################################### # 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 31016 _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' . . . 31016 1 2 '3D 1H-15N NOESY' . . . 31016 1 3 '3D C(CO)NH' . . . 31016 1 4 '3D H(CCO)NH' . . . 31016 1 5 '3D CBCA(CO)NH' . . . 31016 1 6 '3D HNCO' . . . 31016 1 7 '2D 1H-13C HSQC aliphatic' . . . 31016 1 8 '3D HNCACB' . . . 31016 1 9 '2D 1H-13C HSQC aromatic' . . . 31016 1 stop_ loop_ _Systematic_chem_shift_offset.Type _Systematic_chem_shift_offset.Atom_type _Systematic_chem_shift_offset.Atom_isotope_number _Systematic_chem_shift_offset.Val _Systematic_chem_shift_offset.Val_err _Systematic_chem_shift_offset.Entry_ID _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID 'TROSY offset' 'all 15N' 15 0.5 0.05 31016 1 'TROSY offset' 'all 1H' 1 -0.04 0.005 31016 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 HA2 H 1 3.8498 0.0000 . 2 . . . . A 1 GLY HA2 . 31016 1 2 . 1 . 1 1 1 GLY CA C 13 43.5027 0.0000 . 1 . . . . A 1 GLY CA . 31016 1 3 . 1 . 1 2 2 ARG HA H 1 4.3110 0.0000 . 1 . . 27515 . A 2 ARG HA . 31016 1 4 . 1 . 1 2 2 ARG HB2 H 1 1.8290 0.0000 . 2 . . 27521 . A 2 ARG HB2 . 31016 1 5 . 1 . 1 2 2 ARG HG2 H 1 1.6560 0.0000 . 2 . . 27524 . A 2 ARG HG2 . 31016 1 6 . 1 . 1 2 2 ARG HD2 H 1 3.1960 0.0000 . 2 . . 27518 . A 2 ARG HD2 . 31016 1 7 . 1 . 1 2 2 ARG CA C 13 56.9457 0.0000 . 1 . . 16219 . A 2 ARG CA . 31016 1 8 . 1 . 1 2 2 ARG CB C 13 30.6041 0.0000 . 1 . . 16219 . A 2 ARG CB . 31016 1 9 . 1 . 1 2 2 ARG CG C 13 26.7800 0.0000 . 1 . . 27998 . A 2 ARG CG . 31016 1 10 . 1 . 1 2 2 ARG CD C 13 43.0880 0.0000 . 1 . . 27992 . A 2 ARG CD . 31016 1 11 . 1 . 1 3 3 GLY H H 1 8.7230 0.0000 . 1 . . 16218 . A 3 GLY H . 31016 1 12 . 1 . 1 3 3 GLY HA2 H 1 3.9820 0.0000 . 2 . . 27272 . A 3 GLY HA2 . 31016 1 13 . 1 . 1 3 3 GLY HA3 H 1 4.0264 0.0000 . 2 . . 27272 . A 3 GLY HA3 . 31016 1 14 . 1 . 1 3 3 GLY CA C 13 45.4253 0.0000 . 1 . . 28085 . A 3 GLY CA . 31016 1 15 . 1 . 1 3 3 GLY N N 15 111.5377 0.0000 . 1 . . 16220 . A 3 GLY N . 31016 1 16 . 1 . 1 4 4 ASP H H 1 8.0440 0.0000 . 1 . . 21676 . A 4 ASP H . 31016 1 17 . 1 . 1 4 4 ASP HA H 1 4.5950 0.0000 . 1 . . 27185 . A 4 ASP HA . 31016 1 18 . 1 . 1 4 4 ASP HB2 H 1 2.6630 0.0000 . 2 . . 27209 . A 4 ASP HB2 . 31016 1 19 . 1 . 1 4 4 ASP CA C 13 54.3526 0.0000 . 1 . . 21677 . A 4 ASP CA . 31016 1 20 . 1 . 1 4 4 ASP CB C 13 41.0798 0.0000 . 1 . . 21683 . A 4 ASP CB . 31016 1 21 . 1 . 1 4 4 ASP N N 15 120.5742 0.0000 . 1 . . 21678 . A 4 ASP N . 31016 1 22 . 1 . 1 5 5 GLU H H 1 8.4992 0.0000 . 1 . . 20778 . A 5 GLU H . 31016 1 23 . 1 . 1 5 5 GLU HA H 1 4.1550 0.0000 . 1 . . 27287 . A 5 GLU HA . 31016 1 24 . 1 . 1 5 5 GLU HB2 H 1 1.8800 0.0000 . 2 . . 27311 . A 5 GLU HB2 . 31016 1 25 . 1 . 1 5 5 GLU HG2 H 1 2.0610 0.0000 . 2 . . 27311 . A 5 GLU HG2 . 31016 1 26 . 1 . 1 5 5 GLU CA C 13 57.2373 0.0000 . 1 . . 20779 . A 5 GLU CA . 31016 1 27 . 1 . 1 5 5 GLU CB C 13 30.0248 0.0000 . 1 . . 20788 . A 5 GLU CB . 31016 1 28 . 1 . 1 5 5 GLU CG C 13 35.8475 0.0000 . 1 . . . . A 5 GLU CG . 31016 1 29 . 1 . 1 5 5 GLU N N 15 121.4242 0.0000 . 1 . . 20780 . A 5 GLU N . 31016 1 30 . 1 . 1 6 6 PHE H H 1 8.1340 0.0000 . 1 . . 21778 . A 6 PHE H . 31016 1 31 . 1 . 1 6 6 PHE HA H 1 4.6510 0.0000 . 1 . . 27470 . A 6 PHE HA . 31016 1 32 . 1 . 1 6 6 PHE HB2 H 1 3.2130 0.0000 . 2 . . 27473 . A 6 PHE HB2 . 31016 1 33 . 1 . 1 6 6 PHE HB3 H 1 2.9970 0.0000 . 2 . . 27476 . A 6 PHE HB3 . 31016 1 34 . 1 . 1 6 6 PHE HD1 H 1 7.2676 0.0000 . 3 . . . . A 6 PHE HD1 . 31016 1 35 . 1 . 1 6 6 PHE HD2 H 1 7.2376 0.0000 . 3 . . . . A 6 PHE HD2 . 31016 1 36 . 1 . 1 6 6 PHE CA C 13 57.7050 0.0000 . 1 . . 21779 . A 6 PHE CA . 31016 1 37 . 1 . 1 6 6 PHE CB C 13 39.1400 0.0000 . 1 . . 21782 . A 6 PHE CB . 31016 1 38 . 1 . 1 6 6 PHE CD1 C 13 129.8500 0.0000 . 3 . . . . A 6 PHE CD1 . 31016 1 39 . 1 . 1 6 6 PHE CD2 C 13 131.8315 0.0000 . 3 . . . . A 6 PHE CD2 . 31016 1 40 . 1 . 1 6 6 PHE N N 15 120.5385 0.0000 . 1 . . 21780 . A 6 PHE N . 31016 1 41 . 1 . 1 7 7 SER H H 1 8.1086 0.0000 . 1 . . 23715 . A 7 SER H . 31016 1 42 . 1 . 1 7 7 SER HA H 1 4.4870 0.0000 . 1 . . 27482 . A 7 SER HA . 31016 1 43 . 1 . 1 7 7 SER HB2 H 1 3.8530 0.0000 . 2 . . 27488 . A 7 SER HB2 . 31016 1 44 . 1 . 1 7 7 SER HB3 H 1 3.8198 0.0000 . 2 . . . . A 7 SER HB3 . 31016 1 45 . 1 . 1 7 7 SER CA C 13 58.4240 0.0000 . 1 . . 23719 . A 7 SER CA . 31016 1 46 . 1 . 1 7 7 SER CB C 13 63.9047 0.0000 . 1 . . 23716 . A 7 SER CB . 31016 1 47 . 1 . 1 7 7 SER N N 15 117.3517 0.0000 . 1 . . 23717 . A 7 SER N . 31016 1 48 . 1 . 1 8 8 THR H H 1 8.0983 0.0000 . 1 . . 23875 . A 8 THR H . 31016 1 49 . 1 . 1 8 8 THR HA H 1 4.3206 0.0000 . 1 . . . . A 8 THR HA . 31016 1 50 . 1 . 1 8 8 THR HB H 1 4.2186 0.0000 . 1 . . . . A 8 THR HB . 31016 1 51 . 1 . 1 8 8 THR HG21 H 1 1.1710 0.0000 . 1 . . 27152 . A 8 THR HG21 . 31016 1 52 . 1 . 1 8 8 THR HG22 H 1 1.1710 0.0000 . 1 . . 27152 . A 8 THR HG22 . 31016 1 53 . 1 . 1 8 8 THR HG23 H 1 1.1710 0.0000 . 1 . . 27152 . A 8 THR HG23 . 31016 1 54 . 1 . 1 8 8 THR CA C 13 61.9020 0.0000 . 1 . . 23882 . A 8 THR CA . 31016 1 55 . 1 . 1 8 8 THR CB C 13 69.5896 0.0000 . 1 . . 23876 . A 8 THR CB . 31016 1 56 . 1 . 1 8 8 THR CG2 C 13 21.3640 0.0000 . 1 . . 27698 . A 8 THR CG2 . 31016 1 57 . 1 . 1 8 8 THR N N 15 115.8123 0.0000 . 1 . . 23877 . A 8 THR N . 31016 1 58 . 1 . 1 9 9 HIS H H 1 8.2523 0.0000 . 1 . . . . A 9 HIS H . 31016 1 59 . 1 . 1 9 9 HIS HA H 1 4.2370 0.0000 . 1 . . . . A 9 HIS HA . 31016 1 60 . 1 . 1 9 9 HIS N N 15 121.6180 0.0000 . 1 . . . . A 9 HIS N . 31016 1 61 . 1 . 1 10 10 GLU H H 1 8.0000 0.0000 . 1 . . . . A 10 GLU H . 31016 1 62 . 1 . 1 10 10 GLU N N 15 120.0000 0.0000 . 1 . . . . A 10 GLU N . 31016 1 63 . 1 . 1 11 11 PRO HA H 1 4.3800 0.0000 . 1 . . 27548 . A 11 PRO HA . 31016 1 64 . 1 . 1 11 11 PRO HB2 H 1 2.3640 0.0000 . 2 . . . . A 11 PRO HB2 . 31016 1 65 . 1 . 1 11 11 PRO HB3 H 1 2.0420 0.0000 . 2 . . . . A 11 PRO HB3 . 31016 1 66 . 1 . 1 11 11 PRO HG2 H 1 1.9760 0.0000 . 2 . . . . A 11 PRO HG2 . 31016 1 67 . 1 . 1 11 11 PRO HD2 H 1 3.6840 0.0000 . 2 . . . . A 11 PRO HD2 . 31016 1 68 . 1 . 1 11 11 PRO HD3 H 1 3.7923 0.0000 . 2 . . . . A 11 PRO HD3 . 31016 1 69 . 1 . 1 11 11 PRO CA C 13 64.3209 0.0000 . 1 . . 24276 . A 11 PRO CA . 31016 1 70 . 1 . 1 11 11 PRO CB C 13 32.1231 0.0000 . 1 . . 24276 . A 11 PRO CB . 31016 1 71 . 1 . 1 11 11 PRO CG C 13 27.2840 0.0000 . 1 . . . . A 11 PRO CG . 31016 1 72 . 1 . 1 11 11 PRO CD C 13 50.5270 0.0000 . 1 . . . . A 11 PRO CD . 31016 1 73 . 1 . 1 12 12 GLY H H 1 8.7167 0.0000 . 1 . . 24275 . A 12 GLY H . 31016 1 74 . 1 . 1 12 12 GLY HA2 H 1 3.8980 0.0000 . 2 . . . . A 12 GLY HA2 . 31016 1 75 . 1 . 1 12 12 GLY HA3 H 1 4.0645 0.0000 . 2 . . . . A 12 GLY HA3 . 31016 1 76 . 1 . 1 12 12 GLY CA C 13 46.5269 0.0000 . 1 . . 24279 . A 12 GLY CA . 31016 1 77 . 1 . 1 12 12 GLY N N 15 109.4004 0.0000 . 1 . . 24277 . A 12 GLY N . 31016 1 78 . 1 . 1 13 13 GLU H H 1 8.2576 0.0000 . 1 . . 19765 . A 13 GLU H . 31016 1 79 . 1 . 1 13 13 GLU HA H 1 4.1050 0.0000 . 1 . . . . A 13 GLU HA . 31016 1 80 . 1 . 1 13 13 GLU HB2 H 1 2.1080 0.0000 . 2 . . . . A 13 GLU HB2 . 31016 1 81 . 1 . 1 13 13 GLU HG2 H 1 2.3200 0.0000 . 2 . . . . A 13 GLU HG2 . 31016 1 82 . 1 . 1 13 13 GLU CA C 13 58.5576 0.0000 . 1 . . 19766 . A 13 GLU CA . 31016 1 83 . 1 . 1 13 13 GLU CB C 13 29.5850 0.0000 . 1 . . 19772 . A 13 GLU CB . 31016 1 84 . 1 . 1 13 13 GLU CG C 13 36.3050 0.0000 . 1 . . 27638 . A 13 GLU CG . 31016 1 85 . 1 . 1 13 13 GLU N N 15 122.0057 0.0000 . 1 . . 19767 . A 13 GLU N . 31016 1 86 . 1 . 1 14 14 LYS H H 1 8.0877 0.0000 . 1 . . 18155 . A 14 LYS H . 31016 1 87 . 1 . 1 14 14 LYS HA H 1 4.1450 0.0000 . 1 . . 27320 . A 14 LYS HA . 31016 1 88 . 1 . 1 14 14 LYS HB2 H 1 1.8640 0.0000 . 2 . . 27329 . A 14 LYS HB2 . 31016 1 89 . 1 . 1 14 14 LYS HG2 H 1 1.4310 0.0000 . 2 . . 27335 . A 14 LYS HG2 . 31016 1 90 . 1 . 1 14 14 LYS HD2 H 1 1.6710 0.0000 . 2 . . 27332 . A 14 LYS HD2 . 31016 1 91 . 1 . 1 14 14 LYS HE2 H 1 2.9513 0.0000 . 2 . . 27326 . A 14 LYS HE2 . 31016 1 92 . 1 . 1 14 14 LYS HE3 H 1 2.9819 0.0000 . 2 . . . . A 14 LYS HE3 . 31016 1 93 . 1 . 1 14 14 LYS CA C 13 58.4419 0.0000 . 1 . . 18156 . A 14 LYS CA . 31016 1 94 . 1 . 1 14 14 LYS CB C 13 32.1783 0.0000 . 1 . . 18162 . A 14 LYS CB . 31016 1 95 . 1 . 1 14 14 LYS CG C 13 24.8300 0.0000 . 1 . . 27854 . A 14 LYS CG . 31016 1 96 . 1 . 1 14 14 LYS CD C 13 28.8900 0.0000 . 1 . . . . A 14 LYS CD . 31016 1 97 . 1 . 1 14 14 LYS CE C 13 41.8530 0.0000 . 1 . . 27845 . A 14 LYS CE . 31016 1 98 . 1 . 1 14 14 LYS N N 15 122.4649 0.0000 . 1 . . 18157 . A 14 LYS N . 31016 1 99 . 1 . 1 15 15 ARG H H 1 7.9993 0.0000 . 1 . . 21879 . A 15 ARG H . 31016 1 100 . 1 . 1 15 15 ARG HA H 1 3.9820 0.0000 . 1 . . 27038 . A 15 ARG HA . 31016 1 101 . 1 . 1 15 15 ARG HB2 H 1 1.6170 0.0000 . 2 . . 27047 . A 15 ARG HB2 . 31016 1 102 . 1 . 1 15 15 ARG HG2 H 1 1.6170 0.0000 . 2 . . 27047 . A 15 ARG HG2 . 31016 1 103 . 1 . 1 15 15 ARG HD2 H 1 3.2060 0.0000 . 2 . . . . A 15 ARG HD2 . 31016 1 104 . 1 . 1 15 15 ARG CA C 13 58.9708 0.0000 . 1 . . 21880 . A 15 ARG CA . 31016 1 105 . 1 . 1 15 15 ARG CB C 13 30.1525 0.0000 . 1 . . 21886 . A 15 ARG CB . 31016 1 106 . 1 . 1 15 15 ARG CG C 13 27.7420 0.0000 . 1 . . 27626 . A 15 ARG CG . 31016 1 107 . 1 . 1 15 15 ARG CD C 13 43.1280 0.0000 . 1 . . 27623 . A 15 ARG CD . 31016 1 108 . 1 . 1 15 15 ARG N N 15 120.1587 0.0000 . 1 . . 21881 . A 15 ARG N . 31016 1 109 . 1 . 1 16 16 LEU H H 1 8.0017 0.0000 . 1 . . 18016 . A 16 LEU H . 31016 1 110 . 1 . 1 16 16 LEU HA H 1 4.0930 0.0000 . 1 . . 27497 . A 16 LEU HA . 31016 1 111 . 1 . 1 16 16 LEU HB2 H 1 1.7970 0.0000 . 2 . . 27500 . A 16 LEU HB2 . 31016 1 112 . 1 . 1 16 16 LEU HB3 H 1 1.4840 0.0000 . 2 . . 27503 . A 16 LEU HB3 . 31016 1 113 . 1 . 1 16 16 LEU HG H 1 1.3170 0.0000 . 1 . . 27506 . A 16 LEU HG . 31016 1 114 . 1 . 1 16 16 LEU HD11 H 1 0.6510 0.0000 . 2 . . 27512 . A 16 LEU HD11 . 31016 1 115 . 1 . 1 16 16 LEU HD12 H 1 0.6510 0.0000 . 2 . . 27512 . A 16 LEU HD12 . 31016 1 116 . 1 . 1 16 16 LEU HD13 H 1 0.6510 0.0000 . 2 . . 27512 . A 16 LEU HD13 . 31016 1 117 . 1 . 1 16 16 LEU HD21 H 1 0.8660 0.0000 . 2 . . 27509 . A 16 LEU HD21 . 31016 1 118 . 1 . 1 16 16 LEU HD22 H 1 0.8660 0.0000 . 2 . . 27509 . A 16 LEU HD22 . 31016 1 119 . 1 . 1 16 16 LEU HD23 H 1 0.8660 0.0000 . 2 . . 27509 . A 16 LEU HD23 . 31016 1 120 . 1 . 1 16 16 LEU CA C 13 58.1911 0.0000 . 1 . . 18056 . A 16 LEU CA . 31016 1 121 . 1 . 1 16 16 LEU CB C 13 40.9634 0.0000 . 1 . . 18020 . A 16 LEU CB . 31016 1 122 . 1 . 1 16 16 LEU CG C 13 26.8230 0.0000 . 1 . . . . A 16 LEU CG . 31016 1 123 . 1 . 1 16 16 LEU CD1 C 13 25.0930 0.0000 . 2 . . 27983 . A 16 LEU CD1 . 31016 1 124 . 1 . 1 16 16 LEU CD2 C 13 23.6160 0.0000 . 2 . . 27986 . A 16 LEU CD2 . 31016 1 125 . 1 . 1 16 16 LEU N N 15 122.5266 0.0000 . 1 . . 18018 . A 16 LEU N . 31016 1 126 . 1 . 1 17 17 SER H H 1 8.0288 0.0000 . 1 . . 23899 . A 17 SER H . 31016 1 127 . 1 . 1 17 17 SER HA H 1 3.9450 0.0000 . 1 . . 27200 . A 17 SER HA . 31016 1 128 . 1 . 1 17 17 SER HB2 H 1 3.9760 0.0000 . 2 . . . . A 17 SER HB2 . 31016 1 129 . 1 . 1 17 17 SER CA C 13 61.5868 0.0000 . 1 . . 23900 . A 17 SER CA . 31016 1 130 . 1 . 1 17 17 SER CB C 13 62.4606 0.0000 . 1 . . 23909 . A 17 SER CB . 31016 1 131 . 1 . 1 17 17 SER N N 15 114.6847 0.0000 . 1 . . 23901 . A 17 SER N . 31016 1 132 . 1 . 1 18 18 GLN H H 1 7.9419 0.0000 . 1 . . 20157 . A 18 GLN H . 31016 1 133 . 1 . 1 18 18 GLN HA H 1 4.0440 0.0000 . 1 . . . . A 18 GLN HA . 31016 1 134 . 1 . 1 18 18 GLN HB2 H 1 2.1090 0.0000 . 2 . . . . A 18 GLN HB2 . 31016 1 135 . 1 . 1 18 18 GLN HG2 H 1 2.4140 0.0000 . 2 . . . . A 18 GLN HG2 . 31016 1 136 . 1 . 1 18 18 GLN CA C 13 59.0067 0.0000 . 1 . . 20164 . A 18 GLN CA . 31016 1 137 . 1 . 1 18 18 GLN CB C 13 28.4714 0.0000 . 1 . . 20167 . A 18 GLN CB . 31016 1 138 . 1 . 1 18 18 GLN CG C 13 33.6672 0.0000 . 1 . . . . A 18 GLN CG . 31016 1 139 . 1 . 1 18 18 GLN N N 15 121.3796 0.0000 . 1 . . 20159 . A 18 GLN N . 31016 1 140 . 1 . 1 19 19 CYS H H 1 8.0543 0.0000 . 1 . . 13050 . A 19 CYS H . 31016 1 141 . 1 . 1 19 19 CYS HA H 1 4.2328 0.0000 . 1 . . 27431 . A 19 CYS HA . 31016 1 142 . 1 . 1 19 19 CYS HB2 H 1 3.1170 0.0000 . 2 . . 27434 . A 19 CYS HB2 . 31016 1 143 . 1 . 1 19 19 CYS HB3 H 1 3.5550 0.0000 . 2 . . 27434 . A 19 CYS HB3 . 31016 1 144 . 1 . 1 19 19 CYS CA C 13 60.8295 0.0000 . 1 . . 19832 . A 19 CYS CA . 31016 1 145 . 1 . 1 19 19 CYS CB C 13 36.6801 0.0000 . 1 . . 13051 . A 19 CYS CB . 31016 1 146 . 1 . 1 19 19 CYS N N 15 121.6701 0.0000 . 1 . . 13052 . A 19 CYS N . 31016 1 147 . 1 . 1 20 20 MET H H 1 8.5709 0.0000 . 1 . . 23173 . A 20 MET H . 31016 1 148 . 1 . 1 20 20 MET HA H 1 4.0010 0.0000 . 1 . . 27161 . A 20 MET HA . 31016 1 149 . 1 . 1 20 20 MET HB2 H 1 2.3560 0.0000 . 2 . . . . A 20 MET HB2 . 31016 1 150 . 1 . 1 20 20 MET HG2 H 1 2.7270 0.0000 . 2 . . . . A 20 MET HG2 . 31016 1 151 . 1 . 1 20 20 MET CA C 13 58.0140 0.0000 . 1 . . 23177 . A 20 MET CA . 31016 1 152 . 1 . 1 20 20 MET CB C 13 32.0264 0.0000 . 1 . . 23183 . A 20 MET CB . 31016 1 153 . 1 . 1 20 20 MET CG C 13 33.0770 0.0000 . 1 . . . . A 20 MET CG . 31016 1 154 . 1 . 1 20 20 MET N N 15 118.1996 0.0000 . 1 . . 23175 . A 20 MET N . 31016 1 155 . 1 . 1 21 21 LYS H H 1 8.0888 0.0000 . 1 . . 19200 . A 21 LYS H . 31016 1 156 . 1 . 1 21 21 LYS HA H 1 4.1176 0.0000 . 1 . . . . A 21 LYS HA . 31016 1 157 . 1 . 1 21 21 LYS HB2 H 1 1.9723 0.0000 . 2 . . . . A 21 LYS HB2 . 31016 1 158 . 1 . 1 21 21 LYS HG2 H 1 1.5096 0.0000 . 2 . . . . A 21 LYS HG2 . 31016 1 159 . 1 . 1 21 21 LYS HD2 H 1 1.6673 0.0000 . 2 . . . . A 21 LYS HD2 . 31016 1 160 . 1 . 1 21 21 LYS HE2 H 1 2.9503 0.0000 . 2 . . . . A 21 LYS HE2 . 31016 1 161 . 1 . 1 21 21 LYS CA C 13 58.9818 0.0000 . 1 . . 19204 . A 21 LYS CA . 31016 1 162 . 1 . 1 21 21 LYS CB C 13 31.9371 0.0000 . 1 . . 19201 . A 21 LYS CB . 31016 1 163 . 1 . 1 21 21 LYS CG C 13 24.9255 0.0000 . 1 . . . . A 21 LYS CG . 31016 1 164 . 1 . 1 21 21 LYS CD C 13 28.8411 0.0000 . 1 . . . . A 21 LYS CD . 31016 1 165 . 1 . 1 21 21 LYS CE C 13 41.8626 0.0000 . 1 . . . . A 21 LYS CE . 31016 1 166 . 1 . 1 21 21 LYS N N 15 121.7751 0.0000 . 1 . . 19202 . A 21 LYS N . 31016 1 167 . 1 . 1 22 22 GLN H H 1 7.7902 0.0000 . 1 . . 22624 . A 22 GLN H . 31016 1 168 . 1 . 1 22 22 GLN HA H 1 4.1400 0.0000 . 1 . . 27440 . A 22 GLN HA . 31016 1 169 . 1 . 1 22 22 GLN HB2 H 1 2.3060 0.0000 . 2 . . 27452 . A 22 GLN HB2 . 31016 1 170 . 1 . 1 22 22 GLN HG2 H 1 2.5580 0.0000 . 2 . . 27449 . A 22 GLN HG2 . 31016 1 171 . 1 . 1 22 22 GLN CA C 13 58.4891 0.0000 . 1 . . 22651 . A 22 GLN CA . 31016 1 172 . 1 . 1 22 22 GLN CB C 13 27.6922 0.0000 . 1 . . 22625 . A 22 GLN CB . 31016 1 173 . 1 . 1 22 22 GLN CG C 13 33.6270 0.0000 . 1 . . 27941 . A 22 GLN CG . 31016 1 174 . 1 . 1 22 22 GLN N N 15 119.6134 0.0000 . 1 . . 22626 . A 22 GLN N . 31016 1 175 . 1 . 1 23 23 CYS H H 1 7.7661 0.0000 . 1 . . 23463 . A 23 CYS H . 31016 1 176 . 1 . 1 23 23 CYS HA H 1 4.6790 0.0000 . 1 . . 27464 . A 23 CYS HA . 31016 1 177 . 1 . 1 23 23 CYS HB2 H 1 3.2080 0.0000 . 2 . . 27467 . A 23 CYS HB2 . 31016 1 178 . 1 . 1 23 23 CYS HB3 H 1 3.1857 0.0000 . 2 . . 27467 . A 23 CYS HB3 . 31016 1 179 . 1 . 1 23 23 CYS CA C 13 55.3222 0.0000 . 1 . . 23467 . A 23 CYS CA . 31016 1 180 . 1 . 1 23 23 CYS CB C 13 35.8731 0.0000 . 1 . . 23470 . A 23 CYS CB . 31016 1 181 . 1 . 1 23 23 CYS N N 15 117.9886 0.0000 . 1 . . 23465 . A 23 CYS N . 31016 1 182 . 1 . 1 24 24 GLU H H 1 7.6010 0.0000 . 1 . . 23574 . A 24 GLU H . 31016 1 183 . 1 . 1 24 24 GLU HA H 1 4.0610 0.0000 . 1 . . 27485 . A 24 GLU HA . 31016 1 184 . 1 . 1 24 24 GLU HB2 H 1 2.1660 0.0000 . 2 . . . . A 24 GLU HB2 . 31016 1 185 . 1 . 1 24 24 GLU HB3 H 1 2.2650 0.0000 . 2 . . . . A 24 GLU HB3 . 31016 1 186 . 1 . 1 24 24 GLU HG2 H 1 2.5240 0.0000 . 2 . . 27491 . A 24 GLU HG2 . 31016 1 187 . 1 . 1 24 24 GLU HG3 H 1 2.4040 0.0000 . 2 . . 27494 . A 24 GLU HG3 . 31016 1 188 . 1 . 1 24 24 GLU CA C 13 57.9353 0.0000 . 1 . . 23575 . A 24 GLU CA . 31016 1 189 . 1 . 1 24 24 GLU CB C 13 29.5344 0.0000 . 1 . . 23584 . A 24 GLU CB . 31016 1 190 . 1 . 1 24 24 GLU CG C 13 35.9200 0.0000 . 1 . . 27971 . A 24 GLU CG . 31016 1 191 . 1 . 1 24 24 GLU N N 15 117.5425 0.0000 . 1 . . 23576 . A 24 GLU N . 31016 1 192 . 1 . 1 25 25 ARG H H 1 7.3552 0.0000 . 1 . . 23817 . A 25 ARG H . 31016 1 193 . 1 . 1 25 25 ARG HA H 1 4.3510 0.0000 . 1 . . 27389 . A 25 ARG HA . 31016 1 194 . 1 . 1 25 25 ARG HB2 H 1 2.0780 0.0000 . 2 . . 27395 . A 25 ARG HB2 . 31016 1 195 . 1 . 1 25 25 ARG HB3 H 1 1.8770 0.0000 . 2 . . . . A 25 ARG HB3 . 31016 1 196 . 1 . 1 25 25 ARG HG2 H 1 1.7550 0.0000 . 2 . . 27398 . A 25 ARG HG2 . 31016 1 197 . 1 . 1 25 25 ARG HD2 H 1 3.2540 0.0000 . 2 . . 27392 . A 25 ARG HD2 . 31016 1 198 . 1 . 1 25 25 ARG CA C 13 56.1806 0.0000 . 1 . . 28045 . A 25 ARG CA . 31016 1 199 . 1 . 1 25 25 ARG CB C 13 30.3812 0.0000 . 1 . . 28049 . A 25 ARG CB . 31016 1 200 . 1 . 1 25 25 ARG CG C 13 27.0670 0.0000 . 1 . . 27908 . A 25 ARG CG . 31016 1 201 . 1 . 1 25 25 ARG CD C 13 43.1820 0.0000 . 1 . . 27902 . A 25 ARG CD . 31016 1 202 . 1 . 1 25 25 ARG N N 15 115.7267 0.0000 . 1 . . 23819 . A 25 ARG N . 31016 1 203 . 1 . 1 26 26 GLN H H 1 7.4771 0.0000 . 1 . . 22805 . A 26 GLN H . 31016 1 204 . 1 . 1 26 26 GLN HA H 1 4.2430 0.0000 . 1 . . 27098 . A 26 GLN HA . 31016 1 205 . 1 . 1 26 26 GLN HB2 H 1 2.0410 0.0000 . 2 . . . . A 26 GLN HB2 . 31016 1 206 . 1 . 1 26 26 GLN HB3 H 1 2.0990 0.0000 . 2 . . . . A 26 GLN HB3 . 31016 1 207 . 1 . 1 26 26 GLN HG2 H 1 2.5120 0.0000 . 2 . . 27119 . A 26 GLN HG2 . 31016 1 208 . 1 . 1 26 26 GLN HG3 H 1 2.3410 0.0000 . 2 . . 27122 . A 26 GLN HG3 . 31016 1 209 . 1 . 1 26 26 GLN CA C 13 55.4971 0.0000 . 1 . . 22806 . A 26 GLN CA . 31016 1 210 . 1 . 1 26 26 GLN CB C 13 28.7518 0.0000 . 1 . . 22812 . A 26 GLN CB . 31016 1 211 . 1 . 1 26 26 GLN CG C 13 33.7390 0.0000 . 1 . . 27689 . A 26 GLN CG . 31016 1 212 . 1 . 1 26 26 GLN N N 15 119.0394 0.0000 . 1 . . 22807 . A 26 GLN N . 31016 1 213 . 1 . 1 27 27 ASP H H 1 8.4602 0.0000 . 1 . . 19927 . A 27 ASP H . 31016 1 214 . 1 . 1 27 27 ASP HA H 1 4.5860 0.0000 . 1 . . 27536 . A 27 ASP HA . 31016 1 215 . 1 . 1 27 27 ASP HB2 H 1 2.6302 0.0000 . 2 . . 27539 . A 27 ASP HB2 . 31016 1 216 . 1 . 1 27 27 ASP HB3 H 1 2.7357 0.0000 . 2 . . . . A 27 ASP HB3 . 31016 1 217 . 1 . 1 27 27 ASP CA C 13 54.8416 0.0000 . 1 . . 19928 . A 27 ASP CA . 31016 1 218 . 1 . 1 27 27 ASP CB C 13 41.6092 0.0000 . 1 . . 19931 . A 27 ASP CB . 31016 1 219 . 1 . 1 27 27 ASP N N 15 121.7345 0.0000 . 1 . . 19929 . A 27 ASP N . 31016 1 220 . 1 . 1 28 28 GLY H H 1 8.2274 0.0000 . 1 . . 24055 . A 28 GLY H . 31016 1 221 . 1 . 1 28 28 GLY HA2 H 1 3.9220 0.0000 . 2 . . 27533 . A 28 GLY HA2 . 31016 1 222 . 1 . 1 28 28 GLY HA3 H 1 4.2600 0.0000 . 2 . . 27530 . A 28 GLY HA3 . 31016 1 223 . 1 . 1 28 28 GLY CA C 13 45.1491 0.0000 . 1 . . 24059 . A 28 GLY CA . 31016 1 224 . 1 . 1 28 28 GLY N N 15 110.5538 0.0000 . 1 . . 24057 . A 28 GLY N . 31016 1 225 . 1 . 1 29 29 GLY H H 1 8.5883 0.0000 . 1 . . 14607 . A 29 GLY H . 31016 1 226 . 1 . 1 29 29 GLY HA2 H 1 4.0786 0.0000 . 2 . . . . A 29 GLY HA2 . 31016 1 227 . 1 . 1 29 29 GLY HA3 H 1 3.7876 0.0000 . 2 . . . . A 29 GLY HA3 . 31016 1 228 . 1 . 1 29 29 GLY CA C 13 47.0920 0.0000 . 1 . . 14605 . A 29 GLY CA . 31016 1 229 . 1 . 1 29 29 GLY N N 15 111.1379 0.0000 . 1 . . 14609 . A 29 GLY N . 31016 1 230 . 1 . 1 30 30 GLN HA H 1 4.1820 0.0000 . 1 . . 27338 . A 30 GLN HA . 31016 1 231 . 1 . 1 30 30 GLN HB2 H 1 2.1050 0.0000 . 2 . . 27359 . A 30 GLN HB2 . 31016 1 232 . 1 . 1 30 30 GLN HG2 H 1 2.4190 0.0000 . 2 . . 27350 . A 30 GLN HG2 . 31016 1 233 . 1 . 1 30 30 GLN CA C 13 58.5831 0.0000 . 1 . . 22207 . A 30 GLN CA . 31016 1 234 . 1 . 1 30 30 GLN CB C 13 28.4136 0.0000 . 1 . . 22204 . A 30 GLN CB . 31016 1 235 . 1 . 1 30 30 GLN CG C 13 33.7110 0.0000 . 1 . . 27866 . A 30 GLN CG . 31016 1 236 . 1 . 1 31 31 GLN H H 1 8.5138 0.0000 . 1 . . 22194 . A 31 GLN H . 31016 1 237 . 1 . 1 31 31 GLN HA H 1 4.1040 0.0000 . 1 . . 27056 . A 31 GLN HA . 31016 1 238 . 1 . 1 31 31 GLN HB2 H 1 2.2020 0.0000 . 2 . . 27080 . A 31 GLN HB2 . 31016 1 239 . 1 . 1 31 31 GLN HG2 H 1 2.5500 0.0000 . 2 . . 27071 . A 31 GLN HG2 . 31016 1 240 . 1 . 1 31 31 GLN CA C 13 58.9181 0.0000 . 1 . . 22198 . A 31 GLN CA . 31016 1 241 . 1 . 1 31 31 GLN CB C 13 27.9965 0.0000 . 1 . . 22195 . A 31 GLN CB . 31016 1 242 . 1 . 1 31 31 GLN CG C 13 34.3240 0.0000 . 1 . . 27650 . A 31 GLN CG . 31016 1 243 . 1 . 1 31 31 GLN N N 15 119.9474 0.0000 . 1 . . 22196 . A 31 GLN N . 31016 1 244 . 1 . 1 32 32 LYS H H 1 8.1706 0.0000 . 1 . . 18633 . A 32 LYS H . 31016 1 245 . 1 . 1 32 32 LYS HA H 1 3.8780 0.0000 . 1 . . 27401 . A 32 LYS HA . 31016 1 246 . 1 . 1 32 32 LYS HB2 H 1 1.8760 0.0000 . 2 . . . . A 32 LYS HB2 . 31016 1 247 . 1 . 1 32 32 LYS HG2 H 1 1.4786 0.0000 . 2 . . . . A 32 LYS HG2 . 31016 1 248 . 1 . 1 32 32 LYS HG3 H 1 1.5130 0.0000 . 2 . . 27410 . A 32 LYS HG3 . 31016 1 249 . 1 . 1 32 32 LYS HD2 H 1 1.7890 0.0000 . 2 . . . . A 32 LYS HD2 . 31016 1 250 . 1 . 1 32 32 LYS HD3 H 1 1.7890 0.0000 . 2 . . 27407 . A 32 LYS HD3 . 31016 1 251 . 1 . 1 32 32 LYS HE2 H 1 3.0010 0.0000 . 2 . . 27404 . A 32 LYS HE2 . 31016 1 252 . 1 . 1 32 32 LYS CA C 13 60.9096 0.0000 . 1 . . 18643 . A 32 LYS CA . 31016 1 253 . 1 . 1 32 32 LYS CB C 13 32.7758 0.0000 . 1 . . 18637 . A 32 LYS CB . 31016 1 254 . 1 . 1 32 32 LYS CG C 13 25.1000 0.0000 . 1 . . 27920 . A 32 LYS CG . 31016 1 255 . 1 . 1 32 32 LYS CD C 13 29.6010 0.0000 . 1 . . . . A 32 LYS CD . 31016 1 256 . 1 . 1 32 32 LYS CE C 13 42.1400 0.0000 . 1 . . 27914 . A 32 LYS CE . 31016 1 257 . 1 . 1 32 32 LYS N N 15 122.1702 0.0000 . 1 . . 18635 . A 32 LYS N . 31016 1 258 . 1 . 1 33 33 GLN H H 1 8.0156 0.0000 . 1 . . 22926 . A 33 GLN H . 31016 1 259 . 1 . 1 33 33 GLN HA H 1 3.9960 0.0000 . 1 . . . . A 33 GLN HA . 31016 1 260 . 1 . 1 33 33 GLN HB2 H 1 2.1320 0.0000 . 2 . . . . A 33 GLN HB2 . 31016 1 261 . 1 . 1 33 33 GLN HG2 H 1 2.3710 0.0000 . 2 . . . . A 33 GLN HG2 . 31016 1 262 . 1 . 1 33 33 GLN CA C 13 59.1224 0.0000 . 1 . . 22930 . A 33 GLN CA . 31016 1 263 . 1 . 1 33 33 GLN CB C 13 28.2103 0.0000 . 1 . . 22936 . A 33 GLN CB . 31016 1 264 . 1 . 1 33 33 GLN CG C 13 33.6460 0.0000 . 1 . . . . A 33 GLN CG . 31016 1 265 . 1 . 1 33 33 GLN N N 15 118.7771 0.0000 . 1 . . 22928 . A 33 GLN N . 31016 1 266 . 1 . 1 34 34 LEU H H 1 8.0752 0.0000 . 1 . . 20006 . A 34 LEU H . 31016 1 267 . 1 . 1 34 34 LEU HA H 1 4.2330 0.0000 . 1 . . 27362 . A 34 LEU HA . 31016 1 268 . 1 . 1 34 34 LEU HB2 H 1 1.7150 0.0000 . 2 . . 27374 . A 34 LEU HB2 . 31016 1 269 . 1 . 1 34 34 LEU HB3 H 1 1.6931 0.0000 . 2 . . . . A 34 LEU HB3 . 31016 1 270 . 1 . 1 34 34 LEU HG H 1 1.6600 0.0000 . 1 . . . . A 34 LEU HG . 31016 1 271 . 1 . 1 34 34 LEU HD11 H 1 0.9310 0.0000 . 2 . . 27377 . A 34 LEU HD11 . 31016 1 272 . 1 . 1 34 34 LEU HD12 H 1 0.9310 0.0000 . 2 . . 27377 . A 34 LEU HD12 . 31016 1 273 . 1 . 1 34 34 LEU HD13 H 1 0.9310 0.0000 . 2 . . 27377 . A 34 LEU HD13 . 31016 1 274 . 1 . 1 34 34 LEU HD21 H 1 0.9035 0.0000 . 2 . . . . A 34 LEU HD21 . 31016 1 275 . 1 . 1 34 34 LEU HD22 H 1 0.9035 0.0000 . 2 . . . . A 34 LEU HD22 . 31016 1 276 . 1 . 1 34 34 LEU HD23 H 1 0.9035 0.0000 . 2 . . . . A 34 LEU HD23 . 31016 1 277 . 1 . 1 34 34 LEU CA C 13 57.8391 0.0000 . 1 . . 20007 . A 34 LEU CA . 31016 1 278 . 1 . 1 34 34 LEU CB C 13 41.6747 0.0000 . 1 . . 20039 . A 34 LEU CB . 31016 1 279 . 1 . 1 34 34 LEU CG C 13 26.8590 0.0000 . 1 . . 27881 . A 34 LEU CG . 31016 1 280 . 1 . 1 34 34 LEU CD1 C 13 23.9380 0.0000 . 2 . . 27884 . A 34 LEU CD1 . 31016 1 281 . 1 . 1 34 34 LEU CD2 C 13 23.8900 0.0000 . 2 . . . . A 34 LEU CD2 . 31016 1 282 . 1 . 1 34 34 LEU N N 15 121.6139 0.0000 . 1 . . 20008 . A 34 LEU N . 31016 1 283 . 1 . 1 35 35 CYS H H 1 7.8621 0.0000 . 1 . . 22577 . A 35 CYS H . 31016 1 284 . 1 . 1 35 35 CYS HA H 1 4.2278 0.0000 . 1 . . . . A 35 CYS HA . 31016 1 285 . 1 . 1 35 35 CYS HB2 H 1 3.5100 0.0000 . 2 . . 27107 . A 35 CYS HB2 . 31016 1 286 . 1 . 1 35 35 CYS HB3 H 1 3.0680 0.0000 . 2 . . 27110 . A 35 CYS HB3 . 31016 1 287 . 1 . 1 35 35 CYS CA C 13 60.0646 0.0000 . 1 . . 22578 . A 35 CYS CA . 31016 1 288 . 1 . 1 35 35 CYS CB C 13 35.2291 0.0000 . 1 . . 22587 . A 35 CYS CB . 31016 1 289 . 1 . 1 35 35 CYS N N 15 119.7286 0.0000 . 1 . . 22579 . A 35 CYS N . 31016 1 290 . 1 . 1 36 36 ARG H H 1 8.3259 0.0000 . 1 . . 19412 . A 36 ARG H . 31016 1 291 . 1 . 1 36 36 ARG HA H 1 3.8757 0.0000 . 1 . . . . A 36 ARG HA . 31016 1 292 . 1 . 1 36 36 ARG HB2 H 1 1.8290 0.0000 . 2 . . . . A 36 ARG HB2 . 31016 1 293 . 1 . 1 36 36 ARG HB3 H 1 1.7334 0.0000 . 2 . . . . A 36 ARG HB3 . 31016 1 294 . 1 . 1 36 36 ARG HG2 H 1 1.6546 0.0000 . 2 . . . . A 36 ARG HG2 . 31016 1 295 . 1 . 1 36 36 ARG HG3 H 1 1.5933 0.0000 . 2 . . . . A 36 ARG HG3 . 31016 1 296 . 1 . 1 36 36 ARG HD2 H 1 3.1922 0.0000 . 2 . . . . A 36 ARG HD2 . 31016 1 297 . 1 . 1 36 36 ARG CA C 13 60.1840 0.0000 . 1 . . 19413 . A 36 ARG CA . 31016 1 298 . 1 . 1 36 36 ARG CB C 13 30.4646 0.0000 . 1 . . 19419 . A 36 ARG CB . 31016 1 299 . 1 . 1 36 36 ARG CG C 13 26.8860 0.0000 . 1 . . . . A 36 ARG CG . 31016 1 300 . 1 . 1 36 36 ARG CD C 13 43.5499 0.0000 . 1 . . . . A 36 ARG CD . 31016 1 301 . 1 . 1 36 36 ARG N N 15 121.9300 0.0000 . 1 . . 19414 . A 36 ARG N . 31016 1 302 . 1 . 1 37 37 PHE H H 1 8.2741 0.0000 . 1 . . 20766 . A 37 PHE H . 31016 1 303 . 1 . 1 37 37 PHE HA H 1 4.3725 0.0000 . 1 . . . . A 37 PHE HA . 31016 1 304 . 1 . 1 37 37 PHE HB2 H 1 3.3394 0.0000 . 2 . . . . A 37 PHE HB2 . 31016 1 305 . 1 . 1 37 37 PHE HD1 H 1 7.2380 0.0000 . 3 . . . . A 37 PHE HD1 . 31016 1 306 . 1 . 1 37 37 PHE HD2 H 1 7.3252 0.0000 . 3 . . . . A 37 PHE HD2 . 31016 1 307 . 1 . 1 37 37 PHE CA C 13 60.8534 0.0000 . 1 . . 20767 . A 37 PHE CA . 31016 1 308 . 1 . 1 37 37 PHE CB C 13 38.6324 0.0000 . 1 . . 20770 . A 37 PHE CB . 31016 1 309 . 1 . 1 37 37 PHE CD1 C 13 131.9030 0.0000 . 3 . . . . A 37 PHE CD1 . 31016 1 310 . 1 . 1 37 37 PHE CD2 C 13 131.9030 0.0000 . 3 . . . . A 37 PHE CD2 . 31016 1 311 . 1 . 1 37 37 PHE N N 15 121.2246 0.0000 . 1 . . 20768 . A 37 PHE N . 31016 1 312 . 1 . 1 38 38 ARG H H 1 8.3798 0.0000 . 1 . . 21951 . A 38 ARG H . 31016 1 313 . 1 . 1 38 38 ARG HA H 1 4.0057 0.0000 . 1 . . . . A 38 ARG HA . 31016 1 314 . 1 . 1 38 38 ARG HB2 H 1 2.0024 0.0000 . 2 . . . . A 38 ARG HB2 . 31016 1 315 . 1 . 1 38 38 ARG HB3 H 1 2.1187 0.0000 . 2 . . . . A 38 ARG HB3 . 31016 1 316 . 1 . 1 38 38 ARG HG2 H 1 1.7789 0.0000 . 2 . . . . A 38 ARG HG2 . 31016 1 317 . 1 . 1 38 38 ARG HD2 H 1 3.2545 0.0000 . 2 . . . . A 38 ARG HD2 . 31016 1 318 . 1 . 1 38 38 ARG CA C 13 59.7181 0.0000 . 1 . . 21961 . A 38 ARG CA . 31016 1 319 . 1 . 1 38 38 ARG CB C 13 29.6366 0.0000 . 1 . . 21958 . A 38 ARG CB . 31016 1 320 . 1 . 1 38 38 ARG CG C 13 27.8980 0.0000 . 1 . . 27929 . A 38 ARG CG . 31016 1 321 . 1 . 1 38 38 ARG CD C 13 43.5017 0.0000 . 1 . . . . A 38 ARG CD . 31016 1 322 . 1 . 1 38 38 ARG N N 15 120.1086 0.0000 . 1 . . 21953 . A 38 ARG N . 31016 1 323 . 1 . 1 39 39 CYS H H 1 8.1953 0.0000 . 1 . . 22998 . A 39 CYS H . 31016 1 324 . 1 . 1 39 39 CYS HA H 1 4.4350 0.0000 . 1 . . . . A 39 CYS HA . 31016 1 325 . 1 . 1 39 39 CYS HB2 H 1 2.9862 0.0000 . 2 . . . . A 39 CYS HB2 . 31016 1 326 . 1 . 1 39 39 CYS HB3 H 1 3.5138 0.0000 . 2 . . . . A 39 CYS HB3 . 31016 1 327 . 1 . 1 39 39 CYS CA C 13 57.6114 0.0000 . 1 . . 23072 . A 39 CYS CA . 31016 1 328 . 1 . 1 39 39 CYS CB C 13 37.9051 0.0000 . 1 . . 23002 . A 39 CYS CB . 31016 1 329 . 1 . 1 39 39 CYS N N 15 118.3753 0.0000 . 1 . . 23000 . A 39 CYS N . 31016 1 330 . 1 . 1 40 40 GLN H H 1 8.0650 0.0000 . 1 . . 21730 . A 40 GLN H . 31016 1 331 . 1 . 1 40 40 GLN HA H 1 3.9690 0.0000 . 1 . . 27341 . A 40 GLN HA . 31016 1 332 . 1 . 1 40 40 GLN HB2 H 1 2.1740 0.0000 . 2 . . 27356 . A 40 GLN HB2 . 31016 1 333 . 1 . 1 40 40 GLN HB3 H 1 2.3940 0.0000 . 2 . . 27353 . A 40 GLN HB3 . 31016 1 334 . 1 . 1 40 40 GLN HG2 H 1 2.5730 0.0000 . 2 . . 27347 . A 40 GLN HG2 . 31016 1 335 . 1 . 1 40 40 GLN CA C 13 58.9763 0.0000 . 1 . . 21731 . A 40 GLN CA . 31016 1 336 . 1 . 1 40 40 GLN CB C 13 28.2851 0.0000 . 1 . . 21740 . A 40 GLN CB . 31016 1 337 . 1 . 1 40 40 GLN CG C 13 33.9840 0.0000 . 1 . . 27863 . A 40 GLN CG . 31016 1 338 . 1 . 1 40 40 GLN N N 15 120.4951 0.0000 . 1 . . 21732 . A 40 GLN N . 31016 1 339 . 1 . 1 41 41 GLU H H 1 8.2735 0.0000 . 1 . . 22301 . A 41 GLU H . 31016 1 340 . 1 . 1 41 41 GLU HA H 1 3.9073 0.0000 . 1 . . . . A 41 GLU HA . 31016 1 341 . 1 . 1 41 41 GLU HB2 H 1 1.9488 0.0000 . 2 . . . . A 41 GLU HB2 . 31016 1 342 . 1 . 1 41 41 GLU HB3 H 1 1.8504 0.0000 . 2 . . . . A 41 GLU HB3 . 31016 1 343 . 1 . 1 41 41 GLU HG2 H 1 1.9488 0.0000 . 2 . . . . A 41 GLU HG2 . 31016 1 344 . 1 . 1 41 41 GLU HG3 H 1 1.8504 0.0000 . 2 . . . . A 41 GLU HG3 . 31016 1 345 . 1 . 1 41 41 GLU CA C 13 58.8094 0.0000 . 1 . . 22302 . A 41 GLU CA . 31016 1 346 . 1 . 1 41 41 GLU CB C 13 29.9799 0.0000 . 1 . . 22305 . A 41 GLU CB . 31016 1 347 . 1 . 1 41 41 GLU CG C 13 36.3247 0.0000 . 1 . . . . A 41 GLU CG . 31016 1 348 . 1 . 1 41 41 GLU N N 15 119.9162 0.0000 . 1 . . 22303 . A 41 GLU N . 31016 1 349 . 1 . 1 42 42 LYS H H 1 7.7963 0.0000 . 1 . . 22518 . A 42 LYS H . 31016 1 350 . 1 . 1 42 42 LYS HA H 1 3.9660 0.0000 . 1 . . 27443 . A 42 LYS HA . 31016 1 351 . 1 . 1 42 42 LYS HB2 H 1 1.6290 0.0000 . 2 . . 27458 . A 42 LYS HB2 . 31016 1 352 . 1 . 1 42 42 LYS HB3 H 1 1.7130 0.0000 . 2 . . . . A 42 LYS HB3 . 31016 1 353 . 1 . 1 42 42 LYS HG2 H 1 1.0130 0.0000 . 2 . . 27461 . A 42 LYS HG2 . 31016 1 354 . 1 . 1 42 42 LYS HD2 H 1 1.3110 0.0000 . 2 . . . . A 42 LYS HD2 . 31016 1 355 . 1 . 1 42 42 LYS HE2 H 1 2.9100 0.0000 . 2 . . 27446 . A 42 LYS HE2 . 31016 1 356 . 1 . 1 42 42 LYS CA C 13 59.0953 0.0000 . 1 . . 22519 . A 42 LYS CA . 31016 1 357 . 1 . 1 42 42 LYS CB C 13 32.6706 0.0000 . 1 . . 22522 . A 42 LYS CB . 31016 1 358 . 1 . 1 42 42 LYS CG C 13 24.7110 0.0000 . 1 . . 27953 . A 42 LYS CG . 31016 1 359 . 1 . 1 42 42 LYS CD C 13 29.1960 0.0000 . 1 . . . . A 42 LYS CD . 31016 1 360 . 1 . 1 42 42 LYS CE C 13 41.8550 0.0000 . 1 . . 27947 . A 42 LYS CE . 31016 1 361 . 1 . 1 42 42 LYS N N 15 119.7544 0.0000 . 1 . . 22520 . A 42 LYS N . 31016 1 362 . 1 . 1 43 43 TYR H H 1 7.5854 0.0000 . 1 . . 23529 . A 43 TYR H . 31016 1 363 . 1 . 1 43 43 TYR HA H 1 4.5910 0.0000 . 1 . . . . A 43 TYR HA . 31016 1 364 . 1 . 1 43 43 TYR HB2 H 1 3.2420 0.0000 . 2 . . 27299 . A 43 TYR HB2 . 31016 1 365 . 1 . 1 43 43 TYR HB3 H 1 2.9530 0.0000 . 2 . . 27305 . A 43 TYR HB3 . 31016 1 366 . 1 . 1 43 43 TYR HD1 H 1 7.2031 0.0000 . 3 . . . . A 43 TYR HD1 . 31016 1 367 . 1 . 1 43 43 TYR HE1 H 1 6.7220 0.0000 . 3 . . . . A 43 TYR HE1 . 31016 1 368 . 1 . 1 43 43 TYR CA C 13 59.3743 0.0000 . 1 . . 23530 . A 43 TYR CA . 31016 1 369 . 1 . 1 43 43 TYR CB C 13 38.8837 0.0000 . 1 . . 23533 . A 43 TYR CB . 31016 1 370 . 1 . 1 43 43 TYR CD1 C 13 133.5236 0.0000 . 3 . . . . A 43 TYR CD1 . 31016 1 371 . 1 . 1 43 43 TYR CE1 C 13 117.8968 0.0000 . 3 . . . . A 43 TYR CE1 . 31016 1 372 . 1 . 1 43 43 TYR N N 15 117.9533 0.0000 . 1 . . 23531 . A 43 TYR N . 31016 1 373 . 1 . 1 44 44 LYS H H 1 7.8623 0.0000 . 1 . . 21754 . A 44 LYS H . 31016 1 374 . 1 . 1 44 44 LYS HA H 1 3.9920 0.0000 . 1 . . 27251 . A 44 LYS HA . 31016 1 375 . 1 . 1 44 44 LYS HB2 H 1 1.8910 0.0000 . 2 . . 27263 . A 44 LYS HB2 . 31016 1 376 . 1 . 1 44 44 LYS HG2 H 1 1.4630 0.0000 . 2 . . . . A 44 LYS HG2 . 31016 1 377 . 1 . 1 44 44 LYS HD2 H 1 1.6570 0.0000 . 2 . . . . A 44 LYS HD2 . 31016 1 378 . 1 . 1 44 44 LYS HE2 H 1 2.9570 0.0000 . 2 . . 27257 . A 44 LYS HE2 . 31016 1 379 . 1 . 1 44 44 LYS CA C 13 58.3972 0.0000 . 1 . . 28073 . A 44 LYS CA . 31016 1 380 . 1 . 1 44 44 LYS CB C 13 32.7038 0.0000 . 1 . . 21764 . A 44 LYS CB . 31016 1 381 . 1 . 1 44 44 LYS CG C 13 24.9240 0.0000 . 1 . . 27794 . A 44 LYS CG . 31016 1 382 . 1 . 1 44 44 LYS CD C 13 29.2960 0.0000 . 1 . . . . A 44 LYS CD . 31016 1 383 . 1 . 1 44 44 LYS CE C 13 41.8310 0.0000 . 1 . . 27776 . A 44 LYS CE . 31016 1 384 . 1 . 1 44 44 LYS N N 15 120.4748 0.0000 . 1 . . 21756 . A 44 LYS N . 31016 1 385 . 1 . 1 45 45 LYS H H 1 7.9915 0.0000 . 1 . . 21317 . A 45 LYS H . 31016 1 386 . 1 . 1 45 45 LYS HA H 1 4.1620 0.0000 . 1 . . . . A 45 LYS HA . 31016 1 387 . 1 . 1 45 45 LYS HB2 H 1 1.8860 0.0000 . 2 . . . . A 45 LYS HB2 . 31016 1 388 . 1 . 1 45 45 LYS HG2 H 1 1.4400 0.0000 . 2 . . . . A 45 LYS HG2 . 31016 1 389 . 1 . 1 45 45 LYS HD2 H 1 1.6630 0.0000 . 2 . . . . A 45 LYS HD2 . 31016 1 390 . 1 . 1 45 45 LYS HE2 H 1 2.9910 0.0000 . 2 . . . . A 45 LYS HE2 . 31016 1 391 . 1 . 1 45 45 LYS CA C 13 57.8662 0.0000 . 1 . . 21318 . A 45 LYS CA . 31016 1 392 . 1 . 1 45 45 LYS CB C 13 32.8288 0.0000 . 1 . . 21321 . A 45 LYS CB . 31016 1 393 . 1 . 1 45 45 LYS CG C 13 24.7990 0.0000 . 1 . . 27806 . A 45 LYS CG . 31016 1 394 . 1 . 1 45 45 LYS CD C 13 29.1960 0.0000 . 1 . . . . A 45 LYS CD . 31016 1 395 . 1 . 1 45 45 LYS CE C 13 41.9160 0.0000 . 1 . . 27800 . A 45 LYS CE . 31016 1 396 . 1 . 1 45 45 LYS N N 15 120.9718 0.0000 . 1 . . 21319 . A 45 LYS N . 31016 1 397 . 1 . 1 46 46 GLU H H 1 8.1187 0.0000 . 1 . . 25875 . A 46 GLU H . 31016 1 398 . 1 . 1 46 46 GLU HA H 1 4.1870 0.0000 . 1 . . . . A 46 GLU HA . 31016 1 399 . 1 . 1 46 46 GLU HB2 H 1 2.0460 0.0000 . 2 . . 27242 . A 46 GLU HB2 . 31016 1 400 . 1 . 1 46 46 GLU HG2 H 1 2.2650 0.0000 . 2 . . . . A 46 GLU HG2 . 31016 1 401 . 1 . 1 46 46 GLU HG3 H 1 2.4050 0.0000 . 2 . . . . A 46 GLU HG3 . 31016 1 402 . 1 . 1 46 46 GLU CA C 13 57.5452 0.0000 . 1 . . 25876 . A 46 GLU CA . 31016 1 403 . 1 . 1 46 46 GLU CB C 13 29.9824 0.0000 . 1 . . 25882 . A 46 GLU CB . 31016 1 404 . 1 . 1 46 46 GLU CG C 13 36.3700 0.0000 . 1 . . 27779 . A 46 GLU CG . 31016 1 405 . 1 . 1 46 46 GLU N N 15 120.8263 0.0000 . 1 . . 25877 . A 46 GLU N . 31016 1 406 . 1 . 1 47 47 ARG H H 1 8.0465 0.0000 . 1 . . 21536 . A 47 ARG H . 31016 1 407 . 1 . 1 47 47 ARG HA H 1 4.1870 0.0000 . 1 . . . . A 47 ARG HA . 31016 1 408 . 1 . 1 47 47 ARG HB2 H 1 1.7210 0.0000 . 2 . . . . A 47 ARG HB2 . 31016 1 409 . 1 . 1 47 47 ARG HG2 H 1 1.5060 0.0000 . 2 . . . . A 47 ARG HG2 . 31016 1 410 . 1 . 1 47 47 ARG HD2 H 1 3.0490 0.0000 . 2 . . . . A 47 ARG HD2 . 31016 1 411 . 1 . 1 47 47 ARG CA C 13 56.7468 0.0000 . 1 . . 21537 . A 47 ARG CA . 31016 1 412 . 1 . 1 47 47 ARG CB C 13 30.3099 0.0000 . 1 . . 21540 . A 47 ARG CB . 31016 1 413 . 1 . 1 47 47 ARG CG C 13 26.6880 0.0000 . 1 . . . . A 47 ARG CG . 31016 1 414 . 1 . 1 47 47 ARG CD C 13 43.0300 0.0000 . 1 . . . . A 47 ARG CD . 31016 1 415 . 1 . 1 47 47 ARG N N 15 121.0954 0.0000 . 1 . . 21538 . A 47 ARG N . 31016 1 416 . 1 . 1 48 48 ARG H H 1 8.1011 0.0000 . 1 . . 19014 . A 48 ARG H . 31016 1 417 . 1 . 1 48 48 ARG HA H 1 4.3180 0.0000 . 1 . . 26981 . A 48 ARG HA . 31016 1 418 . 1 . 1 48 48 ARG HB2 H 1 2.2710 0.0000 . 2 . . 26993 . A 48 ARG HB2 . 31016 1 419 . 1 . 1 48 48 ARG HG2 H 1 2.0750 0.0000 . 2 . . 26999 . A 48 ARG HG2 . 31016 1 420 . 1 . 1 48 48 ARG HG3 H 1 1.9440 0.0000 . 2 . . 27005 . A 48 ARG HG3 . 31016 1 421 . 1 . 1 48 48 ARG CA C 13 56.6368 0.0000 . 1 . . 19018 . A 48 ARG CA . 31016 1 422 . 1 . 1 48 48 ARG CB C 13 30.3404 0.0000 . 1 . . 19015 . A 48 ARG CB . 31016 1 423 . 1 . 1 48 48 ARG N N 15 121.9082 0.0000 . 1 . . 19016 . A 48 ARG N . 31016 1 424 . 1 . 1 49 49 GLU H H 1 8.5513 0.0000 . 1 . . 12627 . A 49 GLU H . 31016 1 425 . 1 . 1 49 49 GLU HA H 1 4.2450 0.0000 . 1 . . . . A 49 GLU HA . 31016 1 426 . 1 . 1 49 49 GLU HB2 H 1 1.9850 0.0000 . 2 . . 26951 . A 49 GLU HB2 . 31016 1 427 . 1 . 1 49 49 GLU HG2 H 1 2.2580 0.0000 . 2 . . 26948 . A 49 GLU HG2 . 31016 1 428 . 1 . 1 49 49 GLU CA C 13 56.6481 0.0000 . 1 . . 28286 . A 49 GLU CA . 31016 1 429 . 1 . 1 49 49 GLU CB C 13 30.2153 0.0000 . 1 . . 28290 . A 49 GLU CB . 31016 1 430 . 1 . 1 49 49 GLU CG C 13 35.9820 0.0000 . 1 . . 27587 . A 49 GLU CG . 31016 1 431 . 1 . 1 49 49 GLU N N 15 122.9551 0.0000 . 1 . . 12629 . A 49 GLU N . 31016 1 432 . 1 . 1 50 50 HIS H H 1 8.2045 0.0000 . 1 . . 16592 . A 50 HIS H . 31016 1 433 . 1 . 1 50 50 HIS HA H 1 4.5875 0.0000 . 1 . . . . A 50 HIS HA . 31016 1 434 . 1 . 1 50 50 HIS HB2 H 1 3.0838 0.0000 . 2 . . . . A 50 HIS HB2 . 31016 1 435 . 1 . 1 50 50 HIS HD2 H 1 6.9911 0.0000 . 1 . . . . A 50 HIS HD2 . 31016 1 436 . 1 . 1 50 50 HIS CA C 13 53.8986 0.0000 . 1 . . 26048 . A 50 HIS CA . 31016 1 437 . 1 . 1 50 50 HIS CB C 13 30.1528 0.0000 . 1 . . 26070 . A 50 HIS CB . 31016 1 438 . 1 . 1 50 50 HIS CD2 C 13 120.1310 0.0000 . 1 . . . . A 50 HIS CD2 . 31016 1 439 . 1 . 1 50 50 HIS N N 15 123.7265 0.0000 . 1 . . 16594 . A 50 HIS N . 31016 1 440 . 1 . 1 51 51 SER HA H 1 4.4100 0.0000 . 1 . . . . A 51 SER HA . 31016 1 441 . 1 . 1 51 51 SER HB2 H 1 3.7724 0.0000 . 2 . . 27020 . A 51 SER HB2 . 31016 1 442 . 1 . 1 51 51 SER HB3 H 1 3.8017 0.0000 . 2 . . . . A 51 SER HB3 . 31016 1 443 . 1 . 1 51 51 SER CA C 13 58.4738 0.0000 . 1 . . 28074 . A 51 SER CA . 31016 1 444 . 1 . 1 51 51 SER CB C 13 63.8792 0.0000 . 1 . . 17872 . A 51 SER CB . 31016 1 445 . 1 . 1 52 52 TYR H H 1 8.1492 0.0000 . 1 . . 17865 . A 52 TYR H . 31016 1 446 . 1 . 1 52 52 TYR HA H 1 4.6110 0.0000 . 1 . . 27428 . A 52 TYR HA . 31016 1 447 . 1 . 1 52 52 TYR HB2 H 1 3.0722 0.0000 . 2 . . 27437 . A 52 TYR HB2 . 31016 1 448 . 1 . 1 52 52 TYR HB3 H 1 2.9671 0.0000 . 2 . . . . A 52 TYR HB3 . 31016 1 449 . 1 . 1 52 52 TYR HD1 H 1 7.1481 0.0000 . 3 . . . . A 52 TYR HD1 . 31016 1 450 . 1 . 1 52 52 TYR HE1 H 1 6.8020 0.0000 . 3 . . . . A 52 TYR HE1 . 31016 1 451 . 1 . 1 52 52 TYR CA C 13 57.9179 0.0000 . 1 . . 28284 . A 52 TYR CA . 31016 1 452 . 1 . 1 52 52 TYR CB C 13 38.7735 0.0000 . 1 . . 28280 . A 52 TYR CB . 31016 1 453 . 1 . 1 52 52 TYR CD1 C 13 133.2626 0.0000 . 3 . . . . A 52 TYR CD1 . 31016 1 454 . 1 . 1 52 52 TYR CE1 C 13 118.2481 0.0000 . 3 . . . . A 52 TYR CE1 . 31016 1 455 . 1 . 1 52 52 TYR N N 15 122.6230 0.0000 . 1 . . 17867 . A 52 TYR N . 31016 1 456 . 1 . 1 53 53 SER H H 1 8.2061 0.0000 . 1 . . 23278 . A 53 SER H . 31016 1 457 . 1 . 1 53 53 SER HA H 1 4.4180 0.0000 . 1 . . . . A 53 SER HA . 31016 1 458 . 1 . 1 53 53 SER HB2 H 1 3.8628 0.0000 . 2 . . . . A 53 SER HB2 . 31016 1 459 . 1 . 1 53 53 SER HB3 H 1 3.8250 0.0000 . 2 . . . . A 53 SER HB3 . 31016 1 460 . 1 . 1 53 53 SER CA C 13 58.1135 0.0000 . 1 . . 23282 . A 53 SER CA . 31016 1 461 . 1 . 1 53 53 SER CB C 13 63.9517 0.0000 . 1 . . 23279 . A 53 SER CB . 31016 1 462 . 1 . 1 53 53 SER N N 15 118.2171 0.0000 . 1 . . 23280 . A 53 SER N . 31016 1 463 . 1 . 1 54 54 ARG H H 1 8.3303 0.0000 . 1 . . 16875 . A 54 ARG H . 31016 1 464 . 1 . 1 54 54 ARG HA H 1 4.2610 0.0000 . 1 . . . . A 54 ARG HA . 31016 1 465 . 1 . 1 54 54 ARG HB2 H 1 1.8370 0.0000 . 2 . . 27227 . A 54 ARG HB2 . 31016 1 466 . 1 . 1 54 54 ARG HG2 H 1 1.6280 0.0000 . 2 . . 27173 . A 54 ARG HG2 . 31016 1 467 . 1 . 1 54 54 ARG HD2 H 1 3.1950 0.0000 . 2 . . 27164 . A 54 ARG HD2 . 31016 1 468 . 1 . 1 54 54 ARG CA C 13 56.5509 0.0000 . 1 . . 28239 . A 54 ARG CA . 31016 1 469 . 1 . 1 54 54 ARG CB C 13 30.8936 0.0000 . 1 . . 16876 . A 54 ARG CB . 31016 1 470 . 1 . 1 54 54 ARG CG C 13 26.8710 0.0000 . 1 . . 27743 . A 54 ARG CG . 31016 1 471 . 1 . 1 54 54 ARG CD C 13 43.1130 0.0000 . 1 . . 27731 . A 54 ARG CD . 31016 1 472 . 1 . 1 54 54 ARG N N 15 123.7882 0.0000 . 1 . . 16877 . A 54 ARG N . 31016 1 473 . 1 . 1 55 55 ASP H H 1 8.2940 0.0000 . 1 . . 26169 . A 55 ASP H . 31016 1 474 . 1 . 1 55 55 ASP HA H 1 4.5390 0.0000 . 1 . . 27188 . A 55 ASP HA . 31016 1 475 . 1 . 1 55 55 ASP HB2 H 1 2.5770 0.0000 . 2 . . 27212 . A 55 ASP HB2 . 31016 1 476 . 1 . 1 55 55 ASP HB3 H 1 2.7340 0.0000 . 2 . . 27206 . A 55 ASP HB3 . 31016 1 477 . 1 . 1 55 55 ASP CA C 13 55.0069 0.0000 . 1 . . 26170 . A 55 ASP CA . 31016 1 478 . 1 . 1 55 55 ASP CB C 13 40.9440 0.0000 . 1 . . 26176 . A 55 ASP CB . 31016 1 479 . 1 . 1 55 55 ASP N N 15 121.4770 0.0000 . 1 . . 26171 . A 55 ASP N . 31016 1 480 . 1 . 1 56 56 GLU H H 1 8.2964 0.0000 . 1 . . 20578 . A 56 GLU H . 31016 1 481 . 1 . 1 56 56 GLU HA H 1 4.2090 0.0000 . 1 . . 27191 . A 56 GLU HA . 31016 1 482 . 1 . 1 56 56 GLU HB2 H 1 1.9600 0.0000 . 2 . . . . A 56 GLU HB2 . 31016 1 483 . 1 . 1 56 56 GLU HB3 H 1 2.0260 0.0000 . 2 . . . . A 56 GLU HB3 . 31016 1 484 . 1 . 1 56 56 GLU HG2 H 1 2.2640 0.0000 . 2 . . 27218 . A 56 GLU HG2 . 31016 1 485 . 1 . 1 56 56 GLU CA C 13 57.2294 0.0000 . 1 . . 20579 . A 56 GLU CA . 31016 1 486 . 1 . 1 56 56 GLU CB C 13 30.1869 0.0000 . 1 . . 20582 . A 56 GLU CB . 31016 1 487 . 1 . 1 56 56 GLU CG C 13 36.1620 0.0000 . 1 . . 27755 . A 56 GLU CG . 31016 1 488 . 1 . 1 56 56 GLU N N 15 121.3687 0.0000 . 1 . . 20580 . A 56 GLU N . 31016 1 489 . 1 . 1 57 57 GLU H H 1 8.2528 0.0000 . 1 . . 20472 . A 57 GLU H . 31016 1 490 . 1 . 1 57 57 GLU HA H 1 4.2170 0.0000 . 1 . . 27053 . A 57 GLU HA . 31016 1 491 . 1 . 1 57 57 GLU HB2 H 1 2.0310 0.0000 . 2 . . 27083 . A 57 GLU HB2 . 31016 1 492 . 1 . 1 57 57 GLU HG3 H 1 2.2700 0.0000 . 2 . . 27077 . A 57 GLU HG3 . 31016 1 493 . 1 . 1 57 57 GLU CA C 13 56.9749 0.0000 . 1 . . 20473 . A 57 GLU CA . 31016 1 494 . 1 . 1 57 57 GLU CB C 13 30.0406 0.0000 . 1 . . 20476 . A 57 GLU CB . 31016 1 495 . 1 . 1 57 57 GLU CG C 13 36.1460 0.0000 . 1 . . 27647 . A 57 GLU CG . 31016 1 496 . 1 . 1 57 57 GLU N N 15 121.3202 0.0000 . 1 . . 20474 . A 57 GLU N . 31016 1 497 . 1 . 1 58 58 LEU H H 1 7.9614 0.0000 . 1 . . 18774 . A 58 LEU H . 31016 1 498 . 1 . 1 58 58 LEU HA H 1 4.2930 0.0000 . 1 . . . . A 58 LEU HA . 31016 1 499 . 1 . 1 58 58 LEU HB2 H 1 1.6530 0.0000 . 2 . . . . A 58 LEU HB2 . 31016 1 500 . 1 . 1 58 58 LEU HB3 H 1 1.5811 0.0000 . 2 . . . . A 58 LEU HB3 . 31016 1 501 . 1 . 1 58 58 LEU HG H 1 1.5950 0.0000 . 1 . . . . A 58 LEU HG . 31016 1 502 . 1 . 1 58 58 LEU HD11 H 1 0.9264 0.0000 . 2 . . 27248 . A 58 LEU HD11 . 31016 1 503 . 1 . 1 58 58 LEU HD12 H 1 0.9264 0.0000 . 2 . . 27248 . A 58 LEU HD12 . 31016 1 504 . 1 . 1 58 58 LEU HD13 H 1 0.9264 0.0000 . 2 . . 27248 . A 58 LEU HD13 . 31016 1 505 . 1 . 1 58 58 LEU HD21 H 1 0.8610 0.0000 . 2 . . 27248 . A 58 LEU HD21 . 31016 1 506 . 1 . 1 58 58 LEU HD22 H 1 0.8610 0.0000 . 2 . . 27248 . A 58 LEU HD22 . 31016 1 507 . 1 . 1 58 58 LEU HD23 H 1 0.8610 0.0000 . 2 . . 27248 . A 58 LEU HD23 . 31016 1 508 . 1 . 1 58 58 LEU CA C 13 55.4272 0.0000 . 1 . . 28259 . A 58 LEU CA . 31016 1 509 . 1 . 1 58 58 LEU CB C 13 42.4474 0.0000 . 1 . . 28263 . A 58 LEU CB . 31016 1 510 . 1 . 1 58 58 LEU CG C 13 26.7610 0.0000 . 1 . . 27788 . A 58 LEU CG . 31016 1 511 . 1 . 1 58 58 LEU CD1 C 13 24.7910 0.0000 . 2 . . 27791 . A 58 LEU CD1 . 31016 1 512 . 1 . 1 58 58 LEU CD2 C 13 23.1340 0.0000 . 2 . . 27797 . A 58 LEU CD2 . 31016 1 513 . 1 . 1 58 58 LEU N N 15 122.2477 0.0000 . 1 . . 18776 . A 58 LEU N . 31016 1 514 . 1 . 1 59 59 GLU H H 1 8.1469 0.0000 . 1 . . 21391 . A 59 GLU H . 31016 1 515 . 1 . 1 59 59 GLU HA H 1 4.2517 0.0000 . 1 . . . . A 59 GLU HA . 31016 1 516 . 1 . 1 59 59 GLU CA C 13 56.4157 0.0000 . 1 . . 28267 . A 59 GLU CA . 31016 1 517 . 1 . 1 59 59 GLU CB C 13 30.2007 0.0000 . 1 . . 28271 . A 59 GLU CB . 31016 1 518 . 1 . 1 59 59 GLU N N 15 121.1392 0.0000 . 1 . . 21393 . A 59 GLU N . 31016 1 519 . 1 . 1 60 60 LEU H H 1 8.0223 0.0000 . 1 . . . . A 60 LEU H . 31016 1 520 . 1 . 1 60 60 LEU C C 13 174.7661 0.0000 . 1 . . . . A 60 LEU C . 31016 1 521 . 1 . 1 60 60 LEU CA C 13 55.9479 0.0000 . 1 . . . . A 60 LEU CA . 31016 1 522 . 1 . 1 60 60 LEU CB C 13 42.2146 0.0000 . 1 . . . . A 60 LEU CB . 31016 1 523 . 1 . 1 60 60 LEU N N 15 127.9134 0.0000 . 1 . . . . A 60 LEU N . 31016 1 stop_ save_