################################### # 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25666 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_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 5 '3D HNCACB' . . . 25666 1 6 '3D 1H-13C arom NOESY' . . . 25666 1 7 '3D simutaneous 13C-aromatic,13C-aliphatic,15N edited 1H-1H NOESY' . . . 25666 1 8 '3D CCH-TOCSY' . . . 25666 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 4 $AutoAssign . . 25666 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HE1 H 1 2.009 0.020 . 1 . . . . . 1 MET HE1 . 25666 1 2 . 1 1 1 1 MET HE2 H 1 2.009 0.020 . 1 . . . . . 1 MET HE2 . 25666 1 3 . 1 1 1 1 MET HE3 H 1 2.009 0.020 . 1 . . . . . 1 MET HE3 . 25666 1 4 . 1 1 1 1 MET CE C 13 86.665 0.400 . 1 . . . . . 1 MET CE . 25666 1 5 . 1 1 8 8 ARG HA H 1 4.387 0.020 . 1 . . . . . 8 ARG HA . 25666 1 6 . 1 1 8 8 ARG HB2 H 1 1.732 0.020 . 2 . . . . . 8 ARG HB2 . 25666 1 7 . 1 1 8 8 ARG HB3 H 1 1.864 0.020 . 2 . . . . . 8 ARG HB3 . 25666 1 8 . 1 1 8 8 ARG HG2 H 1 1.561 0.020 . 1 . . . . . 8 ARG HG2 . 25666 1 9 . 1 1 8 8 ARG HG3 H 1 1.561 0.020 . 1 . . . . . 8 ARG HG3 . 25666 1 10 . 1 1 8 8 ARG HD2 H 1 3.177 0.020 . 1 . . . . . 8 ARG HD2 . 25666 1 11 . 1 1 8 8 ARG HD3 H 1 3.177 0.020 . 1 . . . . . 8 ARG HD3 . 25666 1 12 . 1 1 8 8 ARG CA C 13 55.493 0.400 . 1 . . . . . 8 ARG CA . 25666 1 13 . 1 1 8 8 ARG CB C 13 30.884 0.400 . 1 . . . . . 8 ARG CB . 25666 1 14 . 1 1 8 8 ARG CG C 13 27.056 0.400 . 1 . . . . . 8 ARG CG . 25666 1 15 . 1 1 8 8 ARG CD C 13 42.915 0.400 . 1 . . . . . 8 ARG CD . 25666 1 16 . 1 1 9 9 SER HA H 1 4.415 0.020 . 1 . . . . . 9 SER HA . 25666 1 17 . 1 1 9 9 SER HB2 H 1 3.858 0.020 . 2 . . . . . 9 SER HB2 . 25666 1 18 . 1 1 9 9 SER HB3 H 1 3.908 0.020 . 2 . . . . . 9 SER HB3 . 25666 1 19 . 1 1 9 9 SER CA C 13 58.775 0.400 . 1 . . . . . 9 SER CA . 25666 1 20 . 1 1 9 9 SER CB C 13 63.696 0.400 . 1 . . . . . 9 SER CB . 25666 1 21 . 1 1 10 10 GLY HA2 H 1 3.999 0.020 . 1 . . . . . 10 GLY HA2 . 25666 1 22 . 1 1 10 10 GLY HA3 H 1 3.999 0.020 . 1 . . . . . 10 GLY HA3 . 25666 1 23 . 1 1 10 10 GLY CA C 13 45.103 0.400 . 1 . . . . . 10 GLY CA . 25666 1 24 . 1 1 11 11 ASP H H 1 7.954 0.020 . 1 . . . . . 11 ASP H . 25666 1 25 . 1 1 11 11 ASP HA H 1 4.673 0.020 . 1 . . . . . 11 ASP HA . 25666 1 26 . 1 1 11 11 ASP HB2 H 1 2.544 0.020 . 2 . . . . . 11 ASP HB2 . 25666 1 27 . 1 1 11 11 ASP HB3 H 1 2.548 0.020 . 2 . . . . . 11 ASP HB3 . 25666 1 28 . 1 1 11 11 ASP CA C 13 54.645 0.400 . 1 . . . . . 11 ASP CA . 25666 1 29 . 1 1 11 11 ASP CB C 13 41.376 0.400 . 1 . . . . . 11 ASP CB . 25666 1 30 . 1 1 11 11 ASP N N 15 120.458 0.400 . 1 . . . . . 11 ASP N . 25666 1 31 . 1 1 12 12 ILE H H 1 8.655 0.020 . 1 . . . . . 12 ILE H . 25666 1 32 . 1 1 12 12 ILE HA H 1 4.163 0.020 . 1 . . . . . 12 ILE HA . 25666 1 33 . 1 1 12 12 ILE HB H 1 1.713 0.020 . 1 . . . . . 12 ILE HB . 25666 1 34 . 1 1 12 12 ILE HG12 H 1 1.617 0.020 . 2 . . . . . 12 ILE HG12 . 25666 1 35 . 1 1 12 12 ILE HG13 H 1 0.971 0.020 . 2 . . . . . 12 ILE HG13 . 25666 1 36 . 1 1 12 12 ILE HG21 H 1 0.665 0.020 . 1 . . . . . 12 ILE HG21 . 25666 1 37 . 1 1 12 12 ILE HG22 H 1 0.665 0.020 . 1 . . . . . 12 ILE HG22 . 25666 1 38 . 1 1 12 12 ILE HG23 H 1 0.665 0.020 . 1 . . . . . 12 ILE HG23 . 25666 1 39 . 1 1 12 12 ILE HD11 H 1 0.722 0.020 . 1 . . . . . 12 ILE HD11 . 25666 1 40 . 1 1 12 12 ILE HD12 H 1 0.722 0.020 . 1 . . . . . 12 ILE HD12 . 25666 1 41 . 1 1 12 12 ILE HD13 H 1 0.722 0.020 . 1 . . . . . 12 ILE HD13 . 25666 1 42 . 1 1 12 12 ILE CA C 13 61.034 0.400 . 1 . . . . . 12 ILE CA . 25666 1 43 . 1 1 12 12 ILE CB C 13 39.219 0.400 . 1 . . . . . 12 ILE CB . 25666 1 44 . 1 1 12 12 ILE CG1 C 13 27.130 0.400 . 1 . . . . . 12 ILE CG1 . 25666 1 45 . 1 1 12 12 ILE CG2 C 13 18.032 0.400 . 1 . . . . . 12 ILE CG2 . 25666 1 46 . 1 1 12 12 ILE CD1 C 13 13.365 0.400 . 1 . . . . . 12 ILE CD1 . 25666 1 47 . 1 1 12 12 ILE N N 15 122.143 0.400 . 1 . . . . . 12 ILE N . 25666 1 48 . 1 1 13 13 GLN H H 1 8.684 0.020 . 1 . . . . . 13 GLN H . 25666 1 49 . 1 1 13 13 GLN HA H 1 5.103 0.020 . 1 . . . . . 13 GLN HA . 25666 1 50 . 1 1 13 13 GLN HB2 H 1 1.993 0.020 . 2 . . . . . 13 GLN HB2 . 25666 1 51 . 1 1 13 13 GLN HB3 H 1 1.883 0.020 . 2 . . . . . 13 GLN HB3 . 25666 1 52 . 1 1 13 13 GLN HG2 H 1 2.269 0.020 . 2 . . . . . 13 GLN HG2 . 25666 1 53 . 1 1 13 13 GLN HG3 H 1 2.221 0.020 . 2 . . . . . 13 GLN HG3 . 25666 1 54 . 1 1 13 13 GLN HE21 H 1 7.317 0.020 . 2 . . . . . 13 GLN HE21 . 25666 1 55 . 1 1 13 13 GLN HE22 H 1 6.731 0.020 . 2 . . . . . 13 GLN HE22 . 25666 1 56 . 1 1 13 13 GLN CA C 13 54.549 0.400 . 1 . . . . . 13 GLN CA . 25666 1 57 . 1 1 13 13 GLN CB C 13 30.674 0.400 . 1 . . . . . 13 GLN CB . 25666 1 58 . 1 1 13 13 GLN CG C 13 33.812 0.400 . 1 . . . . . 13 GLN CG . 25666 1 59 . 1 1 13 13 GLN N N 15 126.298 0.400 . 1 . . . . . 13 GLN N . 25666 1 60 . 1 1 13 13 GLN NE2 N 15 111.810 0.400 . 1 . . . . . 13 GLN NE2 . 25666 1 61 . 1 1 14 14 VAL H H 1 9.129 0.020 . 1 . . . . . 14 VAL H . 25666 1 62 . 1 1 14 14 VAL HA H 1 4.959 0.020 . 1 . . . . . 14 VAL HA . 25666 1 63 . 1 1 14 14 VAL HB H 1 2.121 0.020 . 1 . . . . . 14 VAL HB . 25666 1 64 . 1 1 14 14 VAL HG11 H 1 0.751 0.020 . 2 . . . . . 14 VAL HG11 . 25666 1 65 . 1 1 14 14 VAL HG12 H 1 0.751 0.020 . 2 . . . . . 14 VAL HG12 . 25666 1 66 . 1 1 14 14 VAL HG13 H 1 0.751 0.020 . 2 . . . . . 14 VAL HG13 . 25666 1 67 . 1 1 14 14 VAL HG21 H 1 0.776 0.020 . 2 . . . . . 14 VAL HG21 . 25666 1 68 . 1 1 14 14 VAL HG22 H 1 0.776 0.020 . 2 . . . . . 14 VAL HG22 . 25666 1 69 . 1 1 14 14 VAL HG23 H 1 0.776 0.020 . 2 . . . . . 14 VAL HG23 . 25666 1 70 . 1 1 14 14 VAL CA C 13 60.492 0.400 . 1 . . . . . 14 VAL CA . 25666 1 71 . 1 1 14 14 VAL CB C 13 33.963 0.400 . 1 . . . . . 14 VAL CB . 25666 1 72 . 1 1 14 14 VAL CG1 C 13 20.394 0.400 . 1 . . . . . 14 VAL CG1 . 25666 1 73 . 1 1 14 14 VAL CG2 C 13 20.518 0.400 . 1 . . . . . 14 VAL CG2 . 25666 1 74 . 1 1 14 14 VAL N N 15 126.253 0.400 . 1 . . . . . 14 VAL N . 25666 1 75 . 1 1 15 15 GLN H H 1 9.117 0.020 . 1 . . . . . 15 GLN H . 25666 1 76 . 1 1 15 15 GLN HA H 1 5.226 0.020 . 1 . . . . . 15 GLN HA . 25666 1 77 . 1 1 15 15 GLN HB2 H 1 2.142 0.020 . 2 . . . . . 15 GLN HB2 . 25666 1 78 . 1 1 15 15 GLN HB3 H 1 2.003 0.020 . 2 . . . . . 15 GLN HB3 . 25666 1 79 . 1 1 15 15 GLN HG2 H 1 2.297 0.020 . 2 . . . . . 15 GLN HG2 . 25666 1 80 . 1 1 15 15 GLN HG3 H 1 2.299 0.020 . 2 . . . . . 15 GLN HG3 . 25666 1 81 . 1 1 15 15 GLN HE21 H 1 7.490 0.020 . 2 . . . . . 15 GLN HE21 . 25666 1 82 . 1 1 15 15 GLN HE22 H 1 6.731 0.020 . 2 . . . . . 15 GLN HE22 . 25666 1 83 . 1 1 15 15 GLN CA C 13 54.600 0.400 . 1 . . . . . 15 GLN CA . 25666 1 84 . 1 1 15 15 GLN CB C 13 31.339 0.400 . 1 . . . . . 15 GLN CB . 25666 1 85 . 1 1 15 15 GLN CG C 13 33.641 0.400 . 1 . . . . . 15 GLN CG . 25666 1 86 . 1 1 15 15 GLN N N 15 126.568 0.400 . 1 . . . . . 15 GLN N . 25666 1 87 . 1 1 15 15 GLN NE2 N 15 112.427 0.400 . 1 . . . . . 15 GLN NE2 . 25666 1 88 . 1 1 16 16 ASN H H 1 9.535 0.020 . 1 . . . . . 16 ASN H . 25666 1 89 . 1 1 16 16 ASN HA H 1 5.905 0.020 . 1 . . . . . 16 ASN HA . 25666 1 90 . 1 1 16 16 ASN HB2 H 1 2.838 0.020 . 2 . . . . . 16 ASN HB2 . 25666 1 91 . 1 1 16 16 ASN HB3 H 1 2.754 0.020 . 2 . . . . . 16 ASN HB3 . 25666 1 92 . 1 1 16 16 ASN HD21 H 1 7.249 0.020 . 2 . . . . . 16 ASN HD21 . 25666 1 93 . 1 1 16 16 ASN HD22 H 1 6.320 0.020 . 2 . . . . . 16 ASN HD22 . 25666 1 94 . 1 1 16 16 ASN CA C 13 52.090 0.400 . 1 . . . . . 16 ASN CA . 25666 1 95 . 1 1 16 16 ASN CB C 13 44.391 0.400 . 1 . . . . . 16 ASN CB . 25666 1 96 . 1 1 16 16 ASN N N 15 127.183 0.400 . 1 . . . . . 16 ASN N . 25666 1 97 . 1 1 16 16 ASN ND2 N 15 107.618 0.400 . 1 . . . . . 16 ASN ND2 . 25666 1 98 . 1 1 17 17 ASN H H 1 9.280 0.020 . 1 . . . . . 17 ASN H . 25666 1 99 . 1 1 17 17 ASN HA H 1 5.694 0.020 . 1 . . . . . 17 ASN HA . 25666 1 100 . 1 1 17 17 ASN HB2 H 1 2.631 0.020 . 2 . . . . . 17 ASN HB2 . 25666 1 101 . 1 1 17 17 ASN HB3 H 1 2.684 0.020 . 2 . . . . . 17 ASN HB3 . 25666 1 102 . 1 1 17 17 ASN HD21 H 1 8.291 0.020 . 2 . . . . . 17 ASN HD21 . 25666 1 103 . 1 1 17 17 ASN HD22 H 1 6.469 0.020 . 2 . . . . . 17 ASN HD22 . 25666 1 104 . 1 1 17 17 ASN CA C 13 53.031 0.400 . 1 . . . . . 17 ASN CA . 25666 1 105 . 1 1 17 17 ASN CB C 13 42.851 0.400 . 1 . . . . . 17 ASN CB . 25666 1 106 . 1 1 17 17 ASN N N 15 126.137 0.400 . 1 . . . . . 17 ASN N . 25666 1 107 . 1 1 17 17 ASN ND2 N 15 113.341 0.400 . 1 . . . . . 17 ASN ND2 . 25666 1 108 . 1 1 18 18 ASN H H 1 8.838 0.020 . 1 . . . . . 18 ASN H . 25666 1 109 . 1 1 18 18 ASN HA H 1 5.717 0.020 . 1 . . . . . 18 ASN HA . 25666 1 110 . 1 1 18 18 ASN HB2 H 1 2.990 0.020 . 2 . . . . . 18 ASN HB2 . 25666 1 111 . 1 1 18 18 ASN HB3 H 1 2.774 0.020 . 2 . . . . . 18 ASN HB3 . 25666 1 112 . 1 1 18 18 ASN HD21 H 1 7.520 0.020 . 2 . . . . . 18 ASN HD21 . 25666 1 113 . 1 1 18 18 ASN HD22 H 1 6.793 0.020 . 2 . . . . . 18 ASN HD22 . 25666 1 114 . 1 1 18 18 ASN CA C 13 52.005 0.400 . 1 . . . . . 18 ASN CA . 25666 1 115 . 1 1 18 18 ASN CB C 13 43.084 0.400 . 1 . . . . . 18 ASN CB . 25666 1 116 . 1 1 18 18 ASN N N 15 123.645 0.400 . 1 . . . . . 18 ASN N . 25666 1 117 . 1 1 18 18 ASN ND2 N 15 112.830 0.400 . 1 . . . . . 18 ASN ND2 . 25666 1 118 . 1 1 19 19 THR H H 1 8.877 0.020 . 1 . . . . . 19 THR H . 25666 1 119 . 1 1 19 19 THR HA H 1 5.549 0.020 . 1 . . . . . 19 THR HA . 25666 1 120 . 1 1 19 19 THR HB H 1 4.023 0.020 . 1 . . . . . 19 THR HB . 25666 1 121 . 1 1 19 19 THR HG21 H 1 1.113 0.020 . 1 . . . . . 19 THR HG21 . 25666 1 122 . 1 1 19 19 THR HG22 H 1 1.113 0.020 . 1 . . . . . 19 THR HG22 . 25666 1 123 . 1 1 19 19 THR HG23 H 1 1.113 0.020 . 1 . . . . . 19 THR HG23 . 25666 1 124 . 1 1 19 19 THR CA C 13 62.484 0.400 . 1 . . . . . 19 THR CA . 25666 1 125 . 1 1 19 19 THR CB C 13 72.301 0.400 . 1 . . . . . 19 THR CB . 25666 1 126 . 1 1 19 19 THR CG2 C 13 21.532 0.400 . 1 . . . . . 19 THR CG2 . 25666 1 127 . 1 1 19 19 THR N N 15 121.009 0.400 . 1 . . . . . 19 THR N . 25666 1 128 . 1 1 24 24 THR HA H 1 5.028 0.020 . 1 . . . . . 24 THR HA . 25666 1 129 . 1 1 24 24 THR HB H 1 4.020 0.020 . 1 . . . . . 24 THR HB . 25666 1 130 . 1 1 24 24 THR HG21 H 1 1.228 0.020 . 1 . . . . . 24 THR HG21 . 25666 1 131 . 1 1 24 24 THR HG22 H 1 1.228 0.020 . 1 . . . . . 24 THR HG22 . 25666 1 132 . 1 1 24 24 THR HG23 H 1 1.228 0.020 . 1 . . . . . 24 THR HG23 . 25666 1 133 . 1 1 24 24 THR CA C 13 62.155 0.400 . 1 . . . . . 24 THR CA . 25666 1 134 . 1 1 24 24 THR CB C 13 69.809 0.400 . 1 . . . . . 24 THR CB . 25666 1 135 . 1 1 24 24 THR CG2 C 13 21.532 0.400 . 1 . . . . . 24 THR CG2 . 25666 1 136 . 1 1 25 25 PHE HD1 H 1 7.237 0.020 . 1 . . . . . 25 PHE HD1 . 25666 1 137 . 1 1 25 25 PHE HD2 H 1 7.237 0.020 . 1 . . . . . 25 PHE HD2 . 25666 1 138 . 1 1 25 25 PHE HE1 H 1 7.307 0.020 . 1 . . . . . 25 PHE HE1 . 25666 1 139 . 1 1 25 25 PHE HE2 H 1 7.307 0.020 . 1 . . . . . 25 PHE HE2 . 25666 1 140 . 1 1 25 25 PHE CD1 C 13 132.626 0.400 . 1 . . . . . 25 PHE CD1 . 25666 1 141 . 1 1 25 25 PHE CE1 C 13 131.266 0.400 . 1 . . . . . 25 PHE CE1 . 25666 1 142 . 1 1 27 27 TYR HD1 H 1 6.791 0.020 . 1 . . . . . 27 TYR HD1 . 25666 1 143 . 1 1 27 27 TYR HD2 H 1 6.791 0.020 . 1 . . . . . 27 TYR HD2 . 25666 1 144 . 1 1 27 27 TYR HE1 H 1 6.500 0.020 . 1 . . . . . 27 TYR HE1 . 25666 1 145 . 1 1 27 27 TYR HE2 H 1 6.500 0.020 . 1 . . . . . 27 TYR HE2 . 25666 1 146 . 1 1 27 27 TYR CD1 C 13 132.352 0.400 . 1 . . . . . 27 TYR CD1 . 25666 1 147 . 1 1 27 27 TYR CE1 C 13 118.126 0.400 . 1 . . . . . 27 TYR CE1 . 25666 1 148 . 1 1 28 28 THR HA H 1 5.327 0.020 . 1 . . . . . 28 THR HA . 25666 1 149 . 1 1 28 28 THR HB H 1 3.912 0.020 . 1 . . . . . 28 THR HB . 25666 1 150 . 1 1 28 28 THR HG21 H 1 1.124 0.020 . 1 . . . . . 28 THR HG21 . 25666 1 151 . 1 1 28 28 THR HG22 H 1 1.124 0.020 . 1 . . . . . 28 THR HG22 . 25666 1 152 . 1 1 28 28 THR HG23 H 1 1.124 0.020 . 1 . . . . . 28 THR HG23 . 25666 1 153 . 1 1 28 28 THR CA C 13 60.415 0.400 . 1 . . . . . 28 THR CA . 25666 1 154 . 1 1 28 28 THR CB C 13 71.353 0.400 . 1 . . . . . 28 THR CB . 25666 1 155 . 1 1 28 28 THR CG2 C 13 21.213 0.400 . 1 . . . . . 28 THR CG2 . 25666 1 156 . 1 1 29 29 TYR H H 1 9.110 0.020 . 1 . . . . . 29 TYR H . 25666 1 157 . 1 1 29 29 TYR HA H 1 4.830 0.020 . 1 . . . . . 29 TYR HA . 25666 1 158 . 1 1 29 29 TYR HB2 H 1 2.954 0.020 . 2 . . . . . 29 TYR HB2 . 25666 1 159 . 1 1 29 29 TYR HB3 H 1 2.527 0.020 . 2 . . . . . 29 TYR HB3 . 25666 1 160 . 1 1 29 29 TYR HD2 H 1 6.950 0.020 . 1 . . . . . 29 TYR HD2 . 25666 1 161 . 1 1 29 29 TYR HE2 H 1 6.710 0.020 . 1 . . . . . 29 TYR HE2 . 25666 1 162 . 1 1 29 29 TYR CA C 13 55.935 0.400 . 1 . . . . . 29 TYR CA . 25666 1 163 . 1 1 29 29 TYR CB C 13 43.375 0.400 . 1 . . . . . 29 TYR CB . 25666 1 164 . 1 1 29 29 TYR CD2 C 13 133.423 0.400 . 1 . . . . . 29 TYR CD2 . 25666 1 165 . 1 1 29 29 TYR CE2 C 13 118.055 0.400 . 1 . . . . . 29 TYR CE2 . 25666 1 166 . 1 1 29 29 TYR N N 15 123.155 0.400 . 1 . . . . . 29 TYR N . 25666 1 167 . 1 1 30 30 THR HA H 1 5.161 0.020 . 1 . . . . . 30 THR HA . 25666 1 168 . 1 1 30 30 THR HB H 1 3.898 0.020 . 1 . . . . . 30 THR HB . 25666 1 169 . 1 1 30 30 THR HG21 H 1 1.109 0.020 . 1 . . . . . 30 THR HG21 . 25666 1 170 . 1 1 30 30 THR HG22 H 1 1.109 0.020 . 1 . . . . . 30 THR HG22 . 25666 1 171 . 1 1 30 30 THR HG23 H 1 1.109 0.020 . 1 . . . . . 30 THR HG23 . 25666 1 172 . 1 1 30 30 THR CA C 13 61.970 0.400 . 1 . . . . . 30 THR CA . 25666 1 173 . 1 1 30 30 THR CB C 13 70.288 0.400 . 1 . . . . . 30 THR CB . 25666 1 174 . 1 1 30 30 THR CG2 C 13 21.740 0.400 . 1 . . . . . 30 THR CG2 . 25666 1 175 . 1 1 31 31 VAL H H 1 9.170 0.020 . 1 . . . . . 31 VAL H . 25666 1 176 . 1 1 31 31 VAL HA H 1 4.863 0.020 . 1 . . . . . 31 VAL HA . 25666 1 177 . 1 1 31 31 VAL HB H 1 2.358 0.020 . 1 . . . . . 31 VAL HB . 25666 1 178 . 1 1 31 31 VAL HG11 H 1 0.850 0.020 . 2 . . . . . 31 VAL HG11 . 25666 1 179 . 1 1 31 31 VAL HG12 H 1 0.850 0.020 . 2 . . . . . 31 VAL HG12 . 25666 1 180 . 1 1 31 31 VAL HG13 H 1 0.850 0.020 . 2 . . . . . 31 VAL HG13 . 25666 1 181 . 1 1 31 31 VAL HG21 H 1 0.707 0.020 . 2 . . . . . 31 VAL HG21 . 25666 1 182 . 1 1 31 31 VAL HG22 H 1 0.707 0.020 . 2 . . . . . 31 VAL HG22 . 25666 1 183 . 1 1 31 31 VAL HG23 H 1 0.707 0.020 . 2 . . . . . 31 VAL HG23 . 25666 1 184 . 1 1 31 31 VAL CA C 13 59.059 0.400 . 1 . . . . . 31 VAL CA . 25666 1 185 . 1 1 31 31 VAL CB C 13 34.863 0.400 . 1 . . . . . 31 VAL CB . 25666 1 186 . 1 1 31 31 VAL CG1 C 13 22.594 0.400 . 1 . . . . . 31 VAL CG1 . 25666 1 187 . 1 1 31 31 VAL CG2 C 13 19.188 0.400 . 1 . . . . . 31 VAL CG2 . 25666 1 188 . 1 1 31 31 VAL N N 15 120.425 0.400 . 1 . . . . . 31 VAL N . 25666 1 189 . 1 1 32 32 THR H H 1 8.881 0.020 . 1 . . . . . 32 THR H . 25666 1 190 . 1 1 32 32 THR HA H 1 4.763 0.020 . 1 . . . . . 32 THR HA . 25666 1 191 . 1 1 32 32 THR HB H 1 4.351 0.020 . 1 . . . . . 32 THR HB . 25666 1 192 . 1 1 32 32 THR HG21 H 1 1.242 0.020 . 1 . . . . . 32 THR HG21 . 25666 1 193 . 1 1 32 32 THR HG22 H 1 1.242 0.020 . 1 . . . . . 32 THR HG22 . 25666 1 194 . 1 1 32 32 THR HG23 H 1 1.242 0.020 . 1 . . . . . 32 THR HG23 . 25666 1 195 . 1 1 32 32 THR CA C 13 62.377 0.400 . 1 . . . . . 32 THR CA . 25666 1 196 . 1 1 32 32 THR CB C 13 70.415 0.400 . 1 . . . . . 32 THR CB . 25666 1 197 . 1 1 32 32 THR CG2 C 13 21.716 0.400 . 1 . . . . . 32 THR CG2 . 25666 1 198 . 1 1 32 32 THR N N 15 111.238 0.400 . 1 . . . . . 32 THR N . 25666 1 199 . 1 1 33 33 THR H H 1 7.436 0.020 . 1 . . . . . 33 THR H . 25666 1 200 . 1 1 33 33 THR HA H 1 4.892 0.020 . 1 . . . . . 33 THR HA . 25666 1 201 . 1 1 33 33 THR HB H 1 4.609 0.020 . 1 . . . . . 33 THR HB . 25666 1 202 . 1 1 33 33 THR HG21 H 1 1.268 0.020 . 1 . . . . . 33 THR HG21 . 25666 1 203 . 1 1 33 33 THR HG22 H 1 1.268 0.020 . 1 . . . . . 33 THR HG22 . 25666 1 204 . 1 1 33 33 THR HG23 H 1 1.268 0.020 . 1 . . . . . 33 THR HG23 . 25666 1 205 . 1 1 33 33 THR CA C 13 59.195 0.400 . 1 . . . . . 33 THR CA . 25666 1 206 . 1 1 33 33 THR CB C 13 72.919 0.400 . 1 . . . . . 33 THR CB . 25666 1 207 . 1 1 33 33 THR CG2 C 13 21.532 0.400 . 1 . . . . . 33 THR CG2 . 25666 1 208 . 1 1 33 33 THR N N 15 110.466 0.400 . 1 . . . . . 33 THR N . 25666 1 209 . 1 1 34 34 GLU HA H 1 3.916 0.020 . 1 . . . . . 34 GLU HA . 25666 1 210 . 1 1 34 34 GLU HB2 H 1 2.166 0.020 . 1 . . . . . 34 GLU HB2 . 25666 1 211 . 1 1 34 34 GLU HB3 H 1 2.166 0.020 . 1 . . . . . 34 GLU HB3 . 25666 1 212 . 1 1 34 34 GLU HG2 H 1 2.317 0.020 . 2 . . . . . 34 GLU HG2 . 25666 1 213 . 1 1 34 34 GLU HG3 H 1 2.397 0.020 . 2 . . . . . 34 GLU HG3 . 25666 1 214 . 1 1 34 34 GLU CA C 13 59.691 0.400 . 1 . . . . . 34 GLU CA . 25666 1 215 . 1 1 34 34 GLU CB C 13 29.243 0.400 . 1 . . . . . 34 GLU CB . 25666 1 216 . 1 1 34 34 GLU CG C 13 36.716 0.400 . 1 . . . . . 34 GLU CG . 25666 1 217 . 1 1 35 35 SER HA H 1 4.253 0.020 . 1 . . . . . 35 SER HA . 25666 1 218 . 1 1 35 35 SER HB2 H 1 3.925 0.020 . 2 . . . . . 35 SER HB2 . 25666 1 219 . 1 1 35 35 SER HB3 H 1 3.897 0.020 . 2 . . . . . 35 SER HB3 . 25666 1 220 . 1 1 35 35 SER CA C 13 61.628 0.400 . 1 . . . . . 35 SER CA . 25666 1 221 . 1 1 35 35 SER CB C 13 62.142 0.400 . 1 . . . . . 35 SER CB . 25666 1 222 . 1 1 36 36 GLU H H 1 7.757 0.020 . 1 . . . . . 36 GLU H . 25666 1 223 . 1 1 36 36 GLU HA H 1 4.090 0.020 . 1 . . . . . 36 GLU HA . 25666 1 224 . 1 1 36 36 GLU HB2 H 1 2.224 0.020 . 2 . . . . . 36 GLU HB2 . 25666 1 225 . 1 1 36 36 GLU HB3 H 1 2.134 0.020 . 2 . . . . . 36 GLU HB3 . 25666 1 226 . 1 1 36 36 GLU HG2 H 1 2.325 0.020 . 2 . . . . . 36 GLU HG2 . 25666 1 227 . 1 1 36 36 GLU HG3 H 1 2.414 0.020 . 2 . . . . . 36 GLU HG3 . 25666 1 228 . 1 1 36 36 GLU CA C 13 58.404 0.400 . 1 . . . . . 36 GLU CA . 25666 1 229 . 1 1 36 36 GLU CB C 13 30.168 0.400 . 1 . . . . . 36 GLU CB . 25666 1 230 . 1 1 36 36 GLU CG C 13 36.490 0.400 . 1 . . . . . 36 GLU CG . 25666 1 231 . 1 1 36 36 GLU N N 15 123.195 0.400 . 1 . . . . . 36 GLU N . 25666 1 232 . 1 1 37 37 LEU H H 1 7.953 0.020 . 1 . . . . . 37 LEU H . 25666 1 233 . 1 1 37 37 LEU HA H 1 3.866 0.020 . 1 . . . . . 37 LEU HA . 25666 1 234 . 1 1 37 37 LEU HB2 H 1 2.080 0.020 . 2 . . . . . 37 LEU HB2 . 25666 1 235 . 1 1 37 37 LEU HB3 H 1 1.322 0.020 . 2 . . . . . 37 LEU HB3 . 25666 1 236 . 1 1 37 37 LEU HG H 1 1.311 0.020 . 1 . . . . . 37 LEU HG . 25666 1 237 . 1 1 37 37 LEU HD11 H 1 0.505 0.020 . 2 . . . . . 37 LEU HD11 . 25666 1 238 . 1 1 37 37 LEU HD12 H 1 0.505 0.020 . 2 . . . . . 37 LEU HD12 . 25666 1 239 . 1 1 37 37 LEU HD13 H 1 0.505 0.020 . 2 . . . . . 37 LEU HD13 . 25666 1 240 . 1 1 37 37 LEU HD21 H 1 0.593 0.020 . 2 . . . . . 37 LEU HD21 . 25666 1 241 . 1 1 37 37 LEU HD22 H 1 0.593 0.020 . 2 . . . . . 37 LEU HD22 . 25666 1 242 . 1 1 37 37 LEU HD23 H 1 0.593 0.020 . 2 . . . . . 37 LEU HD23 . 25666 1 243 . 1 1 37 37 LEU CA C 13 57.628 0.400 . 1 . . . . . 37 LEU CA . 25666 1 244 . 1 1 37 37 LEU CB C 13 40.854 0.400 . 1 . . . . . 37 LEU CB . 25666 1 245 . 1 1 37 37 LEU CG C 13 26.466 0.400 . 1 . . . . . 37 LEU CG . 25666 1 246 . 1 1 37 37 LEU CD1 C 13 25.270 0.400 . 1 . . . . . 37 LEU CD1 . 25666 1 247 . 1 1 37 37 LEU CD2 C 13 23.315 0.400 . 1 . . . . . 37 LEU CD2 . 25666 1 248 . 1 1 37 37 LEU N N 15 120.458 0.400 . 1 . . . . . 37 LEU N . 25666 1 249 . 1 1 38 38 GLN H H 1 8.072 0.020 . 1 . . . . . 38 GLN H . 25666 1 250 . 1 1 38 38 GLN HA H 1 3.772 0.020 . 1 . . . . . 38 GLN HA . 25666 1 251 . 1 1 38 38 GLN HB2 H 1 2.140 0.020 . 2 . . . . . 38 GLN HB2 . 25666 1 252 . 1 1 38 38 GLN HB3 H 1 2.136 0.020 . 2 . . . . . 38 GLN HB3 . 25666 1 253 . 1 1 38 38 GLN HG2 H 1 2.373 0.020 . 2 . . . . . 38 GLN HG2 . 25666 1 254 . 1 1 38 38 GLN HG3 H 1 2.448 0.020 . 2 . . . . . 38 GLN HG3 . 25666 1 255 . 1 1 38 38 GLN HE21 H 1 7.401 0.020 . 2 . . . . . 38 GLN HE21 . 25666 1 256 . 1 1 38 38 GLN HE22 H 1 6.645 0.020 . 2 . . . . . 38 GLN HE22 . 25666 1 257 . 1 1 38 38 GLN CA C 13 59.141 0.400 . 1 . . . . . 38 GLN CA . 25666 1 258 . 1 1 38 38 GLN CB C 13 27.824 0.400 . 1 . . . . . 38 GLN CB . 25666 1 259 . 1 1 38 38 GLN CG C 13 33.381 0.400 . 1 . . . . . 38 GLN CG . 25666 1 260 . 1 1 38 38 GLN N N 15 117.479 0.400 . 1 . . . . . 38 GLN N . 25666 1 261 . 1 1 38 38 GLN NE2 N 15 111.810 0.400 . 1 . . . . . 38 GLN NE2 . 25666 1 262 . 1 1 39 39 LYS H H 1 7.400 0.020 . 1 . . . . . 39 LYS H . 25666 1 263 . 1 1 39 39 LYS HA H 1 4.022 0.020 . 1 . . . . . 39 LYS HA . 25666 1 264 . 1 1 39 39 LYS HB2 H 1 1.940 0.020 . 2 . . . . . 39 LYS HB2 . 25666 1 265 . 1 1 39 39 LYS HB3 H 1 1.968 0.020 . 2 . . . . . 39 LYS HB3 . 25666 1 266 . 1 1 39 39 LYS HG2 H 1 1.557 0.020 . 2 . . . . . 39 LYS HG2 . 25666 1 267 . 1 1 39 39 LYS HG3 H 1 1.368 0.020 . 2 . . . . . 39 LYS HG3 . 25666 1 268 . 1 1 39 39 LYS HD2 H 1 1.686 0.020 . 1 . . . . . 39 LYS HD2 . 25666 1 269 . 1 1 39 39 LYS HD3 H 1 1.686 0.020 . 1 . . . . . 39 LYS HD3 . 25666 1 270 . 1 1 39 39 LYS HE2 H 1 2.964 0.020 . 2 . . . . . 39 LYS HE2 . 25666 1 271 . 1 1 39 39 LYS HE3 H 1 2.966 0.020 . 2 . . . . . 39 LYS HE3 . 25666 1 272 . 1 1 39 39 LYS CA C 13 59.558 0.400 . 1 . . . . . 39 LYS CA . 25666 1 273 . 1 1 39 39 LYS CB C 13 32.087 0.400 . 1 . . . . . 39 LYS CB . 25666 1 274 . 1 1 39 39 LYS CG C 13 24.781 0.400 . 1 . . . . . 39 LYS CG . 25666 1 275 . 1 1 39 39 LYS CD C 13 29.407 0.400 . 1 . . . . . 39 LYS CD . 25666 1 276 . 1 1 39 39 LYS CE C 13 41.942 0.400 . 1 . . . . . 39 LYS CE . 25666 1 277 . 1 1 39 39 LYS N N 15 119.531 0.400 . 1 . . . . . 39 LYS N . 25666 1 278 . 1 1 40 40 VAL H H 1 7.838 0.020 . 1 . . . . . 40 VAL H . 25666 1 279 . 1 1 40 40 VAL HA H 1 3.471 0.020 . 1 . . . . . 40 VAL HA . 25666 1 280 . 1 1 40 40 VAL HB H 1 1.727 0.020 . 1 . . . . . 40 VAL HB . 25666 1 281 . 1 1 40 40 VAL HG11 H 1 0.301 0.020 . 2 . . . . . 40 VAL HG11 . 25666 1 282 . 1 1 40 40 VAL HG12 H 1 0.301 0.020 . 2 . . . . . 40 VAL HG12 . 25666 1 283 . 1 1 40 40 VAL HG13 H 1 0.301 0.020 . 2 . . . . . 40 VAL HG13 . 25666 1 284 . 1 1 40 40 VAL HG21 H 1 0.705 0.020 . 2 . . . . . 40 VAL HG21 . 25666 1 285 . 1 1 40 40 VAL HG22 H 1 0.705 0.020 . 2 . . . . . 40 VAL HG22 . 25666 1 286 . 1 1 40 40 VAL HG23 H 1 0.705 0.020 . 2 . . . . . 40 VAL HG23 . 25666 1 287 . 1 1 40 40 VAL CA C 13 65.593 0.400 . 1 . . . . . 40 VAL CA . 25666 1 288 . 1 1 40 40 VAL CB C 13 30.907 0.400 . 1 . . . . . 40 VAL CB . 25666 1 289 . 1 1 40 40 VAL CG1 C 13 20.357 0.400 . 1 . . . . . 40 VAL CG1 . 25666 1 290 . 1 1 40 40 VAL CG2 C 13 22.141 0.400 . 1 . . . . . 40 VAL CG2 . 25666 1 291 . 1 1 40 40 VAL N N 15 119.724 0.400 . 1 . . . . . 40 VAL N . 25666 1 292 . 1 1 41 41 LEU H H 1 8.381 0.020 . 1 . . . . . 41 LEU H . 25666 1 293 . 1 1 41 41 LEU HA H 1 3.887 0.020 . 1 . . . . . 41 LEU HA . 25666 1 294 . 1 1 41 41 LEU HB2 H 1 1.846 0.020 . 2 . . . . . 41 LEU HB2 . 25666 1 295 . 1 1 41 41 LEU HB3 H 1 1.182 0.020 . 2 . . . . . 41 LEU HB3 . 25666 1 296 . 1 1 41 41 LEU HG H 1 1.786 0.020 . 1 . . . . . 41 LEU HG . 25666 1 297 . 1 1 41 41 LEU HD11 H 1 0.686 0.020 . 2 . . . . . 41 LEU HD11 . 25666 1 298 . 1 1 41 41 LEU HD12 H 1 0.686 0.020 . 2 . . . . . 41 LEU HD12 . 25666 1 299 . 1 1 41 41 LEU HD13 H 1 0.686 0.020 . 2 . . . . . 41 LEU HD13 . 25666 1 300 . 1 1 41 41 LEU HD21 H 1 0.657 0.020 . 2 . . . . . 41 LEU HD21 . 25666 1 301 . 1 1 41 41 LEU HD22 H 1 0.657 0.020 . 2 . . . . . 41 LEU HD22 . 25666 1 302 . 1 1 41 41 LEU HD23 H 1 0.657 0.020 . 2 . . . . . 41 LEU HD23 . 25666 1 303 . 1 1 41 41 LEU CA C 13 57.550 0.400 . 1 . . . . . 41 LEU CA . 25666 1 304 . 1 1 41 41 LEU CB C 13 40.415 0.400 . 1 . . . . . 41 LEU CB . 25666 1 305 . 1 1 41 41 LEU CG C 13 25.693 0.400 . 1 . . . . . 41 LEU CG . 25666 1 306 . 1 1 41 41 LEU CD1 C 13 25.693 0.400 . 1 . . . . . 41 LEU CD1 . 25666 1 307 . 1 1 41 41 LEU CD2 C 13 21.959 0.400 . 1 . . . . . 41 LEU CD2 . 25666 1 308 . 1 1 41 41 LEU N N 15 119.402 0.400 . 1 . . . . . 41 LEU N . 25666 1 309 . 1 1 42 42 ASN H H 1 7.833 0.020 . 1 . . . . . 42 ASN H . 25666 1 310 . 1 1 42 42 ASN HA H 1 4.366 0.020 . 1 . . . . . 42 ASN HA . 25666 1 311 . 1 1 42 42 ASN HB2 H 1 2.893 0.020 . 2 . . . . . 42 ASN HB2 . 25666 1 312 . 1 1 42 42 ASN HB3 H 1 2.805 0.020 . 2 . . . . . 42 ASN HB3 . 25666 1 313 . 1 1 42 42 ASN HD21 H 1 6.875 0.020 . 2 . . . . . 42 ASN HD21 . 25666 1 314 . 1 1 42 42 ASN HD22 H 1 7.537 0.020 . 2 . . . . . 42 ASN HD22 . 25666 1 315 . 1 1 42 42 ASN CA C 13 55.797 0.400 . 1 . . . . . 42 ASN CA . 25666 1 316 . 1 1 42 42 ASN CB C 13 37.777 0.400 . 1 . . . . . 42 ASN CB . 25666 1 317 . 1 1 42 42 ASN N N 15 117.985 0.400 . 1 . . . . . 42 ASN N . 25666 1 318 . 1 1 42 42 ASN ND2 N 15 112.268 0.400 . 1 . . . . . 42 ASN ND2 . 25666 1 319 . 1 1 43 43 GLU H H 1 7.635 0.020 . 1 . . . . . 43 GLU H . 25666 1 320 . 1 1 43 43 GLU HA H 1 3.962 0.020 . 1 . . . . . 43 GLU HA . 25666 1 321 . 1 1 43 43 GLU HB2 H 1 2.061 0.020 . 2 . . . . . 43 GLU HB2 . 25666 1 322 . 1 1 43 43 GLU HB3 H 1 1.993 0.020 . 2 . . . . . 43 GLU HB3 . 25666 1 323 . 1 1 43 43 GLU HG2 H 1 2.294 0.020 . 1 . . . . . 43 GLU HG2 . 25666 1 324 . 1 1 43 43 GLU HG3 H 1 2.294 0.020 . 1 . . . . . 43 GLU HG3 . 25666 1 325 . 1 1 43 43 GLU CA C 13 59.050 0.400 . 1 . . . . . 43 GLU CA . 25666 1 326 . 1 1 43 43 GLU CB C 13 29.170 0.400 . 1 . . . . . 43 GLU CB . 25666 1 327 . 1 1 43 43 GLU CG C 13 36.404 0.400 . 1 . . . . . 43 GLU CG . 25666 1 328 . 1 1 43 43 GLU N N 15 122.204 0.400 . 1 . . . . . 43 GLU N . 25666 1 329 . 1 1 44 44 LEU H H 1 8.491 0.020 . 1 . . . . . 44 LEU H . 25666 1 330 . 1 1 44 44 LEU HA H 1 3.863 0.020 . 1 . . . . . 44 LEU HA . 25666 1 331 . 1 1 44 44 LEU HB2 H 1 1.630 0.020 . 2 . . . . . 44 LEU HB2 . 25666 1 332 . 1 1 44 44 LEU HB3 H 1 1.500 0.020 . 2 . . . . . 44 LEU HB3 . 25666 1 333 . 1 1 44 44 LEU HG H 1 1.592 0.020 . 1 . . . . . 44 LEU HG . 25666 1 334 . 1 1 44 44 LEU HD11 H 1 0.749 0.020 . 2 . . . . . 44 LEU HD11 . 25666 1 335 . 1 1 44 44 LEU HD12 H 1 0.749 0.020 . 2 . . . . . 44 LEU HD12 . 25666 1 336 . 1 1 44 44 LEU HD13 H 1 0.749 0.020 . 2 . . . . . 44 LEU HD13 . 25666 1 337 . 1 1 44 44 LEU HD21 H 1 0.744 0.020 . 2 . . . . . 44 LEU HD21 . 25666 1 338 . 1 1 44 44 LEU HD22 H 1 0.744 0.020 . 2 . . . . . 44 LEU HD22 . 25666 1 339 . 1 1 44 44 LEU HD23 H 1 0.744 0.020 . 2 . . . . . 44 LEU HD23 . 25666 1 340 . 1 1 44 44 LEU CA C 13 57.527 0.400 . 1 . . . . . 44 LEU CA . 25666 1 341 . 1 1 44 44 LEU CB C 13 41.583 0.400 . 1 . . . . . 44 LEU CB . 25666 1 342 . 1 1 44 44 LEU CG C 13 25.962 0.400 . 1 . . . . . 44 LEU CG . 25666 1 343 . 1 1 44 44 LEU CD1 C 13 24.430 0.400 . 1 . . . . . 44 LEU CD1 . 25666 1 344 . 1 1 44 44 LEU CD2 C 13 24.298 0.400 . 1 . . . . . 44 LEU CD2 . 25666 1 345 . 1 1 44 44 LEU N N 15 121.029 0.400 . 1 . . . . . 44 LEU N . 25666 1 346 . 1 1 45 45 LYS H H 1 8.059 0.020 . 1 . . . . . 45 LYS H . 25666 1 347 . 1 1 45 45 LYS HA H 1 3.650 0.020 . 1 . . . . . 45 LYS HA . 25666 1 348 . 1 1 45 45 LYS HB2 H 1 1.910 0.020 . 2 . . . . . 45 LYS HB2 . 25666 1 349 . 1 1 45 45 LYS HB3 H 1 1.847 0.020 . 2 . . . . . 45 LYS HB3 . 25666 1 350 . 1 1 45 45 LYS HG2 H 1 1.498 0.020 . 2 . . . . . 45 LYS HG2 . 25666 1 351 . 1 1 45 45 LYS HG3 H 1 1.344 0.020 . 2 . . . . . 45 LYS HG3 . 25666 1 352 . 1 1 45 45 LYS HD2 H 1 1.668 0.020 . 1 . . . . . 45 LYS HD2 . 25666 1 353 . 1 1 45 45 LYS HD3 H 1 1.667 0.020 . 1 . . . . . 45 LYS HD3 . 25666 1 354 . 1 1 45 45 LYS HE2 H 1 2.848 0.020 . 2 . . . . . 45 LYS HE2 . 25666 1 355 . 1 1 45 45 LYS HE3 H 1 2.919 0.020 . 2 . . . . . 45 LYS HE3 . 25666 1 356 . 1 1 45 45 LYS CA C 13 60.003 0.400 . 1 . . . . . 45 LYS CA . 25666 1 357 . 1 1 45 45 LYS CB C 13 32.029 0.400 . 1 . . . . . 45 LYS CB . 25666 1 358 . 1 1 45 45 LYS CG C 13 24.657 0.400 . 1 . . . . . 45 LYS CG . 25666 1 359 . 1 1 45 45 LYS CD C 13 29.666 0.400 . 1 . . . . . 45 LYS CD . 25666 1 360 . 1 1 45 45 LYS CE C 13 41.713 0.400 . 1 . . . . . 45 LYS CE . 25666 1 361 . 1 1 45 45 LYS N N 15 118.199 0.400 . 1 . . . . . 45 LYS N . 25666 1 362 . 1 1 46 46 ASP H H 1 7.117 0.020 . 1 . . . . . 46 ASP H . 25666 1 363 . 1 1 46 46 ASP HA H 1 4.350 0.020 . 1 . . . . . 46 ASP HA . 25666 1 364 . 1 1 46 46 ASP HB2 H 1 2.652 0.020 . 2 . . . . . 46 ASP HB2 . 25666 1 365 . 1 1 46 46 ASP HB3 H 1 2.561 0.020 . 2 . . . . . 46 ASP HB3 . 25666 1 366 . 1 1 46 46 ASP CA C 13 56.994 0.400 . 1 . . . . . 46 ASP CA . 25666 1 367 . 1 1 46 46 ASP CB C 13 40.484 0.400 . 1 . . . . . 46 ASP CB . 25666 1 368 . 1 1 46 46 ASP N N 15 117.602 0.400 . 1 . . . . . 46 ASP N . 25666 1 369 . 1 1 47 47 TYR H H 1 7.832 0.020 . 1 . . . . . 47 TYR H . 25666 1 370 . 1 1 47 47 TYR HA H 1 4.200 0.020 . 1 . . . . . 47 TYR HA . 25666 1 371 . 1 1 47 47 TYR HB2 H 1 2.936 0.020 . 1 . . . . . 47 TYR HB2 . 25666 1 372 . 1 1 47 47 TYR HB3 H 1 2.937 0.020 . 1 . . . . . 47 TYR HB3 . 25666 1 373 . 1 1 47 47 TYR HD2 H 1 6.778 0.020 . 1 . . . . . 47 TYR HD2 . 25666 1 374 . 1 1 47 47 TYR HE2 H 1 6.683 0.020 . 1 . . . . . 47 TYR HE2 . 25666 1 375 . 1 1 47 47 TYR CA C 13 60.595 0.400 . 1 . . . . . 47 TYR CA . 25666 1 376 . 1 1 47 47 TYR CB C 13 37.582 0.400 . 1 . . . . . 47 TYR CB . 25666 1 377 . 1 1 47 47 TYR CD2 C 13 132.352 0.400 . 1 . . . . . 47 TYR CD2 . 25666 1 378 . 1 1 47 47 TYR CE2 C 13 118.421 0.400 . 1 . . . . . 47 TYR CE2 . 25666 1 379 . 1 1 47 47 TYR N N 15 120.869 0.400 . 1 . . . . . 47 TYR N . 25666 1 380 . 1 1 48 48 ILE H H 1 8.746 0.020 . 1 . . . . . 48 ILE H . 25666 1 381 . 1 1 48 48 ILE HA H 1 3.466 0.020 . 1 . . . . . 48 ILE HA . 25666 1 382 . 1 1 48 48 ILE HB H 1 1.676 0.020 . 1 . . . . . 48 ILE HB . 25666 1 383 . 1 1 48 48 ILE HG12 H 1 1.848 0.020 . 2 . . . . . 48 ILE HG12 . 25666 1 384 . 1 1 48 48 ILE HG13 H 1 1.057 0.020 . 2 . . . . . 48 ILE HG13 . 25666 1 385 . 1 1 48 48 ILE HG21 H 1 0.898 0.020 . 1 . . . . . 48 ILE HG21 . 25666 1 386 . 1 1 48 48 ILE HG22 H 1 0.898 0.020 . 1 . . . . . 48 ILE HG22 . 25666 1 387 . 1 1 48 48 ILE HG23 H 1 0.898 0.020 . 1 . . . . . 48 ILE HG23 . 25666 1 388 . 1 1 48 48 ILE HD11 H 1 0.577 0.020 . 1 . . . . . 48 ILE HD11 . 25666 1 389 . 1 1 48 48 ILE HD12 H 1 0.577 0.020 . 1 . . . . . 48 ILE HD12 . 25666 1 390 . 1 1 48 48 ILE HD13 H 1 0.577 0.020 . 1 . . . . . 48 ILE HD13 . 25666 1 391 . 1 1 48 48 ILE CA C 13 65.403 0.400 . 1 . . . . . 48 ILE CA . 25666 1 392 . 1 1 48 48 ILE CB C 13 38.277 0.400 . 1 . . . . . 48 ILE CB . 25666 1 393 . 1 1 48 48 ILE CG1 C 13 28.634 0.400 . 1 . . . . . 48 ILE CG1 . 25666 1 394 . 1 1 48 48 ILE CG2 C 13 18.869 0.400 . 1 . . . . . 48 ILE CG2 . 25666 1 395 . 1 1 48 48 ILE CD1 C 13 12.834 0.400 . 1 . . . . . 48 ILE CD1 . 25666 1 396 . 1 1 48 48 ILE N N 15 119.749 0.400 . 1 . . . . . 48 ILE N . 25666 1 397 . 1 1 49 49 LYS H H 1 8.090 0.020 . 1 . . . . . 49 LYS H . 25666 1 398 . 1 1 49 49 LYS HA H 1 4.019 0.020 . 1 . . . . . 49 LYS HA . 25666 1 399 . 1 1 49 49 LYS HB2 H 1 1.935 0.020 . 2 . . . . . 49 LYS HB2 . 25666 1 400 . 1 1 49 49 LYS HB3 H 1 1.944 0.020 . 2 . . . . . 49 LYS HB3 . 25666 1 401 . 1 1 49 49 LYS HG2 H 1 1.441 0.020 . 1 . . . . . 49 LYS HG2 . 25666 1 402 . 1 1 49 49 LYS HG3 H 1 1.442 0.020 . 1 . . . . . 49 LYS HG3 . 25666 1 403 . 1 1 49 49 LYS HD2 H 1 1.677 0.020 . 2 . . . . . 49 LYS HD2 . 25666 1 404 . 1 1 49 49 LYS HD3 H 1 1.675 0.020 . 2 . . . . . 49 LYS HD3 . 25666 1 405 . 1 1 49 49 LYS HE2 H 1 2.958 0.020 . 2 . . . . . 49 LYS HE2 . 25666 1 406 . 1 1 49 49 LYS HE3 H 1 2.952 0.020 . 2 . . . . . 49 LYS HE3 . 25666 1 407 . 1 1 49 49 LYS CA C 13 58.872 0.400 . 1 . . . . . 49 LYS CA . 25666 1 408 . 1 1 49 49 LYS CB C 13 32.509 0.400 . 1 . . . . . 49 LYS CB . 25666 1 409 . 1 1 49 49 LYS CG C 13 24.515 0.400 . 1 . . . . . 49 LYS CG . 25666 1 410 . 1 1 49 49 LYS CD C 13 29.110 0.400 . 1 . . . . . 49 LYS CD . 25666 1 411 . 1 1 49 49 LYS CE C 13 41.872 0.400 . 1 . . . . . 49 LYS CE . 25666 1 412 . 1 1 49 49 LYS N N 15 120.637 0.400 . 1 . . . . . 49 LYS N . 25666 1 413 . 1 1 50 50 LYS H H 1 7.886 0.020 . 1 . . . . . 50 LYS H . 25666 1 414 . 1 1 50 50 LYS HA H 1 3.978 0.020 . 1 . . . . . 50 LYS HA . 25666 1 415 . 1 1 50 50 LYS HB2 H 1 1.890 0.020 . 2 . . . . . 50 LYS HB2 . 25666 1 416 . 1 1 50 50 LYS HB3 H 1 1.813 0.020 . 2 . . . . . 50 LYS HB3 . 25666 1 417 . 1 1 50 50 LYS HG2 H 1 1.444 0.020 . 2 . . . . . 50 LYS HG2 . 25666 1 418 . 1 1 50 50 LYS HG3 H 1 1.442 0.020 . 2 . . . . . 50 LYS HG3 . 25666 1 419 . 1 1 50 50 LYS HD2 H 1 1.663 0.020 . 1 . . . . . 50 LYS HD2 . 25666 1 420 . 1 1 50 50 LYS HD3 H 1 1.663 0.020 . 1 . . . . . 50 LYS HD3 . 25666 1 421 . 1 1 50 50 LYS HE2 H 1 2.929 0.020 . 1 . . . . . 50 LYS HE2 . 25666 1 422 . 1 1 50 50 LYS HE3 H 1 2.928 0.020 . 1 . . . . . 50 LYS HE3 . 25666 1 423 . 1 1 50 50 LYS CA C 13 58.461 0.400 . 1 . . . . . 50 LYS CA . 25666 1 424 . 1 1 50 50 LYS CB C 13 32.383 0.400 . 1 . . . . . 50 LYS CB . 25666 1 425 . 1 1 50 50 LYS CG C 13 24.829 0.400 . 1 . . . . . 50 LYS CG . 25666 1 426 . 1 1 50 50 LYS CD C 13 28.889 0.400 . 1 . . . . . 50 LYS CD . 25666 1 427 . 1 1 50 50 LYS CE C 13 41.872 0.400 . 1 . . . . . 50 LYS CE . 25666 1 428 . 1 1 50 50 LYS N N 15 118.309 0.400 . 1 . . . . . 50 LYS N . 25666 1 429 . 1 1 51 51 GLN H H 1 7.760 0.020 . 1 . . . . . 51 GLN H . 25666 1 430 . 1 1 51 51 GLN HA H 1 4.110 0.020 . 1 . . . . . 51 GLN HA . 25666 1 431 . 1 1 51 51 GLN HB2 H 1 1.967 0.020 . 2 . . . . . 51 GLN HB2 . 25666 1 432 . 1 1 51 51 GLN HB3 H 1 1.852 0.020 . 2 . . . . . 51 GLN HB3 . 25666 1 433 . 1 1 51 51 GLN HG2 H 1 1.937 0.020 . 1 . . . . . 51 GLN HG2 . 25666 1 434 . 1 1 51 51 GLN HG3 H 1 1.938 0.020 . 1 . . . . . 51 GLN HG3 . 25666 1 435 . 1 1 51 51 GLN HE21 H 1 7.176 0.020 . 2 . . . . . 51 GLN HE21 . 25666 1 436 . 1 1 51 51 GLN HE22 H 1 7.170 0.020 . 2 . . . . . 51 GLN HE22 . 25666 1 437 . 1 1 51 51 GLN CA C 13 56.114 0.400 . 1 . . . . . 51 GLN CA . 25666 1 438 . 1 1 51 51 GLN CB C 13 28.303 0.400 . 1 . . . . . 51 GLN CB . 25666 1 439 . 1 1 51 51 GLN CG C 13 32.158 0.400 . 1 . . . . . 51 GLN CG . 25666 1 440 . 1 1 51 51 GLN N N 15 116.123 0.400 . 1 . . . . . 51 GLN N . 25666 1 441 . 1 1 51 51 GLN NE2 N 15 111.810 0.400 . 1 . . . . . 51 GLN NE2 . 25666 1 442 . 1 1 55 55 ARG HA H 1 5.170 0.020 . 1 . . . . . 55 ARG HA . 25666 1 443 . 1 1 55 55 ARG HB2 H 1 1.865 0.020 . 1 . . . . . 55 ARG HB2 . 25666 1 444 . 1 1 55 55 ARG HB3 H 1 1.865 0.020 . 1 . . . . . 55 ARG HB3 . 25666 1 445 . 1 1 55 55 ARG HG2 H 1 1.681 0.020 . 1 . . . . . 55 ARG HG2 . 25666 1 446 . 1 1 55 55 ARG HG3 H 1 1.681 0.020 . 1 . . . . . 55 ARG HG3 . 25666 1 447 . 1 1 55 55 ARG HD2 H 1 3.199 0.020 . 1 . . . . . 55 ARG HD2 . 25666 1 448 . 1 1 55 55 ARG HD3 H 1 3.199 0.020 . 1 . . . . . 55 ARG HD3 . 25666 1 449 . 1 1 55 55 ARG CA C 13 54.946 0.400 . 1 . . . . . 55 ARG CA . 25666 1 450 . 1 1 55 55 ARG CB C 13 33.618 0.400 . 1 . . . . . 55 ARG CB . 25666 1 451 . 1 1 55 55 ARG CG C 13 27.056 0.400 . 1 . . . . . 55 ARG CG . 25666 1 452 . 1 1 55 55 ARG CD C 13 42.915 0.400 . 1 . . . . . 55 ARG CD . 25666 1 453 . 1 1 56 56 SER H H 1 8.224 0.020 . 1 . . . . . 56 SER H . 25666 1 454 . 1 1 56 56 SER HA H 1 5.293 0.020 . 1 . . . . . 56 SER HA . 25666 1 455 . 1 1 56 56 SER HB2 H 1 3.176 0.020 . 2 . . . . . 56 SER HB2 . 25666 1 456 . 1 1 56 56 SER HB3 H 1 3.742 0.020 . 2 . . . . . 56 SER HB3 . 25666 1 457 . 1 1 56 56 SER CA C 13 57.082 0.400 . 1 . . . . . 56 SER CA . 25666 1 458 . 1 1 56 56 SER CB C 13 64.279 0.400 . 1 . . . . . 56 SER CB . 25666 1 459 . 1 1 56 56 SER N N 15 116.980 0.400 . 1 . . . . . 56 SER N . 25666 1 460 . 1 1 57 57 ARG H H 1 8.968 0.020 . 1 . . . . . 57 ARG H . 25666 1 461 . 1 1 57 57 ARG HA H 1 5.496 0.020 . 1 . . . . . 57 ARG HA . 25666 1 462 . 1 1 57 57 ARG HB2 H 1 1.887 0.020 . 2 . . . . . 57 ARG HB2 . 25666 1 463 . 1 1 57 57 ARG HB3 H 1 1.712 0.020 . 2 . . . . . 57 ARG HB3 . 25666 1 464 . 1 1 57 57 ARG HG2 H 1 1.578 0.020 . 2 . . . . . 57 ARG HG2 . 25666 1 465 . 1 1 57 57 ARG HG3 H 1 1.633 0.020 . 2 . . . . . 57 ARG HG3 . 25666 1 466 . 1 1 57 57 ARG HD2 H 1 3.109 0.020 . 2 . . . . . 57 ARG HD2 . 25666 1 467 . 1 1 57 57 ARG HD3 H 1 3.105 0.020 . 2 . . . . . 57 ARG HD3 . 25666 1 468 . 1 1 57 57 ARG CA C 13 54.813 0.400 . 1 . . . . . 57 ARG CA . 25666 1 469 . 1 1 57 57 ARG CB C 13 34.168 0.400 . 1 . . . . . 57 ARG CB . 25666 1 470 . 1 1 57 57 ARG CG C 13 27.075 0.400 . 1 . . . . . 57 ARG CG . 25666 1 471 . 1 1 57 57 ARG CD C 13 43.487 0.400 . 1 . . . . . 57 ARG CD . 25666 1 472 . 1 1 57 57 ARG N N 15 127.152 0.400 . 1 . . . . . 57 ARG N . 25666 1 473 . 1 1 58 58 THR H H 1 9.198 0.020 . 1 . . . . . 58 THR H . 25666 1 474 . 1 1 58 58 THR HA H 1 5.545 0.020 . 1 . . . . . 58 THR HA . 25666 1 475 . 1 1 58 58 THR HB H 1 3.955 0.020 . 1 . . . . . 58 THR HB . 25666 1 476 . 1 1 58 58 THR HG21 H 1 1.089 0.020 . 1 . . . . . 58 THR HG21 . 25666 1 477 . 1 1 58 58 THR HG22 H 1 1.089 0.020 . 1 . . . . . 58 THR HG22 . 25666 1 478 . 1 1 58 58 THR HG23 H 1 1.089 0.020 . 1 . . . . . 58 THR HG23 . 25666 1 479 . 1 1 58 58 THR CA C 13 62.270 0.400 . 1 . . . . . 58 THR CA . 25666 1 480 . 1 1 58 58 THR CB C 13 71.723 0.400 . 1 . . . . . 58 THR CB . 25666 1 481 . 1 1 58 58 THR CG2 C 13 21.923 0.400 . 1 . . . . . 58 THR CG2 . 25666 1 482 . 1 1 58 58 THR N N 15 121.845 0.400 . 1 . . . . . 58 THR N . 25666 1 483 . 1 1 59 59 SER H H 1 9.539 0.020 . 1 . . . . . 59 SER H . 25666 1 484 . 1 1 59 59 SER HA H 1 6.006 0.020 . 1 . . . . . 59 SER HA . 25666 1 485 . 1 1 59 59 SER HB2 H 1 3.754 0.020 . 2 . . . . . 59 SER HB2 . 25666 1 486 . 1 1 59 59 SER HB3 H 1 3.658 0.020 . 2 . . . . . 59 SER HB3 . 25666 1 487 . 1 1 59 59 SER CA C 13 56.091 0.400 . 1 . . . . . 59 SER CA . 25666 1 488 . 1 1 59 59 SER CB C 13 66.188 0.400 . 1 . . . . . 59 SER CB . 25666 1 489 . 1 1 59 59 SER N N 15 123.259 0.400 . 1 . . . . . 59 SER N . 25666 1 490 . 1 1 60 60 ILE H H 1 9.176 0.020 . 1 . . . . . 60 ILE H . 25666 1 491 . 1 1 60 60 ILE HA H 1 5.194 0.020 . 1 . . . . . 60 ILE HA . 25666 1 492 . 1 1 60 60 ILE HB H 1 1.404 0.020 . 1 . . . . . 60 ILE HB . 25666 1 493 . 1 1 60 60 ILE HG12 H 1 1.543 0.020 . 2 . . . . . 60 ILE HG12 . 25666 1 494 . 1 1 60 60 ILE HG13 H 1 0.986 0.020 . 2 . . . . . 60 ILE HG13 . 25666 1 495 . 1 1 60 60 ILE HG21 H 1 0.621 0.020 . 1 . . . . . 60 ILE HG21 . 25666 1 496 . 1 1 60 60 ILE HG22 H 1 0.621 0.020 . 1 . . . . . 60 ILE HG22 . 25666 1 497 . 1 1 60 60 ILE HG23 H 1 0.621 0.020 . 1 . . . . . 60 ILE HG23 . 25666 1 498 . 1 1 60 60 ILE HD11 H 1 0.627 0.020 . 1 . . . . . 60 ILE HD11 . 25666 1 499 . 1 1 60 60 ILE HD12 H 1 0.627 0.020 . 1 . . . . . 60 ILE HD12 . 25666 1 500 . 1 1 60 60 ILE HD13 H 1 0.627 0.020 . 1 . . . . . 60 ILE HD13 . 25666 1 501 . 1 1 60 60 ILE CA C 13 59.610 0.400 . 1 . . . . . 60 ILE CA . 25666 1 502 . 1 1 60 60 ILE CB C 13 42.176 0.400 . 1 . . . . . 60 ILE CB . 25666 1 503 . 1 1 60 60 ILE CG1 C 13 28.174 0.400 . 1 . . . . . 60 ILE CG1 . 25666 1 504 . 1 1 60 60 ILE CG2 C 13 17.228 0.400 . 1 . . . . . 60 ILE CG2 . 25666 1 505 . 1 1 60 60 ILE CD1 C 13 14.177 0.400 . 1 . . . . . 60 ILE CD1 . 25666 1 506 . 1 1 60 60 ILE N N 15 123.259 0.400 . 1 . . . . . 60 ILE N . 25666 1 507 . 1 1 61 61 THR H H 1 8.188 0.020 . 1 . . . . . 61 THR H . 25666 1 508 . 1 1 61 61 THR HA H 1 4.368 0.020 . 1 . . . . . 61 THR HA . 25666 1 509 . 1 1 61 61 THR HB H 1 4.027 0.020 . 1 . . . . . 61 THR HB . 25666 1 510 . 1 1 61 61 THR HG21 H 1 1.452 0.020 . 1 . . . . . 61 THR HG21 . 25666 1 511 . 1 1 61 61 THR HG22 H 1 1.452 0.020 . 1 . . . . . 61 THR HG22 . 25666 1 512 . 1 1 61 61 THR HG23 H 1 1.452 0.020 . 1 . . . . . 61 THR HG23 . 25666 1 513 . 1 1 61 61 THR CA C 13 64.479 0.400 . 1 . . . . . 61 THR CA . 25666 1 514 . 1 1 61 61 THR CB C 13 70.468 0.400 . 1 . . . . . 61 THR CB . 25666 1 515 . 1 1 61 61 THR CG2 C 13 21.662 0.400 . 1 . . . . . 61 THR CG2 . 25666 1 516 . 1 1 61 61 THR N N 15 123.912 0.400 . 1 . . . . . 61 THR N . 25666 1 517 . 1 1 62 62 ALA H H 1 8.857 0.020 . 1 . . . . . 62 ALA H . 25666 1 518 . 1 1 62 62 ALA HA H 1 4.800 0.020 . 1 . . . . . 62 ALA HA . 25666 1 519 . 1 1 62 62 ALA HB1 H 1 1.409 0.020 . 1 . . . . . 62 ALA HB1 . 25666 1 520 . 1 1 62 62 ALA HB2 H 1 1.409 0.020 . 1 . . . . . 62 ALA HB2 . 25666 1 521 . 1 1 62 62 ALA HB3 H 1 1.409 0.020 . 1 . . . . . 62 ALA HB3 . 25666 1 522 . 1 1 62 62 ALA CA C 13 51.330 0.400 . 1 . . . . . 62 ALA CA . 25666 1 523 . 1 1 62 62 ALA CB C 13 19.807 0.400 . 1 . . . . . 62 ALA CB . 25666 1 524 . 1 1 62 62 ALA N N 15 128.016 0.400 . 1 . . . . . 62 ALA N . 25666 1 525 . 1 1 63 63 ARG H H 1 9.202 0.020 . 1 . . . . . 63 ARG H . 25666 1 526 . 1 1 63 63 ARG HA H 1 4.814 0.020 . 1 . . . . . 63 ARG HA . 25666 1 527 . 1 1 63 63 ARG HB2 H 1 1.903 0.020 . 2 . . . . . 63 ARG HB2 . 25666 1 528 . 1 1 63 63 ARG HB3 H 1 2.208 0.020 . 2 . . . . . 63 ARG HB3 . 25666 1 529 . 1 1 63 63 ARG HG2 H 1 1.918 0.020 . 2 . . . . . 63 ARG HG2 . 25666 1 530 . 1 1 63 63 ARG HG3 H 1 1.791 0.020 . 2 . . . . . 63 ARG HG3 . 25666 1 531 . 1 1 63 63 ARG HD2 H 1 3.288 0.020 . 1 . . . . . 63 ARG HD2 . 25666 1 532 . 1 1 63 63 ARG HD3 H 1 3.287 0.020 . 1 . . . . . 63 ARG HD3 . 25666 1 533 . 1 1 63 63 ARG CA C 13 57.537 0.400 . 1 . . . . . 63 ARG CA . 25666 1 534 . 1 1 63 63 ARG CB C 13 30.616 0.400 . 1 . . . . . 63 ARG CB . 25666 1 535 . 1 1 63 63 ARG CG C 13 28.543 0.400 . 1 . . . . . 63 ARG CG . 25666 1 536 . 1 1 63 63 ARG CD C 13 43.139 0.400 . 1 . . . . . 63 ARG CD . 25666 1 537 . 1 1 63 63 ARG N N 15 122.231 0.400 . 1 . . . . . 63 ARG N . 25666 1 538 . 1 1 64 64 THR H H 1 7.345 0.020 . 1 . . . . . 64 THR H . 25666 1 539 . 1 1 64 64 THR HA H 1 4.869 0.020 . 1 . . . . . 64 THR HA . 25666 1 540 . 1 1 64 64 THR HB H 1 4.546 0.020 . 1 . . . . . 64 THR HB . 25666 1 541 . 1 1 64 64 THR HG21 H 1 1.240 0.020 . 1 . . . . . 64 THR HG21 . 25666 1 542 . 1 1 64 64 THR HG22 H 1 1.240 0.020 . 1 . . . . . 64 THR HG22 . 25666 1 543 . 1 1 64 64 THR HG23 H 1 1.240 0.020 . 1 . . . . . 64 THR HG23 . 25666 1 544 . 1 1 64 64 THR CA C 13 58.353 0.400 . 1 . . . . . 64 THR CA . 25666 1 545 . 1 1 64 64 THR CB C 13 72.751 0.400 . 1 . . . . . 64 THR CB . 25666 1 546 . 1 1 64 64 THR CG2 C 13 21.532 0.400 . 1 . . . . . 64 THR CG2 . 25666 1 547 . 1 1 64 64 THR N N 15 106.353 0.400 . 1 . . . . . 64 THR N . 25666 1 548 . 1 1 65 65 LYS HA H 1 4.540 0.020 . 1 . . . . . 65 LYS HA . 25666 1 549 . 1 1 65 65 LYS HB2 H 1 1.659 0.020 . 2 . . . . . 65 LYS HB2 . 25666 1 550 . 1 1 65 65 LYS HB3 H 1 1.722 0.020 . 2 . . . . . 65 LYS HB3 . 25666 1 551 . 1 1 65 65 LYS HG2 H 1 1.433 0.020 . 2 . . . . . 65 LYS HG2 . 25666 1 552 . 1 1 65 65 LYS HG3 H 1 1.423 0.020 . 2 . . . . . 65 LYS HG3 . 25666 1 553 . 1 1 65 65 LYS HD2 H 1 1.663 0.020 . 1 . . . . . 65 LYS HD2 . 25666 1 554 . 1 1 65 65 LYS HD3 H 1 1.663 0.020 . 1 . . . . . 65 LYS HD3 . 25666 1 555 . 1 1 65 65 LYS HE2 H 1 2.946 0.020 . 2 . . . . . 65 LYS HE2 . 25666 1 556 . 1 1 65 65 LYS HE3 H 1 2.940 0.020 . 2 . . . . . 65 LYS HE3 . 25666 1 557 . 1 1 65 65 LYS CA C 13 58.783 0.400 . 1 . . . . . 65 LYS CA . 25666 1 558 . 1 1 65 65 LYS CB C 13 32.092 0.400 . 1 . . . . . 65 LYS CB . 25666 1 559 . 1 1 65 65 LYS CG C 13 24.806 0.400 . 1 . . . . . 65 LYS CG . 25666 1 560 . 1 1 65 65 LYS CD C 13 28.975 0.400 . 1 . . . . . 65 LYS CD . 25666 1 561 . 1 1 65 65 LYS CE C 13 41.951 0.400 . 1 . . . . . 65 LYS CE . 25666 1 562 . 1 1 66 66 LYS H H 1 7.996 0.020 . 1 . . . . . 66 LYS H . 25666 1 563 . 1 1 66 66 LYS HA H 1 3.949 0.020 . 1 . . . . . 66 LYS HA . 25666 1 564 . 1 1 66 66 LYS HB2 H 1 1.745 0.020 . 2 . . . . . 66 LYS HB2 . 25666 1 565 . 1 1 66 66 LYS HB3 H 1 1.653 0.020 . 2 . . . . . 66 LYS HB3 . 25666 1 566 . 1 1 66 66 LYS HG2 H 1 1.452 0.020 . 2 . . . . . 66 LYS HG2 . 25666 1 567 . 1 1 66 66 LYS HG3 H 1 1.350 0.020 . 2 . . . . . 66 LYS HG3 . 25666 1 568 . 1 1 66 66 LYS HD2 H 1 1.643 0.020 . 1 . . . . . 66 LYS HD2 . 25666 1 569 . 1 1 66 66 LYS HD3 H 1 1.643 0.020 . 1 . . . . . 66 LYS HD3 . 25666 1 570 . 1 1 66 66 LYS HE2 H 1 2.919 0.020 . 1 . . . . . 66 LYS HE2 . 25666 1 571 . 1 1 66 66 LYS HE3 H 1 2.919 0.020 . 1 . . . . . 66 LYS HE3 . 25666 1 572 . 1 1 66 66 LYS CA C 13 58.694 0.400 . 1 . . . . . 66 LYS CA . 25666 1 573 . 1 1 66 66 LYS CB C 13 31.915 0.400 . 1 . . . . . 66 LYS CB . 25666 1 574 . 1 1 66 66 LYS CG C 13 24.795 0.400 . 1 . . . . . 66 LYS CG . 25666 1 575 . 1 1 66 66 LYS CD C 13 28.630 0.400 . 1 . . . . . 66 LYS CD . 25666 1 576 . 1 1 66 66 LYS CE C 13 41.825 0.400 . 1 . . . . . 66 LYS CE . 25666 1 577 . 1 1 66 66 LYS N N 15 117.602 0.400 . 1 . . . . . 66 LYS N . 25666 1 578 . 1 1 67 67 GLU H H 1 7.476 0.020 . 1 . . . . . 67 GLU H . 25666 1 579 . 1 1 67 67 GLU HA H 1 3.542 0.020 . 1 . . . . . 67 GLU HA . 25666 1 580 . 1 1 67 67 GLU HB2 H 1 1.859 0.020 . 2 . . . . . 67 GLU HB2 . 25666 1 581 . 1 1 67 67 GLU HB3 H 1 1.857 0.020 . 2 . . . . . 67 GLU HB3 . 25666 1 582 . 1 1 67 67 GLU HG2 H 1 1.981 0.020 . 2 . . . . . 67 GLU HG2 . 25666 1 583 . 1 1 67 67 GLU HG3 H 1 2.022 0.020 . 2 . . . . . 67 GLU HG3 . 25666 1 584 . 1 1 67 67 GLU CA C 13 59.076 0.400 . 1 . . . . . 67 GLU CA . 25666 1 585 . 1 1 67 67 GLU CB C 13 30.255 0.400 . 1 . . . . . 67 GLU CB . 25666 1 586 . 1 1 67 67 GLU CG C 13 37.670 0.400 . 1 . . . . . 67 GLU CG . 25666 1 587 . 1 1 67 67 GLU N N 15 119.852 0.400 . 1 . . . . . 67 GLU N . 25666 1 588 . 1 1 68 68 ALA H H 1 7.862 0.020 . 1 . . . . . 68 ALA H . 25666 1 589 . 1 1 68 68 ALA HA H 1 3.516 0.020 . 1 . . . . . 68 ALA HA . 25666 1 590 . 1 1 68 68 ALA HB1 H 1 0.555 0.020 . 1 . . . . . 68 ALA HB1 . 25666 1 591 . 1 1 68 68 ALA HB2 H 1 0.555 0.020 . 1 . . . . . 68 ALA HB2 . 25666 1 592 . 1 1 68 68 ALA HB3 H 1 0.555 0.020 . 1 . . . . . 68 ALA HB3 . 25666 1 593 . 1 1 68 68 ALA CA C 13 55.420 0.400 . 1 . . . . . 68 ALA CA . 25666 1 594 . 1 1 68 68 ALA CB C 13 16.061 0.400 . 1 . . . . . 68 ALA CB . 25666 1 595 . 1 1 68 68 ALA N N 15 121.523 0.400 . 1 . . . . . 68 ALA N . 25666 1 596 . 1 1 69 69 GLU H H 1 8.160 0.020 . 1 . . . . . 69 GLU H . 25666 1 597 . 1 1 69 69 GLU HA H 1 3.842 0.020 . 1 . . . . . 69 GLU HA . 25666 1 598 . 1 1 69 69 GLU HB2 H 1 2.035 0.020 . 2 . . . . . 69 GLU HB2 . 25666 1 599 . 1 1 69 69 GLU HB3 H 1 1.953 0.020 . 2 . . . . . 69 GLU HB3 . 25666 1 600 . 1 1 69 69 GLU HG2 H 1 2.390 0.020 . 2 . . . . . 69 GLU HG2 . 25666 1 601 . 1 1 69 69 GLU HG3 H 1 2.131 0.020 . 2 . . . . . 69 GLU HG3 . 25666 1 602 . 1 1 69 69 GLU CA C 13 59.279 0.400 . 1 . . . . . 69 GLU CA . 25666 1 603 . 1 1 69 69 GLU CB C 13 29.471 0.400 . 1 . . . . . 69 GLU CB . 25666 1 604 . 1 1 69 69 GLU CG C 13 36.490 0.400 . 1 . . . . . 69 GLU CG . 25666 1 605 . 1 1 69 69 GLU N N 15 116.831 0.400 . 1 . . . . . 69 GLU N . 25666 1 606 . 1 1 70 70 LYS H H 1 7.543 0.020 . 1 . . . . . 70 LYS H . 25666 1 607 . 1 1 70 70 LYS HA H 1 4.002 0.020 . 1 . . . . . 70 LYS HA . 25666 1 608 . 1 1 70 70 LYS HB2 H 1 1.770 0.020 . 2 . . . . . 70 LYS HB2 . 25666 1 609 . 1 1 70 70 LYS HB3 H 1 1.616 0.020 . 2 . . . . . 70 LYS HB3 . 25666 1 610 . 1 1 70 70 LYS HG2 H 1 1.010 0.020 . 2 . . . . . 70 LYS HG2 . 25666 1 611 . 1 1 70 70 LYS HG3 H 1 1.372 0.020 . 2 . . . . . 70 LYS HG3 . 25666 1 612 . 1 1 70 70 LYS HD2 H 1 1.530 0.020 . 2 . . . . . 70 LYS HD2 . 25666 1 613 . 1 1 70 70 LYS HD3 H 1 1.451 0.020 . 2 . . . . . 70 LYS HD3 . 25666 1 614 . 1 1 70 70 LYS HE2 H 1 2.633 0.020 . 1 . . . . . 70 LYS HE2 . 25666 1 615 . 1 1 70 70 LYS HE3 H 1 2.633 0.020 . 1 . . . . . 70 LYS HE3 . 25666 1 616 . 1 1 70 70 LYS CA C 13 58.970 0.400 . 1 . . . . . 70 LYS CA . 25666 1 617 . 1 1 70 70 LYS CB C 13 31.816 0.400 . 1 . . . . . 70 LYS CB . 25666 1 618 . 1 1 70 70 LYS CG C 13 24.298 0.400 . 1 . . . . . 70 LYS CG . 25666 1 619 . 1 1 70 70 LYS CD C 13 29.243 0.400 . 1 . . . . . 70 LYS CD . 25666 1 620 . 1 1 70 70 LYS CE C 13 41.337 0.400 . 1 . . . . . 70 LYS CE . 25666 1 621 . 1 1 70 70 LYS N N 15 121.694 0.400 . 1 . . . . . 70 LYS N . 25666 1 622 . 1 1 71 71 PHE H H 1 8.424 0.020 . 1 . . . . . 71 PHE H . 25666 1 623 . 1 1 71 71 PHE HA H 1 4.615 0.020 . 1 . . . . . 71 PHE HA . 25666 1 624 . 1 1 71 71 PHE HB2 H 1 3.009 0.020 . 2 . . . . . 71 PHE HB2 . 25666 1 625 . 1 1 71 71 PHE HB3 H 1 3.012 0.020 . 2 . . . . . 71 PHE HB3 . 25666 1 626 . 1 1 71 71 PHE HD2 H 1 6.993 0.020 . 1 . . . . . 71 PHE HD2 . 25666 1 627 . 1 1 71 71 PHE HE2 H 1 7.344 0.020 . 1 . . . . . 71 PHE HE2 . 25666 1 628 . 1 1 71 71 PHE HZ H 1 7.223 0.020 . 1 . . . . . 71 PHE HZ . 25666 1 629 . 1 1 71 71 PHE CA C 13 57.930 0.400 . 1 . . . . . 71 PHE CA . 25666 1 630 . 1 1 71 71 PHE CB C 13 37.135 0.400 . 1 . . . . . 71 PHE CB . 25666 1 631 . 1 1 71 71 PHE CD2 C 13 130.254 0.400 . 1 . . . . . 71 PHE CD2 . 25666 1 632 . 1 1 71 71 PHE CE2 C 13 131.186 0.400 . 1 . . . . . 71 PHE CE2 . 25666 1 633 . 1 1 71 71 PHE CZ C 13 129.346 0.400 . 1 . . . . . 71 PHE CZ . 25666 1 634 . 1 1 71 71 PHE N N 15 118.309 0.400 . 1 . . . . . 71 PHE N . 25666 1 635 . 1 1 72 72 ALA H H 1 8.785 0.020 . 1 . . . . . 72 ALA H . 25666 1 636 . 1 1 72 72 ALA HA H 1 3.950 0.020 . 1 . . . . . 72 ALA HA . 25666 1 637 . 1 1 72 72 ALA HB1 H 1 1.461 0.020 . 1 . . . . . 72 ALA HB1 . 25666 1 638 . 1 1 72 72 ALA HB2 H 1 1.461 0.020 . 1 . . . . . 72 ALA HB2 . 25666 1 639 . 1 1 72 72 ALA HB3 H 1 1.461 0.020 . 1 . . . . . 72 ALA HB3 . 25666 1 640 . 1 1 72 72 ALA CA C 13 55.395 0.400 . 1 . . . . . 72 ALA CA . 25666 1 641 . 1 1 72 72 ALA CB C 13 18.082 0.400 . 1 . . . . . 72 ALA CB . 25666 1 642 . 1 1 72 72 ALA N N 15 122.166 0.400 . 1 . . . . . 72 ALA N . 25666 1 643 . 1 1 73 73 ALA H H 1 7.452 0.020 . 1 . . . . . 73 ALA H . 25666 1 644 . 1 1 73 73 ALA HA H 1 4.065 0.020 . 1 . . . . . 73 ALA HA . 25666 1 645 . 1 1 73 73 ALA HB1 H 1 1.534 0.020 . 1 . . . . . 73 ALA HB1 . 25666 1 646 . 1 1 73 73 ALA HB2 H 1 1.534 0.020 . 1 . . . . . 73 ALA HB2 . 25666 1 647 . 1 1 73 73 ALA HB3 H 1 1.534 0.020 . 1 . . . . . 73 ALA HB3 . 25666 1 648 . 1 1 73 73 ALA CA C 13 55.266 0.400 . 1 . . . . . 73 ALA CA . 25666 1 649 . 1 1 73 73 ALA CB C 13 17.686 0.400 . 1 . . . . . 73 ALA CB . 25666 1 650 . 1 1 73 73 ALA N N 15 117.666 0.400 . 1 . . . . . 73 ALA N . 25666 1 651 . 1 1 74 74 ILE H H 1 7.335 0.020 . 1 . . . . . 74 ILE H . 25666 1 652 . 1 1 74 74 ILE HA H 1 3.765 0.020 . 1 . . . . . 74 ILE HA . 25666 1 653 . 1 1 74 74 ILE HB H 1 1.970 0.020 . 1 . . . . . 74 ILE HB . 25666 1 654 . 1 1 74 74 ILE HG12 H 1 1.882 0.020 . 2 . . . . . 74 ILE HG12 . 25666 1 655 . 1 1 74 74 ILE HG13 H 1 1.171 0.020 . 2 . . . . . 74 ILE HG13 . 25666 1 656 . 1 1 74 74 ILE HG21 H 1 0.887 0.020 . 1 . . . . . 74 ILE HG21 . 25666 1 657 . 1 1 74 74 ILE HG22 H 1 0.887 0.020 . 1 . . . . . 74 ILE HG22 . 25666 1 658 . 1 1 74 74 ILE HG23 H 1 0.887 0.020 . 1 . . . . . 74 ILE HG23 . 25666 1 659 . 1 1 74 74 ILE HD11 H 1 0.902 0.020 . 1 . . . . . 74 ILE HD11 . 25666 1 660 . 1 1 74 74 ILE HD12 H 1 0.902 0.020 . 1 . . . . . 74 ILE HD12 . 25666 1 661 . 1 1 74 74 ILE HD13 H 1 0.902 0.020 . 1 . . . . . 74 ILE HD13 . 25666 1 662 . 1 1 74 74 ILE CA C 13 64.656 0.400 . 1 . . . . . 74 ILE CA . 25666 1 663 . 1 1 74 74 ILE CB C 13 38.585 0.400 . 1 . . . . . 74 ILE CB . 25666 1 664 . 1 1 74 74 ILE CG1 C 13 28.371 0.400 . 1 . . . . . 74 ILE CG1 . 25666 1 665 . 1 1 74 74 ILE CG2 C 13 17.228 0.400 . 1 . . . . . 74 ILE CG2 . 25666 1 666 . 1 1 74 74 ILE CD1 C 13 13.687 0.400 . 1 . . . . . 74 ILE CD1 . 25666 1 667 . 1 1 74 74 ILE N N 15 117.731 0.400 . 1 . . . . . 74 ILE N . 25666 1 668 . 1 1 75 75 LEU H H 1 7.927 0.020 . 1 . . . . . 75 LEU H . 25666 1 669 . 1 1 75 75 LEU HA H 1 3.960 0.020 . 1 . . . . . 75 LEU HA . 25666 1 670 . 1 1 75 75 LEU HB2 H 1 2.027 0.020 . 2 . . . . . 75 LEU HB2 . 25666 1 671 . 1 1 75 75 LEU HB3 H 1 1.289 0.020 . 2 . . . . . 75 LEU HB3 . 25666 1 672 . 1 1 75 75 LEU HG H 1 1.691 0.020 . 1 . . . . . 75 LEU HG . 25666 1 673 . 1 1 75 75 LEU HD11 H 1 0.763 0.020 . 2 . . . . . 75 LEU HD11 . 25666 1 674 . 1 1 75 75 LEU HD12 H 1 0.763 0.020 . 2 . . . . . 75 LEU HD12 . 25666 1 675 . 1 1 75 75 LEU HD13 H 1 0.763 0.020 . 2 . . . . . 75 LEU HD13 . 25666 1 676 . 1 1 75 75 LEU HD21 H 1 0.808 0.020 . 2 . . . . . 75 LEU HD21 . 25666 1 677 . 1 1 75 75 LEU HD22 H 1 0.808 0.020 . 2 . . . . . 75 LEU HD22 . 25666 1 678 . 1 1 75 75 LEU HD23 H 1 0.808 0.020 . 2 . . . . . 75 LEU HD23 . 25666 1 679 . 1 1 75 75 LEU CA C 13 57.265 0.400 . 1 . . . . . 75 LEU CA . 25666 1 680 . 1 1 75 75 LEU CB C 13 42.196 0.400 . 1 . . . . . 75 LEU CB . 25666 1 681 . 1 1 75 75 LEU CG C 13 26.845 0.400 . 1 . . . . . 75 LEU CG . 25666 1 682 . 1 1 75 75 LEU CD1 C 13 22.902 0.400 . 1 . . . . . 75 LEU CD1 . 25666 1 683 . 1 1 75 75 LEU CD2 C 13 24.307 0.400 . 1 . . . . . 75 LEU CD2 . 25666 1 684 . 1 1 75 75 LEU N N 15 120.688 0.400 . 1 . . . . . 75 LEU N . 25666 1 685 . 1 1 76 76 ILE H H 1 9.045 0.020 . 1 . . . . . 76 ILE H . 25666 1 686 . 1 1 76 76 ILE HA H 1 3.575 0.020 . 1 . . . . . 76 ILE HA . 25666 1 687 . 1 1 76 76 ILE HB H 1 1.812 0.020 . 1 . . . . . 76 ILE HB . 25666 1 688 . 1 1 76 76 ILE HG12 H 1 1.812 0.020 . 2 . . . . . 76 ILE HG12 . 25666 1 689 . 1 1 76 76 ILE HG13 H 1 0.912 0.020 . 2 . . . . . 76 ILE HG13 . 25666 1 690 . 1 1 76 76 ILE HG21 H 1 0.937 0.020 . 1 . . . . . 76 ILE HG21 . 25666 1 691 . 1 1 76 76 ILE HG22 H 1 0.937 0.020 . 1 . . . . . 76 ILE HG22 . 25666 1 692 . 1 1 76 76 ILE HG23 H 1 0.937 0.020 . 1 . . . . . 76 ILE HG23 . 25666 1 693 . 1 1 76 76 ILE HD11 H 1 0.818 0.020 . 1 . . . . . 76 ILE HD11 . 25666 1 694 . 1 1 76 76 ILE HD12 H 1 0.818 0.020 . 1 . . . . . 76 ILE HD12 . 25666 1 695 . 1 1 76 76 ILE HD13 H 1 0.818 0.020 . 1 . . . . . 76 ILE HD13 . 25666 1 696 . 1 1 76 76 ILE CA C 13 66.421 0.400 . 1 . . . . . 76 ILE CA . 25666 1 697 . 1 1 76 76 ILE CB C 13 38.118 0.400 . 1 . . . . . 76 ILE CB . 25666 1 698 . 1 1 76 76 ILE CG1 C 13 29.954 0.400 . 1 . . . . . 76 ILE CG1 . 25666 1 699 . 1 1 76 76 ILE CG2 C 13 16.710 0.400 . 1 . . . . . 76 ILE CG2 . 25666 1 700 . 1 1 76 76 ILE CD1 C 13 13.600 0.400 . 1 . . . . . 76 ILE CD1 . 25666 1 701 . 1 1 76 76 ILE N N 15 120.495 0.400 . 1 . . . . . 76 ILE N . 25666 1 702 . 1 1 77 77 LYS H H 1 7.173 0.020 . 1 . . . . . 77 LYS H . 25666 1 703 . 1 1 77 77 LYS HA H 1 4.110 0.020 . 1 . . . . . 77 LYS HA . 25666 1 704 . 1 1 77 77 LYS HB2 H 1 1.934 0.020 . 2 . . . . . 77 LYS HB2 . 25666 1 705 . 1 1 77 77 LYS HB3 H 1 2.033 0.020 . 2 . . . . . 77 LYS HB3 . 25666 1 706 . 1 1 77 77 LYS HG2 H 1 1.588 0.020 . 2 . . . . . 77 LYS HG2 . 25666 1 707 . 1 1 77 77 LYS HG3 H 1 1.441 0.020 . 2 . . . . . 77 LYS HG3 . 25666 1 708 . 1 1 77 77 LYS HD2 H 1 1.717 0.020 . 1 . . . . . 77 LYS HD2 . 25666 1 709 . 1 1 77 77 LYS HD3 H 1 1.718 0.020 . 1 . . . . . 77 LYS HD3 . 25666 1 710 . 1 1 77 77 LYS HE2 H 1 2.990 0.020 . 1 . . . . . 77 LYS HE2 . 25666 1 711 . 1 1 77 77 LYS HE3 H 1 2.990 0.020 . 1 . . . . . 77 LYS HE3 . 25666 1 712 . 1 1 77 77 LYS CA C 13 59.529 0.400 . 1 . . . . . 77 LYS CA . 25666 1 713 . 1 1 77 77 LYS CB C 13 32.045 0.400 . 1 . . . . . 77 LYS CB . 25666 1 714 . 1 1 77 77 LYS CG C 13 24.968 0.400 . 1 . . . . . 77 LYS CG . 25666 1 715 . 1 1 77 77 LYS CD C 13 28.975 0.400 . 1 . . . . . 77 LYS CD . 25666 1 716 . 1 1 77 77 LYS CE C 13 42.058 0.400 . 1 . . . . . 77 LYS CE . 25666 1 717 . 1 1 77 77 LYS N N 15 118.952 0.400 . 1 . . . . . 77 LYS N . 25666 1 718 . 1 1 78 78 VAL H H 1 7.762 0.020 . 1 . . . . . 78 VAL H . 25666 1 719 . 1 1 78 78 VAL HA H 1 3.638 0.020 . 1 . . . . . 78 VAL HA . 25666 1 720 . 1 1 78 78 VAL HB H 1 2.201 0.020 . 1 . . . . . 78 VAL HB . 25666 1 721 . 1 1 78 78 VAL HG11 H 1 1.019 0.020 . 2 . . . . . 78 VAL HG11 . 25666 1 722 . 1 1 78 78 VAL HG12 H 1 1.019 0.020 . 2 . . . . . 78 VAL HG12 . 25666 1 723 . 1 1 78 78 VAL HG13 H 1 1.019 0.020 . 2 . . . . . 78 VAL HG13 . 25666 1 724 . 1 1 78 78 VAL HG21 H 1 0.612 0.020 . 2 . . . . . 78 VAL HG21 . 25666 1 725 . 1 1 78 78 VAL HG22 H 1 0.612 0.020 . 2 . . . . . 78 VAL HG22 . 25666 1 726 . 1 1 78 78 VAL HG23 H 1 0.612 0.020 . 2 . . . . . 78 VAL HG23 . 25666 1 727 . 1 1 78 78 VAL CA C 13 66.468 0.400 . 1 . . . . . 78 VAL CA . 25666 1 728 . 1 1 78 78 VAL CB C 13 31.365 0.400 . 1 . . . . . 78 VAL CB . 25666 1 729 . 1 1 78 78 VAL CG1 C 13 22.736 0.400 . 1 . . . . . 78 VAL CG1 . 25666 1 730 . 1 1 78 78 VAL CG2 C 13 20.301 0.400 . 1 . . . . . 78 VAL CG2 . 25666 1 731 . 1 1 78 78 VAL N N 15 120.282 0.400 . 1 . . . . . 78 VAL N . 25666 1 732 . 1 1 79 79 TYR H H 1 8.509 0.020 . 1 . . . . . 79 TYR H . 25666 1 733 . 1 1 79 79 TYR HA H 1 4.149 0.020 . 1 . . . . . 79 TYR HA . 25666 1 734 . 1 1 79 79 TYR HB2 H 1 3.050 0.020 . 2 . . . . . 79 TYR HB2 . 25666 1 735 . 1 1 79 79 TYR HB3 H 1 2.894 0.020 . 2 . . . . . 79 TYR HB3 . 25666 1 736 . 1 1 79 79 TYR HD2 H 1 6.789 0.020 . 1 . . . . . 79 TYR HD2 . 25666 1 737 . 1 1 79 79 TYR HE2 H 1 6.356 0.020 . 1 . . . . . 79 TYR HE2 . 25666 1 738 . 1 1 79 79 TYR CA C 13 62.203 0.400 . 1 . . . . . 79 TYR CA . 25666 1 739 . 1 1 79 79 TYR CB C 13 37.042 0.400 . 1 . . . . . 79 TYR CB . 25666 1 740 . 1 1 79 79 TYR CD2 C 13 131.365 0.400 . 1 . . . . . 79 TYR CD2 . 25666 1 741 . 1 1 79 79 TYR CE2 C 13 117.175 0.400 . 1 . . . . . 79 TYR CE2 . 25666 1 742 . 1 1 79 79 TYR N N 15 118.151 0.400 . 1 . . . . . 79 TYR N . 25666 1 743 . 1 1 80 80 ALA H H 1 8.879 0.020 . 1 . . . . . 80 ALA H . 25666 1 744 . 1 1 80 80 ALA HA H 1 4.360 0.020 . 1 . . . . . 80 ALA HA . 25666 1 745 . 1 1 80 80 ALA HB1 H 1 1.570 0.020 . 1 . . . . . 80 ALA HB1 . 25666 1 746 . 1 1 80 80 ALA HB2 H 1 1.570 0.020 . 1 . . . . . 80 ALA HB2 . 25666 1 747 . 1 1 80 80 ALA HB3 H 1 1.570 0.020 . 1 . . . . . 80 ALA HB3 . 25666 1 748 . 1 1 80 80 ALA CA C 13 55.201 0.400 . 1 . . . . . 80 ALA CA . 25666 1 749 . 1 1 80 80 ALA CB C 13 17.758 0.400 . 1 . . . . . 80 ALA CB . 25666 1 750 . 1 1 80 80 ALA N N 15 123.516 0.400 . 1 . . . . . 80 ALA N . 25666 1 751 . 1 1 81 81 GLU H H 1 8.206 0.020 . 1 . . . . . 81 GLU H . 25666 1 752 . 1 1 81 81 GLU HA H 1 4.041 0.020 . 1 . . . . . 81 GLU HA . 25666 1 753 . 1 1 81 81 GLU HB2 H 1 2.088 0.020 . 2 . . . . . 81 GLU HB2 . 25666 1 754 . 1 1 81 81 GLU HB3 H 1 2.312 0.020 . 2 . . . . . 81 GLU HB3 . 25666 1 755 . 1 1 81 81 GLU HG2 H 1 2.541 0.020 . 2 . . . . . 81 GLU HG2 . 25666 1 756 . 1 1 81 81 GLU HG3 H 1 2.229 0.020 . 2 . . . . . 81 GLU HG3 . 25666 1 757 . 1 1 81 81 GLU CA C 13 58.849 0.400 . 1 . . . . . 81 GLU CA . 25666 1 758 . 1 1 81 81 GLU CB C 13 29.083 0.400 . 1 . . . . . 81 GLU CB . 25666 1 759 . 1 1 81 81 GLU CG C 13 36.231 0.400 . 1 . . . . . 81 GLU CG . 25666 1 760 . 1 1 81 81 GLU N N 15 121.073 0.400 . 1 . . . . . 81 GLU N . 25666 1 761 . 1 1 82 82 LEU H H 1 7.661 0.020 . 1 . . . . . 82 LEU H . 25666 1 762 . 1 1 82 82 LEU HA H 1 4.228 0.020 . 1 . . . . . 82 LEU HA . 25666 1 763 . 1 1 82 82 LEU HB2 H 1 1.995 0.020 . 1 . . . . . 82 LEU HB2 . 25666 1 764 . 1 1 82 82 LEU HB3 H 1 1.994 0.020 . 1 . . . . . 82 LEU HB3 . 25666 1 765 . 1 1 82 82 LEU HG H 1 1.894 0.020 . 1 . . . . . 82 LEU HG . 25666 1 766 . 1 1 82 82 LEU HD11 H 1 0.907 0.020 . 2 . . . . . 82 LEU HD11 . 25666 1 767 . 1 1 82 82 LEU HD12 H 1 0.907 0.020 . 2 . . . . . 82 LEU HD12 . 25666 1 768 . 1 1 82 82 LEU HD13 H 1 0.907 0.020 . 2 . . . . . 82 LEU HD13 . 25666 1 769 . 1 1 82 82 LEU HD21 H 1 0.725 0.020 . 2 . . . . . 82 LEU HD21 . 25666 1 770 . 1 1 82 82 LEU HD22 H 1 0.725 0.020 . 2 . . . . . 82 LEU HD22 . 25666 1 771 . 1 1 82 82 LEU HD23 H 1 0.725 0.020 . 2 . . . . . 82 LEU HD23 . 25666 1 772 . 1 1 82 82 LEU CA C 13 54.884 0.400 . 1 . . . . . 82 LEU CA . 25666 1 773 . 1 1 82 82 LEU CB C 13 42.832 0.400 . 1 . . . . . 82 LEU CB . 25666 1 774 . 1 1 82 82 LEU CG C 13 26.039 0.400 . 1 . . . . . 82 LEU CG . 25666 1 775 . 1 1 82 82 LEU CD1 C 13 22.954 0.400 . 1 . . . . . 82 LEU CD1 . 25666 1 776 . 1 1 82 82 LEU CD2 C 13 26.070 0.400 . 1 . . . . . 82 LEU CD2 . 25666 1 777 . 1 1 82 82 LEU N N 15 118.373 0.400 . 1 . . . . . 82 LEU N . 25666 1 778 . 1 1 83 83 GLY H H 1 7.690 0.020 . 1 . . . . . 83 GLY H . 25666 1 779 . 1 1 83 83 GLY HA2 H 1 3.698 0.020 . 2 . . . . . 83 GLY HA2 . 25666 1 780 . 1 1 83 83 GLY HA3 H 1 4.127 0.020 . 2 . . . . . 83 GLY HA3 . 25666 1 781 . 1 1 83 83 GLY CA C 13 44.844 0.400 . 1 . . . . . 83 GLY CA . 25666 1 782 . 1 1 83 83 GLY N N 15 105.985 0.400 . 1 . . . . . 83 GLY N . 25666 1 783 . 1 1 84 84 TYR H H 1 7.994 0.020 . 1 . . . . . 84 TYR H . 25666 1 784 . 1 1 84 84 TYR HA H 1 4.718 0.020 . 1 . . . . . 84 TYR HA . 25666 1 785 . 1 1 84 84 TYR HB2 H 1 2.911 0.020 . 2 . . . . . 84 TYR HB2 . 25666 1 786 . 1 1 84 84 TYR HB3 H 1 2.722 0.020 . 2 . . . . . 84 TYR HB3 . 25666 1 787 . 1 1 84 84 TYR HD2 H 1 6.980 0.020 . 1 . . . . . 84 TYR HD2 . 25666 1 788 . 1 1 84 84 TYR HE2 H 1 6.391 0.020 . 1 . . . . . 84 TYR HE2 . 25666 1 789 . 1 1 84 84 TYR CA C 13 54.546 0.400 . 1 . . . . . 84 TYR CA . 25666 1 790 . 1 1 84 84 TYR CB C 13 41.367 0.400 . 1 . . . . . 84 TYR CB . 25666 1 791 . 1 1 84 84 TYR CD2 C 13 133.594 0.400 . 1 . . . . . 84 TYR CD2 . 25666 1 792 . 1 1 84 84 TYR CE2 C 13 117.217 0.400 . 1 . . . . . 84 TYR CE2 . 25666 1 793 . 1 1 84 84 TYR N N 15 120.401 0.400 . 1 . . . . . 84 TYR N . 25666 1 794 . 1 1 85 85 ASN HA H 1 4.886 0.020 . 1 . . . . . 85 ASN HA . 25666 1 795 . 1 1 85 85 ASN HB2 H 1 2.878 0.020 . 1 . . . . . 85 ASN HB2 . 25666 1 796 . 1 1 85 85 ASN HB3 H 1 2.878 0.020 . 1 . . . . . 85 ASN HB3 . 25666 1 797 . 1 1 85 85 ASN HD21 H 1 6.955 0.020 . 2 . . . . . 85 ASN HD21 . 25666 1 798 . 1 1 85 85 ASN HD22 H 1 7.578 0.020 . 2 . . . . . 85 ASN HD22 . 25666 1 799 . 1 1 85 85 ASN CA C 13 52.212 0.400 . 1 . . . . . 85 ASN CA . 25666 1 800 . 1 1 85 85 ASN CB C 13 40.728 0.400 . 1 . . . . . 85 ASN CB . 25666 1 801 . 1 1 85 85 ASN ND2 N 15 112.862 0.400 . 1 . . . . . 85 ASN ND2 . 25666 1 802 . 1 1 86 86 ASP HA H 1 4.611 0.020 . 1 . . . . . 86 ASP HA . 25666 1 803 . 1 1 86 86 ASP HB2 H 1 2.525 0.020 . 2 . . . . . 86 ASP HB2 . 25666 1 804 . 1 1 86 86 ASP HB3 H 1 2.891 0.020 . 2 . . . . . 86 ASP HB3 . 25666 1 805 . 1 1 86 86 ASP CA C 13 53.306 0.400 . 1 . . . . . 86 ASP CA . 25666 1 806 . 1 1 86 86 ASP CB C 13 40.728 0.400 . 1 . . . . . 86 ASP CB . 25666 1 807 . 1 1 87 87 ILE H H 1 8.106 0.020 . 1 . . . . . 87 ILE H . 25666 1 808 . 1 1 87 87 ILE HA H 1 4.903 0.020 . 1 . . . . . 87 ILE HA . 25666 1 809 . 1 1 87 87 ILE HB H 1 1.748 0.020 . 1 . . . . . 87 ILE HB . 25666 1 810 . 1 1 87 87 ILE HG12 H 1 1.499 0.020 . 1 . . . . . 87 ILE HG12 . 25666 1 811 . 1 1 87 87 ILE HG13 H 1 1.500 0.020 . 1 . . . . . 87 ILE HG13 . 25666 1 812 . 1 1 87 87 ILE HG21 H 1 0.778 0.020 . 1 . . . . . 87 ILE HG21 . 25666 1 813 . 1 1 87 87 ILE HG22 H 1 0.778 0.020 . 1 . . . . . 87 ILE HG22 . 25666 1 814 . 1 1 87 87 ILE HG23 H 1 0.778 0.020 . 1 . . . . . 87 ILE HG23 . 25666 1 815 . 1 1 87 87 ILE HD11 H 1 0.882 0.020 . 1 . . . . . 87 ILE HD11 . 25666 1 816 . 1 1 87 87 ILE HD12 H 1 0.882 0.020 . 1 . . . . . 87 ILE HD12 . 25666 1 817 . 1 1 87 87 ILE HD13 H 1 0.882 0.020 . 1 . . . . . 87 ILE HD13 . 25666 1 818 . 1 1 87 87 ILE CA C 13 60.225 0.400 . 1 . . . . . 87 ILE CA . 25666 1 819 . 1 1 87 87 ILE CB C 13 39.343 0.400 . 1 . . . . . 87 ILE CB . 25666 1 820 . 1 1 87 87 ILE CG1 C 13 27.951 0.400 . 1 . . . . . 87 ILE CG1 . 25666 1 821 . 1 1 87 87 ILE CG2 C 13 18.351 0.400 . 1 . . . . . 87 ILE CG2 . 25666 1 822 . 1 1 87 87 ILE CD1 C 13 13.198 0.400 . 1 . . . . . 87 ILE CD1 . 25666 1 823 . 1 1 87 87 ILE N N 15 121.581 0.400 . 1 . . . . . 87 ILE N . 25666 1 824 . 1 1 88 88 ASN H H 1 8.976 0.020 . 1 . . . . . 88 ASN H . 25666 1 825 . 1 1 88 88 ASN HA H 1 5.150 0.020 . 1 . . . . . 88 ASN HA . 25666 1 826 . 1 1 88 88 ASN HB2 H 1 2.681 0.020 . 2 . . . . . 88 ASN HB2 . 25666 1 827 . 1 1 88 88 ASN HB3 H 1 2.684 0.020 . 2 . . . . . 88 ASN HB3 . 25666 1 828 . 1 1 88 88 ASN HD21 H 1 7.516 0.020 . 2 . . . . . 88 ASN HD21 . 25666 1 829 . 1 1 88 88 ASN HD22 H 1 6.831 0.020 . 2 . . . . . 88 ASN HD22 . 25666 1 830 . 1 1 88 88 ASN CA C 13 52.088 0.400 . 1 . . . . . 88 ASN CA . 25666 1 831 . 1 1 88 88 ASN CB C 13 42.620 0.400 . 1 . . . . . 88 ASN CB . 25666 1 832 . 1 1 88 88 ASN N N 15 126.423 0.400 . 1 . . . . . 88 ASN N . 25666 1 833 . 1 1 88 88 ASN ND2 N 15 114.593 0.400 . 1 . . . . . 88 ASN ND2 . 25666 1 834 . 1 1 89 89 VAL H H 1 8.586 0.020 . 1 . . . . . 89 VAL H . 25666 1 835 . 1 1 89 89 VAL HA H 1 5.054 0.020 . 1 . . . . . 89 VAL HA . 25666 1 836 . 1 1 89 89 VAL HB H 1 1.981 0.020 . 1 . . . . . 89 VAL HB . 25666 1 837 . 1 1 89 89 VAL HG11 H 1 0.957 0.020 . 2 . . . . . 89 VAL HG11 . 25666 1 838 . 1 1 89 89 VAL HG12 H 1 0.957 0.020 . 2 . . . . . 89 VAL HG12 . 25666 1 839 . 1 1 89 89 VAL HG13 H 1 0.957 0.020 . 2 . . . . . 89 VAL HG13 . 25666 1 840 . 1 1 89 89 VAL HG21 H 1 0.808 0.020 . 2 . . . . . 89 VAL HG21 . 25666 1 841 . 1 1 89 89 VAL HG22 H 1 0.808 0.020 . 2 . . . . . 89 VAL HG22 . 25666 1 842 . 1 1 89 89 VAL HG23 H 1 0.808 0.020 . 2 . . . . . 89 VAL HG23 . 25666 1 843 . 1 1 89 89 VAL CA C 13 60.941 0.400 . 1 . . . . . 89 VAL CA . 25666 1 844 . 1 1 89 89 VAL CB C 13 34.066 0.400 . 1 . . . . . 89 VAL CB . 25666 1 845 . 1 1 89 89 VAL CG1 C 13 21.251 0.400 . 1 . . . . . 89 VAL CG1 . 25666 1 846 . 1 1 89 89 VAL CG2 C 13 20.717 0.400 . 1 . . . . . 89 VAL CG2 . 25666 1 847 . 1 1 89 89 VAL N N 15 125.657 0.400 . 1 . . . . . 89 VAL N . 25666 1 848 . 1 1 90 90 THR H H 1 9.118 0.020 . 1 . . . . . 90 THR H . 25666 1 849 . 1 1 90 90 THR HA H 1 4.743 0.020 . 1 . . . . . 90 THR HA . 25666 1 850 . 1 1 90 90 THR HB H 1 4.056 0.020 . 1 . . . . . 90 THR HB . 25666 1 851 . 1 1 90 90 THR HG21 H 1 1.167 0.020 . 1 . . . . . 90 THR HG21 . 25666 1 852 . 1 1 90 90 THR HG22 H 1 1.167 0.020 . 1 . . . . . 90 THR HG22 . 25666 1 853 . 1 1 90 90 THR HG23 H 1 1.167 0.020 . 1 . . . . . 90 THR HG23 . 25666 1 854 . 1 1 90 90 THR CA C 13 60.542 0.400 . 1 . . . . . 90 THR CA . 25666 1 855 . 1 1 90 90 THR CB C 13 71.824 0.400 . 1 . . . . . 90 THR CB . 25666 1 856 . 1 1 90 90 THR CG2 C 13 21.413 0.400 . 1 . . . . . 90 THR CG2 . 25666 1 857 . 1 1 90 90 THR N N 15 121.095 0.400 . 1 . . . . . 90 THR N . 25666 1 858 . 1 1 91 91 TRP HA H 1 5.538 0.020 . 1 . . . . . 91 TRP HA . 25666 1 859 . 1 1 91 91 TRP HB2 H 1 2.956 0.020 . 2 . . . . . 91 TRP HB2 . 25666 1 860 . 1 1 91 91 TRP HB3 H 1 3.369 0.020 . 2 . . . . . 91 TRP HB3 . 25666 1 861 . 1 1 91 91 TRP HD1 H 1 7.221 0.020 . 1 . . . . . 91 TRP HD1 . 25666 1 862 . 1 1 91 91 TRP HE1 H 1 10.381 0.020 . 1 . . . . . 91 TRP HE1 . 25666 1 863 . 1 1 91 91 TRP HE3 H 1 7.611 0.020 . 1 . . . . . 91 TRP HE3 . 25666 1 864 . 1 1 91 91 TRP HZ2 H 1 6.987 0.020 . 1 . . . . . 91 TRP HZ2 . 25666 1 865 . 1 1 91 91 TRP HZ3 H 1 7.109 0.020 . 1 . . . . . 91 TRP HZ3 . 25666 1 866 . 1 1 91 91 TRP HH2 H 1 7.130 0.020 . 1 . . . . . 91 TRP HH2 . 25666 1 867 . 1 1 91 91 TRP CA C 13 56.040 0.400 . 1 . . . . . 91 TRP CA . 25666 1 868 . 1 1 91 91 TRP CB C 13 30.884 0.400 . 1 . . . . . 91 TRP CB . 25666 1 869 . 1 1 91 91 TRP CD1 C 13 126.040 0.400 . 1 . . . . . 91 TRP CD1 . 25666 1 870 . 1 1 91 91 TRP CE3 C 13 121.156 0.400 . 1 . . . . . 91 TRP CE3 . 25666 1 871 . 1 1 91 91 TRP CZ2 C 13 114.190 0.400 . 1 . . . . . 91 TRP CZ2 . 25666 1 872 . 1 1 91 91 TRP CZ3 C 13 122.032 0.400 . 1 . . . . . 91 TRP CZ3 . 25666 1 873 . 1 1 91 91 TRP CH2 C 13 124.437 0.400 . 1 . . . . . 91 TRP CH2 . 25666 1 874 . 1 1 91 91 TRP NE1 N 15 130.542 0.400 . 1 . . . . . 91 TRP NE1 . 25666 1 875 . 1 1 92 92 ASP H H 1 8.119 0.020 . 1 . . . . . 92 ASP H . 25666 1 876 . 1 1 92 92 ASP HA H 1 4.602 0.020 . 1 . . . . . 92 ASP HA . 25666 1 877 . 1 1 92 92 ASP HB2 H 1 2.521 0.020 . 2 . . . . . 92 ASP HB2 . 25666 1 878 . 1 1 92 92 ASP HB3 H 1 2.933 0.020 . 2 . . . . . 92 ASP HB3 . 25666 1 879 . 1 1 92 92 ASP CA C 13 52.759 0.400 . 1 . . . . . 92 ASP CA . 25666 1 880 . 1 1 92 92 ASP CB C 13 41.305 0.400 . 1 . . . . . 92 ASP CB . 25666 1 881 . 1 1 92 92 ASP N N 15 126.839 0.400 . 1 . . . . . 92 ASP N . 25666 1 882 . 1 1 93 93 GLY HA2 H 1 2.541 0.020 . 2 . . . . . 93 GLY HA2 . 25666 1 883 . 1 1 93 93 GLY HA3 H 1 3.974 0.020 . 2 . . . . . 93 GLY HA3 . 25666 1 884 . 1 1 93 93 GLY CA C 13 45.415 0.400 . 1 . . . . . 93 GLY CA . 25666 1 885 . 1 1 94 94 ASP H H 1 8.409 0.020 . 1 . . . . . 94 ASP H . 25666 1 886 . 1 1 94 94 ASP HA H 1 4.978 0.020 . 1 . . . . . 94 ASP HA . 25666 1 887 . 1 1 94 94 ASP HB2 H 1 2.745 0.020 . 2 . . . . . 94 ASP HB2 . 25666 1 888 . 1 1 94 94 ASP HB3 H 1 2.570 0.020 . 2 . . . . . 94 ASP HB3 . 25666 1 889 . 1 1 94 94 ASP CA C 13 55.559 0.400 . 1 . . . . . 94 ASP CA . 25666 1 890 . 1 1 94 94 ASP CB C 13 43.317 0.400 . 1 . . . . . 94 ASP CB . 25666 1 891 . 1 1 94 94 ASP N N 15 121.117 0.400 . 1 . . . . . 94 ASP N . 25666 1 892 . 1 1 95 95 THR H H 1 9.043 0.020 . 1 . . . . . 95 THR H . 25666 1 893 . 1 1 95 95 THR HA H 1 5.035 0.020 . 1 . . . . . 95 THR HA . 25666 1 894 . 1 1 95 95 THR HB H 1 4.014 0.020 . 1 . . . . . 95 THR HB . 25666 1 895 . 1 1 95 95 THR HG21 H 1 1.104 0.020 . 1 . . . . . 95 THR HG21 . 25666 1 896 . 1 1 95 95 THR HG22 H 1 1.104 0.020 . 1 . . . . . 95 THR HG22 . 25666 1 897 . 1 1 95 95 THR HG23 H 1 1.104 0.020 . 1 . . . . . 95 THR HG23 . 25666 1 898 . 1 1 95 95 THR CA C 13 61.675 0.400 . 1 . . . . . 95 THR CA . 25666 1 899 . 1 1 95 95 THR CB C 13 71.986 0.400 . 1 . . . . . 95 THR CB . 25666 1 900 . 1 1 95 95 THR CG2 C 13 22.033 0.400 . 1 . . . . . 95 THR CG2 . 25666 1 901 . 1 1 95 95 THR N N 15 115.609 0.400 . 1 . . . . . 95 THR N . 25666 1 902 . 1 1 96 96 VAL H H 1 9.318 0.020 . 1 . . . . . 96 VAL H . 25666 1 903 . 1 1 96 96 VAL HA H 1 5.354 0.020 . 1 . . . . . 96 VAL HA . 25666 1 904 . 1 1 96 96 VAL HB H 1 1.601 0.020 . 1 . . . . . 96 VAL HB . 25666 1 905 . 1 1 96 96 VAL HG11 H 1 0.792 0.020 . 2 . . . . . 96 VAL HG11 . 25666 1 906 . 1 1 96 96 VAL HG12 H 1 0.792 0.020 . 2 . . . . . 96 VAL HG12 . 25666 1 907 . 1 1 96 96 VAL HG13 H 1 0.792 0.020 . 2 . . . . . 96 VAL HG13 . 25666 1 908 . 1 1 96 96 VAL HG21 H 1 1.115 0.020 . 2 . . . . . 96 VAL HG21 . 25666 1 909 . 1 1 96 96 VAL HG22 H 1 1.115 0.020 . 2 . . . . . 96 VAL HG22 . 25666 1 910 . 1 1 96 96 VAL HG23 H 1 1.115 0.020 . 2 . . . . . 96 VAL HG23 . 25666 1 911 . 1 1 96 96 VAL CA C 13 58.677 0.400 . 1 . . . . . 96 VAL CA . 25666 1 912 . 1 1 96 96 VAL CB C 13 34.296 0.400 . 1 . . . . . 96 VAL CB . 25666 1 913 . 1 1 96 96 VAL CG1 C 13 22.065 0.400 . 1 . . . . . 96 VAL CG1 . 25666 1 914 . 1 1 96 96 VAL CG2 C 13 19.301 0.400 . 1 . . . . . 96 VAL CG2 . 25666 1 915 . 1 1 96 96 VAL N N 15 128.016 0.400 . 1 . . . . . 96 VAL N . 25666 1 916 . 1 1 97 97 THR H H 1 9.171 0.020 . 1 . . . . . 97 THR H . 25666 1 917 . 1 1 97 97 THR HA H 1 5.230 0.020 . 1 . . . . . 97 THR HA . 25666 1 918 . 1 1 97 97 THR HB H 1 3.858 0.020 . 1 . . . . . 97 THR HB . 25666 1 919 . 1 1 97 97 THR HG21 H 1 1.031 0.020 . 1 . . . . . 97 THR HG21 . 25666 1 920 . 1 1 97 97 THR HG22 H 1 1.031 0.020 . 1 . . . . . 97 THR HG22 . 25666 1 921 . 1 1 97 97 THR HG23 H 1 1.031 0.020 . 1 . . . . . 97 THR HG23 . 25666 1 922 . 1 1 97 97 THR CA C 13 61.417 0.400 . 1 . . . . . 97 THR CA . 25666 1 923 . 1 1 97 97 THR CB C 13 70.491 0.400 . 1 . . . . . 97 THR CB . 25666 1 924 . 1 1 97 97 THR CG2 C 13 21.123 0.400 . 1 . . . . . 97 THR CG2 . 25666 1 925 . 1 1 97 97 THR N N 15 124.802 0.400 . 1 . . . . . 97 THR N . 25666 1 926 . 1 1 98 98 VAL H H 1 9.073 0.020 . 1 . . . . . 98 VAL H . 25666 1 927 . 1 1 98 98 VAL HA H 1 4.967 0.020 . 1 . . . . . 98 VAL HA . 25666 1 928 . 1 1 98 98 VAL HB H 1 1.832 0.020 . 1 . . . . . 98 VAL HB . 25666 1 929 . 1 1 98 98 VAL HG11 H 1 0.992 0.020 . 2 . . . . . 98 VAL HG11 . 25666 1 930 . 1 1 98 98 VAL HG12 H 1 0.992 0.020 . 2 . . . . . 98 VAL HG12 . 25666 1 931 . 1 1 98 98 VAL HG13 H 1 0.992 0.020 . 2 . . . . . 98 VAL HG13 . 25666 1 932 . 1 1 98 98 VAL HG21 H 1 0.668 0.020 . 2 . . . . . 98 VAL HG21 . 25666 1 933 . 1 1 98 98 VAL HG22 H 1 0.668 0.020 . 2 . . . . . 98 VAL HG22 . 25666 1 934 . 1 1 98 98 VAL HG23 H 1 0.668 0.020 . 2 . . . . . 98 VAL HG23 . 25666 1 935 . 1 1 98 98 VAL CA C 13 60.710 0.400 . 1 . . . . . 98 VAL CA . 25666 1 936 . 1 1 98 98 VAL CB C 13 33.935 0.400 . 1 . . . . . 98 VAL CB . 25666 1 937 . 1 1 98 98 VAL CG1 C 13 22.298 0.400 . 1 . . . . . 98 VAL CG1 . 25666 1 938 . 1 1 98 98 VAL CG2 C 13 21.798 0.400 . 1 . . . . . 98 VAL CG2 . 25666 1 939 . 1 1 98 98 VAL N N 15 127.370 0.400 . 1 . . . . . 98 VAL N . 25666 1 940 . 1 1 99 99 GLU HA H 1 5.297 0.020 . 1 . . . . . 99 GLU HA . 25666 1 941 . 1 1 99 99 GLU HB2 H 1 1.895 0.020 . 2 . . . . . 99 GLU HB2 . 25666 1 942 . 1 1 99 99 GLU HB3 H 1 2.004 0.020 . 2 . . . . . 99 GLU HB3 . 25666 1 943 . 1 1 99 99 GLU HG2 H 1 2.103 0.020 . 2 . . . . . 99 GLU HG2 . 25666 1 944 . 1 1 99 99 GLU HG3 H 1 2.189 0.020 . 2 . . . . . 99 GLU HG3 . 25666 1 945 . 1 1 99 99 GLU CA C 13 53.883 0.400 . 1 . . . . . 99 GLU CA . 25666 1 946 . 1 1 99 99 GLU CB C 13 33.770 0.400 . 1 . . . . . 99 GLU CB . 25666 1 947 . 1 1 99 99 GLU CG C 13 36.334 0.400 . 1 . . . . . 99 GLU CG . 25666 1 948 . 1 1 100 100 GLY H H 1 8.651 0.020 . 1 . . . . . 100 GLY H . 25666 1 949 . 1 1 100 100 GLY N N 15 109.956 0.400 . 1 . . . . . 100 GLY N . 25666 1 950 . 1 1 101 101 GLN H H 1 8.665 0.020 . 1 . . . . . 101 GLN H . 25666 1 951 . 1 1 101 101 GLN HB2 H 1 2.111 0.020 . 1 . . . . . 101 GLN HB2 . 25666 1 952 . 1 1 101 101 GLN HB3 H 1 2.111 0.020 . 1 . . . . . 101 GLN HB3 . 25666 1 953 . 1 1 101 101 GLN HG2 H 1 2.346 0.020 . 1 . . . . . 101 GLN HG2 . 25666 1 954 . 1 1 101 101 GLN HG3 H 1 2.346 0.020 . 1 . . . . . 101 GLN HG3 . 25666 1 955 . 1 1 101 101 GLN HE21 H 1 6.669 0.020 . 2 . . . . . 101 GLN HE21 . 25666 1 956 . 1 1 101 101 GLN HE22 H 1 7.740 0.020 . 2 . . . . . 101 GLN HE22 . 25666 1 957 . 1 1 101 101 GLN CB C 13 32.525 0.400 . 1 . . . . . 101 GLN CB . 25666 1 958 . 1 1 101 101 GLN CG C 13 33.071 0.400 . 1 . . . . . 101 GLN CG . 25666 1 959 . 1 1 101 101 GLN N N 15 124.003 0.400 . 1 . . . . . 101 GLN N . 25666 1 960 . 1 1 101 101 GLN NE2 N 15 112.136 0.400 . 1 . . . . . 101 GLN NE2 . 25666 1 961 . 1 1 102 102 LEU HA H 1 4.309 0.020 . 1 . . . . . 102 LEU HA . 25666 1 962 . 1 1 102 102 LEU HB2 H 1 1.579 0.020 . 2 . . . . . 102 LEU HB2 . 25666 1 963 . 1 1 102 102 LEU HB3 H 1 1.577 0.020 . 2 . . . . . 102 LEU HB3 . 25666 1 964 . 1 1 102 102 LEU HG H 1 1.402 0.020 . 1 . . . . . 102 LEU HG . 25666 1 965 . 1 1 102 102 LEU HD11 H 1 0.687 0.020 . 2 . . . . . 102 LEU HD11 . 25666 1 966 . 1 1 102 102 LEU HD12 H 1 0.687 0.020 . 2 . . . . . 102 LEU HD12 . 25666 1 967 . 1 1 102 102 LEU HD13 H 1 0.687 0.020 . 2 . . . . . 102 LEU HD13 . 25666 1 968 . 1 1 102 102 LEU HD21 H 1 0.505 0.020 . 2 . . . . . 102 LEU HD21 . 25666 1 969 . 1 1 102 102 LEU HD22 H 1 0.505 0.020 . 2 . . . . . 102 LEU HD22 . 25666 1 970 . 1 1 102 102 LEU HD23 H 1 0.505 0.020 . 2 . . . . . 102 LEU HD23 . 25666 1 971 . 1 1 102 102 LEU CA C 13 54.519 0.400 . 1 . . . . . 102 LEU CA . 25666 1 972 . 1 1 102 102 LEU CB C 13 43.014 0.400 . 1 . . . . . 102 LEU CB . 25666 1 973 . 1 1 102 102 LEU CG C 13 24.476 0.400 . 1 . . . . . 102 LEU CG . 25666 1 974 . 1 1 102 102 LEU CD1 C 13 23.876 0.400 . 1 . . . . . 102 LEU CD1 . 25666 1 975 . 1 1 102 102 LEU CD2 C 13 23.191 0.400 . 1 . . . . . 102 LEU CD2 . 25666 1 976 . 1 1 103 103 GLU H H 1 8.503 0.020 . 1 . . . . . 103 GLU H . 25666 1 977 . 1 1 103 103 GLU HA H 1 4.310 0.020 . 1 . . . . . 103 GLU HA . 25666 1 978 . 1 1 103 103 GLU HB2 H 1 1.969 0.020 . 2 . . . . . 103 GLU HB2 . 25666 1 979 . 1 1 103 103 GLU HB3 H 1 2.014 0.020 . 2 . . . . . 103 GLU HB3 . 25666 1 980 . 1 1 103 103 GLU HG2 H 1 2.252 0.020 . 1 . . . . . 103 GLU HG2 . 25666 1 981 . 1 1 103 103 GLU HG3 H 1 2.252 0.020 . 1 . . . . . 103 GLU HG3 . 25666 1 982 . 1 1 103 103 GLU CA C 13 56.451 0.400 . 1 . . . . . 103 GLU CA . 25666 1 983 . 1 1 103 103 GLU CB C 13 30.606 0.400 . 1 . . . . . 103 GLU CB . 25666 1 984 . 1 1 103 103 GLU CG C 13 35.905 0.400 . 1 . . . . . 103 GLU CG . 25666 1 985 . 1 1 103 103 GLU N N 15 123.902 0.400 . 1 . . . . . 103 GLU N . 25666 1 986 . 1 1 104 104 GLY H H 1 8.582 0.020 . 1 . . . . . 104 GLY H . 25666 1 987 . 1 1 104 104 GLY HA2 H 1 3.976 0.020 . 2 . . . . . 104 GLY HA2 . 25666 1 988 . 1 1 104 104 GLY HA3 H 1 3.978 0.020 . 2 . . . . . 104 GLY HA3 . 25666 1 989 . 1 1 104 104 GLY CA C 13 45.326 0.400 . 1 . . . . . 104 GLY CA . 25666 1 990 . 1 1 104 104 GLY N N 15 111.238 0.400 . 1 . . . . . 104 GLY N . 25666 1 991 . 1 1 105 105 VAL H H 1 7.784 0.020 . 1 . . . . . 105 VAL H . 25666 1 992 . 1 1 105 105 VAL HA H 1 4.248 0.020 . 1 . . . . . 105 VAL HA . 25666 1 993 . 1 1 105 105 VAL HB H 1 2.146 0.020 . 1 . . . . . 105 VAL HB . 25666 1 994 . 1 1 105 105 VAL HG11 H 1 0.925 0.020 . 2 . . . . . 105 VAL HG11 . 25666 1 995 . 1 1 105 105 VAL HG12 H 1 0.925 0.020 . 2 . . . . . 105 VAL HG12 . 25666 1 996 . 1 1 105 105 VAL HG13 H 1 0.925 0.020 . 2 . . . . . 105 VAL HG13 . 25666 1 997 . 1 1 105 105 VAL HG21 H 1 0.883 0.020 . 2 . . . . . 105 VAL HG21 . 25666 1 998 . 1 1 105 105 VAL HG22 H 1 0.883 0.020 . 2 . . . . . 105 VAL HG22 . 25666 1 999 . 1 1 105 105 VAL HG23 H 1 0.883 0.020 . 2 . . . . . 105 VAL HG23 . 25666 1 1000 . 1 1 105 105 VAL CA C 13 61.288 0.400 . 1 . . . . . 105 VAL CA . 25666 1 1001 . 1 1 105 105 VAL CB C 13 32.874 0.400 . 1 . . . . . 105 VAL CB . 25666 1 1002 . 1 1 105 105 VAL CG1 C 13 21.202 0.400 . 1 . . . . . 105 VAL CG1 . 25666 1 1003 . 1 1 105 105 VAL CG2 C 13 19.959 0.400 . 1 . . . . . 105 VAL CG2 . 25666 1 1004 . 1 1 105 105 VAL N N 15 118.312 0.400 . 1 . . . . . 105 VAL N . 25666 1 1005 . 1 1 106 106 ASP H H 1 7.988 0.020 . 1 . . . . . 106 ASP H . 25666 1 1006 . 1 1 106 106 ASP HA H 1 4.392 0.020 . 1 . . . . . 106 ASP HA . 25666 1 1007 . 1 1 106 106 ASP HB2 H 1 2.673 0.020 . 2 . . . . . 106 ASP HB2 . 25666 1 1008 . 1 1 106 106 ASP HB3 H 1 2.550 0.020 . 2 . . . . . 106 ASP HB3 . 25666 1 1009 . 1 1 106 106 ASP CA C 13 55.679 0.400 . 1 . . . . . 106 ASP CA . 25666 1 1010 . 1 1 106 106 ASP CB C 13 42.401 0.400 . 1 . . . . . 106 ASP CB . 25666 1 1011 . 1 1 106 106 ASP N N 15 129.302 0.400 . 1 . . . . . 106 ASP N . 25666 1 stop_ save_