6 6 MLE HB3 H 1 1.373 0.02 . 2 . . . . . 6 MLE HB3 . 51170 1 82 . 1 . 1 6 6 MLE HG H 1 1.740 0.02 . 1 . . . . . 6 MLE HG . 51170 1 83 . 1 . 1 6 6 MLE HD11 H 1 0.885 0.02 . 1 . . . . . 6 MLE HD1 . 51170 1 84 . 1 . 1 6 6 MLE HD12 H 1 0.885 0.02 . 1 . . . . . 6 MLE HD1 . 51170 1 85 . 1 . 1 6 6 MLE HD13 H 1 0.885 0.02 . 1 . . . . . 6 MLE HD1 . 51170 1 86 . 1 . 1 6 6 MLE HD21 H 1 0.762 0.02 . 1 . . . . . 6 MLE HD2 . 51170 1 87 . 1 . 1 6 6 MLE HD22 H 1 0.762 0.02 . 1 . . . . . 6 MLE HD2 . 51170 1 88 . 1 . 1 6 6 MLE HD23 H 1 0.762 0.02 . 1 . . . . . 6 MLE HD2 . 51170 1 89 . 1 . 1 7 7 ALA C C 13 171.11 0.10 . 1 . . . . . 7 ALA C . 51170 1 90 . 1 . 1 7 7 ALA CA C 13 48.05 0.10 . 1 . . . . . 7 ALA CA . 51170 1 91 . 1 . 1 7 7 ALA CB C 13 15.23 0.10 . 1 . . . . . 7 ALA CB . 51170 1 92 . 1 . 1 7 7 ALA HA H 1 4.474 0.01 . 1 . . . . . 7 ALA HA . 51170 1 93 . 1 . 1 7 7 ALA HB1 H 1 1.334 0.01 . 1 . . . . . 7 ALA HB . 51170 1 94 . 1 . 1 7 7 ALA HB2 H 1 1.334 0.01 . 1 . . . . . 7 ALA HB . 51170 1 95 . 1 . 1 7 7 ALA HB3 H 1 1.334 0.01 . 1 . . . . . 7 ALA HB . 51170 1 96 . 1 . 1 7 7 ALA H H 1 7.944 0.01 . 1 . . . . . 7 ALA H . 51170 1 97 . 1 . 1 7 7 ALA N N 15 129.98 0.10 . 1 . . . . . 7 ALA N . 51170 1 98 . 1 . 1 8 8 DAL C C 13 173.74 0.10 . 1 . . . . . 8 DAL C . 51170 1 99 . 1 . 1 8 8 DAL CA C 13 44.74 0.10 . 1 . . . . . 8 DAL CA . 51170 1 100 . 1 . 1 8 8 DAL CB C 13 17.95 0.10 . 1 . . . . . 8 DAL CB . 51170 1 101 . 1 . 1 8 8 DAL HA H 1 4.846 0.02 . 1 . . . . . 8 DAL HA . 51170 1 102 . 1 . 1 8 8 DAL HB1 H 1 1.269 0.01 . 1 . . . . . 8 DAL HB . 51170 1 103 . 1 . 1 8 8 DAL HB2 H 1 1.269 0.01 . 1 . . . . . 8 DAL HB . 51170 1 104 . 1 . 1 8 8 DAL HB3 H 1 1.269 0.01 . 1 . . . . . 8 DAL HB . 51170 1 105 . 1 . 1 8 8 DAL H H 1 7.278 0.02 . 1 . . . . . 8 DAL H . 51170 1 106 . 1 . 1 9 9 MLE C C 13 170.74 0.10 . 1 . . . . . 9 MLE C . 51170 1 107 . 1 . 1 9 9 MLE CA C 13 48.01 0.10 . 1 . . . . . 9 MLE CA . 51170 1 108 . 1 . 1 9 9 MLE CB C 13 39.23 0.10 . 1 . . . . . 9 MLE CB . 51170 1 109 . 1 . 1 9 9 MLE CG C 13 24.74 0.10 . 1 . . . . . 9 MLE CG . 51170 1 110 . 1 . 1 9 9 MLE CD1 C 13 23.82 0.10 . 1 . . . . . 9 MLE CD1 . 51170 1 111 . 1 . 1 9 9 MLE CD2 C 13 21.78 0.10 . 1 . . . . . 9 MLE CD2 . 51170 1 112 . 1 . 1 9 9 MLE NC C 13 29.68 0.10 . 1 . . . . . 9 MLE NC . 51170 1 113 . 1 . 1 9 9 MLE HN H 1 3.156 0.01 . 1 . . . . . 9 MLE HN . 51170 1 114 . 1 . 1 9 9 MLE HA H 1 5.692 0.01 . 1 . . . . . 9 MLE HA . 51170 1 115 . 1 . 1 9 9 MLE HB2 H 1 2.138 0.02 . 2 . . . . . 9 MLE HB2 . 51170 1 116 . 1 . 1 9 9 MLE HB3 H 1 1.176 0.02 . 2 . . . . . 9 MLE HB3 . 51170 1 117 . 1 . 1 9 9 MLE HG H 1 1.329 0.02 . 1 . . . . . 9 MLE HG . 51170 1 118 . 1 . 1 9 9 MLE HD11 H 1 0.957 0.02 . 1 . . . . . 9 MLE HD1 . 51170 1 119 . 1 . 1 9 9 MLE HD12 H 1 0.957 0.02 . 1 . . . . . 9 MLE HD1 . 51170 1 120 . 1 . 1 9 9 MLE HD13 H 1 0.957 0.02 . 1 . . . . . 9 MLE HD1 . 51170 1 121 . 1 . 1 9 9 MLE HD21 H 1 0.871 0.02 . 1 . . . . . 9 MLE HD2 . 51170 1 122 . 1 . 1 9 9 MLE HD22 H 1 0.871 0.02 . 1 . . . . . 9 MLE HD2 . 51170 1 123 . 1 . 1 9 9 MLE HD23 H 1 0.871 0.02 . 1 . . . . . 9 MLE HD2 . 51170 1 124 . 1 . 1 9 9 MLE NC N 15 111.00 0.10 . 1 . . . . . 9 MLE NC . 51170 1 125 . 1 . 1 10 10 MLE C C 13 169.76 0.10 . 1 . . . . . 10 MLE C . 51170 1 126 . 1 . 1 10 10 MLE CA C 13 57.57 0.10 . 1 . . . . . 10 MLE CA . 51170 1 127 . 1 . 1 10 10 MLE CB C 13 40.63 0.10 . 1 . . . . . 10 MLE CB . 51170 1 128 . 1 . 1 10 10 MLE CG C 13 24.28 0.10 . 1 . . . . . 10 MLE CG . 51170 1 129 . 1 . 1 10 10 MLE CD1 C 13 23.94 0.10 . 2 . . . . . 10 MLE CD1 . 51170 1 130 . 1 . 1 10 10 MLE CD2 C 13 23.91 0.10 . 2 . . . . . 10 MLE CD2 . 51170 1 131 . 1 . 1 10 10 MLE NC C 13 29.93 0.10 . 1 . . . . . 10 MLE NC . 51170 1 132 . 1 . 1 10 10 MLE HN H 1 2.665 0.01 . 1 . . . . . 10 MLE HN . 51170 1 133 . 1 . 1 10 10 MLE HA H 1 5.118 0.01 . 1 . . . . . 10 MLE HA . 51170 1 134 . 1 . 1 10 10 MLE HB2 H 1 2.045 0.02 . 2 . . . . . 10 MLE HB2 . 51170 1 135 . 1 . 1 10 10 MLE HB3 H 1 1.337 0.02 . 2 . . . . . 10 MLE HB3 . 51170 1 136 . 1 . 1 10 10 MLE HG H 1 1.480 0.02 . 1 . . . . . 10 MLE HG . 51170 1 137 . 1 . 1 10 10 MLE HD11 H 1 1.027 0.02 . 2 . . . . . 10 MLE HD1 . 51170 1 138 . 1 . 1 10 10 MLE HD12 H 1 1.027 0.02 . 2 . . . . . 10 MLE HD1 . 51170 1 139 . 1 . 1 10 10 MLE HD13 H 1 1.027 0.02 . 2 . . . . . 10 MLE HD1 . 51170 1 140 . 1 . 1 10 10 MLE HD21 H 1 1.027 0.02 . 2 . . . . . 10 MLE HD2 . 51170 1 141 . 1 . 1 10 10 MLE HD22 H 1 1.027 0.02 . 2 . . . . . 10 MLE HD2 . 51170 1 142 . 1 . 1 10 10 MLE HD23 H 1 1.027 0.02 . 2 . . . . . 10 MLE HD2 . 51170 1 143 . 1 . 1 10 10 MLE NC N 15 126.30 0.10 . 1 . . . . . 10 MLE NC . 51170 1 144 . 1 . 1 11 11 MVA C C 13 171.89 0.10 . 1 . . . . . 11 MVA C . 51170 1 145 . 1 . 1 11 11 MVA CA C 13 62.72 0.10 . 1 . . . . . 11 MVA CA . 51170 1 146 . 1 . 1 11 11 MVA CB C 13 28.83 0.10 . 1 . . . . . 11 MVA CB . 51170 1 147 . 1 . 1 11 11 MVA CG1 C 13 19.13 0.10 . 1 . . . . . 11 MVA CG1 . 51170 1 148 . 1 . 1 11 11 MVA CG2 C 13 20.16 0.10 . 1 . . . . . 11 MVA CG2 . 51170 1 149 . 1 . 1 11 11 MVA NC C 13 29.73 0.10 . 1 . . . . . 11 MVA NC . 51170 1 150 . 1 . 1 11 11 MVA HA H 1 4.553 0.01 . 1 . . . . . 11 MVA HA . 51170 1 151 . 1 . 1 11 11 MVA HB H 1 2.087 0.01 . 1 . . . . . 11 MVA HB . 51170 1 152 . 1 . 1 11 11 MVA HG11 H 1 0.945 0.01 . 1 . . . . . 11 MVA HG1 . 51170 1 153 . 1 . 1 11 11 MVA HG12 H 1 0.945 0.01 . 1 . . . . . 11 MVA HG1 . 51170 1 154 . 1 . 1 11 11 MVA HG13 H 1 0.945 0.01 . 1 . . . . . 11 MVA HG1 . 51170 1 155 . 1 . 1 11 11 MVA HG21 H 1 0.806 0.01 . 1 . . . . . 11 MVA HG2 . 51170 1 156 . 1 . 1 11 11 MVA HG22 H 1 0.806 0.01 . 1 . . . . . 11 MVA HG2 . 51170 1 157 . 1 . 1 11 11 MVA HG23 H 1 0.806 0.01 . 1 . . . . . 11 MVA HG2 . 51170 1 158 . 1 . 1 11 11 MVA HN H 1 2.697 0.01 . 1 . . . . . 11 MVA HN . 51170 1 159 . 1 . 1 11 11 MVA NC N 15 116.00 0.10 . 1 . . . . . 11 MVA NC . 51170 1 stop_ save_