################################### # 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 31015 _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 '3D 1H-13C NOESY' . . . 31015 1 2 '3D 1H-15N NOESY' . . . 31015 1 3 '2D 1H-13C HSQC aliphatic' . . . 31015 1 4 '2D 1H-13C HSQC aromatic' . . . 31015 1 5 '3D C(CO)NH' . . . 31015 1 6 '3D HNCACB' . . . 31015 1 7 '3D HNCO' . . . 31015 1 8 '3D H(CCO)NH' . . . 31015 1 9 '3D CBCA(CO)NH' . . . 31015 1 10 '2D 1H-15N HSQC' . . . 31015 1 11 '2D 1H-15N HSQC' . . . 31015 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 GLY H H 1 8.2933 0.0000 . 1 . . . . A 1 GLY H1 . 31015 1 2 . 1 . 1 1 1 GLY HA2 H 1 3.9620 0.0000 . 2 . . 20550 . A 1 GLY HA2 . 31015 1 3 . 1 . 1 1 1 GLY C C 13 177.7573 0.0000 . 1 . . . . A 1 GLY C . 31015 1 4 . 1 . 1 1 1 GLY CA C 13 45.8000 0.0000 . 1 . . . . A 1 GLY CA . 31015 1 5 . 1 . 1 1 1 GLY N N 15 109.1532 0.0000 . 1 . . . . A 1 GLY N . 31015 1 6 . 1 . 1 2 2 LYS CA C 13 57.0000 0.0000 . 1 . . . . A 2 LYS CA . 31015 1 7 . 1 . 1 2 2 LYS CB C 13 32.7000 0.0000 . 1 . . . . A 2 LYS CB . 31015 1 8 . 1 . 1 3 3 THR CA C 13 61.9149 0.0000 . 1 . . . . A 3 THR CA . 31015 1 9 . 1 . 1 3 3 THR CB C 13 69.9872 0.0000 . 1 . . . . A 3 THR CB . 31015 1 10 . 1 . 1 5 5 PRO HA H 1 4.1970 0.0000 . 1 . . 20622 . A 5 PRO HA . 31015 1 11 . 1 . 1 5 5 PRO HB2 H 1 2.3240 0.0000 . 2 . . 20652 . A 5 PRO HB2 . 31015 1 12 . 1 . 1 5 5 PRO HG2 H 1 2.3240 0.0000 . 2 . . 20652 . A 5 PRO HG2 . 31015 1 13 . 1 . 1 5 5 PRO CA C 13 58.8540 0.0000 . 1 . . 19986 . A 5 PRO CA . 31015 1 14 . 1 . 1 5 5 PRO CB C 13 35.6690 0.0000 . 1 . . 19998 . A 5 PRO CB . 31015 1 15 . 1 . 1 5 5 PRO CG C 13 28.9770 0.0000 . 1 . . 20010 . A 5 PRO CG . 31015 1 16 . 1 . 1 6 6 GLU H H 1 8.3987 0.0000 . 1 . . 17584 . A 6 GLU H . 31015 1 17 . 1 . 1 6 6 GLU HA H 1 4.0010 0.0000 . 1 . . 20349 . A 6 GLU HA . 31015 1 18 . 1 . 1 6 6 GLU HB2 H 1 1.9900 0.0000 . 2 . . 20382 . A 6 GLU HB2 . 31015 1 19 . 1 . 1 6 6 GLU HB3 H 1 1.8220 0.0000 . 2 . . . . A 6 GLU HB3 . 31015 1 20 . 1 . 1 6 6 GLU HG2 H 1 2.2670 0.0000 . 2 . . 20379 . A 6 GLU HG2 . 31015 1 21 . 1 . 1 6 6 GLU HG3 H 1 2.3122 0.0000 . 2 . . . . A 6 GLU HG3 . 31015 1 22 . 1 . 1 6 6 GLU CA C 13 59.3272 0.0000 . 1 . . 21016 . A 6 GLU CA . 31015 1 23 . 1 . 1 6 6 GLU CB C 13 29.2295 0.0000 . 1 . . 21012 . A 6 GLU CB . 31015 1 24 . 1 . 1 6 6 GLU CG C 13 37.0090 0.0000 . 1 . . 19680 . A 6 GLU CG . 31015 1 25 . 1 . 1 6 6 GLU N N 15 119.5793 0.0000 . 1 . . 17586 . A 6 GLU N . 31015 1 26 . 1 . 1 7 7 LEU H H 1 7.7386 0.0000 . 1 . . 11950 . A 7 LEU H . 31015 1 27 . 1 . 1 7 7 LEU HA H 1 3.8570 0.0000 . 1 . . 20544 . A 7 LEU HA . 31015 1 28 . 1 . 1 7 7 LEU HB2 H 1 1.8210 0.0000 . 2 . . 20586 . A 7 LEU HB2 . 31015 1 29 . 1 . 1 7 7 LEU HB3 H 1 1.2213 0.0000 . 2 . . . . A 7 LEU HB3 . 31015 1 30 . 1 . 1 7 7 LEU HG H 1 1.5079 0.0000 . 1 . . 20586 . A 7 LEU HG . 31015 1 31 . 1 . 1 7 7 LEU HD11 H 1 0.9280 0.0000 . 2 . . . . A 7 LEU HD11 . 31015 1 32 . 1 . 1 7 7 LEU HD12 H 1 0.9280 0.0000 . 2 . . . . A 7 LEU HD12 . 31015 1 33 . 1 . 1 7 7 LEU HD13 H 1 0.9280 0.0000 . 2 . . . . A 7 LEU HD13 . 31015 1 34 . 1 . 1 7 7 LEU HD21 H 1 0.9140 0.0000 . 2 . . 20589 . A 7 LEU HD21 . 31015 1 35 . 1 . 1 7 7 LEU HD22 H 1 0.9140 0.0000 . 2 . . 20589 . A 7 LEU HD22 . 31015 1 36 . 1 . 1 7 7 LEU HD23 H 1 0.9140 0.0000 . 2 . . 20589 . A 7 LEU HD23 . 31015 1 37 . 1 . 1 7 7 LEU CA C 13 58.0810 0.0000 . 1 . . 20914 . A 7 LEU CA . 31015 1 38 . 1 . 1 7 7 LEU CB C 13 41.3659 0.0000 . 1 . . 20910 . A 7 LEU CB . 31015 1 39 . 1 . 1 7 7 LEU CG C 13 25.1081 0.0000 . 1 . . 19938 . A 7 LEU CG . 31015 1 40 . 1 . 1 7 7 LEU CD1 C 13 24.0800 0.0000 . 2 . . 19944 . A 7 LEU CD1 . 31015 1 41 . 1 . 1 7 7 LEU CD2 C 13 25.6960 0.0000 . 2 . . 19941 . A 7 LEU CD2 . 31015 1 42 . 1 . 1 7 7 LEU N N 15 122.9636 0.0000 . 1 . . 11952 . A 7 LEU N . 31015 1 43 . 1 . 1 8 8 LYS H H 1 7.8699 0.0000 . 1 . . 12196 . A 8 LYS H . 31015 1 44 . 1 . 1 8 8 LYS HA H 1 3.8810 0.0000 . 1 . . 20628 . A 8 LYS HA . 31015 1 45 . 1 . 1 8 8 LYS HB2 H 1 1.8230 0.0000 . 2 . . . . A 8 LYS HB2 . 31015 1 46 . 1 . 1 8 8 LYS HB3 H 1 2.2636 0.0000 . 2 . . . . A 8 LYS HB3 . 31015 1 47 . 1 . 1 8 8 LYS HG2 H 1 1.3640 0.0000 . 2 . . . . A 8 LYS HG2 . 31015 1 48 . 1 . 1 8 8 LYS HD2 H 1 1.5780 0.0000 . 2 . . . . A 8 LYS HD2 . 31015 1 49 . 1 . 1 8 8 LYS HE2 H 1 2.9780 0.0000 . 2 . . 20631 . A 8 LYS HE2 . 31015 1 50 . 1 . 1 8 8 LYS CA C 13 59.7207 0.0000 . 1 . . 21018 . A 8 LYS CA . 31015 1 51 . 1 . 1 8 8 LYS CB C 13 32.5555 0.0000 . 1 . . 21020 . A 8 LYS CB . 31015 1 52 . 1 . 1 8 8 LYS CG C 13 24.8950 0.0000 . 1 . . 20016 . A 8 LYS CG . 31015 1 53 . 1 . 1 8 8 LYS CD C 13 29.4730 0.0000 . 1 . . 19992 . A 8 LYS CD . 31015 1 54 . 1 . 1 8 8 LYS CE C 13 41.8660 0.0000 . 1 . . . . A 8 LYS CE . 31015 1 55 . 1 . 1 8 8 LYS N N 15 118.6831 0.0000 . 1 . . 12198 . A 8 LYS N . 31015 1 56 . 1 . 1 9 9 GLN H H 1 7.9815 0.0000 . 1 . . 12166 . A 9 GLN H . 31015 1 57 . 1 . 1 9 9 GLN HA H 1 4.1690 0.0000 . 1 . . 20472 . A 9 GLN HA . 31015 1 58 . 1 . 1 9 9 GLN CA C 13 58.6980 0.0000 . 1 . . 21006 . A 9 GLN CA . 31015 1 59 . 1 . 1 9 9 GLN CB C 13 28.2041 0.0000 . 1 . . 21004 . A 9 GLN CB . 31015 1 60 . 1 . 1 9 9 GLN CG C 13 33.3380 0.0000 . 1 . . 19872 . A 9 GLN CG . 31015 1 61 . 1 . 1 9 9 GLN N N 15 119.3905 0.0000 . 1 . . 12168 . A 9 GLN N . 31015 1 62 . 1 . 1 10 10 CYS H H 1 8.1523 0.0000 . 1 . . 14851 . A 10 CYS H . 31015 1 63 . 1 . 1 10 10 CYS HA H 1 4.3220 0.0000 . 1 . . . . A 10 CYS HA . 31015 1 64 . 1 . 1 10 10 CYS HB2 H 1 3.2450 0.0000 . 2 . . 20697 . A 10 CYS HB2 . 31015 1 65 . 1 . 1 10 10 CYS HB3 H 1 3.5080 0.0000 . 2 . . 20694 . A 10 CYS HB3 . 31015 1 66 . 1 . 1 10 10 CYS CA C 13 60.5450 0.0000 . 1 . . 21000 . A 10 CYS CA . 31015 1 67 . 1 . 1 10 10 CYS CB C 13 37.1004 0.0000 . 1 . . 21002 . A 10 CYS CB . 31015 1 68 . 1 . 1 10 10 CYS N N 15 120.9312 0.0000 . 1 . . 14853 . A 10 CYS N . 31015 1 69 . 1 . 1 11 11 LYS H H 1 8.3565 0.0000 . 1 . . 12208 . A 11 LYS H . 31015 1 70 . 1 . 1 11 11 LYS HA H 1 4.0000 0.0000 . 1 . . . . A 11 LYS HA . 31015 1 71 . 1 . 1 11 11 LYS HG2 H 1 1.9700 0.0000 . 2 . . . . A 11 LYS HG2 . 31015 1 72 . 1 . 1 11 11 LYS CA C 13 61.1758 0.0000 . 1 . . 12206 . A 11 LYS CA . 31015 1 73 . 1 . 1 11 11 LYS CB C 13 32.3531 0.0000 . 1 . . 12209 . A 11 LYS CB . 31015 1 74 . 1 . 1 11 11 LYS CD C 13 29.8750 0.0000 . 1 . . . . A 11 LYS CD . 31015 1 75 . 1 . 1 11 11 LYS CE C 13 41.8700 0.0000 . 1 . . . . A 11 LYS CE . 31015 1 76 . 1 . 1 11 11 LYS N N 15 118.4802 0.0000 . 1 . . 12210 . A 11 LYS N . 31015 1 77 . 1 . 1 12 12 HIS H H 1 8.3364 0.0000 . 1 . . 14749 . A 12 HIS H . 31015 1 78 . 1 . 1 12 12 HIS HA H 1 4.2200 0.0000 . 1 . . . . A 12 HIS HA . 31015 1 79 . 1 . 1 12 12 HIS HB2 H 1 3.1700 0.0000 . 2 . . 20721 . A 12 HIS HB2 . 31015 1 80 . 1 . 1 12 12 HIS HB3 H 1 3.2930 0.0000 . 2 . . . . A 12 HIS HB3 . 31015 1 81 . 1 . 1 12 12 HIS HD2 H 1 7.1350 0.0000 . 1 . . . . A 12 HIS HD2 . 31015 1 82 . 1 . 1 12 12 HIS HE1 H 1 8.1590 0.0000 . 1 . . . . A 12 HIS HE1 . 31015 1 83 . 1 . 1 12 12 HIS CA C 13 60.3321 0.0000 . 1 . . 14753 . A 12 HIS CA . 31015 1 84 . 1 . 1 12 12 HIS CB C 13 30.3400 0.0000 . 1 . . 20073 . A 12 HIS CB . 31015 1 85 . 1 . 1 12 12 HIS CD2 C 13 120.0520 0.0000 . 1 . . . . A 12 HIS CD2 . 31015 1 86 . 1 . 1 12 12 HIS CE1 C 13 137.6570 0.0000 . 1 . . . . A 12 HIS CE1 . 31015 1 87 . 1 . 1 12 12 HIS N N 15 121.1102 0.0000 . 1 . . 14751 . A 12 HIS N . 31015 1 88 . 1 . 1 13 13 GLN H H 1 8.2510 0.0000 . 1 . . 12241 . A 13 GLN H . 31015 1 89 . 1 . 1 13 13 GLN HA H 1 3.9520 0.0000 . 1 . . 20733 . A 13 GLN HA . 31015 1 90 . 1 . 1 13 13 GLN HB2 H 1 2.0680 0.0000 . 2 . . . . A 13 GLN HB2 . 31015 1 91 . 1 . 1 13 13 GLN HG2 H 1 2.5300 0.0000 . 2 . . 20739 . A 13 GLN HG2 . 31015 1 92 . 1 . 1 13 13 GLN HG3 H 1 2.1030 0.0000 . 2 . . . . A 13 GLN HG3 . 31015 1 93 . 1 . 1 13 13 GLN CA C 13 58.5387 0.0000 . 1 . . 12233 . A 13 GLN CA . 31015 1 94 . 1 . 1 13 13 GLN CB C 13 27.9169 0.0000 . 1 . . 12236 . A 13 GLN CB . 31015 1 95 . 1 . 1 13 13 GLN CG C 13 34.1170 0.0000 . 1 . . 20100 . A 13 GLN CG . 31015 1 96 . 1 . 1 13 13 GLN N N 15 116.7400 0.0000 . 1 . . 12243 . A 13 GLN N . 31015 1 97 . 1 . 1 14 14 CYS H H 1 7.7624 0.0000 . 1 . . 12253 . A 14 CYS H . 31015 1 98 . 1 . 1 14 14 CYS HA H 1 4.4820 0.0000 . 1 . . . . A 14 CYS HA . 31015 1 99 . 1 . 1 14 14 CYS HB2 H 1 3.3900 0.0000 . 2 . . 20736 . A 14 CYS HB2 . 31015 1 100 . 1 . 1 14 14 CYS HB3 H 1 3.2245 0.0000 . 2 . . 20736 . A 14 CYS HB3 . 31015 1 101 . 1 . 1 14 14 CYS CA C 13 57.4147 0.0000 . 1 . . 12254 . A 14 CYS CA . 31015 1 102 . 1 . 1 14 14 CYS CB C 13 37.1530 0.0000 . 1 . . 12257 . A 14 CYS CB . 31015 1 103 . 1 . 1 14 14 CYS N N 15 116.2651 0.0000 . 1 . . 12255 . A 14 CYS N . 31015 1 104 . 1 . 1 15 15 LYS H H 1 7.4734 0.0000 . 1 . . 12556 . A 15 LYS H . 31015 1 105 . 1 . 1 15 15 LYS HA H 1 3.9990 0.0000 . 1 . . . . A 15 LYS HA . 31015 1 106 . 1 . 1 15 15 LYS HB2 H 1 1.9500 0.0000 . 2 . . . . A 15 LYS HB2 . 31015 1 107 . 1 . 1 15 15 LYS CA C 13 58.6941 0.0000 . 1 . . 12260 . A 15 LYS CA . 31015 1 108 . 1 . 1 15 15 LYS CB C 13 32.6805 0.0000 . 1 . . 12263 . A 15 LYS CB . 31015 1 109 . 1 . 1 15 15 LYS N N 15 116.0675 0.0000 . 1 . . 12558 . A 15 LYS N . 31015 1 110 . 1 . 1 16 16 VAL HA H 1 4.2530 0.0000 . 1 . . 20400 . A 16 VAL HA . 31015 1 111 . 1 . 1 16 16 VAL HB H 1 2.3245 0.0000 . 1 . . . . A 16 VAL HB . 31015 1 112 . 1 . 1 16 16 VAL HG11 H 1 0.7840 0.0000 . 2 . . . . A 16 VAL HG11 . 31015 1 113 . 1 . 1 16 16 VAL HG12 H 1 0.7840 0.0000 . 2 . . . . A 16 VAL HG12 . 31015 1 114 . 1 . 1 16 16 VAL HG13 H 1 0.7840 0.0000 . 2 . . . . A 16 VAL HG13 . 31015 1 115 . 1 . 1 16 16 VAL HG21 H 1 0.7327 0.0000 . 2 . . 20394 . A 16 VAL HG21 . 31015 1 116 . 1 . 1 16 16 VAL HG22 H 1 0.7327 0.0000 . 2 . . 20394 . A 16 VAL HG22 . 31015 1 117 . 1 . 1 16 16 VAL HG23 H 1 0.7327 0.0000 . 2 . . 20394 . A 16 VAL HG23 . 31015 1 118 . 1 . 1 16 16 VAL CA C 13 61.4547 0.0000 . 1 . . . . A 16 VAL CA . 31015 1 119 . 1 . 1 16 16 VAL CB C 13 31.4315 0.0000 . 1 . . . . A 16 VAL CB . 31015 1 120 . 1 . 1 16 16 VAL CG1 C 13 18.4300 0.0000 . 2 . . . . A 16 VAL CG1 . 31015 1 121 . 1 . 1 16 16 VAL CG2 C 13 20.5520 0.0000 . 2 . . 19821 . A 16 VAL CG2 . 31015 1 122 . 1 . 1 16 16 VAL N N 15 110.3300 0.0000 . 1 . . . . A 16 VAL N . 31015 1 123 . 1 . 1 17 17 GLN H H 1 7.0177 0.0000 . 1 . . . . A 17 GLN H . 31015 1 124 . 1 . 1 17 17 GLN HA H 1 4.0718 0.0000 . 1 . . . . A 17 GLN HA . 31015 1 125 . 1 . 1 17 17 GLN HB2 H 1 1.7932 0.0000 . 2 . . . . A 17 GLN HB2 . 31015 1 126 . 1 . 1 17 17 GLN HG2 H 1 2.2646 0.0000 . 2 . . . . A 17 GLN HG2 . 31015 1 127 . 1 . 1 17 17 GLN CA C 13 55.8848 0.0000 . 1 . . . . A 17 GLN CA . 31015 1 128 . 1 . 1 17 17 GLN CB C 13 27.8191 0.0000 . 1 . . . . A 17 GLN CB . 31015 1 129 . 1 . 1 17 17 GLN CG C 13 32.8538 0.0000 . 1 . . . . A 17 GLN CG . 31015 1 130 . 1 . 1 17 17 GLN N N 15 121.7048 0.0000 . 1 . . . . A 17 GLN N . 31015 1 131 . 1 . 1 18 18 ARG H H 1 8.3600 0.0000 . 1 . . . . A 18 ARG H . 31015 1 132 . 1 . 1 18 18 ARG HA H 1 4.0791 0.0000 . 1 . . . . A 18 ARG HA . 31015 1 133 . 1 . 1 18 18 ARG HB2 H 1 1.7514 0.0000 . 2 . . . . A 18 ARG HB2 . 31015 1 134 . 1 . 1 18 18 ARG HB3 H 1 1.7989 0.0000 . 2 . . . . A 18 ARG HB3 . 31015 1 135 . 1 . 1 18 18 ARG CA C 13 55.9060 0.0000 . 1 . . . . A 18 ARG CA . 31015 1 136 . 1 . 1 18 18 ARG CB C 13 30.2960 0.0000 . 1 . . . . A 18 ARG CB . 31015 1 137 . 1 . 1 18 18 ARG N N 15 125.8832 0.0000 . 1 . . . . A 18 ARG N . 31015 1 138 . 1 . 1 19 19 GLN HA H 1 4.2820 0.0000 . 1 . . 20619 . A 19 GLN HA . 31015 1 139 . 1 . 1 19 19 GLN HB2 H 1 2.30405 0.0000 . 2 . . . . A 19 GLN HB2 . 31015 1 140 . 1 . 1 19 19 GLN HG2 H 1 2.2310 0.0000 . 2 . . 20658 . A 19 GLN HG2 . 31015 1 141 . 1 . 1 19 19 GLN CA C 13 56.3677 0.0000 . 1 . . 17846 . A 19 GLN CA . 31015 1 142 . 1 . 1 19 19 GLN CB C 13 28.1456 0.0000 . 1 . . 17849 . A 19 GLN CB . 31015 1 143 . 1 . 1 19 19 GLN CG C 13 33.5720 0.0000 . 1 . . 20001 . A 19 GLN CG . 31015 1 144 . 1 . 1 20 20 TYR H H 1 7.2209 0.0000 . 1 . . 17833 . A 20 TYR H . 31015 1 145 . 1 . 1 20 20 TYR HA H 1 5.1100 0.0000 . 1 . . 20385 . A 20 TYR HA . 31015 1 146 . 1 . 1 20 20 TYR HB2 H 1 3.0600 0.0000 . 2 . . 20391 . A 20 TYR HB2 . 31015 1 147 . 1 . 1 20 20 TYR HB3 H 1 3.3010 0.0000 . 2 . . 20388 . A 20 TYR HB3 . 31015 1 148 . 1 . 1 20 20 TYR HD1 H 1 6.9770 0.0000 . 3 . . . . A 20 TYR HD1 . 31015 1 149 . 1 . 1 20 20 TYR HE1 H 1 6.7910 0.0000 . 3 . . . . A 20 TYR HE1 . 31015 1 150 . 1 . 1 20 20 TYR CA C 13 53.8361 0.0000 . 1 . . 17837 . A 20 TYR CA . 31015 1 151 . 1 . 1 20 20 TYR CB C 13 39.4828 0.0000 . 1 . . 17906 . A 20 TYR CB . 31015 1 152 . 1 . 1 20 20 TYR CD1 C 13 131.0350 0.0000 . 2 . . . . A 20 TYR CD1 . 31015 1 153 . 1 . 1 20 20 TYR CE1 C 13 118.2020 0.0000 . 2 . . . . A 20 TYR CE1 . 31015 1 154 . 1 . 1 20 20 TYR N N 15 119.5240 0.0000 . 1 . . 17835 . A 20 TYR N . 31015 1 155 . 1 . 1 21 21 ASP H H 1 8.5572 0.0000 . 1 . . 13538 . A 21 ASP H . 31015 1 156 . 1 . 1 21 21 ASP HA H 1 4.7540 0.0000 . 1 . . 20709 . A 21 ASP HA . 31015 1 157 . 1 . 1 21 21 ASP HB2 H 1 2.7850 0.0000 . 2 . . 20715 . A 21 ASP HB2 . 31015 1 158 . 1 . 1 21 21 ASP HB3 H 1 3.2020 0.0000 . 2 . . 20712 . A 21 ASP HB3 . 31015 1 159 . 1 . 1 21 21 ASP CA C 13 52.4222 0.0000 . 1 . . 13542 . A 21 ASP CA . 31015 1 160 . 1 . 1 21 21 ASP CB C 13 40.8149 0.0000 . 1 . . 13548 . A 21 ASP CB . 31015 1 161 . 1 . 1 21 21 ASP N N 15 121.9988 0.0000 . 1 . . 13540 . A 21 ASP N . 31015 1 162 . 1 . 1 22 22 GLU H H 1 8.4934 0.0000 . 1 . . 12229 . A 22 GLU H . 31015 1 163 . 1 . 1 22 22 GLU HA H 1 3.9310 0.0000 . 1 . . 20553 . A 22 GLU HA . 31015 1 164 . 1 . 1 22 22 GLU HB2 H 1 2.0910 0.0000 . 2 . . 20577 . A 22 GLU HB2 . 31015 1 165 . 1 . 1 22 22 GLU HG2 H 1 2.4020 0.0000 . 2 . . 20571 . A 22 GLU HG2 . 31015 1 166 . 1 . 1 22 22 GLU CA C 13 60.3053 0.0000 . 1 . . 12221 . A 22 GLU CA . 31015 1 167 . 1 . 1 22 22 GLU CB C 13 29.3632 0.0000 . 1 . . 12227 . A 22 GLU CB . 31015 1 168 . 1 . 1 22 22 GLU CG C 13 36.1850 0.0000 . 1 . . . . A 22 GLU CG . 31015 1 169 . 1 . 1 22 22 GLU N N 15 117.5237 0.0000 . 1 . . 12231 . A 22 GLU N . 31015 1 170 . 1 . 1 23 23 GLU H H 1 8.1865 0.0000 . 1 . . 12100 . A 23 GLU H . 31015 1 171 . 1 . 1 23 23 GLU HA H 1 4.1070 0.0000 . 1 . . 20547 . A 23 GLU HA . 31015 1 172 . 1 . 1 23 23 GLU HB2 H 1 2.0290 0.0000 . 2 . . 20580 . A 23 GLU HB2 . 31015 1 173 . 1 . 1 23 23 GLU HG2 H 1 2.2500 0.0000 . 2 . . 20574 . A 23 GLU HG2 . 31015 1 174 . 1 . 1 23 23 GLU CA C 13 59.5726 0.0000 . 1 . . 21291 . A 23 GLU CA . 31015 1 175 . 1 . 1 23 23 GLU CB C 13 29.1913 0.0000 . 1 . . 21287 . A 23 GLU CB . 31015 1 176 . 1 . 1 23 23 GLU CG C 13 36.2800 0.0000 . 1 . . 19923 . A 23 GLU CG . 31015 1 177 . 1 . 1 23 23 GLU N N 15 120.7923 0.0000 . 1 . . 12102 . A 23 GLU N . 31015 1 178 . 1 . 1 24 24 GLN H H 1 8.7702 0.0000 . 1 . . 12085 . A 24 GLN H . 31015 1 179 . 1 . 1 24 24 GLN HA H 1 3.8310 0.0000 . 1 . . 20409 . A 24 GLN HA . 31015 1 180 . 1 . 1 24 24 GLN HB2 H 1 2.0960 0.0000 . 2 . . 20442 . A 24 GLN HB2 . 31015 1 181 . 1 . 1 24 24 GLN HG2 H 1 2.5230 0.0000 . 2 . . 20430 . A 24 GLN HG2 . 31015 1 182 . 1 . 1 24 24 GLN CA C 13 58.7042 0.0000 . 1 . . 20746 . A 24 GLN CA . 31015 1 183 . 1 . 1 24 24 GLN CB C 13 28.1765 0.0000 . 1 . . 20748 . A 24 GLN CB . 31015 1 184 . 1 . 1 24 24 GLN CG C 13 34.3920 0.0000 . 1 . . 19788 . A 24 GLN CG . 31015 1 185 . 1 . 1 24 24 GLN N N 15 120.7005 0.0000 . 1 . . 12087 . A 24 GLN N . 31015 1 186 . 1 . 1 25 25 LYS H H 1 8.6379 0.0000 . 1 . . 12013 . A 25 LYS H . 31015 1 187 . 1 . 1 25 25 LYS HA H 1 3.8520 0.0000 . 1 . . . . A 25 LYS HA . 31015 1 188 . 1 . 1 25 25 LYS HB2 H 1 1.7770 0.0000 . 2 . . . . A 25 LYS HB2 . 31015 1 189 . 1 . 1 25 25 LYS HG2 H 1 1.6850 0.0000 . 2 . . . . A 25 LYS HG2 . 31015 1 190 . 1 . 1 25 25 LYS HD2 H 1 1.6850 0.0000 . 2 . . . . A 25 LYS HD2 . 31015 1 191 . 1 . 1 25 25 LYS HE2 H 1 2.9920 0.0000 . 2 . . . . A 25 LYS HE2 . 31015 1 192 . 1 . 1 25 25 LYS CA C 13 61.4770 0.0000 . 1 . . 12011 . A 25 LYS CA . 31015 1 193 . 1 . 1 25 25 LYS CB C 13 33.0976 0.0000 . 1 . . 12017 . A 25 LYS CB . 31015 1 194 . 1 . 1 25 25 LYS CG C 13 26.0600 0.0000 . 1 . . . . A 25 LYS CG . 31015 1 195 . 1 . 1 25 25 LYS CD C 13 30.3150 0.0000 . 1 . . . . A 25 LYS CD . 31015 1 196 . 1 . 1 25 25 LYS CE C 13 42.4210 0.0000 . 1 . . . . A 25 LYS CE . 31015 1 197 . 1 . 1 25 25 LYS N N 15 121.3590 0.0000 . 1 . . 12015 . A 25 LYS N . 31015 1 198 . 1 . 1 26 26 GLU H H 1 7.9235 0.0000 . 1 . . 11986 . A 26 GLU H . 31015 1 199 . 1 . 1 26 26 GLU HA H 1 4.1970 0.0000 . 1 . . 20622 . A 26 GLU HA . 31015 1 200 . 1 . 1 26 26 GLU HB2 H 1 2.2350 0.0000 . 2 . . . . A 26 GLU HB2 . 31015 1 201 . 1 . 1 26 26 GLU HG2 H 1 2.3240 0.0000 . 2 . . 20652 . A 26 GLU HG2 . 31015 1 202 . 1 . 1 26 26 GLU CA C 13 59.1739 0.0000 . 1 . . 11990 . A 26 GLU CA . 31015 1 203 . 1 . 1 26 26 GLU CB C 13 29.2196 0.0000 . 1 . . 11993 . A 26 GLU CB . 31015 1 204 . 1 . 1 26 26 GLU CG C 13 35.6690 0.0000 . 1 . . 19998 . A 26 GLU CG . 31015 1 205 . 1 . 1 26 26 GLU N N 15 121.6521 0.0000 . 1 . . 11988 . A 26 GLU N . 31015 1 206 . 1 . 1 27 27 GLN H H 1 8.3890 0.0000 . 1 . . 17226 . A 27 GLN H . 31015 1 207 . 1 . 1 27 27 GLN HA H 1 3.9850 0.0000 . 1 . . 20478 . A 27 GLN HA . 31015 1 208 . 1 . 1 27 27 GLN HB2 H 1 2.0350 0.0000 . 2 . . 20445 . A 27 GLN HB2 . 31015 1 209 . 1 . 1 27 27 GLN HG2 H 1 2.4390 0.0000 . 2 . . 20433 . A 27 GLN HG2 . 31015 1 210 . 1 . 1 27 27 GLN CA C 13 58.8200 0.0000 . 1 . . 17230 . A 27 GLN CA . 31015 1 211 . 1 . 1 27 27 GLN CB C 13 28.1058 0.0000 . 1 . . 17227 . A 27 GLN CB . 31015 1 212 . 1 . 1 27 27 GLN CG C 13 33.4100 0.0000 . 1 . . 19797 . A 27 GLN CG . 31015 1 213 . 1 . 1 27 27 GLN N N 15 119.6627 0.0000 . 1 . . 17228 . A 27 GLN N . 31015 1 214 . 1 . 1 28 28 CYS H H 1 8.2490 0.0000 . 1 . . 12028 . A 28 CYS H . 31015 1 215 . 1 . 1 28 28 CYS HA H 1 4.2870 0.0000 . 1 . . . . A 28 CYS HA . 31015 1 216 . 1 . 1 28 28 CYS HB2 H 1 3.5630 0.0000 . 2 . . 20322 . A 28 CYS HB2 . 31015 1 217 . 1 . 1 28 28 CYS HB3 H 1 2.9330 0.0000 . 2 . . 20325 . A 28 CYS HB3 . 31015 1 218 . 1 . 1 28 28 CYS CA C 13 59.5016 0.0000 . 1 . . 14164 . A 28 CYS CA . 31015 1 219 . 1 . 1 28 28 CYS CB C 13 33.8351 0.0000 . 1 . . 12029 . A 28 CYS CB . 31015 1 220 . 1 . 1 28 28 CYS N N 15 121.3182 0.0000 . 1 . . 12030 . A 28 CYS N . 31015 1 221 . 1 . 1 29 29 ALA H H 1 8.2374 0.0000 . 1 . . 11917 . A 29 ALA H . 31015 1 222 . 1 . 1 29 29 ALA HA H 1 3.8630 0.0000 . 1 . . 20667 . A 29 ALA HA . 31015 1 223 . 1 . 1 29 29 ALA HB1 H 1 1.5600 0.0000 . 1 . . 20670 . A 29 ALA HB1 . 31015 1 224 . 1 . 1 29 29 ALA HB2 H 1 1.5600 0.0000 . 1 . . 20670 . A 29 ALA HB2 . 31015 1 225 . 1 . 1 29 29 ALA HB3 H 1 1.5600 0.0000 . 1 . . 20670 . A 29 ALA HB3 . 31015 1 226 . 1 . 1 29 29 ALA CA C 13 56.2870 0.0000 . 1 . . 11915 . A 29 ALA CA . 31015 1 227 . 1 . 1 29 29 ALA CB C 13 18.1263 0.0000 . 1 . . 11921 . A 29 ALA CB . 31015 1 228 . 1 . 1 29 29 ALA N N 15 125.2466 0.0000 . 1 . . 11919 . A 29 ALA N . 31015 1 229 . 1 . 1 30 30 LYS H H 1 8.3063 0.0000 . 1 . . 12178 . A 30 LYS H . 31015 1 230 . 1 . 1 30 30 LYS HA H 1 4.0580 0.0000 . 1 . . . . A 30 LYS HA . 31015 1 231 . 1 . 1 30 30 LYS HB2 H 1 1.9370 0.0000 . 2 . . . . A 30 LYS HB2 . 31015 1 232 . 1 . 1 30 30 LYS HG2 H 1 1.6390 0.0000 . 2 . . . . A 30 LYS HG2 . 31015 1 233 . 1 . 1 30 30 LYS HE2 H 1 2.9460 0.0000 . 2 . . . . A 30 LYS HE2 . 31015 1 234 . 1 . 1 30 30 LYS CA C 13 59.3028 0.0000 . 1 . . 17927 . A 30 LYS CA . 31015 1 235 . 1 . 1 30 30 LYS CB C 13 32.1396 0.0000 . 1 . . 17947 . A 30 LYS CB . 31015 1 236 . 1 . 1 30 30 LYS CG C 13 25.2070 0.0000 . 1 . . 20145 . A 30 LYS CG . 31015 1 237 . 1 . 1 30 30 LYS CE C 13 41.9420 0.0000 . 1 . . 20133 . A 30 LYS CE . 31015 1 238 . 1 . 1 30 30 LYS N N 15 119.1859 0.0000 . 1 . . 12180 . A 30 LYS N . 31015 1 239 . 1 . 1 31 31 GLY H H 1 8.3266 0.0000 . 1 . . 12337 . A 31 GLY H . 31015 1 240 . 1 . 1 31 31 GLY HA2 H 1 3.9285 0.0000 . 2 . . 20550 . A 31 GLY HA2 . 31015 1 241 . 1 . 1 31 31 GLY HA3 H 1 4.0180 0.0000 . 2 . . . . A 31 GLY HA3 . 31015 1 242 . 1 . 1 31 31 GLY CA C 13 47.3635 0.0000 . 1 . . 12341 . A 31 GLY CA . 31015 1 243 . 1 . 1 31 31 GLY N N 15 110.0609 0.0000 . 1 . . 12339 . A 31 GLY N . 31015 1 244 . 1 . 1 32 32 CYS H H 1 8.1128 0.0000 . 1 . . 12112 . A 32 CYS H . 31015 1 245 . 1 . 1 32 32 CYS HA H 1 4.5570 0.0000 . 1 . . 20688 . A 32 CYS HA . 31015 1 246 . 1 . 1 32 32 CYS HB2 H 1 3.5725 0.0000 . 2 . . 20691 . A 32 CYS HB2 . 31015 1 247 . 1 . 1 32 32 CYS HB3 H 1 3.0530 0.0000 . 2 . . 20700 . A 32 CYS HB3 . 31015 1 248 . 1 . 1 32 32 CYS CA C 13 58.3233 0.0000 . 1 . . 12107 . A 32 CYS CA . 31015 1 249 . 1 . 1 32 32 CYS CB C 13 39.4128 0.0000 . 1 . . 12113 . A 32 CYS CB . 31015 1 250 . 1 . 1 32 32 CYS N N 15 120.7204 0.0000 . 1 . . 12114 . A 32 CYS N . 31015 1 251 . 1 . 1 33 33 GLU H H 1 7.7800 0.0000 . 1 . . 12214 . A 33 GLU H . 31015 1 252 . 1 . 1 33 33 GLU HA H 1 4.0480 0.0000 . 1 . . 20625 . A 33 GLU HA . 31015 1 253 . 1 . 1 33 33 GLU HB2 H 1 2.2610 0.0000 . 2 . . 20655 . A 33 GLU HB2 . 31015 1 254 . 1 . 1 33 33 GLU HG2 H 1 2.5450 0.0000 . 2 . . 20649 . A 33 GLU HG2 . 31015 1 255 . 1 . 1 33 33 GLU HG3 H 1 2.2848 0.0000 . 2 . . . . A 33 GLU HG3 . 31015 1 256 . 1 . 1 33 33 GLU CA C 13 59.4296 0.0000 . 1 . . 12212 . A 33 GLU CA . 31015 1 257 . 1 . 1 33 33 GLU CB C 13 29.4235 0.0000 . 1 . . 12218 . A 33 GLU CB . 31015 1 258 . 1 . 1 33 33 GLU CG C 13 36.4650 0.0000 . 1 . . 19995 . A 33 GLU CG . 31015 1 259 . 1 . 1 33 33 GLU N N 15 118.4491 0.0000 . 1 . . 12216 . A 33 GLU N . 31015 1 260 . 1 . 1 34 34 LYS H H 1 8.0016 0.0000 . 1 . . 17797 . A 34 LYS H . 31015 1 261 . 1 . 1 34 34 LYS HA H 1 4.0680 0.0000 . 1 . . 20673 . A 34 LYS HA . 31015 1 262 . 1 . 1 34 34 LYS HB2 H 1 1.8970 0.0000 . 2 . . 20679 . A 34 LYS HB2 . 31015 1 263 . 1 . 1 34 34 LYS HG2 H 1 1.3980 0.0000 . 2 . . . . A 34 LYS HG2 . 31015 1 264 . 1 . 1 34 34 LYS HD2 H 1 1.6720 0.0000 . 2 . . 20682 . A 34 LYS HD2 . 31015 1 265 . 1 . 1 34 34 LYS HE2 H 1 2.9700 0.0000 . 2 . . 20676 . A 34 LYS HE2 . 31015 1 266 . 1 . 1 34 34 LYS CA C 13 59.2898 0.0000 . 1 . . 17867 . A 34 LYS CA . 31015 1 267 . 1 . 1 34 34 LYS CB C 13 32.8078 0.0000 . 1 . . 17798 . A 34 LYS CB . 31015 1 268 . 1 . 1 34 34 LYS CG C 13 24.6590 0.0000 . 1 . . 20040 . A 34 LYS CG . 31015 1 269 . 1 . 1 34 34 LYS CD C 13 29.2880 0.0000 . 1 . . . . A 34 LYS CD . 31015 1 270 . 1 . 1 34 34 LYS CE C 13 41.8940 0.0000 . 1 . . 20031 . A 34 LYS CE . 31015 1 271 . 1 . 1 34 34 LYS N N 15 119.5794 0.0000 . 1 . . 17799 . A 34 LYS N . 31015 1 272 . 1 . 1 35 35 TYR H H 1 8.1132 0.0000 . 1 . . 12187 . A 35 TYR H . 31015 1 273 . 1 . 1 35 35 TYR HA H 1 4.2410 0.0000 . 1 . . . . A 35 TYR HA . 31015 1 274 . 1 . 1 35 35 TYR HB2 H 1 2.9730 0.0000 . 2 . . 20727 . A 35 TYR HB2 . 31015 1 275 . 1 . 1 35 35 TYR HD1 H 1 6.5870 0.0000 . 3 . . . . A 35 TYR HD1 . 31015 1 276 . 1 . 1 35 35 TYR HD2 H 1 7.4280 0.0000 . 3 . . . . A 35 TYR HD2 . 31015 1 277 . 1 . 1 35 35 TYR HE1 H 1 6.8910 0.0000 . 3 . . . . A 35 TYR HE1 . 31015 1 278 . 1 . 1 35 35 TYR CA C 13 60.7752 0.0000 . 1 . . 12188 . A 35 TYR CA . 31015 1 279 . 1 . 1 35 35 TYR CB C 13 38.4680 0.0000 . 1 . . 12194 . A 35 TYR CB . 31015 1 280 . 1 . 1 35 35 TYR CD1 C 13 133.1900 0.0000 . 2 . . . . A 35 TYR CD1 . 31015 1 281 . 1 . 1 35 35 TYR CD2 C 13 133.5500 0.0000 . 2 . . . . A 35 TYR CD2 . 31015 1 282 . 1 . 1 35 35 TYR CE1 C 13 118.4300 0.0000 . 2 . . . . A 35 TYR CE1 . 31015 1 283 . 1 . 1 35 35 TYR N N 15 118.7938 0.0000 . 1 . . 12189 . A 35 TYR N . 31015 1 284 . 1 . 1 36 36 TYR H H 1 8.0254 0.0000 . 1 . . 12247 . A 36 TYR H . 31015 1 285 . 1 . 1 36 36 TYR HA H 1 4.1380 0.0000 . 1 . . . . A 36 TYR HA . 31015 1 286 . 1 . 1 36 36 TYR HB2 H 1 2.9860 0.0000 . 2 . . 20487 . A 36 TYR HB2 . 31015 1 287 . 1 . 1 36 36 TYR HB3 H 1 2.9580 0.0000 . 2 . . . . A 36 TYR HB3 . 31015 1 288 . 1 . 1 36 36 TYR HD1 H 1 7.1130 0.0000 . 3 . . . . A 36 TYR HD1 . 31015 1 289 . 1 . 1 36 36 TYR HE1 H 1 6.6500 0.0000 . 3 . . . . A 36 TYR HE1 . 31015 1 290 . 1 . 1 36 36 TYR CA C 13 61.4083 0.0000 . 1 . . 12245 . A 36 TYR CA . 31015 1 291 . 1 . 1 36 36 TYR CB C 13 38.3307 0.0000 . 1 . . 12248 . A 36 TYR CB . 31015 1 292 . 1 . 1 36 36 TYR CD1 C 13 133.3350 0.0000 . 2 . . . . A 36 TYR CD1 . 31015 1 293 . 1 . 1 36 36 TYR CE1 C 13 118.0100 0.0000 . 2 . . . . A 36 TYR CE1 . 31015 1 294 . 1 . 1 36 36 TYR N N 15 116.4465 0.0000 . 1 . . 12249 . A 36 TYR N . 31015 1 295 . 1 . 1 37 37 LYS H H 1 7.9910 0.0000 . 1 . . 15734 . A 37 LYS H . 31015 1 296 . 1 . 1 37 37 LYS HA H 1 4.1490 0.0000 . 1 . . 20595 . A 37 LYS HA . 31015 1 297 . 1 . 1 37 37 LYS HB2 H 1 1.9390 0.0000 . 2 . . 20607 . A 37 LYS HB2 . 31015 1 298 . 1 . 1 37 37 LYS HG2 H 1 1.4780 0.0000 . 2 . . 20616 . A 37 LYS HG2 . 31015 1 299 . 1 . 1 37 37 LYS HD2 H 1 1.6590 0.0000 . 2 . . 20610 . A 37 LYS HD2 . 31015 1 300 . 1 . 1 37 37 LYS HE2 H 1 2.9840 0.0000 . 2 . . 20598 . A 37 LYS HE2 . 31015 1 301 . 1 . 1 37 37 LYS CA C 13 58.4066 0.0000 . 1 . . 15738 . A 37 LYS CA . 31015 1 302 . 1 . 1 37 37 LYS CB C 13 32.8095 0.0000 . 1 . . 15741 . A 37 LYS CB . 31015 1 303 . 1 . 1 37 37 LYS CG C 13 24.9130 0.0000 . 1 . . 19980 . A 37 LYS CG . 31015 1 304 . 1 . 1 37 37 LYS CD C 13 29.3320 0.0000 . 1 . . 19977 . A 37 LYS CD . 31015 1 305 . 1 . 1 37 37 LYS CE C 13 41.9600 0.0000 . 1 . . 19959 . A 37 LYS CE . 31015 1 306 . 1 . 1 37 37 LYS N N 15 121.0911 0.0000 . 1 . . 15736 . A 37 LYS N . 31015 1 307 . 1 . 1 38 38 GLU H H 1 8.0715 0.0000 . 1 . . 16601 . A 38 GLU H . 31015 1 308 . 1 . 1 38 38 GLU HA H 1 4.1480 0.0000 . 1 . . 20403 . A 38 GLU HA . 31015 1 309 . 1 . 1 38 38 GLU HB2 H 1 2.0240 0.0000 . 2 . . 20604 . A 38 GLU HB2 . 31015 1 310 . 1 . 1 38 38 GLU HG2 H 1 2.3010 0.0000 . 2 . . 20601 . A 38 GLU HG2 . 31015 1 311 . 1 . 1 38 38 GLU HG3 H 1 2.2350 0.0000 . 2 . . . . A 38 GLU HG3 . 31015 1 312 . 1 . 1 38 38 GLU CA C 13 57.7061 0.0000 . 1 . . 21077 . A 38 GLU CA . 31015 1 313 . 1 . 1 38 38 GLU CB C 13 29.8083 0.0000 . 1 . . 21073 . A 38 GLU CB . 31015 1 314 . 1 . 1 38 38 GLU CG C 13 36.2980 0.0000 . 1 . . 19968 . A 38 GLU CG . 31015 1 315 . 1 . 1 38 38 GLU N N 15 119.9021 0.0000 . 1 . . 16603 . A 38 GLU N . 31015 1 316 . 1 . 1 39 39 LYS H H 1 7.9771 0.0000 . 1 . . 12082 . A 39 LYS H . 31015 1 317 . 1 . 1 39 39 LYS HA H 1 4.2087 0.0000 . 1 . . . . A 39 LYS HA . 31015 1 318 . 1 . 1 39 39 LYS HB2 H 1 1.9477 0.0000 . 2 . . . . A 39 LYS HB2 . 31015 1 319 . 1 . 1 39 39 LYS CA C 13 57.5411 0.0000 . 1 . . 14203 . A 39 LYS CA . 31015 1 320 . 1 . 1 39 39 LYS CB C 13 32.8041 0.0000 . 1 . . 12083 . A 39 LYS CB . 31015 1 321 . 1 . 1 39 39 LYS N N 15 121.2477 0.0000 . 1 . . 12084 . A 39 LYS N . 31015 1 322 . 1 . 1 41 41 GLY HA2 H 1 3.9837 0.0000 . 2 . . . . A 41 GLY HA2 . 31015 1 323 . 1 . 1 41 41 GLY CA C 13 45.3981 0.0000 . 1 . . . . A 41 GLY CA . 31015 1 324 . 1 . 1 47 47 LEU HA H 1 4.3590 0.0000 . 1 . . 20277 . A 47 LEU HA . 31015 1 325 . 1 . 1 47 47 LEU HB2 H 1 1.8170 0.0000 . 2 . . 20298 . A 47 LEU HB2 . 31015 1 326 . 1 . 1 47 47 LEU HB3 H 1 1.2256 0.0000 . 2 . . . . A 47 LEU HB3 . 31015 1 327 . 1 . 1 47 47 LEU C C 13 174.7600 0.0000 . 1 . . . . A 47 LEU C . 31015 1 328 . 1 . 1 47 47 LEU CA C 13 56.2000 0.0000 . 1 . . . . A 47 LEU CA . 31015 1 329 . 1 . 1 47 47 LEU CB C 13 43.1370 0.0000 . 1 . . 19605 . A 47 LEU CB . 31015 1 330 . 1 . 1 48 48 GLU H H 1 8.0613 0.0000 . 1 . . . . A 48 GLU H . 31015 1 331 . 1 . 1 48 48 GLU CA C 13 56.2000 0.0000 . 1 . . . . A 48 GLU CA . 31015 1 332 . 1 . 1 48 48 GLU CB C 13 29.9000 0.0000 . 1 . . . . A 48 GLU CB . 31015 1 333 . 1 . 1 48 48 GLU N N 15 127.3883 0.0000 . 1 . . . . A 48 GLU N . 31015 1 stop_ save_