################################### # 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 31056 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 31056 1 2 '2D 1H-13C HSQC aliphatic' . . . 31056 1 3 '2D 1H-13C HSQC aromatic' . . . 31056 1 4 '3D HNCA' . . . 31056 1 5 '3D HNCO' . . . 31056 1 6 '3D HN(CO)CA' . . . 31056 1 7 '3D HCCH-TOCSY aromatic' . . . 31056 1 8 '3D HCCH-TOCSY aliphatic' . . . 31056 1 9 '3D HN(CA)CO' . . . 31056 1 10 '3D C(CO)NH' . . . 31056 1 11 '3D CBCA(CO)NH' . . . 31056 1 12 '3D HNCACB' . . . 31056 1 13 '3D 1H-15N NOESY' . . . 31056 1 14 '3D 1H-13C NOESY aromatic' . . . 31056 1 15 '3D 1H-13C NOESY aliphatic' . . . 31056 1 16 '3D H(CCO)NH' . . . 31056 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 THR HA H 1 4.4300 0.0000 . 1 . . . . A 2 THR HA . 31056 1 2 . 1 . 1 2 2 THR HB H 1 4.2220 0.0000 . 1 . . . . A 2 THR HB . 31056 1 3 . 1 . 1 2 2 THR HG21 H 1 1.2570 0.0000 . 1 . . . . A 2 THR HG21 . 31056 1 4 . 1 . 1 2 2 THR HG22 H 1 1.2570 0.0000 . 1 . . . . A 2 THR HG22 . 31056 1 5 . 1 . 1 2 2 THR HG23 H 1 1.2570 0.0000 . 1 . . . . A 2 THR HG23 . 31056 1 6 . 1 . 1 2 2 THR C C 13 174.4790 0.0000 . 1 . . . . A 2 THR C . 31056 1 7 . 1 . 1 2 2 THR CA C 13 62.1820 0.0000 . 1 . . . . A 2 THR CA . 31056 1 8 . 1 . 1 2 2 THR CB C 13 70.0240 0.0000 . 1 . . . . A 2 THR CB . 31056 1 9 . 1 . 1 2 2 THR CG2 C 13 21.6580 0.0000 . 1 . . . . A 2 THR CG2 . 31056 1 10 . 1 . 1 3 3 ARG H H 1 8.5250 0.0000 . 1 . . . . A 3 ARG H . 31056 1 11 . 1 . 1 3 3 ARG HA H 1 4.4090 0.0000 . 1 . . . . A 3 ARG HA . 31056 1 12 . 1 . 1 3 3 ARG HB2 H 1 1.8640 0.0000 . 2 . . . . A 3 ARG HB2 . 31056 1 13 . 1 . 1 3 3 ARG HB3 H 1 1.8640 0.0000 . 2 . . . . A 3 ARG HB3 . 31056 1 14 . 1 . 1 3 3 ARG HG2 H 1 1.6820 0.0000 . 2 . . . . A 3 ARG HG2 . 31056 1 15 . 1 . 1 3 3 ARG HG3 H 1 1.6820 0.0000 . 2 . . . . A 3 ARG HG3 . 31056 1 16 . 1 . 1 3 3 ARG HD2 H 1 3.2440 0.0000 . 2 . . . . A 3 ARG HD2 . 31056 1 17 . 1 . 1 3 3 ARG HD3 H 1 3.2440 0.0000 . 2 . . . . A 3 ARG HD3 . 31056 1 18 . 1 . 1 3 3 ARG C C 13 176.3750 0.0000 . 1 . . . . A 3 ARG C . 31056 1 19 . 1 . 1 3 3 ARG CA C 13 56.2350 0.0000 . 1 . . . . A 3 ARG CA . 31056 1 20 . 1 . 1 3 3 ARG CB C 13 30.9160 0.0000 . 1 . . . . A 3 ARG CB . 31056 1 21 . 1 . 1 3 3 ARG CG C 13 27.1510 0.0000 . 1 . . . . A 3 ARG CG . 31056 1 22 . 1 . 1 3 3 ARG CD C 13 43.4880 0.0000 . 1 . . . . A 3 ARG CD . 31056 1 23 . 1 . 1 3 3 ARG N N 15 124.3480 0.0000 . 1 . . . . A 3 ARG N . 31056 1 24 . 1 . 1 4 4 ARG H H 1 8.5030 0.0000 . 1 . . . . A 4 ARG H . 31056 1 25 . 1 . 1 4 4 ARG HA H 1 4.4090 0.0000 . 1 . . . . A 4 ARG HA . 31056 1 26 . 1 . 1 4 4 ARG HB2 H 1 1.8640 0.0000 . 2 . . . . A 4 ARG HB2 . 31056 1 27 . 1 . 1 4 4 ARG HB3 H 1 1.8640 0.0000 . 2 . . . . A 4 ARG HB3 . 31056 1 28 . 1 . 1 4 4 ARG HG2 H 1 1.6820 0.0000 . 2 . . . . A 4 ARG HG2 . 31056 1 29 . 1 . 1 4 4 ARG HG3 H 1 1.6820 0.0000 . 2 . . . . A 4 ARG HG3 . 31056 1 30 . 1 . 1 4 4 ARG HD2 H 1 3.2440 0.0000 . 2 . . . . A 4 ARG HD2 . 31056 1 31 . 1 . 1 4 4 ARG HD3 H 1 3.2440 0.0000 . 2 . . . . A 4 ARG HD3 . 31056 1 32 . 1 . 1 4 4 ARG C C 13 176.7200 0.0000 . 1 . . . . A 4 ARG C . 31056 1 33 . 1 . 1 4 4 ARG CA C 13 56.2350 0.0000 . 1 . . . . A 4 ARG CA . 31056 1 34 . 1 . 1 4 4 ARG CB C 13 30.9030 0.0000 . 1 . . . . A 4 ARG CB . 31056 1 35 . 1 . 1 4 4 ARG CG C 13 27.1510 0.0000 . 1 . . . . A 4 ARG CG . 31056 1 36 . 1 . 1 4 4 ARG CD C 13 43.4880 0.0000 . 1 . . . . A 4 ARG CD . 31056 1 37 . 1 . 1 4 4 ARG N N 15 123.4260 0.0000 . 1 . . . . A 4 ARG N . 31056 1 38 . 1 . 1 5 5 ARG H H 1 8.5030 0.0000 . 1 . . . . A 5 ARG H . 31056 1 39 . 1 . 1 5 5 ARG HA H 1 4.3910 0.0000 . 1 . . . . A 5 ARG HA . 31056 1 40 . 1 . 1 5 5 ARG HB2 H 1 1.9160 0.0000 . 2 . . . . A 5 ARG HB2 . 31056 1 41 . 1 . 1 5 5 ARG HB3 H 1 1.9160 0.0000 . 2 . . . . A 5 ARG HB3 . 31056 1 42 . 1 . 1 5 5 ARG HG2 H 1 1.7000 0.0000 . 2 . . . . A 5 ARG HG2 . 31056 1 43 . 1 . 1 5 5 ARG HG3 H 1 1.7000 0.0000 . 2 . . . . A 5 ARG HG3 . 31056 1 44 . 1 . 1 5 5 ARG HD2 H 1 3.2540 0.0000 . 2 . . . . A 5 ARG HD2 . 31056 1 45 . 1 . 1 5 5 ARG HD3 H 1 3.2540 0.0000 . 2 . . . . A 5 ARG HD3 . 31056 1 46 . 1 . 1 5 5 ARG C C 13 176.2670 0.0000 . 1 . . . . A 5 ARG C . 31056 1 47 . 1 . 1 5 5 ARG CA C 13 56.2540 0.0000 . 1 . . . . A 5 ARG CA . 31056 1 48 . 1 . 1 5 5 ARG CB C 13 31.0440 0.0000 . 1 . . . . A 5 ARG CB . 31056 1 49 . 1 . 1 5 5 ARG CG C 13 27.1810 0.0000 . 1 . . . . A 5 ARG CG . 31056 1 50 . 1 . 1 5 5 ARG CD C 13 43.4460 0.0000 . 1 . . . . A 5 ARG CD . 31056 1 51 . 1 . 1 5 5 ARG N N 15 123.4200 0.0000 . 1 . . . . A 5 ARG N . 31056 1 52 . 1 . 1 6 6 GLY H H 1 8.4710 0.0000 . 1 . . . . A 6 GLY H . 31056 1 53 . 1 . 1 6 6 GLY HA2 H 1 3.9870 0.0000 . 2 . . . . A 6 GLY HA2 . 31056 1 54 . 1 . 1 6 6 GLY HA3 H 1 4.0500 0.0000 . 2 . . . . A 6 GLY HA3 . 31056 1 55 . 1 . 1 6 6 GLY C C 13 173.8580 0.0000 . 1 . . . . A 6 GLY C . 31056 1 56 . 1 . 1 6 6 GLY CA C 13 45.1520 0.0000 . 1 . . . . A 6 GLY CA . 31056 1 57 . 1 . 1 6 6 GLY N N 15 110.5290 0.0000 . 1 . . . . A 6 GLY N . 31056 1 58 . 1 . 1 7 7 ARG H H 1 8.2960 0.0000 . 1 . . . . A 7 ARG H . 31056 1 59 . 1 . 1 7 7 ARG HA H 1 4.3860 0.0000 . 1 . . . . A 7 ARG HA . 31056 1 60 . 1 . 1 7 7 ARG HB2 H 1 1.8710 0.0000 . 2 . . . . A 7 ARG HB2 . 31056 1 61 . 1 . 1 7 7 ARG HB3 H 1 1.8710 0.0000 . 2 . . . . A 7 ARG HB3 . 31056 1 62 . 1 . 1 7 7 ARG HG2 H 1 1.6580 0.0000 . 2 . . . . A 7 ARG HG2 . 31056 1 63 . 1 . 1 7 7 ARG HG3 H 1 1.6580 0.0000 . 2 . . . . A 7 ARG HG3 . 31056 1 64 . 1 . 1 7 7 ARG HD2 H 1 3.2370 0.0000 . 2 . . . . A 7 ARG HD2 . 31056 1 65 . 1 . 1 7 7 ARG HD3 H 1 3.2370 0.0000 . 2 . . . . A 7 ARG HD3 . 31056 1 66 . 1 . 1 7 7 ARG C C 13 176.3000 0.0000 . 1 . . . . A 7 ARG C . 31056 1 67 . 1 . 1 7 7 ARG CA C 13 56.1200 0.0000 . 1 . . . . A 7 ARG CA . 31056 1 68 . 1 . 1 7 7 ARG CB C 13 31.1170 0.0000 . 1 . . . . A 7 ARG CB . 31056 1 69 . 1 . 1 7 7 ARG CG C 13 27.0820 0.0000 . 1 . . . . A 7 ARG CG . 31056 1 70 . 1 . 1 7 7 ARG CD C 13 43.5060 0.0000 . 1 . . . . A 7 ARG CD . 31056 1 71 . 1 . 1 7 7 ARG N N 15 120.7520 0.0000 . 1 . . . . A 7 ARG N . 31056 1 72 . 1 . 1 8 8 GLN H H 1 8.5600 0.0000 . 1 . . . . A 8 GLN H . 31056 1 73 . 1 . 1 8 8 GLN HA H 1 4.4100 0.0000 . 1 . . . . A 8 GLN HA . 31056 1 74 . 1 . 1 8 8 GLN HB2 H 1 2.1110 0.0000 . 2 . . . . A 8 GLN HB2 . 31056 1 75 . 1 . 1 8 8 GLN HB3 H 1 2.0540 0.0000 . 2 . . . . A 8 GLN HB3 . 31056 1 76 . 1 . 1 8 8 GLN HG2 H 1 2.3200 0.0000 . 2 . . . . A 8 GLN HG2 . 31056 1 77 . 1 . 1 8 8 GLN HG3 H 1 2.3200 0.0000 . 2 . . . . A 8 GLN HG3 . 31056 1 78 . 1 . 1 8 8 GLN HE21 H 1 7.5180 0.0000 . 2 . . . . A 8 GLN HE21 . 31056 1 79 . 1 . 1 8 8 GLN HE22 H 1 6.8520 0.0000 . 2 . . . . A 8 GLN HE22 . 31056 1 80 . 1 . 1 8 8 GLN C C 13 175.6100 0.0000 . 1 . . . . A 8 GLN C . 31056 1 81 . 1 . 1 8 8 GLN CA C 13 55.7190 0.0000 . 1 . . . . A 8 GLN CA . 31056 1 82 . 1 . 1 8 8 GLN CB C 13 29.5680 0.0000 . 1 . . . . A 8 GLN CB . 31056 1 83 . 1 . 1 8 8 GLN CG C 13 33.8190 0.0000 . 1 . . . . A 8 GLN CG . 31056 1 84 . 1 . 1 8 8 GLN CD C 13 180.4110 0.0000 . 1 . . . . A 8 GLN CD . 31056 1 85 . 1 . 1 8 8 GLN N N 15 122.4990 0.0000 . 1 . . . . A 8 GLN N . 31056 1 86 . 1 . 1 8 8 GLN NE2 N 15 112.9280 0.0000 . 1 . . . . A 8 GLN NE2 . 31056 1 87 . 1 . 1 9 9 THR H H 1 8.1710 0.0000 . 1 . . . . A 9 THR H . 31056 1 88 . 1 . 1 9 9 THR HA H 1 4.2770 0.0000 . 1 . . . . A 9 THR HA . 31056 1 89 . 1 . 1 9 9 THR HB H 1 4.0650 0.0000 . 1 . . . . A 9 THR HB . 31056 1 90 . 1 . 1 9 9 THR HG21 H 1 1.0530 0.0000 . 1 . . . . A 9 THR HG21 . 31056 1 91 . 1 . 1 9 9 THR HG22 H 1 1.0530 0.0000 . 1 . . . . A 9 THR HG22 . 31056 1 92 . 1 . 1 9 9 THR HG23 H 1 1.0530 0.0000 . 1 . . . . A 9 THR HG23 . 31056 1 93 . 1 . 1 9 9 THR C C 13 173.3980 0.0000 . 1 . . . . A 9 THR C . 31056 1 94 . 1 . 1 9 9 THR CA C 13 62.0450 0.0000 . 1 . . . . A 9 THR CA . 31056 1 95 . 1 . 1 9 9 THR CB C 13 70.1300 0.0000 . 1 . . . . A 9 THR CB . 31056 1 96 . 1 . 1 9 9 THR CG2 C 13 21.4730 0.0000 . 1 . . . . A 9 THR CG2 . 31056 1 97 . 1 . 1 9 9 THR N N 15 117.2700 0.0000 . 1 . . . . A 9 THR N . 31056 1 98 . 1 . 1 10 10 TYR H H 1 8.1800 0.0000 . 1 . . . . A 10 TYR H . 31056 1 99 . 1 . 1 10 10 TYR HA H 1 4.9790 0.0000 . 1 . . . . A 10 TYR HA . 31056 1 100 . 1 . 1 10 10 TYR HB2 H 1 3.1260 0.0000 . 2 . . . . A 10 TYR HB2 . 31056 1 101 . 1 . 1 10 10 TYR HB3 H 1 2.7630 0.0000 . 2 . . . . A 10 TYR HB3 . 31056 1 102 . 1 . 1 10 10 TYR HD1 H 1 7.0590 0.0000 . 3 . . . . A 10 TYR HD1 . 31056 1 103 . 1 . 1 10 10 TYR HD2 H 1 7.0590 0.0000 . 3 . . . . A 10 TYR HD2 . 31056 1 104 . 1 . 1 10 10 TYR HE1 H 1 6.7610 0.0000 . 3 . . . . A 10 TYR HE1 . 31056 1 105 . 1 . 1 10 10 TYR HE2 H 1 6.7610 0.0000 . 3 . . . . A 10 TYR HE2 . 31056 1 106 . 1 . 1 10 10 TYR C C 13 176.8830 0.0000 . 1 . . . . A 10 TYR C . 31056 1 107 . 1 . 1 10 10 TYR CA C 13 56.7390 0.0000 . 1 . . . . A 10 TYR CA . 31056 1 108 . 1 . 1 10 10 TYR CB C 13 40.2160 0.0000 . 1 . . . . A 10 TYR CB . 31056 1 109 . 1 . 1 10 10 TYR CD1 C 13 133.0310 0.0000 . 3 . . . . A 10 TYR CD1 . 31056 1 110 . 1 . 1 10 10 TYR CD2 C 13 133.0310 0.0000 . 3 . . . . A 10 TYR CD2 . 31056 1 111 . 1 . 1 10 10 TYR CE1 C 13 117.5890 0.0000 . 3 . . . . A 10 TYR CE1 . 31056 1 112 . 1 . 1 10 10 TYR CE2 C 13 117.5890 0.0000 . 3 . . . . A 10 TYR CE2 . 31056 1 113 . 1 . 1 10 10 TYR N N 15 120.7490 0.0000 . 1 . . . . A 10 TYR N . 31056 1 114 . 1 . 1 11 11 THR H H 1 9.2100 0.0000 . 1 . . . . A 11 THR H . 31056 1 115 . 1 . 1 11 11 THR HA H 1 4.8760 0.0000 . 1 . . . . A 11 THR HA . 31056 1 116 . 1 . 1 11 11 THR HB H 1 4.4950 0.0000 . 1 . . . . A 11 THR HB . 31056 1 117 . 1 . 1 11 11 THR HG21 H 1 1.4030 0.0000 . 1 . . . . A 11 THR HG21 . 31056 1 118 . 1 . 1 11 11 THR HG22 H 1 1.4030 0.0000 . 1 . . . . A 11 THR HG22 . 31056 1 119 . 1 . 1 11 11 THR HG23 H 1 1.4030 0.0000 . 1 . . . . A 11 THR HG23 . 31056 1 120 . 1 . 1 11 11 THR C C 13 175.6820 0.0000 . 1 . . . . A 11 THR C . 31056 1 121 . 1 . 1 11 11 THR CA C 13 61.0360 0.0000 . 1 . . . . A 11 THR CA . 31056 1 122 . 1 . 1 11 11 THR CB C 13 71.2080 0.0000 . 1 . . . . A 11 THR CB . 31056 1 123 . 1 . 1 11 11 THR CG2 C 13 21.8410 0.0000 . 1 . . . . A 11 THR CG2 . 31056 1 124 . 1 . 1 11 11 THR N N 15 114.4640 0.0000 . 1 . . . . A 11 THR N . 31056 1 125 . 1 . 1 12 12 ARG H H 1 9.0900 0.0000 . 1 . . . . A 12 ARG H . 31056 1 126 . 1 . 1 12 12 ARG HA H 1 4.1420 0.0000 . 1 . . . . A 12 ARG HA . 31056 1 127 . 1 . 1 12 12 ARG HB2 H 1 1.9970 0.0000 . 2 . . . . A 12 ARG HB2 . 31056 1 128 . 1 . 1 12 12 ARG HB3 H 1 1.9970 0.0000 . 2 . . . . A 12 ARG HB3 . 31056 1 129 . 1 . 1 12 12 ARG HG2 H 1 1.7860 0.0000 . 2 . . . . A 12 ARG HG2 . 31056 1 130 . 1 . 1 12 12 ARG HG3 H 1 1.7240 0.0000 . 2 . . . . A 12 ARG HG3 . 31056 1 131 . 1 . 1 12 12 ARG HD2 H 1 3.3150 0.0000 . 2 . . . . A 12 ARG HD2 . 31056 1 132 . 1 . 1 12 12 ARG HD3 H 1 3.3150 0.0000 . 2 . . . . A 12 ARG HD3 . 31056 1 133 . 1 . 1 12 12 ARG C C 13 178.0120 0.0000 . 1 . . . . A 12 ARG C . 31056 1 134 . 1 . 1 12 12 ARG CA C 13 59.8720 0.0000 . 1 . . . . A 12 ARG CA . 31056 1 135 . 1 . 1 12 12 ARG CB C 13 29.5650 0.0000 . 1 . . . . A 12 ARG CB . 31056 1 136 . 1 . 1 12 12 ARG CG C 13 27.2100 0.0000 . 1 . . . . A 12 ARG CG . 31056 1 137 . 1 . 1 12 12 ARG CD C 13 43.4120 0.0000 . 1 . . . . A 12 ARG CD . 31056 1 138 . 1 . 1 12 12 ARG N N 15 123.2290 0.0000 . 1 . . . . A 12 ARG N . 31056 1 139 . 1 . 1 13 13 TYR H H 1 8.4000 0.0000 . 1 . . . . A 13 TYR H . 31056 1 140 . 1 . 1 13 13 TYR HA H 1 4.2020 0.0000 . 1 . . . . A 13 TYR HA . 31056 1 141 . 1 . 1 13 13 TYR HB2 H 1 3.3000 0.0000 . 2 . . . . A 13 TYR HB2 . 31056 1 142 . 1 . 1 13 13 TYR HB3 H 1 2.8330 0.0000 . 2 . . . . A 13 TYR HB3 . 31056 1 143 . 1 . 1 13 13 TYR HD1 H 1 7.1210 0.0000 . 3 . . . . A 13 TYR HD1 . 31056 1 144 . 1 . 1 13 13 TYR HD2 H 1 7.1210 0.0000 . 3 . . . . A 13 TYR HD2 . 31056 1 145 . 1 . 1 13 13 TYR HE1 H 1 6.8000 0.0000 . 3 . . . . A 13 TYR HE1 . 31056 1 146 . 1 . 1 13 13 TYR HE2 H 1 6.8000 0.0000 . 3 . . . . A 13 TYR HE2 . 31056 1 147 . 1 . 1 13 13 TYR C C 13 177.0010 0.0000 . 1 . . . . A 13 TYR C . 31056 1 148 . 1 . 1 13 13 TYR CA C 13 61.4700 0.0000 . 1 . . . . A 13 TYR CA . 31056 1 149 . 1 . 1 13 13 TYR CB C 13 38.7530 0.0000 . 1 . . . . A 13 TYR CB . 31056 1 150 . 1 . 1 13 13 TYR CD1 C 13 132.5360 0.0000 . 3 . . . . A 13 TYR CD1 . 31056 1 151 . 1 . 1 13 13 TYR CD2 C 13 132.5360 0.0000 . 3 . . . . A 13 TYR CD2 . 31056 1 152 . 1 . 1 13 13 TYR CE1 C 13 118.0250 0.0000 . 3 . . . . A 13 TYR CE1 . 31056 1 153 . 1 . 1 13 13 TYR CE2 C 13 118.0250 0.0000 . 3 . . . . A 13 TYR CE2 . 31056 1 154 . 1 . 1 13 13 TYR N N 15 118.2860 0.0000 . 1 . . . . A 13 TYR N . 31056 1 155 . 1 . 1 14 14 GLN H H 1 7.7190 0.0000 . 1 . . . . A 14 GLN H . 31056 1 156 . 1 . 1 14 14 GLN HA H 1 3.5530 0.0000 . 1 . . . . A 14 GLN HA . 31056 1 157 . 1 . 1 14 14 GLN HB2 H 1 2.6430 0.0000 . 2 . . . . A 14 GLN HB2 . 31056 1 158 . 1 . 1 14 14 GLN HB3 H 1 1.6100 0.0000 . 2 . . . . A 14 GLN HB3 . 31056 1 159 . 1 . 1 14 14 GLN HG2 H 1 2.7520 0.0000 . 2 . . . . A 14 GLN HG2 . 31056 1 160 . 1 . 1 14 14 GLN HG3 H 1 2.4500 0.0000 . 2 . . . . A 14 GLN HG3 . 31056 1 161 . 1 . 1 14 14 GLN HE21 H 1 7.7460 0.0000 . 2 . . . . A 14 GLN HE21 . 31056 1 162 . 1 . 1 14 14 GLN HE22 H 1 6.7880 0.0000 . 2 . . . . A 14 GLN HE22 . 31056 1 163 . 1 . 1 14 14 GLN C C 13 177.0820 0.0000 . 1 . . . . A 14 GLN C . 31056 1 164 . 1 . 1 14 14 GLN CA C 13 59.3700 0.0000 . 1 . . . . A 14 GLN CA . 31056 1 165 . 1 . 1 14 14 GLN CB C 13 27.8590 0.0000 . 1 . . . . A 14 GLN CB . 31056 1 166 . 1 . 1 14 14 GLN CG C 13 34.8460 0.0000 . 1 . . . . A 14 GLN CG . 31056 1 167 . 1 . 1 14 14 GLN CD C 13 178.4250 0.0000 . 1 . . . . A 14 GLN CD . 31056 1 168 . 1 . 1 14 14 GLN N N 15 115.8690 0.0000 . 1 . . . . A 14 GLN N . 31056 1 169 . 1 . 1 14 14 GLN NE2 N 15 110.9100 0.0000 . 1 . . . . A 14 GLN NE2 . 31056 1 170 . 1 . 1 15 15 THR H H 1 8.5290 0.0000 . 1 . . . . A 15 THR H . 31056 1 171 . 1 . 1 15 15 THR HA H 1 4.3330 0.0000 . 1 . . . . A 15 THR HA . 31056 1 172 . 1 . 1 15 15 THR HB H 1 3.3610 0.0000 . 1 . . . . A 15 THR HB . 31056 1 173 . 1 . 1 15 15 THR HG21 H 1 1.3410 0.0000 . 1 . . . . A 15 THR HG21 . 31056 1 174 . 1 . 1 15 15 THR HG22 H 1 1.3410 0.0000 . 1 . . . . A 15 THR HG22 . 31056 1 175 . 1 . 1 15 15 THR HG23 H 1 1.3410 0.0000 . 1 . . . . A 15 THR HG23 . 31056 1 176 . 1 . 1 15 15 THR C C 13 175.4600 0.0000 . 1 . . . . A 15 THR C . 31056 1 177 . 1 . 1 15 15 THR CA C 13 67.5110 0.0000 . 1 . . . . A 15 THR CA . 31056 1 178 . 1 . 1 15 15 THR CB C 13 68.4660 0.0000 . 1 . . . . A 15 THR CB . 31056 1 179 . 1 . 1 15 15 THR CG2 C 13 22.2380 0.0000 . 1 . . . . A 15 THR CG2 . 31056 1 180 . 1 . 1 15 15 THR N N 15 113.4150 0.0000 . 1 . . . . A 15 THR N . 31056 1 181 . 1 . 1 16 16 LEU H H 1 8.2330 0.0000 . 1 . . . . A 16 LEU H . 31056 1 182 . 1 . 1 16 16 LEU HA H 1 3.9960 0.0000 . 1 . . . . A 16 LEU HA . 31056 1 183 . 1 . 1 16 16 LEU HB2 H 1 1.9160 0.0000 . 2 . . . . A 16 LEU HB2 . 31056 1 184 . 1 . 1 16 16 LEU HB3 H 1 1.5390 0.0000 . 2 . . . . A 16 LEU HB3 . 31056 1 185 . 1 . 1 16 16 LEU HG H 1 1.7940 0.0000 . 1 . . . . A 16 LEU HG . 31056 1 186 . 1 . 1 16 16 LEU HD11 H 1 0.9220 0.0000 . 2 . . . . A 16 LEU HD11 . 31056 1 187 . 1 . 1 16 16 LEU HD12 H 1 0.9220 0.0000 . 2 . . . . A 16 LEU HD12 . 31056 1 188 . 1 . 1 16 16 LEU HD13 H 1 0.9220 0.0000 . 2 . . . . A 16 LEU HD13 . 31056 1 189 . 1 . 1 16 16 LEU HD21 H 1 0.9220 0.0000 . 2 . . . . A 16 LEU HD21 . 31056 1 190 . 1 . 1 16 16 LEU HD22 H 1 0.9220 0.0000 . 2 . . . . A 16 LEU HD22 . 31056 1 191 . 1 . 1 16 16 LEU HD23 H 1 0.9220 0.0000 . 2 . . . . A 16 LEU HD23 . 31056 1 192 . 1 . 1 16 16 LEU C C 13 180.5810 0.0000 . 1 . . . . A 16 LEU C . 31056 1 193 . 1 . 1 16 16 LEU CA C 13 58.3280 0.0000 . 1 . . . . A 16 LEU CA . 31056 1 194 . 1 . 1 16 16 LEU CB C 13 41.8210 0.0000 . 1 . . . . A 16 LEU CB . 31056 1 195 . 1 . 1 16 16 LEU CG C 13 27.0890 0.0000 . 1 . . . . A 16 LEU CG . 31056 1 196 . 1 . 1 16 16 LEU CD1 C 13 25.2030 0.0000 . 2 . . . . A 16 LEU CD1 . 31056 1 197 . 1 . 1 16 16 LEU CD2 C 13 23.5100 0.0000 . 2 . . . . A 16 LEU CD2 . 31056 1 198 . 1 . 1 16 16 LEU N N 15 121.0960 0.0000 . 1 . . . . A 16 LEU N . 31056 1 199 . 1 . 1 17 17 GLU H H 1 7.7010 0.0000 . 1 . . . . A 17 GLU H . 31056 1 200 . 1 . 1 17 17 GLU HA H 1 3.8980 0.0000 . 1 . . . . A 17 GLU HA . 31056 1 201 . 1 . 1 17 17 GLU HB2 H 1 1.7090 0.0000 . 2 . . . . A 17 GLU HB2 . 31056 1 202 . 1 . 1 17 17 GLU HB3 H 1 1.8950 0.0000 . 2 . . . . A 17 GLU HB3 . 31056 1 203 . 1 . 1 17 17 GLU HG2 H 1 1.8080 0.0000 . 2 . . . . A 17 GLU HG2 . 31056 1 204 . 1 . 1 17 17 GLU HG3 H 1 1.7310 0.0000 . 2 . . . . A 17 GLU HG3 . 31056 1 205 . 1 . 1 17 17 GLU C C 13 179.8670 0.0000 . 1 . . . . A 17 GLU C . 31056 1 206 . 1 . 1 17 17 GLU CA C 13 58.7070 0.0000 . 1 . . . . A 17 GLU CA . 31056 1 207 . 1 . 1 17 17 GLU CB C 13 30.2290 0.0000 . 1 . . . . A 17 GLU CB . 31056 1 208 . 1 . 1 17 17 GLU CG C 13 35.8780 0.0000 . 1 . . . . A 17 GLU CG . 31056 1 209 . 1 . 1 17 17 GLU N N 15 118.6440 0.0000 . 1 . . . . A 17 GLU N . 31056 1 210 . 1 . 1 18 18 LEU H H 1 8.2250 0.0000 . 1 . . . . A 18 LEU H . 31056 1 211 . 1 . 1 18 18 LEU HA H 1 3.5690 0.0000 . 1 . . . . A 18 LEU HA . 31056 1 212 . 1 . 1 18 18 LEU HB2 H 1 0.5010 0.0000 . 2 . . . . A 18 LEU HB2 . 31056 1 213 . 1 . 1 18 18 LEU HB3 H 1 -1.1150 0.0000 . 2 . . . . A 18 LEU HB3 . 31056 1 214 . 1 . 1 18 18 LEU HG H 1 1.1350 0.0000 . 1 . . . . A 18 LEU HG . 31056 1 215 . 1 . 1 18 18 LEU HD11 H 1 0.4530 0.0000 . 2 . . . . A 18 LEU HD11 . 31056 1 216 . 1 . 1 18 18 LEU HD12 H 1 0.4530 0.0000 . 2 . . . . A 18 LEU HD12 . 31056 1 217 . 1 . 1 18 18 LEU HD13 H 1 0.4530 0.0000 . 2 . . . . A 18 LEU HD13 . 31056 1 218 . 1 . 1 18 18 LEU HD21 H 1 -0.5940 0.0000 . 2 . . . . A 18 LEU HD21 . 31056 1 219 . 1 . 1 18 18 LEU HD22 H 1 -0.5940 0.0000 . 2 . . . . A 18 LEU HD22 . 31056 1 220 . 1 . 1 18 18 LEU HD23 H 1 -0.5940 0.0000 . 2 . . . . A 18 LEU HD23 . 31056 1 221 . 1 . 1 18 18 LEU C C 13 177.6580 0.0000 . 1 . . . . A 18 LEU C . 31056 1 222 . 1 . 1 18 18 LEU CA C 13 58.6520 0.0000 . 1 . . . . A 18 LEU CA . 31056 1 223 . 1 . 1 18 18 LEU CB C 13 37.7660 0.0000 . 1 . . . . A 18 LEU CB . 31056 1 224 . 1 . 1 18 18 LEU CG C 13 26.0600 0.0000 . 1 . . . . A 18 LEU CG . 31056 1 225 . 1 . 1 18 18 LEU CD1 C 13 23.2000 0.0000 . 2 . . . . A 18 LEU CD1 . 31056 1 226 . 1 . 1 18 18 LEU CD2 C 13 23.1230 0.0000 . 2 . . . . A 18 LEU CD2 . 31056 1 227 . 1 . 1 18 18 LEU N N 15 123.8940 0.0000 . 1 . . . . A 18 LEU N . 31056 1 228 . 1 . 1 19 19 GLU H H 1 8.2350 0.0000 . 1 . . . . A 19 GLU H . 31056 1 229 . 1 . 1 19 19 GLU HA H 1 4.2520 0.0000 . 1 . . . . A 19 GLU HA . 31056 1 230 . 1 . 1 19 19 GLU HB2 H 1 2.1980 0.0000 . 2 . . . . A 19 GLU HB2 . 31056 1 231 . 1 . 1 19 19 GLU HB3 H 1 2.0430 0.0000 . 2 . . . . A 19 GLU HB3 . 31056 1 232 . 1 . 1 19 19 GLU HG2 H 1 2.5580 0.0000 . 2 . . . . A 19 GLU HG2 . 31056 1 233 . 1 . 1 19 19 GLU HG3 H 1 2.4070 0.0000 . 2 . . . . A 19 GLU HG3 . 31056 1 234 . 1 . 1 19 19 GLU C C 13 179.7050 0.0000 . 1 . . . . A 19 GLU C . 31056 1 235 . 1 . 1 19 19 GLU CA C 13 59.2770 0.0000 . 1 . . . . A 19 GLU CA . 31056 1 236 . 1 . 1 19 19 GLU CB C 13 28.9780 0.0000 . 1 . . . . A 19 GLU CB . 31056 1 237 . 1 . 1 19 19 GLU CG C 13 35.0540 0.0000 . 1 . . . . A 19 GLU CG . 31056 1 238 . 1 . 1 19 19 GLU N N 15 118.9920 0.0000 . 1 . . . . A 19 GLU N . 31056 1 239 . 1 . 1 20 20 LYS H H 1 7.9430 0.0000 . 1 . . . . A 20 LYS H . 31056 1 240 . 1 . 1 20 20 LYS HA H 1 4.0800 0.0000 . 1 . . . . A 20 LYS HA . 31056 1 241 . 1 . 1 20 20 LYS HB2 H 1 1.9480 0.0000 . 2 . . . . A 20 LYS HB2 . 31056 1 242 . 1 . 1 20 20 LYS HB3 H 1 1.9480 0.0000 . 2 . . . . A 20 LYS HB3 . 31056 1 243 . 1 . 1 20 20 LYS HG2 H 1 1.6160 0.0000 . 2 . . . . A 20 LYS HG2 . 31056 1 244 . 1 . 1 20 20 LYS HG3 H 1 1.4380 0.0000 . 2 . . . . A 20 LYS HG3 . 31056 1 245 . 1 . 1 20 20 LYS HD2 H 1 1.7190 0.0000 . 2 . . . . A 20 LYS HD2 . 31056 1 246 . 1 . 1 20 20 LYS HD3 H 1 1.7190 0.0000 . 2 . . . . A 20 LYS HD3 . 31056 1 247 . 1 . 1 20 20 LYS HE2 H 1 2.9310 0.0000 . 2 . . . . A 20 LYS HE2 . 31056 1 248 . 1 . 1 20 20 LYS HE3 H 1 2.9310 0.0000 . 2 . . . . A 20 LYS HE3 . 31056 1 249 . 1 . 1 20 20 LYS C C 13 179.6840 0.0000 . 1 . . . . A 20 LYS C . 31056 1 250 . 1 . 1 20 20 LYS CA C 13 59.8010 0.0000 . 1 . . . . A 20 LYS CA . 31056 1 251 . 1 . 1 20 20 LYS CB C 13 32.5810 0.0000 . 1 . . . . A 20 LYS CB . 31056 1 252 . 1 . 1 20 20 LYS CG C 13 24.7980 0.0000 . 1 . . . . A 20 LYS CG . 31056 1 253 . 1 . 1 20 20 LYS CD C 13 29.6550 0.0000 . 1 . . . . A 20 LYS CD . 31056 1 254 . 1 . 1 20 20 LYS CE C 13 41.8680 0.0000 . 1 . . . . A 20 LYS CE . 31056 1 255 . 1 . 1 20 20 LYS N N 15 120.3760 0.0000 . 1 . . . . A 20 LYS N . 31056 1 256 . 1 . 1 21 21 GLU H H 1 7.8690 0.0000 . 1 . . . . A 21 GLU H . 31056 1 257 . 1 . 1 21 21 GLU HA H 1 4.1700 0.0000 . 1 . . . . A 21 GLU HA . 31056 1 258 . 1 . 1 21 21 GLU HB2 H 1 2.3300 0.0000 . 2 . . . . A 21 GLU HB2 . 31056 1 259 . 1 . 1 21 21 GLU HB3 H 1 1.8330 0.0000 . 2 . . . . A 21 GLU HB3 . 31056 1 260 . 1 . 1 21 21 GLU HG2 H 1 2.4650 0.0000 . 2 . . . . A 21 GLU HG2 . 31056 1 261 . 1 . 1 21 21 GLU HG3 H 1 2.6910 0.0000 . 2 . . . . A 21 GLU HG3 . 31056 1 262 . 1 . 1 21 21 GLU C C 13 178.6310 0.0000 . 1 . . . . A 21 GLU C . 31056 1 263 . 1 . 1 21 21 GLU CA C 13 59.3870 0.0000 . 1 . . . . A 21 GLU CA . 31056 1 264 . 1 . 1 21 21 GLU CB C 13 29.2980 0.0000 . 1 . . . . A 21 GLU CB . 31056 1 265 . 1 . 1 21 21 GLU CG C 13 35.7640 0.0000 . 1 . . . . A 21 GLU CG . 31056 1 266 . 1 . 1 21 21 GLU N N 15 121.0960 0.0000 . 1 . . . . A 21 GLU N . 31056 1 267 . 1 . 1 22 22 PHE H H 1 9.0210 0.0000 . 1 . . . . A 22 PHE H . 31056 1 268 . 1 . 1 22 22 PHE HA H 1 4.6440 0.0000 . 1 . . . . A 22 PHE HA . 31056 1 269 . 1 . 1 22 22 PHE HB2 H 1 3.1930 0.0000 . 2 . . . . A 22 PHE HB2 . 31056 1 270 . 1 . 1 22 22 PHE HB3 H 1 3.1120 0.0000 . 2 . . . . A 22 PHE HB3 . 31056 1 271 . 1 . 1 22 22 PHE HD1 H 1 7.0040 0.0000 . 3 . . . . A 22 PHE HD1 . 31056 1 272 . 1 . 1 22 22 PHE HD2 H 1 7.0040 0.0000 . 3 . . . . A 22 PHE HD2 . 31056 1 273 . 1 . 1 22 22 PHE HE1 H 1 6.9580 0.0000 . 3 . . . . A 22 PHE HE1 . 31056 1 274 . 1 . 1 22 22 PHE HE2 H 1 6.9580 0.0000 . 3 . . . . A 22 PHE HE2 . 31056 1 275 . 1 . 1 22 22 PHE HZ H 1 6.3600 0.0000 . 1 . . . . A 22 PHE HZ . 31056 1 276 . 1 . 1 22 22 PHE C C 13 176.1180 0.0000 . 1 . . . . A 22 PHE C . 31056 1 277 . 1 . 1 22 22 PHE CA C 13 60.7930 0.0000 . 1 . . . . A 22 PHE CA . 31056 1 278 . 1 . 1 22 22 PHE CB C 13 39.1470 0.0000 . 1 . . . . A 22 PHE CB . 31056 1 279 . 1 . 1 22 22 PHE CD1 C 13 131.9910 0.0000 . 3 . . . . A 22 PHE CD1 . 31056 1 280 . 1 . 1 22 22 PHE CD2 C 13 131.9910 0.0000 . 3 . . . . A 22 PHE CD2 . 31056 1 281 . 1 . 1 22 22 PHE CE1 C 13 130.1490 0.0000 . 3 . . . . A 22 PHE CE1 . 31056 1 282 . 1 . 1 22 22 PHE CE2 C 13 130.1490 0.0000 . 3 . . . . A 22 PHE CE2 . 31056 1 283 . 1 . 1 22 22 PHE CZ C 13 127.4580 0.0000 . 1 . . . . A 22 PHE CZ . 31056 1 284 . 1 . 1 22 22 PHE N N 15 121.4510 0.0000 . 1 . . . . A 22 PHE N . 31056 1 285 . 1 . 1 23 23 HIS H H 1 8.0340 0.0000 . 1 . . . . A 23 HIS H . 31056 1 286 . 1 . 1 23 23 HIS HA H 1 4.3280 0.0000 . 1 . . . . A 23 HIS HA . 31056 1 287 . 1 . 1 23 23 HIS HB2 H 1 3.4180 0.0000 . 2 . . . . A 23 HIS HB2 . 31056 1 288 . 1 . 1 23 23 HIS HB3 H 1 3.4180 0.0000 . 2 . . . . A 23 HIS HB3 . 31056 1 289 . 1 . 1 23 23 HIS HD2 H 1 7.3870 0.0000 . 1 . . . . A 23 HIS HD2 . 31056 1 290 . 1 . 1 23 23 HIS HE1 H 1 8.3130 0.0000 . 1 . . . . A 23 HIS HE1 . 31056 1 291 . 1 . 1 23 23 HIS C C 13 176.9150 0.0000 . 1 . . . . A 23 HIS C . 31056 1 292 . 1 . 1 23 23 HIS CA C 13 58.8750 0.0000 . 1 . . . . A 23 HIS CA . 31056 1 293 . 1 . 1 23 23 HIS CB C 13 29.0910 0.0000 . 1 . . . . A 23 HIS CB . 31056 1 294 . 1 . 1 23 23 HIS CD2 C 13 119.9390 0.0000 . 1 . . . . A 23 HIS CD2 . 31056 1 295 . 1 . 1 23 23 HIS CE1 C 13 136.1910 0.0000 . 1 . . . . A 23 HIS CE1 . 31056 1 296 . 1 . 1 23 23 HIS N N 15 113.7610 0.0000 . 1 . . . . A 23 HIS N . 31056 1 297 . 1 . 1 24 24 THR H H 1 7.6870 0.0000 . 1 . . . . A 24 THR H . 31056 1 298 . 1 . 1 24 24 THR HA H 1 4.3730 0.0000 . 1 . . . . A 24 THR HA . 31056 1 299 . 1 . 1 24 24 THR HB H 1 4.1070 0.0000 . 1 . . . . A 24 THR HB . 31056 1 300 . 1 . 1 24 24 THR HG21 H 1 1.2810 0.0000 . 1 . . . . A 24 THR HG21 . 31056 1 301 . 1 . 1 24 24 THR HG22 H 1 1.2810 0.0000 . 1 . . . . A 24 THR HG22 . 31056 1 302 . 1 . 1 24 24 THR HG23 H 1 1.2810 0.0000 . 1 . . . . A 24 THR HG23 . 31056 1 303 . 1 . 1 24 24 THR C C 13 174.0100 0.0000 . 1 . . . . A 24 THR C . 31056 1 304 . 1 . 1 24 24 THR CA C 13 64.9540 0.0000 . 1 . . . . A 24 THR CA . 31056 1 305 . 1 . 1 24 24 THR CB C 13 69.3660 0.0000 . 1 . . . . A 24 THR CB . 31056 1 306 . 1 . 1 24 24 THR CG2 C 13 22.0360 0.0000 . 1 . . . . A 24 THR CG2 . 31056 1 307 . 1 . 1 24 24 THR N N 15 114.4520 0.0000 . 1 . . . . A 24 THR N . 31056 1 308 . 1 . 1 25 25 ASN H H 1 8.4800 0.0000 . 1 . . . . A 25 ASN H . 31056 1 309 . 1 . 1 25 25 ASN HA H 1 4.7160 0.0000 . 1 . . . . A 25 ASN HA . 31056 1 310 . 1 . 1 25 25 ASN HB2 H 1 2.9360 0.0000 . 2 . . . . A 25 ASN HB2 . 31056 1 311 . 1 . 1 25 25 ASN HB3 H 1 2.9360 0.0000 . 2 . . . . A 25 ASN HB3 . 31056 1 312 . 1 . 1 25 25 ASN HD21 H 1 8.1030 0.0000 . 2 . . . . A 25 ASN HD21 . 31056 1 313 . 1 . 1 25 25 ASN HD22 H 1 7.3140 0.0000 . 2 . . . . A 25 ASN HD22 . 31056 1 314 . 1 . 1 25 25 ASN C C 13 173.1580 0.0000 . 1 . . . . A 25 ASN C . 31056 1 315 . 1 . 1 25 25 ASN CA C 13 52.9340 0.0000 . 1 . . . . A 25 ASN CA . 31056 1 316 . 1 . 1 25 25 ASN CB C 13 40.9910 0.0000 . 1 . . . . A 25 ASN CB . 31056 1 317 . 1 . 1 25 25 ASN CG C 13 177.3660 0.0000 . 1 . . . . A 25 ASN CG . 31056 1 318 . 1 . 1 25 25 ASN N N 15 119.3600 0.0000 . 1 . . . . A 25 ASN N . 31056 1 319 . 1 . 1 25 25 ASN ND2 N 15 116.0240 0.0000 . 1 . . . . A 25 ASN ND2 . 31056 1 320 . 1 . 1 26 26 HIS H H 1 8.6550 0.0000 . 1 . . . . A 26 HIS H . 31056 1 321 . 1 . 1 26 26 HIS HA H 1 4.2740 0.0000 . 1 . . . . A 26 HIS HA . 31056 1 322 . 1 . 1 26 26 HIS HB2 H 1 3.0290 0.0000 . 2 . . . . A 26 HIS HB2 . 31056 1 323 . 1 . 1 26 26 HIS HB3 H 1 2.7300 0.0000 . 2 . . . . A 26 HIS HB3 . 31056 1 324 . 1 . 1 26 26 HIS HD2 H 1 6.7370 0.0000 . 1 . . . . A 26 HIS HD2 . 31056 1 325 . 1 . 1 26 26 HIS HE1 H 1 8.3930 0.0000 . 1 . . . . A 26 HIS HE1 . 31056 1 326 . 1 . 1 26 26 HIS C C 13 173.1280 0.0000 . 1 . . . . A 26 HIS C . 31056 1 327 . 1 . 1 26 26 HIS CA C 13 54.7570 0.0000 . 1 . . . . A 26 HIS CA . 31056 1 328 . 1 . 1 26 26 HIS CB C 13 28.9660 0.0000 . 1 . . . . A 26 HIS CB . 31056 1 329 . 1 . 1 26 26 HIS CD2 C 13 119.3930 0.0000 . 1 . . . . A 26 HIS CD2 . 31056 1 330 . 1 . 1 26 26 HIS CE1 C 13 136.7250 0.0000 . 1 . . . . A 26 HIS CE1 . 31056 1 331 . 1 . 1 26 26 HIS N N 15 119.0180 0.0000 . 1 . . . . A 26 HIS N . 31056 1 332 . 1 . 1 27 27 TYR H H 1 7.9410 0.0000 . 1 . . . . A 27 TYR H . 31056 1 333 . 1 . 1 27 27 TYR HA H 1 4.7600 0.0000 . 1 . . . . A 27 TYR HA . 31056 1 334 . 1 . 1 27 27 TYR HB2 H 1 2.9980 0.0000 . 2 . . . . A 27 TYR HB2 . 31056 1 335 . 1 . 1 27 27 TYR HB3 H 1 2.7490 0.0000 . 2 . . . . A 27 TYR HB3 . 31056 1 336 . 1 . 1 27 27 TYR HD1 H 1 7.2100 0.0000 . 3 . . . . A 27 TYR HD1 . 31056 1 337 . 1 . 1 27 27 TYR HD2 H 1 7.2100 0.0000 . 3 . . . . A 27 TYR HD2 . 31056 1 338 . 1 . 1 27 27 TYR HE1 H 1 6.8730 0.0000 . 3 . . . . A 27 TYR HE1 . 31056 1 339 . 1 . 1 27 27 TYR HE2 H 1 6.8730 0.0000 . 3 . . . . A 27 TYR HE2 . 31056 1 340 . 1 . 1 27 27 TYR C C 13 174.6390 0.0000 . 1 . . . . A 27 TYR C . 31056 1 341 . 1 . 1 27 27 TYR CA C 13 56.7600 0.0000 . 1 . . . . A 27 TYR CA . 31056 1 342 . 1 . 1 27 27 TYR CB C 13 40.9970 0.0000 . 1 . . . . A 27 TYR CB . 31056 1 343 . 1 . 1 27 27 TYR CD1 C 13 133.1390 0.0000 . 3 . . . . A 27 TYR CD1 . 31056 1 344 . 1 . 1 27 27 TYR CD2 C 13 133.1390 0.0000 . 3 . . . . A 27 TYR CD2 . 31056 1 345 . 1 . 1 27 27 TYR CE1 C 13 117.4260 0.0000 . 3 . . . . A 27 TYR CE1 . 31056 1 346 . 1 . 1 27 27 TYR CE2 C 13 117.4260 0.0000 . 3 . . . . A 27 TYR CE2 . 31056 1 347 . 1 . 1 27 27 TYR N N 15 114.7960 0.0000 . 1 . . . . A 27 TYR N . 31056 1 348 . 1 . 1 28 28 LEU H H 1 8.3760 0.0000 . 1 . . . . A 28 LEU H . 31056 1 349 . 1 . 1 28 28 LEU HA H 1 4.6980 0.0000 . 1 . . . . A 28 LEU HA . 31056 1 350 . 1 . 1 28 28 LEU HB2 H 1 1.2840 0.0000 . 2 . . . . A 28 LEU HB2 . 31056 1 351 . 1 . 1 28 28 LEU HB3 H 1 1.4550 0.0000 . 2 . . . . A 28 LEU HB3 . 31056 1 352 . 1 . 1 28 28 LEU HG H 1 0.6670 0.0000 . 1 . . . . A 28 LEU HG . 31056 1 353 . 1 . 1 28 28 LEU HD11 H 1 0.5960 0.0000 . 2 . . . . A 28 LEU HD11 . 31056 1 354 . 1 . 1 28 28 LEU HD12 H 1 0.5960 0.0000 . 2 . . . . A 28 LEU HD12 . 31056 1 355 . 1 . 1 28 28 LEU HD13 H 1 0.5960 0.0000 . 2 . . . . A 28 LEU HD13 . 31056 1 356 . 1 . 1 28 28 LEU HD21 H 1 0.2830 0.0000 . 2 . . . . A 28 LEU HD21 . 31056 1 357 . 1 . 1 28 28 LEU HD22 H 1 0.2830 0.0000 . 2 . . . . A 28 LEU HD22 . 31056 1 358 . 1 . 1 28 28 LEU HD23 H 1 0.2830 0.0000 . 2 . . . . A 28 LEU HD23 . 31056 1 359 . 1 . 1 28 28 LEU C C 13 178.5950 0.0000 . 1 . . . . A 28 LEU C . 31056 1 360 . 1 . 1 28 28 LEU CA C 13 53.3040 0.0000 . 1 . . . . A 28 LEU CA . 31056 1 361 . 1 . 1 28 28 LEU CB C 13 44.3970 0.0000 . 1 . . . . A 28 LEU CB . 31056 1 362 . 1 . 1 28 28 LEU CG C 13 26.3140 0.0000 . 1 . . . . A 28 LEU CG . 31056 1 363 . 1 . 1 28 28 LEU CD1 C 13 23.9620 0.0000 . 2 . . . . A 28 LEU CD1 . 31056 1 364 . 1 . 1 28 28 LEU CD2 C 13 26.5030 0.0000 . 2 . . . . A 28 LEU CD2 . 31056 1 365 . 1 . 1 28 28 LEU N N 15 121.8030 0.0000 . 1 . . . . A 28 LEU N . 31056 1 366 . 1 . 1 29 29 THR H H 1 7.7180 0.0000 . 1 . . . . A 29 THR H . 31056 1 367 . 1 . 1 29 29 THR HA H 1 4.6950 0.0000 . 1 . . . . A 29 THR HA . 31056 1 368 . 1 . 1 29 29 THR HB H 1 4.4250 0.0000 . 1 . . . . A 29 THR HB . 31056 1 369 . 1 . 1 29 29 THR HG21 H 1 1.3910 0.0000 . 1 . . . . A 29 THR HG21 . 31056 1 370 . 1 . 1 29 29 THR HG22 H 1 1.3910 0.0000 . 1 . . . . A 29 THR HG22 . 31056 1 371 . 1 . 1 29 29 THR HG23 H 1 1.3910 0.0000 . 1 . . . . A 29 THR HG23 . 31056 1 372 . 1 . 1 29 29 THR C C 13 175.1110 0.0000 . 1 . . . . A 29 THR C . 31056 1 373 . 1 . 1 29 29 THR CA C 13 60.4270 0.0000 . 1 . . . . A 29 THR CA . 31056 1 374 . 1 . 1 29 29 THR CB C 13 70.8480 0.0000 . 1 . . . . A 29 THR CB . 31056 1 375 . 1 . 1 29 29 THR CG2 C 13 22.1190 0.0000 . 1 . . . . A 29 THR CG2 . 31056 1 376 . 1 . 1 29 29 THR N N 15 112.0060 0.0000 . 1 . . . . A 29 THR N . 31056 1 377 . 1 . 1 30 30 ARG H H 1 8.8490 0.0000 . 1 . . . . A 30 ARG H . 31056 1 378 . 1 . 1 30 30 ARG HA H 1 3.8570 0.0000 . 1 . . . . A 30 ARG HA . 31056 1 379 . 1 . 1 30 30 ARG HB2 H 1 1.9110 0.0000 . 2 . . . . A 30 ARG HB2 . 31056 1 380 . 1 . 1 30 30 ARG HB3 H 1 1.9110 0.0000 . 2 . . . . A 30 ARG HB3 . 31056 1 381 . 1 . 1 30 30 ARG HG2 H 1 1.6930 0.0000 . 2 . . . . A 30 ARG HG2 . 31056 1 382 . 1 . 1 30 30 ARG HG3 H 1 1.6930 0.0000 . 2 . . . . A 30 ARG HG3 . 31056 1 383 . 1 . 1 30 30 ARG HD2 H 1 3.2490 0.0000 . 2 . . . . A 30 ARG HD2 . 31056 1 384 . 1 . 1 30 30 ARG HD3 H 1 3.2490 0.0000 . 2 . . . . A 30 ARG HD3 . 31056 1 385 . 1 . 1 30 30 ARG C C 13 178.0990 0.0000 . 1 . . . . A 30 ARG C . 31056 1 386 . 1 . 1 30 30 ARG CA C 13 60.4370 0.0000 . 1 . . . . A 30 ARG CA . 31056 1 387 . 1 . 1 30 30 ARG CB C 13 29.3690 0.0000 . 1 . . . . A 30 ARG CB . 31056 1 388 . 1 . 1 30 30 ARG CG C 13 27.7000 0.0000 . 1 . . . . A 30 ARG CG . 31056 1 389 . 1 . 1 30 30 ARG CD C 13 43.3750 0.0000 . 1 . . . . A 30 ARG CD . 31056 1 390 . 1 . 1 30 30 ARG N N 15 122.8320 0.0000 . 1 . . . . A 30 ARG N . 31056 1 391 . 1 . 1 31 31 ARG H H 1 8.3450 0.0000 . 1 . . . . A 31 ARG H . 31056 1 392 . 1 . 1 31 31 ARG HA H 1 3.9630 0.0000 . 1 . . . . A 31 ARG HA . 31056 1 393 . 1 . 1 31 31 ARG HB2 H 1 1.9330 0.0000 . 2 . . . . A 31 ARG HB2 . 31056 1 394 . 1 . 1 31 31 ARG HB3 H 1 1.7170 0.0000 . 2 . . . . A 31 ARG HB3 . 31056 1 395 . 1 . 1 31 31 ARG HG2 H 1 1.7020 0.0000 . 2 . . . . A 31 ARG HG2 . 31056 1 396 . 1 . 1 31 31 ARG HG3 H 1 1.5780 0.0000 . 2 . . . . A 31 ARG HG3 . 31056 1 397 . 1 . 1 31 31 ARG HD2 H 1 3.2230 0.0000 . 2 . . . . A 31 ARG HD2 . 31056 1 398 . 1 . 1 31 31 ARG HD3 H 1 3.2230 0.0000 . 2 . . . . A 31 ARG HD3 . 31056 1 399 . 1 . 1 31 31 ARG C C 13 178.5170 0.0000 . 1 . . . . A 31 ARG C . 31056 1 400 . 1 . 1 31 31 ARG CA C 13 59.2180 0.0000 . 1 . . . . A 31 ARG CA . 31056 1 401 . 1 . 1 31 31 ARG CB C 13 29.8950 0.0000 . 1 . . . . A 31 ARG CB . 31056 1 402 . 1 . 1 31 31 ARG CG C 13 26.8670 0.0000 . 1 . . . . A 31 ARG CG . 31056 1 403 . 1 . 1 31 31 ARG CD C 13 43.3180 0.0000 . 1 . . . . A 31 ARG CD . 31056 1 404 . 1 . 1 31 31 ARG N N 15 116.1950 0.0000 . 1 . . . . A 31 ARG N . 31056 1 405 . 1 . 1 32 32 ARG H H 1 7.7470 0.0000 . 1 . . . . A 32 ARG H . 31056 1 406 . 1 . 1 32 32 ARG HA H 1 4.1660 0.0000 . 1 . . . . A 32 ARG HA . 31056 1 407 . 1 . 1 32 32 ARG HB2 H 1 1.9530 0.0000 . 2 . . . . A 32 ARG HB2 . 31056 1 408 . 1 . 1 32 32 ARG HB3 H 1 1.8240 0.0000 . 2 . . . . A 32 ARG HB3 . 31056 1 409 . 1 . 1 32 32 ARG HG2 H 1 1.9380 0.0000 . 2 . . . . A 32 ARG HG2 . 31056 1 410 . 1 . 1 32 32 ARG HG3 H 1 1.4960 0.0000 . 2 . . . . A 32 ARG HG3 . 31056 1 411 . 1 . 1 32 32 ARG HD2 H 1 3.5940 0.0000 . 2 . . . . A 32 ARG HD2 . 31056 1 412 . 1 . 1 32 32 ARG HD3 H 1 3.0700 0.0000 . 2 . . . . A 32 ARG HD3 . 31056 1 413 . 1 . 1 32 32 ARG C C 13 177.9470 0.0000 . 1 . . . . A 32 ARG C . 31056 1 414 . 1 . 1 32 32 ARG CA C 13 56.9750 0.0000 . 1 . . . . A 32 ARG CA . 31056 1 415 . 1 . 1 32 32 ARG CB C 13 29.5690 0.0000 . 1 . . . . A 32 ARG CB . 31056 1 416 . 1 . 1 32 32 ARG CG C 13 26.8610 0.0000 . 1 . . . . A 32 ARG CG . 31056 1 417 . 1 . 1 32 32 ARG CD C 13 42.7090 0.0000 . 1 . . . . A 32 ARG CD . 31056 1 418 . 1 . 1 32 32 ARG N N 15 119.4160 0.0000 . 1 . . . . A 32 ARG N . 31056 1 419 . 1 . 1 33 33 ARG H H 1 8.4620 0.0000 . 1 . . . . A 33 ARG H . 31056 1 420 . 1 . 1 33 33 ARG HA H 1 3.7690 0.0000 . 1 . . . . A 33 ARG HA . 31056 1 421 . 1 . 1 33 33 ARG HB2 H 1 2.0680 0.0000 . 2 . . . . A 33 ARG HB2 . 31056 1 422 . 1 . 1 33 33 ARG HB3 H 1 1.8980 0.0000 . 2 . . . . A 33 ARG HB3 . 31056 1 423 . 1 . 1 33 33 ARG HG2 H 1 1.6660 0.0000 . 2 . . . . A 33 ARG HG2 . 31056 1 424 . 1 . 1 33 33 ARG HG3 H 1 1.5040 0.0000 . 2 . . . . A 33 ARG HG3 . 31056 1 425 . 1 . 1 33 33 ARG HD2 H 1 3.5550 0.0000 . 2 . . . . A 33 ARG HD2 . 31056 1 426 . 1 . 1 33 33 ARG HD3 H 1 3.3730 0.0000 . 2 . . . . A 33 ARG HD3 . 31056 1 427 . 1 . 1 33 33 ARG C C 13 178.0300 0.0000 . 1 . . . . A 33 ARG C . 31056 1 428 . 1 . 1 33 33 ARG CA C 13 60.8320 0.0000 . 1 . . . . A 33 ARG CA . 31056 1 429 . 1 . 1 33 33 ARG CB C 13 30.4910 0.0000 . 1 . . . . A 33 ARG CB . 31056 1 430 . 1 . 1 33 33 ARG CG C 13 28.6210 0.0000 . 1 . . . . A 33 ARG CG . 31056 1 431 . 1 . 1 33 33 ARG CD C 13 43.7730 0.0000 . 1 . . . . A 33 ARG CD . 31056 1 432 . 1 . 1 33 33 ARG N N 15 120.3860 0.0000 . 1 . . . . A 33 ARG N . 31056 1 433 . 1 . 1 34 34 ILE H H 1 8.0920 0.0000 . 1 . . . . A 34 ILE H . 31056 1 434 . 1 . 1 34 34 ILE HA H 1 3.5780 0.0000 . 1 . . . . A 34 ILE HA . 31056 1 435 . 1 . 1 34 34 ILE HB H 1 1.9190 0.0000 . 1 . . . . A 34 ILE HB . 31056 1 436 . 1 . 1 34 34 ILE HG12 H 1 1.7330 0.0000 . 2 . . . . A 34 ILE HG12 . 31056 1 437 . 1 . 1 34 34 ILE HG13 H 1 1.0890 0.0000 . 2 . . . . A 34 ILE HG13 . 31056 1 438 . 1 . 1 34 34 ILE HG21 H 1 0.8810 0.0000 . 1 . . . . A 34 ILE HG21 . 31056 1 439 . 1 . 1 34 34 ILE HG22 H 1 0.8810 0.0000 . 1 . . . . A 34 ILE HG22 . 31056 1 440 . 1 . 1 34 34 ILE HG23 H 1 0.8810 0.0000 . 1 . . . . A 34 ILE HG23 . 31056 1 441 . 1 . 1 34 34 ILE HD11 H 1 0.8380 0.0000 . 1 . . . . A 34 ILE HD11 . 31056 1 442 . 1 . 1 34 34 ILE HD12 H 1 0.8380 0.0000 . 1 . . . . A 34 ILE HD12 . 31056 1 443 . 1 . 1 34 34 ILE HD13 H 1 0.8380 0.0000 . 1 . . . . A 34 ILE HD13 . 31056 1 444 . 1 . 1 34 34 ILE C C 13 178.2950 0.0000 . 1 . . . . A 34 ILE C . 31056 1 445 . 1 . 1 34 34 ILE CA C 13 65.5610 0.0000 . 1 . . . . A 34 ILE CA . 31056 1 446 . 1 . 1 34 34 ILE CB C 13 38.2670 0.0000 . 1 . . . . A 34 ILE CB . 31056 1 447 . 1 . 1 34 34 ILE CG1 C 13 29.4820 0.0000 . 1 . . . . A 34 ILE CG1 . 31056 1 448 . 1 . 1 34 34 ILE CG2 C 13 17.2960 0.0000 . 1 . . . . A 34 ILE CG2 . 31056 1 449 . 1 . 1 34 34 ILE CD1 C 13 13.7570 0.0000 . 1 . . . . A 34 ILE CD1 . 31056 1 450 . 1 . 1 34 34 ILE N N 15 118.9890 0.0000 . 1 . . . . A 34 ILE N . 31056 1 451 . 1 . 1 35 35 GLU H H 1 7.8940 0.0000 . 1 . . . . A 35 GLU H . 31056 1 452 . 1 . 1 35 35 GLU HA H 1 4.0950 0.0000 . 1 . . . . A 35 GLU HA . 31056 1 453 . 1 . 1 35 35 GLU HB2 H 1 2.3350 0.0000 . 2 . . . . A 35 GLU HB2 . 31056 1 454 . 1 . 1 35 35 GLU HB3 H 1 2.0870 0.0000 . 2 . . . . A 35 GLU HB3 . 31056 1 455 . 1 . 1 35 35 GLU HG2 H 1 2.5800 0.0000 . 2 . . . . A 35 GLU HG2 . 31056 1 456 . 1 . 1 35 35 GLU HG3 H 1 2.2970 0.0000 . 2 . . . . A 35 GLU HG3 . 31056 1 457 . 1 . 1 35 35 GLU C C 13 180.7450 0.0000 . 1 . . . . A 35 GLU C . 31056 1 458 . 1 . 1 35 35 GLU CA C 13 59.6110 0.0000 . 1 . . . . A 35 GLU CA . 31056 1 459 . 1 . 1 35 35 GLU CB C 13 30.2320 0.0000 . 1 . . . . A 35 GLU CB . 31056 1 460 . 1 . 1 35 35 GLU CG C 13 36.4040 0.0000 . 1 . . . . A 35 GLU CG . 31056 1 461 . 1 . 1 35 35 GLU N N 15 120.4030 0.0000 . 1 . . . . A 35 GLU N . 31056 1 462 . 1 . 1 36 36 MET H H 1 8.7160 0.0000 . 1 . . . . A 36 MET H . 31056 1 463 . 1 . 1 36 36 MET HA H 1 4.1460 0.0000 . 1 . . . . A 36 MET HA . 31056 1 464 . 1 . 1 36 36 MET HB2 H 1 2.1330 0.0000 . 2 . . . . A 36 MET HB2 . 31056 1 465 . 1 . 1 36 36 MET HB3 H 1 1.9630 0.0000 . 2 . . . . A 36 MET HB3 . 31056 1 466 . 1 . 1 36 36 MET HG2 H 1 2.6310 0.0000 . 2 . . . . A 36 MET HG2 . 31056 1 467 . 1 . 1 36 36 MET HG3 H 1 2.4290 0.0000 . 2 . . . . A 36 MET HG3 . 31056 1 468 . 1 . 1 36 36 MET HE1 H 1 1.9730 0.0000 . 1 . . . . A 36 MET HE1 . 31056 1 469 . 1 . 1 36 36 MET HE2 H 1 1.9730 0.0000 . 1 . . . . A 36 MET HE2 . 31056 1 470 . 1 . 1 36 36 MET HE3 H 1 1.9730 0.0000 . 1 . . . . A 36 MET HE3 . 31056 1 471 . 1 . 1 36 36 MET C C 13 180.8760 0.0000 . 1 . . . . A 36 MET C . 31056 1 472 . 1 . 1 36 36 MET CA C 13 58.9140 0.0000 . 1 . . . . A 36 MET CA . 31056 1 473 . 1 . 1 36 36 MET CB C 13 33.5390 0.0000 . 1 . . . . A 36 MET CB . 31056 1 474 . 1 . 1 36 36 MET CG C 13 32.6380 0.0000 . 1 . . . . A 36 MET CG . 31056 1 475 . 1 . 1 36 36 MET CE C 13 17.1530 0.0000 . 1 . . . . A 36 MET CE . 31056 1 476 . 1 . 1 36 36 MET N N 15 119.0010 0.0000 . 1 . . . . A 36 MET N . 31056 1 477 . 1 . 1 37 37 ALA H H 1 8.4730 0.0000 . 1 . . . . A 37 ALA H . 31056 1 478 . 1 . 1 37 37 ALA HA H 1 3.8600 0.0000 . 1 . . . . A 37 ALA HA . 31056 1 479 . 1 . 1 37 37 ALA HB1 H 1 1.5120 0.0000 . 1 . . . . A 37 ALA HB1 . 31056 1 480 . 1 . 1 37 37 ALA HB2 H 1 1.5120 0.0000 . 1 . . . . A 37 ALA HB2 . 31056 1 481 . 1 . 1 37 37 ALA HB3 H 1 1.5120 0.0000 . 1 . . . . A 37 ALA HB3 . 31056 1 482 . 1 . 1 37 37 ALA C C 13 180.1270 0.0000 . 1 . . . . A 37 ALA C . 31056 1 483 . 1 . 1 37 37 ALA CA C 13 56.3920 0.0000 . 1 . . . . A 37 ALA CA . 31056 1 484 . 1 . 1 37 37 ALA CB C 13 17.5120 0.0000 . 1 . . . . A 37 ALA CB . 31056 1 485 . 1 . 1 37 37 ALA N N 15 123.5970 0.0000 . 1 . . . . A 37 ALA N . 31056 1 486 . 1 . 1 38 38 HIS H H 1 7.8920 0.0000 . 1 . . . . A 38 HIS H . 31056 1 487 . 1 . 1 38 38 HIS HA H 1 4.5020 0.0000 . 1 . . . . A 38 HIS HA . 31056 1 488 . 1 . 1 38 38 HIS HB2 H 1 3.3610 0.0000 . 2 . . . . A 38 HIS HB2 . 31056 1 489 . 1 . 1 38 38 HIS HB3 H 1 3.3610 0.0000 . 2 . . . . A 38 HIS HB3 . 31056 1 490 . 1 . 1 38 38 HIS HD2 H 1 7.3270 0.0000 . 1 . . . . A 38 HIS HD2 . 31056 1 491 . 1 . 1 38 38 HIS HE1 H 1 8.3430 0.0000 . 1 . . . . A 38 HIS HE1 . 31056 1 492 . 1 . 1 38 38 HIS C C 13 177.8960 0.0000 . 1 . . . . A 38 HIS C . 31056 1 493 . 1 . 1 38 38 HIS CA C 13 58.3150 0.0000 . 1 . . . . A 38 HIS CA . 31056 1 494 . 1 . 1 38 38 HIS CB C 13 29.1740 0.0000 . 1 . . . . A 38 HIS CB . 31056 1 495 . 1 . 1 38 38 HIS CD2 C 13 119.3950 0.0000 . 1 . . . . A 38 HIS CD2 . 31056 1 496 . 1 . 1 38 38 HIS CE1 C 13 137.1230 0.0000 . 1 . . . . A 38 HIS CE1 . 31056 1 497 . 1 . 1 38 38 HIS N N 15 114.4360 0.0000 . 1 . . . . A 38 HIS N . 31056 1 498 . 1 . 1 39 39 ALA H H 1 8.2520 0.0000 . 1 . . . . A 39 ALA H . 31056 1 499 . 1 . 1 39 39 ALA HA H 1 4.2120 0.0000 . 1 . . . . A 39 ALA HA . 31056 1 500 . 1 . 1 39 39 ALA HB1 H 1 1.6110 0.0000 . 1 . . . . A 39 ALA HB1 . 31056 1 501 . 1 . 1 39 39 ALA HB2 H 1 1.6110 0.0000 . 1 . . . . A 39 ALA HB2 . 31056 1 502 . 1 . 1 39 39 ALA HB3 H 1 1.6110 0.0000 . 1 . . . . A 39 ALA HB3 . 31056 1 503 . 1 . 1 39 39 ALA C C 13 179.7490 0.0000 . 1 . . . . A 39 ALA C . 31056 1 504 . 1 . 1 39 39 ALA CA C 13 55.1050 0.0000 . 1 . . . . A 39 ALA CA . 31056 1 505 . 1 . 1 39 39 ALA CB C 13 18.9480 0.0000 . 1 . . . . A 39 ALA CB . 31056 1 506 . 1 . 1 39 39 ALA N N 15 121.0880 0.0000 . 1 . . . . A 39 ALA N . 31056 1 507 . 1 . 1 40 40 LEU H H 1 8.5020 0.0000 . 1 . . . . A 40 LEU H . 31056 1 508 . 1 . 1 40 40 LEU HA H 1 4.5570 0.0000 . 1 . . . . A 40 LEU HA . 31056 1 509 . 1 . 1 40 40 LEU HB2 H 1 1.8170 0.0000 . 2 . . . . A 40 LEU HB2 . 31056 1 510 . 1 . 1 40 40 LEU HB3 H 1 1.5260 0.0000 . 2 . . . . A 40 LEU HB3 . 31056 1 511 . 1 . 1 40 40 LEU HG H 1 1.9620 0.0000 . 1 . . . . A 40 LEU HG . 31056 1 512 . 1 . 1 40 40 LEU HD11 H 1 0.7390 0.0000 . 2 . . . . A 40 LEU HD11 . 31056 1 513 . 1 . 1 40 40 LEU HD12 H 1 0.7390 0.0000 . 2 . . . . A 40 LEU HD12 . 31056 1 514 . 1 . 1 40 40 LEU HD13 H 1 0.7390 0.0000 . 2 . . . . A 40 LEU HD13 . 31056 1 515 . 1 . 1 40 40 LEU HD21 H 1 0.7640 0.0000 . 2 . . . . A 40 LEU HD21 . 31056 1 516 . 1 . 1 40 40 LEU HD22 H 1 0.7640 0.0000 . 2 . . . . A 40 LEU HD22 . 31056 1 517 . 1 . 1 40 40 LEU HD23 H 1 0.7640 0.0000 . 2 . . . . A 40 LEU HD23 . 31056 1 518 . 1 . 1 40 40 LEU C C 13 176.5550 0.0000 . 1 . . . . A 40 LEU C . 31056 1 519 . 1 . 1 40 40 LEU CA C 13 54.3590 0.0000 . 1 . . . . A 40 LEU CA . 31056 1 520 . 1 . 1 40 40 LEU CB C 13 42.7320 0.0000 . 1 . . . . A 40 LEU CB . 31056 1 521 . 1 . 1 40 40 LEU CG C 13 27.2350 0.0000 . 1 . . . . A 40 LEU CG . 31056 1 522 . 1 . 1 40 40 LEU CD1 C 13 26.0080 0.0000 . 2 . . . . A 40 LEU CD1 . 31056 1 523 . 1 . 1 40 40 LEU CD2 C 13 23.1720 0.0000 . 2 . . . . A 40 LEU CD2 . 31056 1 524 . 1 . 1 40 40 LEU N N 15 113.0590 0.0000 . 1 . . . . A 40 LEU N . 31056 1 525 . 1 . 1 41 41 CYS H H 1 7.9630 0.0000 . 1 . . . . A 41 CYS H . 31056 1 526 . 1 . 1 41 41 CYS HA H 1 4.1390 0.0000 . 1 . . . . A 41 CYS HA . 31056 1 527 . 1 . 1 41 41 CYS HB2 H 1 3.2560 0.0000 . 2 . . . . A 41 CYS HB2 . 31056 1 528 . 1 . 1 41 41 CYS HB3 H 1 3.1890 0.0000 . 2 . . . . A 41 CYS HB3 . 31056 1 529 . 1 . 1 41 41 CYS C C 13 173.7590 0.0000 . 1 . . . . A 41 CYS C . 31056 1 530 . 1 . 1 41 41 CYS CA C 13 60.4640 0.0000 . 1 . . . . A 41 CYS CA . 31056 1 531 . 1 . 1 41 41 CYS CB C 13 24.8720 0.0000 . 1 . . . . A 41 CYS CB . 31056 1 532 . 1 . 1 41 41 CYS N N 15 117.2580 0.0000 . 1 . . . . A 41 CYS N . 31056 1 533 . 1 . 1 42 42 LEU H H 1 8.1940 0.0000 . 1 . . . . A 42 LEU H . 31056 1 534 . 1 . 1 42 42 LEU HA H 1 4.9690 0.0000 . 1 . . . . A 42 LEU HA . 31056 1 535 . 1 . 1 42 42 LEU HB2 H 1 1.3540 0.0000 . 2 . . . . A 42 LEU HB2 . 31056 1 536 . 1 . 1 42 42 LEU HB3 H 1 1.6790 0.0000 . 2 . . . . A 42 LEU HB3 . 31056 1 537 . 1 . 1 42 42 LEU HG H 1 1.5880 0.0000 . 1 . . . . A 42 LEU HG . 31056 1 538 . 1 . 1 42 42 LEU HD11 H 1 0.7050 0.0000 . 2 . . . . A 42 LEU HD11 . 31056 1 539 . 1 . 1 42 42 LEU HD12 H 1 0.7050 0.0000 . 2 . . . . A 42 LEU HD12 . 31056 1 540 . 1 . 1 42 42 LEU HD13 H 1 0.7050 0.0000 . 2 . . . . A 42 LEU HD13 . 31056 1 541 . 1 . 1 42 42 LEU HD21 H 1 0.9280 0.0000 . 2 . . . . A 42 LEU HD21 . 31056 1 542 . 1 . 1 42 42 LEU HD22 H 1 0.9280 0.0000 . 2 . . . . A 42 LEU HD22 . 31056 1 543 . 1 . 1 42 42 LEU HD23 H 1 0.9280 0.0000 . 2 . . . . A 42 LEU HD23 . 31056 1 544 . 1 . 1 42 42 LEU C C 13 176.3090 0.0000 . 1 . . . . A 42 LEU C . 31056 1 545 . 1 . 1 42 42 LEU CA C 13 52.6040 0.0000 . 1 . . . . A 42 LEU CA . 31056 1 546 . 1 . 1 42 42 LEU CB C 13 47.7140 0.0000 . 1 . . . . A 42 LEU CB . 31056 1 547 . 1 . 1 42 42 LEU CG C 13 26.8530 0.0000 . 1 . . . . A 42 LEU CG . 31056 1 548 . 1 . 1 42 42 LEU CD1 C 13 26.7710 0.0000 . 2 . . . . A 42 LEU CD1 . 31056 1 549 . 1 . 1 42 42 LEU CD2 C 13 23.8360 0.0000 . 2 . . . . A 42 LEU CD2 . 31056 1 550 . 1 . 1 42 42 LEU N N 15 119.7040 0.0000 . 1 . . . . A 42 LEU N . 31056 1 551 . 1 . 1 43 43 THR H H 1 8.7940 0.0000 . 1 . . . . A 43 THR H . 31056 1 552 . 1 . 1 43 43 THR HA H 1 4.8210 0.0000 . 1 . . . . A 43 THR HA . 31056 1 553 . 1 . 1 43 43 THR HB H 1 4.6560 0.0000 . 1 . . . . A 43 THR HB . 31056 1 554 . 1 . 1 43 43 THR HG21 H 1 1.3640 0.0000 . 1 . . . . A 43 THR HG21 . 31056 1 555 . 1 . 1 43 43 THR HG22 H 1 1.3640 0.0000 . 1 . . . . A 43 THR HG22 . 31056 1 556 . 1 . 1 43 43 THR HG23 H 1 1.3640 0.0000 . 1 . . . . A 43 THR HG23 . 31056 1 557 . 1 . 1 43 43 THR C C 13 176.3750 0.0000 . 1 . . . . A 43 THR C . 31056 1 558 . 1 . 1 43 43 THR CA C 13 60.5410 0.0000 . 1 . . . . A 43 THR CA . 31056 1 559 . 1 . 1 43 43 THR CB C 13 71.0880 0.0000 . 1 . . . . A 43 THR CB . 31056 1 560 . 1 . 1 43 43 THR CG2 C 13 21.9880 0.0000 . 1 . . . . A 43 THR CG2 . 31056 1 561 . 1 . 1 43 43 THR N N 15 109.2710 0.0000 . 1 . . . . A 43 THR N . 31056 1 562 . 1 . 1 44 44 GLU H H 1 9.1650 0.0000 . 1 . . . . A 44 GLU H . 31056 1 563 . 1 . 1 44 44 GLU HA H 1 3.7180 0.0000 . 1 . . . . A 44 GLU HA . 31056 1 564 . 1 . 1 44 44 GLU HB2 H 1 2.0820 0.0000 . 2 . . . . A 44 GLU HB2 . 31056 1 565 . 1 . 1 44 44 GLU HB3 H 1 2.0820 0.0000 . 2 . . . . A 44 GLU HB3 . 31056 1 566 . 1 . 1 44 44 GLU HG2 H 1 2.3590 0.0000 . 2 . . . . A 44 GLU HG2 . 31056 1 567 . 1 . 1 44 44 GLU HG3 H 1 2.0720 0.0000 . 2 . . . . A 44 GLU HG3 . 31056 1 568 . 1 . 1 44 44 GLU C C 13 178.5920 0.0000 . 1 . . . . A 44 GLU C . 31056 1 569 . 1 . 1 44 44 GLU CA C 13 61.3380 0.0000 . 1 . . . . A 44 GLU CA . 31056 1 570 . 1 . 1 44 44 GLU CB C 13 30.0590 0.0000 . 1 . . . . A 44 GLU CB . 31056 1 571 . 1 . 1 44 44 GLU CG C 13 38.0770 0.0000 . 1 . . . . A 44 GLU CG . 31056 1 572 . 1 . 1 44 44 GLU N N 15 120.4080 0.0000 . 1 . . . . A 44 GLU N . 31056 1 573 . 1 . 1 45 45 ARG H H 1 8.3150 0.0000 . 1 . . . . A 45 ARG H . 31056 1 574 . 1 . 1 45 45 ARG HA H 1 4.0580 0.0000 . 1 . . . . A 45 ARG HA . 31056 1 575 . 1 . 1 45 45 ARG HB2 H 1 1.9910 0.0000 . 2 . . . . A 45 ARG HB2 . 31056 1 576 . 1 . 1 45 45 ARG HB3 H 1 1.8530 0.0000 . 2 . . . . A 45 ARG HB3 . 31056 1 577 . 1 . 1 45 45 ARG HG2 H 1 1.7480 0.0000 . 2 . . . . A 45 ARG HG2 . 31056 1 578 . 1 . 1 45 45 ARG HG3 H 1 1.7150 0.0000 . 2 . . . . A 45 ARG HG3 . 31056 1 579 . 1 . 1 45 45 ARG HD2 H 1 3.2910 0.0000 . 2 . . . . A 45 ARG HD2 . 31056 1 580 . 1 . 1 45 45 ARG HD3 H 1 3.2910 0.0000 . 2 . . . . A 45 ARG HD3 . 31056 1 581 . 1 . 1 45 45 ARG C C 13 177.9470 0.0000 . 1 . . . . A 45 ARG C . 31056 1 582 . 1 . 1 45 45 ARG CA C 13 59.6070 0.0000 . 1 . . . . A 45 ARG CA . 31056 1 583 . 1 . 1 45 45 ARG CB C 13 30.0990 0.0000 . 1 . . . . A 45 ARG CB . 31056 1 584 . 1 . 1 45 45 ARG CG C 13 27.5500 0.0000 . 1 . . . . A 45 ARG CG . 31056 1 585 . 1 . 1 45 45 ARG CD C 13 43.4040 0.0000 . 1 . . . . A 45 ARG CD . 31056 1 586 . 1 . 1 45 45 ARG N N 15 118.6520 0.0000 . 1 . . . . A 45 ARG N . 31056 1 587 . 1 . 1 46 46 GLN H H 1 8.0560 0.0000 . 1 . . . . A 46 GLN H . 31056 1 588 . 1 . 1 46 46 GLN HA H 1 4.0870 0.0000 . 1 . . . . A 46 GLN HA . 31056 1 589 . 1 . 1 46 46 GLN HB2 H 1 2.6490 0.0000 . 2 . . . . A 46 GLN HB2 . 31056 1 590 . 1 . 1 46 46 GLN HB3 H 1 2.0770 0.0000 . 2 . . . . A 46 GLN HB3 . 31056 1 591 . 1 . 1 46 46 GLN HG2 H 1 2.6290 0.0000 . 2 . . . . A 46 GLN HG2 . 31056 1 592 . 1 . 1 46 46 GLN HG3 H 1 2.5040 0.0000 . 2 . . . . A 46 GLN HG3 . 31056 1 593 . 1 . 1 46 46 GLN HE21 H 1 7.4340 0.0000 . 2 . . . . A 46 GLN HE21 . 31056 1 594 . 1 . 1 46 46 GLN HE22 H 1 6.8910 0.0000 . 2 . . . . A 46 GLN HE22 . 31056 1 595 . 1 . 1 46 46 GLN C C 13 180.4160 0.0000 . 1 . . . . A 46 GLN C . 31056 1 596 . 1 . 1 46 46 GLN CA C 13 59.4970 0.0000 . 1 . . . . A 46 GLN CA . 31056 1 597 . 1 . 1 46 46 GLN CB C 13 29.5260 0.0000 . 1 . . . . A 46 GLN CB . 31056 1 598 . 1 . 1 46 46 GLN CG C 13 35.6800 0.0000 . 1 . . . . A 46 GLN CG . 31056 1 599 . 1 . 1 46 46 GLN CD C 13 175.7780 0.0000 . 1 . . . . A 46 GLN CD . 31056 1 600 . 1 . 1 46 46 GLN N N 15 117.5990 0.0000 . 1 . . . . A 46 GLN N . 31056 1 601 . 1 . 1 46 46 GLN NE2 N 15 112.0060 0.0000 . 1 . . . . A 46 GLN NE2 . 31056 1 602 . 1 . 1 47 47 ILE H H 1 7.9980 0.0000 . 1 . . . . A 47 ILE H . 31056 1 603 . 1 . 1 47 47 ILE HA H 1 3.9280 0.0000 . 1 . . . . A 47 ILE HA . 31056 1 604 . 1 . 1 47 47 ILE HB H 1 2.1080 0.0000 . 1 . . . . A 47 ILE HB . 31056 1 605 . 1 . 1 47 47 ILE HG12 H 1 1.2680 0.0000 . 2 . . . . A 47 ILE HG12 . 31056 1 606 . 1 . 1 47 47 ILE HG13 H 1 1.7710 0.0000 . 2 . . . . A 47 ILE HG13 . 31056 1 607 . 1 . 1 47 47 ILE HG21 H 1 1.0070 0.0000 . 1 . . . . A 47 ILE HG21 . 31056 1 608 . 1 . 1 47 47 ILE HG22 H 1 1.0070 0.0000 . 1 . . . . A 47 ILE HG22 . 31056 1 609 . 1 . 1 47 47 ILE HG23 H 1 1.0070 0.0000 . 1 . . . . A 47 ILE HG23 . 31056 1 610 . 1 . 1 47 47 ILE HD11 H 1 0.7750 0.0000 . 1 . . . . A 47 ILE HD11 . 31056 1 611 . 1 . 1 47 47 ILE HD12 H 1 0.7750 0.0000 . 1 . . . . A 47 ILE HD12 . 31056 1 612 . 1 . 1 47 47 ILE HD13 H 1 0.7750 0.0000 . 1 . . . . A 47 ILE HD13 . 31056 1 613 . 1 . 1 47 47 ILE C C 13 177.0130 0.0000 . 1 . . . . A 47 ILE C . 31056 1 614 . 1 . 1 47 47 ILE CA C 13 65.1330 0.0000 . 1 . . . . A 47 ILE CA . 31056 1 615 . 1 . 1 47 47 ILE CB C 13 37.1980 0.0000 . 1 . . . . A 47 ILE CB . 31056 1 616 . 1 . 1 47 47 ILE CG1 C 13 28.9270 0.0000 . 1 . . . . A 47 ILE CG1 . 31056 1 617 . 1 . 1 47 47 ILE CG2 C 13 18.8390 0.0000 . 1 . . . . A 47 ILE CG2 . 31056 1 618 . 1 . 1 47 47 ILE CD1 C 13 12.8910 0.0000 . 1 . . . . A 47 ILE CD1 . 31056 1 619 . 1 . 1 47 47 ILE N N 15 120.7830 0.0000 . 1 . . . . A 47 ILE N . 31056 1 620 . 1 . 1 48 48 LYS H H 1 8.5940 0.0000 . 1 . . . . A 48 LYS H . 31056 1 621 . 1 . 1 48 48 LYS HA H 1 4.4310 0.0000 . 1 . . . . A 48 LYS HA . 31056 1 622 . 1 . 1 48 48 LYS HB2 H 1 2.1730 0.0000 . 2 . . . . A 48 LYS HB2 . 31056 1 623 . 1 . 1 48 48 LYS HB3 H 1 1.9490 0.0000 . 2 . . . . A 48 LYS HB3 . 31056 1 624 . 1 . 1 48 48 LYS HG2 H 1 1.6800 0.0000 . 2 . . . . A 48 LYS HG2 . 31056 1 625 . 1 . 1 48 48 LYS HG3 H 1 1.4700 0.0000 . 2 . . . . A 48 LYS HG3 . 31056 1 626 . 1 . 1 48 48 LYS HD2 H 1 1.8570 0.0000 . 2 . . . . A 48 LYS HD2 . 31056 1 627 . 1 . 1 48 48 LYS HD3 H 1 1.8570 0.0000 . 2 . . . . A 48 LYS HD3 . 31056 1 628 . 1 . 1 48 48 LYS HE2 H 1 3.0190 0.0000 . 2 . . . . A 48 LYS HE2 . 31056 1 629 . 1 . 1 48 48 LYS HE3 H 1 3.0190 0.0000 . 2 . . . . A 48 LYS HE3 . 31056 1 630 . 1 . 1 48 48 LYS C C 13 180.3890 0.0000 . 1 . . . . A 48 LYS C . 31056 1 631 . 1 . 1 48 48 LYS CA C 13 60.2330 0.0000 . 1 . . . . A 48 LYS CA . 31056 1 632 . 1 . 1 48 48 LYS CB C 13 33.2230 0.0000 . 1 . . . . A 48 LYS CB . 31056 1 633 . 1 . 1 48 48 LYS CG C 13 25.3240 0.0000 . 1 . . . . A 48 LYS CG . 31056 1 634 . 1 . 1 48 48 LYS CD C 13 29.9880 0.0000 . 1 . . . . A 48 LYS CD . 31056 1 635 . 1 . 1 48 48 LYS CE C 13 42.2100 0.0000 . 1 . . . . A 48 LYS CE . 31056 1 636 . 1 . 1 48 48 LYS N N 15 121.7710 0.0000 . 1 . . . . A 48 LYS N . 31056 1 637 . 1 . 1 49 49 ILE H H 1 8.6990 0.0000 . 1 . . . . A 49 ILE H . 31056 1 638 . 1 . 1 49 49 ILE HA H 1 3.8860 0.0000 . 1 . . . . A 49 ILE HA . 31056 1 639 . 1 . 1 49 49 ILE HB H 1 1.9880 0.0000 . 1 . . . . A 49 ILE HB . 31056 1 640 . 1 . 1 49 49 ILE HG12 H 1 1.3510 0.0000 . 2 . . . . A 49 ILE HG12 . 31056 1 641 . 1 . 1 49 49 ILE HG13 H 1 1.7940 0.0000 . 2 . . . . A 49 ILE HG13 . 31056 1 642 . 1 . 1 49 49 ILE HG21 H 1 1.0510 0.0000 . 1 . . . . A 49 ILE HG21 . 31056 1 643 . 1 . 1 49 49 ILE HG22 H 1 1.0510 0.0000 . 1 . . . . A 49 ILE HG22 . 31056 1 644 . 1 . 1 49 49 ILE HG23 H 1 1.0510 0.0000 . 1 . . . . A 49 ILE HG23 . 31056 1 645 . 1 . 1 49 49 ILE HD11 H 1 0.8900 0.0000 . 1 . . . . A 49 ILE HD11 . 31056 1 646 . 1 . 1 49 49 ILE HD12 H 1 0.8900 0.0000 . 1 . . . . A 49 ILE HD12 . 31056 1 647 . 1 . 1 49 49 ILE HD13 H 1 0.8900 0.0000 . 1 . . . . A 49 ILE HD13 . 31056 1 648 . 1 . 1 49 49 ILE C C 13 177.5930 0.0000 . 1 . . . . A 49 ILE C . 31056 1 649 . 1 . 1 49 49 ILE CA C 13 64.4540 0.0000 . 1 . . . . A 49 ILE CA . 31056 1 650 . 1 . 1 49 49 ILE CB C 13 38.1930 0.0000 . 1 . . . . A 49 ILE CB . 31056 1 651 . 1 . 1 49 49 ILE CG1 C 13 29.2340 0.0000 . 1 . . . . A 49 ILE CG1 . 31056 1 652 . 1 . 1 49 49 ILE CG2 C 13 17.3510 0.0000 . 1 . . . . A 49 ILE CG2 . 31056 1 653 . 1 . 1 49 49 ILE CD1 C 13 13.0370 0.0000 . 1 . . . . A 49 ILE CD1 . 31056 1 654 . 1 . 1 49 49 ILE N N 15 119.7000 0.0000 . 1 . . . . A 49 ILE N . 31056 1 655 . 1 . 1 50 50 TRP H H 1 8.1310 0.0000 . 1 . . . . A 50 TRP H . 31056 1 656 . 1 . 1 50 50 TRP HA H 1 3.9180 0.0000 . 1 . . . . A 50 TRP HA . 31056 1 657 . 1 . 1 50 50 TRP HB2 H 1 3.5300 0.0000 . 2 . . . . A 50 TRP HB2 . 31056 1 658 . 1 . 1 50 50 TRP HB3 H 1 3.3010 0.0000 . 2 . . . . A 50 TRP HB3 . 31056 1 659 . 1 . 1 50 50 TRP HD1 H 1 6.0740 0.0000 . 1 . . . . A 50 TRP HD1 . 31056 1 660 . 1 . 1 50 50 TRP HE1 H 1 9.9520 0.0000 . 1 . . . . A 50 TRP HE1 . 31056 1 661 . 1 . 1 50 50 TRP HE3 H 1 6.7920 0.0000 . 1 . . . . A 50 TRP HE3 . 31056 1 662 . 1 . 1 50 50 TRP HZ2 H 1 7.1960 0.0000 . 1 . . . . A 50 TRP HZ2 . 31056 1 663 . 1 . 1 50 50 TRP HZ3 H 1 5.6710 0.0000 . 1 . . . . A 50 TRP HZ3 . 31056 1 664 . 1 . 1 50 50 TRP HH2 H 1 6.4640 0.0000 . 1 . . . . A 50 TRP HH2 . 31056 1 665 . 1 . 1 50 50 TRP C C 13 180.1770 0.0000 . 1 . . . . A 50 TRP C . 31056 1 666 . 1 . 1 50 50 TRP CA C 13 63.2640 0.0000 . 1 . . . . A 50 TRP CA . 31056 1 667 . 1 . 1 50 50 TRP CB C 13 29.2310 0.0000 . 1 . . . . A 50 TRP CB . 31056 1 668 . 1 . 1 50 50 TRP CD1 C 13 126.5510 0.0000 . 1 . . . . A 50 TRP CD1 . 31056 1 669 . 1 . 1 50 50 TRP CE3 C 13 121.1680 0.0000 . 1 . . . . A 50 TRP CE3 . 31056 1 670 . 1 . 1 50 50 TRP CZ2 C 13 113.9030 0.0000 . 1 . . . . A 50 TRP CZ2 . 31056 1 671 . 1 . 1 50 50 TRP CZ3 C 13 120.4460 0.0000 . 1 . . . . A 50 TRP CZ3 . 31056 1 672 . 1 . 1 50 50 TRP CH2 C 13 123.0450 0.0000 . 1 . . . . A 50 TRP CH2 . 31056 1 673 . 1 . 1 50 50 TRP N N 15 122.3090 0.0000 . 1 . . . . A 50 TRP N . 31056 1 674 . 1 . 1 50 50 TRP NE1 N 15 128.9580 0.0000 . 1 . . . . A 50 TRP NE1 . 31056 1 675 . 1 . 1 51 51 PHE H H 1 8.9450 0.0000 . 1 . . . . A 51 PHE H . 31056 1 676 . 1 . 1 51 51 PHE HA H 1 3.8030 0.0000 . 1 . . . . A 51 PHE HA . 31056 1 677 . 1 . 1 51 51 PHE HB2 H 1 3.5690 0.0000 . 2 . . . . A 51 PHE HB2 . 31056 1 678 . 1 . 1 51 51 PHE HB3 H 1 3.3420 0.0000 . 2 . . . . A 51 PHE HB3 . 31056 1 679 . 1 . 1 51 51 PHE HD1 H 1 7.7950 0.0000 . 3 . . . . A 51 PHE HD1 . 31056 1 680 . 1 . 1 51 51 PHE HD2 H 1 7.7950 0.0000 . 3 . . . . A 51 PHE HD2 . 31056 1 681 . 1 . 1 51 51 PHE HE1 H 1 7.6060 0.0000 . 3 . . . . A 51 PHE HE1 . 31056 1 682 . 1 . 1 51 51 PHE HE2 H 1 7.6060 0.0000 . 3 . . . . A 51 PHE HE2 . 31056 1 683 . 1 . 1 51 51 PHE HZ H 1 7.2520 0.0000 . 1 . . . . A 51 PHE HZ . 31056 1 684 . 1 . 1 51 51 PHE C C 13 177.7000 0.0000 . 1 . . . . A 51 PHE C . 31056 1 685 . 1 . 1 51 51 PHE CA C 13 63.6070 0.0000 . 1 . . . . A 51 PHE CA . 31056 1 686 . 1 . 1 51 51 PHE CB C 13 39.8360 0.0000 . 1 . . . . A 51 PHE CB . 31056 1 687 . 1 . 1 51 51 PHE CD1 C 13 131.4580 0.0000 . 3 . . . . A 51 PHE CD1 . 31056 1 688 . 1 . 1 51 51 PHE CD2 C 13 131.4580 0.0000 . 3 . . . . A 51 PHE CD2 . 31056 1 689 . 1 . 1 51 51 PHE CE1 C 13 131.9580 0.0000 . 3 . . . . A 51 PHE CE1 . 31056 1 690 . 1 . 1 51 51 PHE CE2 C 13 131.9580 0.0000 . 3 . . . . A 51 PHE CE2 . 31056 1 691 . 1 . 1 51 51 PHE CZ C 13 129.1120 0.0000 . 1 . . . . A 51 PHE CZ . 31056 1 692 . 1 . 1 51 51 PHE N N 15 119.3320 0.0000 . 1 . . . . A 51 PHE N . 31056 1 693 . 1 . 1 52 52 GLN H H 1 8.2290 0.0000 . 1 . . . . A 52 GLN H . 31056 1 694 . 1 . 1 52 52 GLN HA H 1 4.0060 0.0000 . 1 . . . . A 52 GLN HA . 31056 1 695 . 1 . 1 52 52 GLN HB2 H 1 2.2890 0.0000 . 2 . . . . A 52 GLN HB2 . 31056 1 696 . 1 . 1 52 52 GLN HB3 H 1 2.1900 0.0000 . 2 . . . . A 52 GLN HB3 . 31056 1 697 . 1 . 1 52 52 GLN HG2 H 1 2.5350 0.0000 . 2 . . . . A 52 GLN HG2 . 31056 1 698 . 1 . 1 52 52 GLN HG3 H 1 2.4870 0.0000 . 2 . . . . A 52 GLN HG3 . 31056 1 699 . 1 . 1 52 52 GLN HE21 H 1 7.5470 0.0000 . 2 . . . . A 52 GLN HE21 . 31056 1 700 . 1 . 1 52 52 GLN HE22 H 1 6.9200 0.0000 . 2 . . . . A 52 GLN HE22 . 31056 1 701 . 1 . 1 52 52 GLN C C 13 178.8190 0.0000 . 1 . . . . A 52 GLN C . 31056 1 702 . 1 . 1 52 52 GLN CA C 13 59.4890 0.0000 . 1 . . . . A 52 GLN CA . 31056 1 703 . 1 . 1 52 52 GLN CB C 13 28.6620 0.0000 . 1 . . . . A 52 GLN CB . 31056 1 704 . 1 . 1 52 52 GLN CG C 13 33.7770 0.0000 . 1 . . . . A 52 GLN CG . 31056 1 705 . 1 . 1 52 52 GLN CD C 13 179.2860 0.0000 . 1 . . . . A 52 GLN CD . 31056 1 706 . 1 . 1 52 52 GLN N N 15 119.0010 0.0000 . 1 . . . . A 52 GLN N . 31056 1 707 . 1 . 1 52 52 GLN NE2 N 15 111.2210 0.0000 . 1 . . . . A 52 GLN NE2 . 31056 1 708 . 1 . 1 53 53 ASN H H 1 8.3230 0.0000 . 1 . . . . A 53 ASN H . 31056 1 709 . 1 . 1 53 53 ASN HA H 1 4.3290 0.0000 . 1 . . . . A 53 ASN HA . 31056 1 710 . 1 . 1 53 53 ASN HB2 H 1 2.6430 0.0000 . 2 . . . . A 53 ASN HB2 . 31056 1 711 . 1 . 1 53 53 ASN HB3 H 1 2.4520 0.0000 . 2 . . . . A 53 ASN HB3 . 31056 1 712 . 1 . 1 53 53 ASN HD21 H 1 7.4170 0.0000 . 2 . . . . A 53 ASN HD21 . 31056 1 713 . 1 . 1 53 53 ASN HD22 H 1 6.8800 0.0000 . 2 . . . . A 53 ASN HD22 . 31056 1 714 . 1 . 1 53 53 ASN C C 13 177.7160 0.0000 . 1 . . . . A 53 ASN C . 31056 1 715 . 1 . 1 53 53 ASN CA C 13 55.6560 0.0000 . 1 . . . . A 53 ASN CA . 31056 1 716 . 1 . 1 53 53 ASN CB C 13 37.7910 0.0000 . 1 . . . . A 53 ASN CB . 31056 1 717 . 1 . 1 53 53 ASN CG C 13 175.8440 0.0000 . 1 . . . . A 53 ASN CG . 31056 1 718 . 1 . 1 53 53 ASN N N 15 117.9670 0.0000 . 1 . . . . A 53 ASN N . 31056 1 719 . 1 . 1 53 53 ASN ND2 N 15 112.3610 0.0000 . 1 . . . . A 53 ASN ND2 . 31056 1 720 . 1 . 1 54 54 ARG H H 1 8.1620 0.0000 . 1 . . . . A 54 ARG H . 31056 1 721 . 1 . 1 54 54 ARG HA H 1 3.4040 0.0000 . 1 . . . . A 54 ARG HA . 31056 1 722 . 1 . 1 54 54 ARG HB2 H 1 -0.2870 0.0000 . 2 . . . . A 54 ARG HB2 . 31056 1 723 . 1 . 1 54 54 ARG HB3 H 1 0.6870 0.0000 . 2 . . . . A 54 ARG HB3 . 31056 1 724 . 1 . 1 54 54 ARG HG2 H 1 -0.3050 0.0000 . 2 . . . . A 54 ARG HG2 . 31056 1 725 . 1 . 1 54 54 ARG HG3 H 1 -0.5900 0.0000 . 2 . . . . A 54 ARG HG3 . 31056 1 726 . 1 . 1 54 54 ARG HD2 H 1 2.3820 0.0000 . 2 . . . . A 54 ARG HD2 . 31056 1 727 . 1 . 1 54 54 ARG HD3 H 1 1.9400 0.0000 . 2 . . . . A 54 ARG HD3 . 31056 1 728 . 1 . 1 54 54 ARG HE H 1 9.2780 0.0000 . 1 . . . . A 54 ARG HE . 31056 1 729 . 1 . 1 54 54 ARG C C 13 179.4410 0.0000 . 1 . . . . A 54 ARG C . 31056 1 730 . 1 . 1 54 54 ARG CA C 13 56.3900 0.0000 . 1 . . . . A 54 ARG CA . 31056 1 731 . 1 . 1 54 54 ARG CB C 13 28.3710 0.0000 . 1 . . . . A 54 ARG CB . 31056 1 732 . 1 . 1 54 54 ARG CG C 13 23.1980 0.0000 . 1 . . . . A 54 ARG CG . 31056 1 733 . 1 . 1 54 54 ARG CD C 13 40.5460 0.0000 . 1 . . . . A 54 ARG CD . 31056 1 734 . 1 . 1 54 54 ARG N N 15 123.1690 0.0000 . 1 . . . . A 54 ARG N . 31056 1 735 . 1 . 1 54 54 ARG NE N 15 88.5040 0.0000 . 1 . . . . A 54 ARG NE . 31056 1 736 . 1 . 1 55 55 ARG H H 1 7.9420 0.0000 . 1 . . . . A 55 ARG H . 31056 1 737 . 1 . 1 55 55 ARG HA H 1 3.9430 0.0000 . 1 . . . . A 55 ARG HA . 31056 1 738 . 1 . 1 55 55 ARG HB2 H 1 1.8380 0.0000 . 2 . . . . A 55 ARG HB2 . 31056 1 739 . 1 . 1 55 55 ARG HB3 H 1 2.1460 0.0000 . 2 . . . . A 55 ARG HB3 . 31056 1 740 . 1 . 1 55 55 ARG HG2 H 1 1.3380 0.0000 . 2 . . . . A 55 ARG HG2 . 31056 1 741 . 1 . 1 55 55 ARG HG3 H 1 2.3260 0.0000 . 2 . . . . A 55 ARG HG3 . 31056 1 742 . 1 . 1 55 55 ARG HD2 H 1 2.9370 0.0000 . 2 . . . . A 55 ARG HD2 . 31056 1 743 . 1 . 1 55 55 ARG HD3 H 1 2.6110 0.0000 . 2 . . . . A 55 ARG HD3 . 31056 1 744 . 1 . 1 55 55 ARG C C 13 178.9520 0.0000 . 1 . . . . A 55 ARG C . 31056 1 745 . 1 . 1 55 55 ARG CA C 13 60.2000 0.0000 . 1 . . . . A 55 ARG CA . 31056 1 746 . 1 . 1 55 55 ARG CB C 13 31.5700 0.0000 . 1 . . . . A 55 ARG CB . 31056 1 747 . 1 . 1 55 55 ARG CG C 13 31.1580 0.0000 . 1 . . . . A 55 ARG CG . 31056 1 748 . 1 . 1 55 55 ARG CD C 13 43.4430 0.0000 . 1 . . . . A 55 ARG CD . 31056 1 749 . 1 . 1 55 55 ARG N N 15 117.5800 0.0000 . 1 . . . . A 55 ARG N . 31056 1 750 . 1 . 1 56 56 MET H H 1 7.4820 0.0000 . 1 . . . . A 56 MET H . 31056 1 751 . 1 . 1 56 56 MET HA H 1 4.2890 0.0000 . 1 . . . . A 56 MET HA . 31056 1 752 . 1 . 1 56 56 MET HB2 H 1 2.1780 0.0000 . 2 . . . . A 56 MET HB2 . 31056 1 753 . 1 . 1 56 56 MET HB3 H 1 2.1780 0.0000 . 2 . . . . A 56 MET HB3 . 31056 1 754 . 1 . 1 56 56 MET HG2 H 1 2.8340 0.0000 . 2 . . . . A 56 MET HG2 . 31056 1 755 . 1 . 1 56 56 MET HG3 H 1 2.6840 0.0000 . 2 . . . . A 56 MET HG3 . 31056 1 756 . 1 . 1 56 56 MET HE1 H 1 2.1160 0.0000 . 1 . . . . A 56 MET HE1 . 31056 1 757 . 1 . 1 56 56 MET HE2 H 1 2.1160 0.0000 . 1 . . . . A 56 MET HE2 . 31056 1 758 . 1 . 1 56 56 MET HE3 H 1 2.1160 0.0000 . 1 . . . . A 56 MET HE3 . 31056 1 759 . 1 . 1 56 56 MET C C 13 177.5200 0.0000 . 1 . . . . A 56 MET C . 31056 1 760 . 1 . 1 56 56 MET CA C 13 57.6830 0.0000 . 1 . . . . A 56 MET CA . 31056 1 761 . 1 . 1 56 56 MET CB C 13 32.2840 0.0000 . 1 . . . . A 56 MET CB . 31056 1 762 . 1 . 1 56 56 MET CG C 13 32.1510 0.0000 . 1 . . . . A 56 MET CG . 31056 1 763 . 1 . 1 56 56 MET CE C 13 16.9590 0.0000 . 1 . . . . A 56 MET CE . 31056 1 764 . 1 . 1 56 56 MET N N 15 117.9640 0.0000 . 1 . . . . A 56 MET N . 31056 1 765 . 1 . 1 57 57 LYS H H 1 7.3560 0.0000 . 1 . . . . A 57 LYS H . 31056 1 766 . 1 . 1 57 57 LYS HA H 1 4.1350 0.0000 . 1 . . . . A 57 LYS HA . 31056 1 767 . 1 . 1 57 57 LYS HB2 H 1 1.8270 0.0000 . 2 . . . . A 57 LYS HB2 . 31056 1 768 . 1 . 1 57 57 LYS HB3 H 1 1.6610 0.0000 . 2 . . . . A 57 LYS HB3 . 31056 1 769 . 1 . 1 57 57 LYS HG2 H 1 1.4220 0.0000 . 2 . . . . A 57 LYS HG2 . 31056 1 770 . 1 . 1 57 57 LYS HG3 H 1 1.3310 0.0000 . 2 . . . . A 57 LYS HG3 . 31056 1 771 . 1 . 1 57 57 LYS HD2 H 1 1.4990 0.0000 . 2 . . . . A 57 LYS HD2 . 31056 1 772 . 1 . 1 57 57 LYS HD3 H 1 1.4990 0.0000 . 2 . . . . A 57 LYS HD3 . 31056 1 773 . 1 . 1 57 57 LYS HE2 H 1 2.8540 0.0000 . 2 . . . . A 57 LYS HE2 . 31056 1 774 . 1 . 1 57 57 LYS HE3 H 1 2.8540 0.0000 . 2 . . . . A 57 LYS HE3 . 31056 1 775 . 1 . 1 57 57 LYS C C 13 177.3020 0.0000 . 1 . . . . A 57 LYS C . 31056 1 776 . 1 . 1 57 57 LYS CA C 13 57.2630 0.0000 . 1 . . . . A 57 LYS CA . 31056 1 777 . 1 . 1 57 57 LYS CB C 13 32.5650 0.0000 . 1 . . . . A 57 LYS CB . 31056 1 778 . 1 . 1 57 57 LYS CG C 13 24.9030 0.0000 . 1 . . . . A 57 LYS CG . 31056 1 779 . 1 . 1 57 57 LYS CD C 13 28.8950 0.0000 . 1 . . . . A 57 LYS CD . 31056 1 780 . 1 . 1 57 57 LYS CE C 13 42.0690 0.0000 . 1 . . . . A 57 LYS CE . 31056 1 781 . 1 . 1 57 57 LYS N N 15 118.2890 0.0000 . 1 . . . . A 57 LYS N . 31056 1 782 . 1 . 1 58 58 LEU H H 1 7.4970 0.0000 . 1 . . . . A 58 LEU H . 31056 1 783 . 1 . 1 58 58 LEU HA H 1 4.2870 0.0000 . 1 . . . . A 58 LEU HA . 31056 1 784 . 1 . 1 58 58 LEU HB2 H 1 1.7320 0.0000 . 2 . . . . A 58 LEU HB2 . 31056 1 785 . 1 . 1 58 58 LEU HB3 H 1 1.7320 0.0000 . 2 . . . . A 58 LEU HB3 . 31056 1 786 . 1 . 1 58 58 LEU HG H 1 1.7150 0.0000 . 1 . . . . A 58 LEU HG . 31056 1 787 . 1 . 1 58 58 LEU HD11 H 1 0.9500 0.0000 . 2 . . . . A 58 LEU HD11 . 31056 1 788 . 1 . 1 58 58 LEU HD12 H 1 0.9500 0.0000 . 2 . . . . A 58 LEU HD12 . 31056 1 789 . 1 . 1 58 58 LEU HD13 H 1 0.9500 0.0000 . 2 . . . . A 58 LEU HD13 . 31056 1 790 . 1 . 1 58 58 LEU HD21 H 1 0.8930 0.0000 . 2 . . . . A 58 LEU HD21 . 31056 1 791 . 1 . 1 58 58 LEU HD22 H 1 0.8930 0.0000 . 2 . . . . A 58 LEU HD22 . 31056 1 792 . 1 . 1 58 58 LEU HD23 H 1 0.8930 0.0000 . 2 . . . . A 58 LEU HD23 . 31056 1 793 . 1 . 1 58 58 LEU C C 13 177.5000 0.0000 . 1 . . . . A 58 LEU C . 31056 1 794 . 1 . 1 58 58 LEU CA C 13 56.0140 0.0000 . 1 . . . . A 58 LEU CA . 31056 1 795 . 1 . 1 58 58 LEU CB C 13 42.2560 0.0000 . 1 . . . . A 58 LEU CB . 31056 1 796 . 1 . 1 58 58 LEU CG C 13 27.2100 0.0000 . 1 . . . . A 58 LEU CG . 31056 1 797 . 1 . 1 58 58 LEU CD1 C 13 25.1110 0.0000 . 2 . . . . A 58 LEU CD1 . 31056 1 798 . 1 . 1 58 58 LEU CD2 C 13 23.9560 0.0000 . 2 . . . . A 58 LEU CD2 . 31056 1 799 . 1 . 1 58 58 LEU N N 15 119.8050 0.0000 . 1 . . . . A 58 LEU N . 31056 1 800 . 1 . 1 59 59 LYS H H 1 7.8890 0.0000 . 1 . . . . A 59 LYS H . 31056 1 801 . 1 . 1 59 59 LYS HA H 1 4.2840 0.0000 . 1 . . . . A 59 LYS HA . 31056 1 802 . 1 . 1 59 59 LYS HB2 H 1 1.8870 0.0000 . 2 . . . . A 59 LYS HB2 . 31056 1 803 . 1 . 1 59 59 LYS HB3 H 1 1.8870 0.0000 . 2 . . . . A 59 LYS HB3 . 31056 1 804 . 1 . 1 59 59 LYS HG2 H 1 1.5120 0.0000 . 2 . . . . A 59 LYS HG2 . 31056 1 805 . 1 . 1 59 59 LYS HG3 H 1 1.5120 0.0000 . 2 . . . . A 59 LYS HG3 . 31056 1 806 . 1 . 1 59 59 LYS HD2 H 1 1.7390 0.0000 . 2 . . . . A 59 LYS HD2 . 31056 1 807 . 1 . 1 59 59 LYS HD3 H 1 1.7390 0.0000 . 2 . . . . A 59 LYS HD3 . 31056 1 808 . 1 . 1 59 59 LYS HE2 H 1 3.0580 0.0000 . 2 . . . . A 59 LYS HE2 . 31056 1 809 . 1 . 1 59 59 LYS HE3 H 1 3.0580 0.0000 . 2 . . . . A 59 LYS HE3 . 31056 1 810 . 1 . 1 59 59 LYS C C 13 176.4510 0.0000 . 1 . . . . A 59 LYS C . 31056 1 811 . 1 . 1 59 59 LYS CA C 13 56.7820 0.0000 . 1 . . . . A 59 LYS CA . 31056 1 812 . 1 . 1 59 59 LYS CB C 13 33.0140 0.0000 . 1 . . . . A 59 LYS CB . 31056 1 813 . 1 . 1 59 59 LYS CG C 13 24.8580 0.0000 . 1 . . . . A 59 LYS CG . 31056 1 814 . 1 . 1 59 59 LYS CD C 13 29.1520 0.0000 . 1 . . . . A 59 LYS CD . 31056 1 815 . 1 . 1 59 59 LYS CE C 13 42.1540 0.0000 . 1 . . . . A 59 LYS CE . 31056 1 816 . 1 . 1 59 59 LYS N N 15 119.9970 0.0000 . 1 . . . . A 59 LYS N . 31056 1 817 . 1 . 1 60 60 LYS H H 1 8.1180 0.0000 . 1 . . . . A 60 LYS H . 31056 1 818 . 1 . 1 60 60 LYS HA H 1 4.3600 0.0000 . 1 . . . . A 60 LYS HA . 31056 1 819 . 1 . 1 60 60 LYS HB2 H 1 1.8710 0.0000 . 2 . . . . A 60 LYS HB2 . 31056 1 820 . 1 . 1 60 60 LYS HB3 H 1 1.8710 0.0000 . 2 . . . . A 60 LYS HB3 . 31056 1 821 . 1 . 1 60 60 LYS HG2 H 1 1.4780 0.0000 . 2 . . . . A 60 LYS HG2 . 31056 1 822 . 1 . 1 60 60 LYS HG3 H 1 1.4780 0.0000 . 2 . . . . A 60 LYS HG3 . 31056 1 823 . 1 . 1 60 60 LYS HD2 H 1 1.7210 0.0000 . 2 . . . . A 60 LYS HD2 . 31056 1 824 . 1 . 1 60 60 LYS HD3 H 1 1.7210 0.0000 . 2 . . . . A 60 LYS HD3 . 31056 1 825 . 1 . 1 60 60 LYS HE2 H 1 3.0430 0.0000 . 2 . . . . A 60 LYS HE2 . 31056 1 826 . 1 . 1 60 60 LYS HE3 H 1 3.0430 0.0000 . 2 . . . . A 60 LYS HE3 . 31056 1 827 . 1 . 1 60 60 LYS C C 13 176.3750 0.0000 . 1 . . . . A 60 LYS C . 31056 1 828 . 1 . 1 60 60 LYS CA C 13 56.6690 0.0000 . 1 . . . . A 60 LYS CA . 31056 1 829 . 1 . 1 60 60 LYS CB C 13 33.1090 0.0000 . 1 . . . . A 60 LYS CB . 31056 1 830 . 1 . 1 60 60 LYS CG C 13 24.7820 0.0000 . 1 . . . . A 60 LYS CG . 31056 1 831 . 1 . 1 60 60 LYS CD C 13 29.0470 0.0000 . 1 . . . . A 60 LYS CD . 31056 1 832 . 1 . 1 60 60 LYS CE C 13 42.2130 0.0000 . 1 . . . . A 60 LYS CE . 31056 1 833 . 1 . 1 60 60 LYS N N 15 121.1330 0.0000 . 1 . . . . A 60 LYS N . 31056 1 834 . 1 . 1 61 61 GLU H H 1 8.3240 0.0000 . 1 . . . . A 61 GLU H . 31056 1 835 . 1 . 1 61 61 GLU HA H 1 4.3740 0.0000 . 1 . . . . A 61 GLU HA . 31056 1 836 . 1 . 1 61 61 GLU HB2 H 1 2.1230 0.0000 . 2 . . . . A 61 GLU HB2 . 31056 1 837 . 1 . 1 61 61 GLU HB3 H 1 2.0020 0.0000 . 2 . . . . A 61 GLU HB3 . 31056 1 838 . 1 . 1 61 61 GLU HG2 H 1 2.3590 0.0000 . 2 . . . . A 61 GLU HG2 . 31056 1 839 . 1 . 1 61 61 GLU HG3 H 1 2.2840 0.0000 . 2 . . . . A 61 GLU HG3 . 31056 1 840 . 1 . 1 61 61 GLU C C 13 175.4370 0.0000 . 1 . . . . A 61 GLU C . 31056 1 841 . 1 . 1 61 61 GLU CA C 13 56.8590 0.0000 . 1 . . . . A 61 GLU CA . 31056 1 842 . 1 . 1 61 61 GLU CB C 13 30.3930 0.0000 . 1 . . . . A 61 GLU CB . 31056 1 843 . 1 . 1 61 61 GLU CG C 13 36.4240 0.0000 . 1 . . . . A 61 GLU CG . 31056 1 844 . 1 . 1 61 61 GLU N N 15 122.4990 0.0000 . 1 . . . . A 61 GLU N . 31056 1 845 . 1 . 1 62 62 ILE H H 1 7.6800 0.0000 . 1 . . . . A 62 ILE H . 31056 1 846 . 1 . 1 62 62 ILE HA H 1 4.132 0.0000 . 1 . . . . A 62 ILE HA . 31056 1 847 . 1 . 1 62 62 ILE HB H 1 1.8800 0.0000 . 1 . . . . A 62 ILE HB . 31056 1 848 . 1 . 1 62 62 ILE HG12 H 1 1.4600 0.0000 . 2 . . . . A 62 ILE HG12 . 31056 1 849 . 1 . 1 62 62 ILE HG13 H 1 1.1830 0.0000 . 2 . . . . A 62 ILE HG13 . 31056 1 850 . 1 . 1 62 62 ILE HG21 H 1 0.9170 0.0000 . 1 . . . . A 62 ILE HG21 . 31056 1 851 . 1 . 1 62 62 ILE HG22 H 1 0.9170 0.0000 . 1 . . . . A 62 ILE HG22 . 31056 1 852 . 1 . 1 62 62 ILE HG23 H 1 0.9170 0.0000 . 1 . . . . A 62 ILE HG23 . 31056 1 853 . 1 . 1 62 62 ILE HD11 H 1 0.8980 0.0000 . 1 . . . . A 62 ILE HD11 . 31056 1 854 . 1 . 1 62 62 ILE HD12 H 1 0.8980 0.0000 . 1 . . . . A 62 ILE HD12 . 31056 1 855 . 1 . 1 62 62 ILE HD13 H 1 0.8980 0.0000 . 1 . . . . A 62 ILE HD13 . 31056 1 856 . 1 . 1 62 62 ILE C C 13 180.9710 0.0000 . 1 . . . . A 62 ILE C . 31056 1 857 . 1 . 1 62 62 ILE CA C 13 62.9130 0.0000 . 1 . . . . A 62 ILE CA . 31056 1 858 . 1 . 1 62 62 ILE CB C 13 39.8080 0.0000 . 1 . . . . A 62 ILE CB . 31056 1 859 . 1 . 1 62 62 ILE CG1 C 13 27.3270 0.0000 . 1 . . . . A 62 ILE CG1 . 31056 1 860 . 1 . 1 62 62 ILE CG2 C 13 18.1020 0.0000 . 1 . . . . A 62 ILE CG2 . 31056 1 861 . 1 . 1 62 62 ILE CD1 C 13 13.6770 0.0000 . 1 . . . . A 62 ILE CD1 . 31056 1 862 . 1 . 1 62 62 ILE N N 15 125.2990 0.0000 . 1 . . . . A 62 ILE N . 31056 1 stop_ save_