################################### # 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 27798 _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 $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 27798 1 2 '3D HNCO' . . . 27798 1 3 '3D HNCA' . . . 27798 1 5 '3D HNCACB' . . . 27798 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 MET C C 13 176.04 0.20 . 1 . . . . . 1 MET C . 27798 1 2 . 1 . 1 1 1 MET CA C 13 56.62 0.20 . 1 . . . . . 1 MET CA . 27798 1 3 . 1 . 1 1 1 MET CB C 13 30.25 0.20 . 1 . . . . . 1 MET CB . 27798 1 4 . 1 . 1 2 2 ASN H H 1 8.28 0.03 . 1 . . . . . 2 ASN H . 27798 1 5 . 1 . 1 2 2 ASN CA C 13 53.26 0.20 . 1 . . . . . 2 ASN CA . 27798 1 6 . 1 . 1 2 2 ASN CB C 13 39.55 0.20 . 1 . . . . . 2 ASN CB . 27798 1 7 . 1 . 1 2 2 ASN N N 15 118.80 0.20 . 1 . . . . . 2 ASN N . 27798 1 8 . 1 . 1 4 4 ASN C C 13 175.55 0.20 . 1 . . . . . 4 ASN C . 27798 1 9 . 1 . 1 4 4 ASN CA C 13 53.73 0.20 . 1 . . . . . 4 ASN CA . 27798 1 10 . 1 . 1 4 4 ASN CB C 13 38.82 0.20 . 1 . . . . . 4 ASN CB . 27798 1 11 . 1 . 1 5 5 VAL H H 1 8.04 0.03 . 1 . . . . . 5 VAL H . 27798 1 12 . 1 . 1 5 5 VAL C C 13 176.14 0.20 . 1 . . . . . 5 VAL C . 27798 1 13 . 1 . 1 5 5 VAL CA C 13 62.89 0.20 . 1 . . . . . 5 VAL CA . 27798 1 14 . 1 . 1 5 5 VAL CB C 13 32.63 0.20 . 1 . . . . . 5 VAL CB . 27798 1 15 . 1 . 1 5 5 VAL N N 15 119.59 0.20 . 1 . . . . . 5 VAL N . 27798 1 16 . 1 . 1 6 6 GLU H H 1 8.34 0.03 . 1 . . . . . 6 GLU H . 27798 1 17 . 1 . 1 6 6 GLU CA C 13 56.62 0.20 . 1 . . . . . 6 GLU CA . 27798 1 18 . 1 . 1 6 6 GLU CB C 13 30.27 0.20 . 1 . . . . . 6 GLU CB . 27798 1 19 . 1 . 1 6 6 GLU N N 15 122.82 0.20 . 1 . . . . . 6 GLU N . 27798 1 20 . 1 . 1 7 7 ASN C C 13 174.94 0.20 . 1 . . . . . 7 ASN C . 27798 1 21 . 1 . 1 7 7 ASN CA C 13 53.27 0.20 . 1 . . . . . 7 ASN CA . 27798 1 22 . 1 . 1 7 7 ASN CB C 13 39.53 0.20 . 1 . . . . . 7 ASN CB . 27798 1 23 . 1 . 1 8 8 LEU H H 1 8.16 0.03 . 1 . . . . . 8 LEU H . 27798 1 24 . 1 . 1 8 8 LEU CA C 13 52.95 0.20 . 1 . . . . . 8 LEU CA . 27798 1 25 . 1 . 1 8 8 LEU CB C 13 42.69 0.20 . 1 . . . . . 8 LEU CB . 27798 1 26 . 1 . 1 8 8 LEU N N 15 121.98 0.20 . 1 . . . . . 8 LEU N . 27798 1 27 . 1 . 1 11 11 HIS C C 13 177.36 0.20 . 1 . . . . . 11 HIS C . 27798 1 28 . 1 . 1 11 11 HIS CA C 13 59.12 0.20 . 1 . . . . . 11 HIS CA . 27798 1 29 . 1 . 1 11 11 HIS CB C 13 29.46 0.20 . 1 . . . . . 11 HIS CB . 27798 1 30 . 1 . 1 12 12 ILE H H 1 7.06 0.03 . 1 . . . . . 12 ILE H . 27798 1 31 . 1 . 1 12 12 ILE C C 13 177.63 0.20 . 1 . . . . . 12 ILE C . 27798 1 32 . 1 . 1 12 12 ILE CA C 13 61.62 0.20 . 1 . . . . . 12 ILE CA . 27798 1 33 . 1 . 1 12 12 ILE CB C 13 36.22 0.20 . 1 . . . . . 12 ILE CB . 27798 1 34 . 1 . 1 12 12 ILE N N 15 122.37 0.20 . 1 . . . . . 12 ILE N . 27798 1 35 . 1 . 1 13 13 ILE H H 1 7.76 0.03 . 1 . . . . . 13 ILE H . 27798 1 36 . 1 . 1 13 13 ILE C C 13 177.78 0.20 . 1 . . . . . 13 ILE C . 27798 1 37 . 1 . 1 13 13 ILE CA C 13 64.80 0.20 . 1 . . . . . 13 ILE CA . 27798 1 38 . 1 . 1 13 13 ILE CB C 13 37.05 0.20 . 1 . . . . . 13 ILE CB . 27798 1 39 . 1 . 1 13 13 ILE N N 15 121.49 0.20 . 1 . . . . . 13 ILE N . 27798 1 40 . 1 . 1 14 14 ARG H H 1 7.76 0.03 . 1 . . . . . 14 ARG H . 27798 1 41 . 1 . 1 14 14 ARG C C 13 178.82 0.20 . 1 . . . . . 14 ARG C . 27798 1 42 . 1 . 1 14 14 ARG CA C 13 59.68 0.20 . 1 . . . . . 14 ARG CA . 27798 1 43 . 1 . 1 14 14 ARG CB C 13 30.22 0.20 . 1 . . . . . 14 ARG CB . 27798 1 44 . 1 . 1 14 14 ARG N N 15 116.80 0.20 . 1 . . . . . 14 ARG N . 27798 1 45 . 1 . 1 15 15 LEU H H 1 7.41 0.03 . 1 . . . . . 15 LEU H . 27798 1 46 . 1 . 1 15 15 LEU C C 13 179.93 0.20 . 1 . . . . . 15 LEU C . 27798 1 47 . 1 . 1 15 15 LEU CA C 13 58.33 0.20 . 1 . . . . . 15 LEU CA . 27798 1 48 . 1 . 1 15 15 LEU CB C 13 42.42 0.20 . 1 . . . . . 15 LEU CB . 27798 1 49 . 1 . 1 15 15 LEU N N 15 120.66 0.20 . 1 . . . . . 15 LEU N . 27798 1 50 . 1 . 1 16 16 VAL H H 1 8.62 0.03 . 1 . . . . . 16 VAL H . 27798 1 51 . 1 . 1 16 16 VAL C C 13 177.55 0.20 . 1 . . . . . 16 VAL C . 27798 1 52 . 1 . 1 16 16 VAL CA C 13 67.01 0.20 . 1 . . . . . 16 VAL CA . 27798 1 53 . 1 . 1 16 16 VAL CB C 13 31.72 0.20 . 1 . . . . . 16 VAL CB . 27798 1 54 . 1 . 1 16 16 VAL N N 15 121.34 0.20 . 1 . . . . . 16 VAL N . 27798 1 55 . 1 . 1 17 17 TYR H H 1 8.91 0.03 . 1 . . . . . 17 TYR H . 27798 1 56 . 1 . 1 17 17 TYR C C 13 178.94 0.20 . 1 . . . . . 17 TYR C . 27798 1 57 . 1 . 1 17 17 TYR CA C 13 62.14 0.20 . 1 . . . . . 17 TYR CA . 27798 1 58 . 1 . 1 17 17 TYR CB C 13 38.06 0.20 . 1 . . . . . 17 TYR CB . 27798 1 59 . 1 . 1 17 17 TYR N N 15 119.87 0.20 . 1 . . . . . 17 TYR N . 27798 1 60 . 1 . 1 18 18 LYS H H 1 8.14 0.03 . 1 . . . . . 18 LYS H . 27798 1 61 . 1 . 1 18 18 LYS C C 13 174.00 0.20 . 1 . . . . . 18 LYS C . 27798 1 62 . 1 . 1 18 18 LYS CA C 13 59.74 0.20 . 1 . . . . . 18 LYS CA . 27798 1 63 . 1 . 1 18 18 LYS CB C 13 32.40 0.20 . 1 . . . . . 18 LYS CB . 27798 1 64 . 1 . 1 18 18 LYS N N 15 120.36 0.20 . 1 . . . . . 18 LYS N . 27798 1 65 . 1 . 1 19 19 GLU H H 1 8.11 0.03 . 1 . . . . . 19 GLU H . 27798 1 66 . 1 . 1 19 19 GLU C C 13 179.88 0.20 . 1 . . . . . 19 GLU C . 27798 1 67 . 1 . 1 19 19 GLU CA C 13 59.86 0.20 . 1 . . . . . 19 GLU CA . 27798 1 68 . 1 . 1 19 19 GLU CB C 13 29.73 0.20 . 1 . . . . . 19 GLU CB . 27798 1 69 . 1 . 1 19 19 GLU N N 15 120.49 0.20 . 1 . . . . . 19 GLU N . 27798 1 70 . 1 . 1 20 20 VAL H H 1 9.18 0.03 . 1 . . . . . 20 VAL H . 27798 1 71 . 1 . 1 20 20 VAL C C 13 178.31 0.20 . 1 . . . . . 20 VAL C . 27798 1 72 . 1 . 1 20 20 VAL CA C 13 67.47 0.20 . 1 . . . . . 20 VAL CA . 27798 1 73 . 1 . 1 20 20 VAL CB C 13 31.32 0.20 . 1 . . . . . 20 VAL CB . 27798 1 74 . 1 . 1 20 20 VAL N N 15 118.94 0.20 . 1 . . . . . 20 VAL N . 27798 1 75 . 1 . 1 21 21 THR H H 1 8.22 0.03 . 1 . . . . . 21 THR H . 27798 1 76 . 1 . 1 21 21 THR C C 13 177.42 0.20 . 1 . . . . . 21 THR C . 27798 1 77 . 1 . 1 21 21 THR CA C 13 66.89 0.20 . 1 . . . . . 21 THR CA . 27798 1 78 . 1 . 1 21 21 THR CB C 13 68.50 0.20 . 1 . . . . . 21 THR CB . 27798 1 79 . 1 . 1 21 21 THR N N 15 116.18 0.20 . 1 . . . . . 21 THR N . 27798 1 80 . 1 . 1 22 22 THR H H 1 7.75 0.03 . 1 . . . . . 22 THR H . 27798 1 81 . 1 . 1 22 22 THR C C 13 176.50 0.20 . 1 . . . . . 22 THR C . 27798 1 82 . 1 . 1 22 22 THR CA C 13 66.21 0.20 . 1 . . . . . 22 THR CA . 27798 1 83 . 1 . 1 22 22 THR CB C 13 68.60 0.20 . 1 . . . . . 22 THR CB . 27798 1 84 . 1 . 1 22 22 THR N N 15 117.47 0.20 . 1 . . . . . 22 THR N . 27798 1 85 . 1 . 1 23 23 LEU H H 1 8.08 0.03 . 1 . . . . . 23 LEU H . 27798 1 86 . 1 . 1 23 23 LEU C C 13 177.57 0.20 . 1 . . . . . 23 LEU C . 27798 1 87 . 1 . 1 23 23 LEU CA C 13 57.42 0.20 . 1 . . . . . 23 LEU CA . 27798 1 88 . 1 . 1 23 23 LEU CB C 13 42.96 0.20 . 1 . . . . . 23 LEU CB . 27798 1 89 . 1 . 1 23 23 LEU N N 15 122.71 0.20 . 1 . . . . . 23 LEU N . 27798 1 90 . 1 . 1 24 24 THR H H 1 7.93 0.03 . 1 . . . . . 24 THR H . 27798 1 91 . 1 . 1 24 24 THR C C 13 176.22 0.20 . 1 . . . . . 24 THR C . 27798 1 92 . 1 . 1 24 24 THR CA C 13 65.08 0.20 . 1 . . . . . 24 THR CA . 27798 1 93 . 1 . 1 24 24 THR CB C 13 68.84 0.20 . 1 . . . . . 24 THR CB . 27798 1 94 . 1 . 1 24 24 THR N N 15 110.64 0.20 . 1 . . . . . 24 THR N . 27798 1 95 . 1 . 1 25 25 ALA H H 1 7.31 0.03 . 1 . . . . . 25 ALA H . 27798 1 96 . 1 . 1 25 25 ALA C C 13 177.76 0.20 . 1 . . . . . 25 ALA C . 27798 1 97 . 1 . 1 25 25 ALA CA C 13 53.86 0.20 . 1 . . . . . 25 ALA CA . 27798 1 98 . 1 . 1 25 25 ALA CB C 13 19.40 0.20 . 1 . . . . . 25 ALA CB . 27798 1 99 . 1 . 1 25 25 ALA N N 15 122.82 0.20 . 1 . . . . . 25 ALA N . 27798 1 100 . 1 . 1 26 26 ASP H H 1 7.76 0.03 . 1 . . . . . 26 ASP H . 27798 1 101 . 1 . 1 26 26 ASP CA C 13 51.79 0.20 . 1 . . . . . 26 ASP CA . 27798 1 102 . 1 . 1 26 26 ASP CB C 13 41.17 0.20 . 1 . . . . . 26 ASP CB . 27798 1 103 . 1 . 1 26 26 ASP N N 15 115.66 0.20 . 1 . . . . . 26 ASP N . 27798 1 104 . 1 . 1 28 28 PRO C C 13 175.31 0.20 . 1 . . . . . 28 PRO C . 27798 1 105 . 1 . 1 28 28 PRO CA C 13 61.65 0.20 . 1 . . . . . 28 PRO CA . 27798 1 106 . 1 . 1 28 28 PRO CB C 13 31.45 0.20 . 1 . . . . . 28 PRO CB . 27798 1 107 . 1 . 1 29 29 ASP H H 1 8.29 0.03 . 1 . . . . . 29 ASP H . 27798 1 108 . 1 . 1 29 29 ASP C C 13 177.63 0.20 . 1 . . . . . 29 ASP C . 27798 1 109 . 1 . 1 29 29 ASP CA C 13 56.07 0.20 . 1 . . . . . 29 ASP CA . 27798 1 110 . 1 . 1 29 29 ASP CB C 13 40.76 0.20 . 1 . . . . . 29 ASP CB . 27798 1 111 . 1 . 1 29 29 ASP N N 15 120.36 0.20 . 1 . . . . . 29 ASP N . 27798 1 112 . 1 . 1 30 30 GLY H H 1 8.68 0.03 . 1 . . . . . 30 GLY H . 27798 1 113 . 1 . 1 30 30 GLY C C 13 173.50 0.20 . 1 . . . . . 30 GLY C . 27798 1 114 . 1 . 1 30 30 GLY CA C 13 45.74 0.20 . 1 . . . . . 30 GLY CA . 27798 1 115 . 1 . 1 30 30 GLY N N 15 112.34 0.20 . 1 . . . . . 30 GLY N . 27798 1 116 . 1 . 1 31 31 ILE H H 1 7.89 0.03 . 1 . . . . . 31 ILE H . 27798 1 117 . 1 . 1 31 31 ILE C C 13 174.12 0.20 . 1 . . . . . 31 ILE C . 27798 1 118 . 1 . 1 31 31 ILE CA C 13 59.88 0.20 . 1 . . . . . 31 ILE CA . 27798 1 119 . 1 . 1 31 31 ILE CB C 13 40.34 0.20 . 1 . . . . . 31 ILE CB . 27798 1 120 . 1 . 1 31 31 ILE N N 15 121.45 0.20 . 1 . . . . . 31 ILE N . 27798 1 121 . 1 . 1 32 32 LYS H H 1 8.46 0.03 . 1 . . . . . 32 LYS H . 27798 1 122 . 1 . 1 32 32 LYS C C 13 174.64 0.20 . 1 . . . . . 32 LYS C . 27798 1 123 . 1 . 1 32 32 LYS CA C 13 54.74 0.20 . 1 . . . . . 32 LYS CA . 27798 1 124 . 1 . 1 32 32 LYS CB C 13 36.50 0.20 . 1 . . . . . 32 LYS CB . 27798 1 125 . 1 . 1 32 32 LYS N N 15 125.13 0.20 . 1 . . . . . 32 LYS N . 27798 1 126 . 1 . 1 33 33 VAL H H 1 8.34 0.03 . 1 . . . . . 33 VAL H . 27798 1 127 . 1 . 1 33 33 VAL C C 13 173.83 0.20 . 1 . . . . . 33 VAL C . 27798 1 128 . 1 . 1 33 33 VAL CA C 13 60.58 0.20 . 1 . . . . . 33 VAL CA . 27798 1 129 . 1 . 1 33 33 VAL CB C 13 33.91 0.20 . 1 . . . . . 33 VAL CB . 27798 1 130 . 1 . 1 33 33 VAL N N 15 119.03 0.20 . 1 . . . . . 33 VAL N . 27798 1 131 . 1 . 1 34 34 PHE H H 1 8.71 0.03 . 1 . . . . . 34 PHE H . 27798 1 132 . 1 . 1 34 34 PHE CA C 13 54.93 0.20 . 1 . . . . . 34 PHE CA . 27798 1 133 . 1 . 1 34 34 PHE CB C 13 39.41 0.20 . 1 . . . . . 34 PHE CB . 27798 1 134 . 1 . 1 34 34 PHE N N 15 123.12 0.20 . 1 . . . . . 34 PHE N . 27798 1 135 . 1 . 1 35 35 PRO C C 13 175.83 0.20 . 1 . . . . . 35 PRO C . 27798 1 136 . 1 . 1 35 35 PRO CA C 13 62.87 0.20 . 1 . . . . . 35 PRO CA . 27798 1 137 . 1 . 1 35 35 PRO CB C 13 32.44 0.20 . 1 . . . . . 35 PRO CB . 27798 1 138 . 1 . 1 36 36 ASN H H 1 8.92 0.03 . 1 . . . . . 36 ASN H . 27798 1 139 . 1 . 1 36 36 ASN C C 13 176.18 0.20 . 1 . . . . . 36 ASN C . 27798 1 140 . 1 . 1 36 36 ASN CA C 13 52.24 0.20 . 1 . . . . . 36 ASN CA . 27798 1 141 . 1 . 1 36 36 ASN CB C 13 39.05 0.20 . 1 . . . . . 36 ASN CB . 27798 1 142 . 1 . 1 36 36 ASN N N 15 121.71 0.20 . 1 . . . . . 36 ASN N . 27798 1 143 . 1 . 1 37 37 GLU H H 1 9.03 0.03 . 1 . . . . . 37 GLU H . 27798 1 144 . 1 . 1 37 37 GLU C C 13 177.05 0.20 . 1 . . . . . 37 GLU C . 27798 1 145 . 1 . 1 37 37 GLU CA C 13 58.94 0.20 . 1 . . . . . 37 GLU CA . 27798 1 146 . 1 . 1 37 37 GLU CB C 13 29.56 0.20 . 1 . . . . . 37 GLU CB . 27798 1 147 . 1 . 1 37 37 GLU N N 15 124.02 0.20 . 1 . . . . . 37 GLU N . 27798 1 148 . 1 . 1 38 38 GLU H H 1 8.15 0.03 . 1 . . . . . 38 GLU H . 27798 1 149 . 1 . 1 38 38 GLU C C 13 176.58 0.20 . 1 . . . . . 38 GLU C . 27798 1 150 . 1 . 1 38 38 GLU CA C 13 57.12 0.20 . 1 . . . . . 38 GLU CA . 27798 1 151 . 1 . 1 38 38 GLU CB C 13 30.23 0.20 . 1 . . . . . 38 GLU CB . 27798 1 152 . 1 . 1 38 38 GLU N N 15 116.18 0.20 . 1 . . . . . 38 GLU N . 27798 1 153 . 1 . 1 39 39 ASP H H 1 7.54 0.03 . 1 . . . . . 39 ASP H . 27798 1 154 . 1 . 1 39 39 ASP C C 13 175.50 0.20 . 1 . . . . . 39 ASP C . 27798 1 155 . 1 . 1 39 39 ASP CA C 13 53.78 0.20 . 1 . . . . . 39 ASP CA . 27798 1 156 . 1 . 1 39 39 ASP CB C 13 40.60 0.20 . 1 . . . . . 39 ASP CB . 27798 1 157 . 1 . 1 39 39 ASP N N 15 117.55 0.20 . 1 . . . . . 39 ASP N . 27798 1 158 . 1 . 1 40 40 LEU H H 1 8.66 0.03 . 1 . . . . . 40 LEU H . 27798 1 159 . 1 . 1 40 40 LEU C C 13 175.51 0.20 . 1 . . . . . 40 LEU C . 27798 1 160 . 1 . 1 40 40 LEU CA C 13 56.23 0.20 . 1 . . . . . 40 LEU CA . 27798 1 161 . 1 . 1 40 40 LEU CB C 13 42.16 0.20 . 1 . . . . . 40 LEU CB . 27798 1 162 . 1 . 1 40 40 LEU N N 15 125.87 0.20 . 1 . . . . . 40 LEU N . 27798 1 163 . 1 . 1 41 41 THR H H 1 7.99 0.03 . 1 . . . . . 41 THR H . 27798 1 164 . 1 . 1 41 41 THR C C 13 173.17 0.20 . 1 . . . . . 41 THR C . 27798 1 165 . 1 . 1 41 41 THR CA C 13 62.65 0.20 . 1 . . . . . 41 THR CA . 27798 1 166 . 1 . 1 41 41 THR CB C 13 69.18 0.20 . 1 . . . . . 41 THR CB . 27798 1 167 . 1 . 1 41 41 THR N N 15 103.41 0.20 . 1 . . . . . 41 THR N . 27798 1 168 . 1 . 1 42 42 ASP H H 1 7.20 0.03 . 1 . . . . . 42 ASP H . 27798 1 169 . 1 . 1 42 42 ASP C C 13 174.95 0.20 . 1 . . . . . 42 ASP C . 27798 1 170 . 1 . 1 42 42 ASP CA C 13 52.72 0.20 . 1 . . . . . 42 ASP CA . 27798 1 171 . 1 . 1 42 42 ASP CB C 13 42.22 0.20 . 1 . . . . . 42 ASP CB . 27798 1 172 . 1 . 1 42 42 ASP N N 15 122.23 0.20 . 1 . . . . . 42 ASP N . 27798 1 173 . 1 . 1 43 43 LEU H H 1 8.64 0.03 . 1 . . . . . 43 LEU H . 27798 1 174 . 1 . 1 43 43 LEU C C 13 175.35 0.20 . 1 . . . . . 43 LEU C . 27798 1 175 . 1 . 1 43 43 LEU CA C 13 53.87 0.20 . 1 . . . . . 43 LEU CA . 27798 1 176 . 1 . 1 43 43 LEU CB C 13 44.47 0.20 . 1 . . . . . 43 LEU CB . 27798 1 177 . 1 . 1 43 43 LEU N N 15 124.97 0.20 . 1 . . . . . 43 LEU N . 27798 1 178 . 1 . 1 44 44 GLN H H 1 8.10 0.03 . 1 . . . . . 44 GLN H . 27798 1 179 . 1 . 1 44 44 GLN C C 13 174.87 0.20 . 1 . . . . . 44 GLN C . 27798 1 180 . 1 . 1 44 44 GLN CA C 13 55.36 0.20 . 1 . . . . . 44 GLN CA . 27798 1 181 . 1 . 1 44 44 GLN CB C 13 29.82 0.20 . 1 . . . . . 44 GLN CB . 27798 1 182 . 1 . 1 44 44 GLN N N 15 124.17 0.20 . 1 . . . . . 44 GLN N . 27798 1 183 . 1 . 1 45 45 VAL H H 1 8.69 0.03 . 1 . . . . . 45 VAL H . 27798 1 184 . 1 . 1 45 45 VAL C C 13 175.84 0.20 . 1 . . . . . 45 VAL C . 27798 1 185 . 1 . 1 45 45 VAL CA C 13 59.72 0.20 . 1 . . . . . 45 VAL CA . 27798 1 186 . 1 . 1 45 45 VAL CB C 13 37.22 0.20 . 1 . . . . . 45 VAL CB . 27798 1 187 . 1 . 1 45 45 VAL N N 15 121.45 0.20 . 1 . . . . . 45 VAL N . 27798 1 188 . 1 . 1 46 46 THR H H 1 9.39 0.03 . 1 . . . . . 46 THR H . 27798 1 189 . 1 . 1 46 46 THR C C 13 173.55 0.20 . 1 . . . . . 46 THR C . 27798 1 190 . 1 . 1 46 46 THR CA C 13 60.36 0.20 . 1 . . . . . 46 THR CA . 27798 1 191 . 1 . 1 46 46 THR CB C 13 71.29 0.20 . 1 . . . . . 46 THR CB . 27798 1 192 . 1 . 1 46 46 THR N N 15 117.01 0.20 . 1 . . . . . 46 THR N . 27798 1 193 . 1 . 1 47 47 ILE H H 1 9.19 0.03 . 1 . . . . . 47 ILE H . 27798 1 194 . 1 . 1 47 47 ILE C C 13 175.09 0.20 . 1 . . . . . 47 ILE C . 27798 1 195 . 1 . 1 47 47 ILE CA C 13 59.58 0.20 . 1 . . . . . 47 ILE CA . 27798 1 196 . 1 . 1 47 47 ILE CB C 13 42.40 0.20 . 1 . . . . . 47 ILE CB . 27798 1 197 . 1 . 1 47 47 ILE N N 15 122.03 0.20 . 1 . . . . . 47 ILE N . 27798 1 198 . 1 . 1 48 48 GLU H H 1 8.75 0.03 . 1 . . . . . 48 GLU H . 27798 1 199 . 1 . 1 48 48 GLU C C 13 177.73 0.20 . 1 . . . . . 48 GLU C . 27798 1 200 . 1 . 1 48 48 GLU CA C 13 55.63 0.20 . 1 . . . . . 48 GLU CA . 27798 1 201 . 1 . 1 48 48 GLU CB C 13 30.44 0.20 . 1 . . . . . 48 GLU CB . 27798 1 202 . 1 . 1 48 48 GLU N N 15 127.86 0.20 . 1 . . . . . 48 GLU N . 27798 1 203 . 1 . 1 49 49 GLY H H 1 9.57 0.03 . 1 . . . . . 49 GLY H . 27798 1 204 . 1 . 1 49 49 GLY CA C 13 44.30 0.20 . 1 . . . . . 49 GLY CA . 27798 1 205 . 1 . 1 49 49 GLY N N 15 112.63 0.20 . 1 . . . . . 49 GLY N . 27798 1 206 . 1 . 1 50 50 PRO C C 13 176.79 0.20 . 1 . . . . . 50 PRO C . 27798 1 207 . 1 . 1 50 50 PRO CA C 13 63.12 0.20 . 1 . . . . . 50 PRO CA . 27798 1 208 . 1 . 1 50 50 PRO CB C 13 32.32 0.20 . 1 . . . . . 50 PRO CB . 27798 1 209 . 1 . 1 51 51 GLU H H 1 8.93 0.03 . 1 . . . . . 51 GLU H . 27798 1 210 . 1 . 1 51 51 GLU C C 13 177.17 0.20 . 1 . . . . . 51 GLU C . 27798 1 211 . 1 . 1 51 51 GLU CA C 13 57.74 0.20 . 1 . . . . . 51 GLU CA . 27798 1 212 . 1 . 1 51 51 GLU CB C 13 29.77 0.20 . 1 . . . . . 51 GLU CB . 27798 1 213 . 1 . 1 51 51 GLU N N 15 124.57 0.20 . 1 . . . . . 51 GLU N . 27798 1 214 . 1 . 1 52 52 GLY H H 1 9.16 0.03 . 1 . . . . . 52 GLY H . 27798 1 215 . 1 . 1 52 52 GLY C C 13 173.99 0.20 . 1 . . . . . 52 GLY C . 27798 1 216 . 1 . 1 52 52 GLY CA C 13 45.59 0.20 . 1 . . . . . 52 GLY CA . 27798 1 217 . 1 . 1 52 52 GLY N N 15 110.77 0.20 . 1 . . . . . 52 GLY N . 27798 1 218 . 1 . 1 53 53 THR H H 1 7.51 0.03 . 1 . . . . . 53 THR H . 27798 1 219 . 1 . 1 53 53 THR CA C 13 59.53 0.20 . 1 . . . . . 53 THR CA . 27798 1 220 . 1 . 1 53 53 THR CB C 13 70.70 0.20 . 1 . . . . . 53 THR CB . 27798 1 221 . 1 . 1 53 53 THR N N 15 108.50 0.20 . 1 . . . . . 53 THR N . 27798 1 222 . 1 . 1 54 54 PRO C C 13 174.41 0.20 . 1 . . . . . 54 PRO C . 27798 1 223 . 1 . 1 54 54 PRO CA C 13 63.83 0.20 . 1 . . . . . 54 PRO CA . 27798 1 224 . 1 . 1 54 54 PRO CB C 13 32.58 0.20 . 1 . . . . . 54 PRO CB . 27798 1 225 . 1 . 1 55 55 TYR H H 1 6.93 0.03 . 1 . . . . . 55 TYR H . 27798 1 226 . 1 . 1 55 55 TYR C C 13 175.15 0.20 . 1 . . . . . 55 TYR C . 27798 1 227 . 1 . 1 55 55 TYR CA C 13 55.94 0.20 . 1 . . . . . 55 TYR CA . 27798 1 228 . 1 . 1 55 55 TYR CB C 13 38.40 0.20 . 1 . . . . . 55 TYR CB . 27798 1 229 . 1 . 1 55 55 TYR N N 15 113.95 0.20 . 1 . . . . . 55 TYR N . 27798 1 230 . 1 . 1 56 56 ALA H H 1 7.28 0.03 . 1 . . . . . 56 ALA H . 27798 1 231 . 1 . 1 56 56 ALA C C 13 178.55 0.20 . 1 . . . . . 56 ALA C . 27798 1 232 . 1 . 1 56 56 ALA CA C 13 53.75 0.20 . 1 . . . . . 56 ALA CA . 27798 1 233 . 1 . 1 56 56 ALA CB C 13 19.65 0.20 . 1 . . . . . 56 ALA CB . 27798 1 234 . 1 . 1 56 56 ALA N N 15 123.29 0.20 . 1 . . . . . 56 ALA N . 27798 1 235 . 1 . 1 57 57 GLY H H 1 8.69 0.03 . 1 . . . . . 57 GLY H . 27798 1 236 . 1 . 1 57 57 GLY C C 13 174.74 0.20 . 1 . . . . . 57 GLY C . 27798 1 237 . 1 . 1 57 57 GLY CA C 13 45.32 0.20 . 1 . . . . . 57 GLY CA . 27798 1 238 . 1 . 1 57 57 GLY N N 15 111.77 0.20 . 1 . . . . . 57 GLY N . 27798 1 239 . 1 . 1 58 58 GLY H H 1 8.28 0.03 . 1 . . . . . 58 GLY H . 27798 1 240 . 1 . 1 58 58 GLY C C 13 171.89 0.20 . 1 . . . . . 58 GLY C . 27798 1 241 . 1 . 1 58 58 GLY CA C 13 44.57 0.20 . 1 . . . . . 58 GLY CA . 27798 1 242 . 1 . 1 58 58 GLY N N 15 107.17 0.20 . 1 . . . . . 58 GLY N . 27798 1 243 . 1 . 1 59 59 LEU H H 1 9.31 0.03 . 1 . . . . . 59 LEU H . 27798 1 244 . 1 . 1 59 59 LEU C C 13 175.01 0.20 . 1 . . . . . 59 LEU C . 27798 1 245 . 1 . 1 59 59 LEU CA C 13 54.07 0.20 . 1 . . . . . 59 LEU CA . 27798 1 246 . 1 . 1 59 59 LEU CB C 13 43.24 0.20 . 1 . . . . . 59 LEU CB . 27798 1 247 . 1 . 1 59 59 LEU N N 15 126.95 0.20 . 1 . . . . . 59 LEU N . 27798 1 248 . 1 . 1 60 60 PHE H H 1 8.83 0.03 . 1 . . . . . 60 PHE H . 27798 1 249 . 1 . 1 60 60 PHE C C 13 174.77 0.20 . 1 . . . . . 60 PHE C . 27798 1 250 . 1 . 1 60 60 PHE CA C 13 57.39 0.20 . 1 . . . . . 60 PHE CA . 27798 1 251 . 1 . 1 60 60 PHE CB C 13 40.52 0.20 . 1 . . . . . 60 PHE CB . 27798 1 252 . 1 . 1 60 60 PHE N N 15 123.66 0.20 . 1 . . . . . 60 PHE N . 27798 1 253 . 1 . 1 61 61 ARG H H 1 9.40 0.03 . 1 . . . . . 61 ARG H . 27798 1 254 . 1 . 1 61 61 ARG C C 13 176.07 0.20 . 1 . . . . . 61 ARG C . 27798 1 255 . 1 . 1 61 61 ARG CA C 13 55.39 0.20 . 1 . . . . . 61 ARG CA . 27798 1 256 . 1 . 1 61 61 ARG CB C 13 31.62 0.20 . 1 . . . . . 61 ARG CB . 27798 1 257 . 1 . 1 61 61 ARG N N 15 123.68 0.20 . 1 . . . . . 61 ARG N . 27798 1 258 . 1 . 1 62 62 MET H H 1 9.47 0.03 . 1 . . . . . 62 MET H . 27798 1 259 . 1 . 1 62 62 MET C C 13 173.07 0.20 . 1 . . . . . 62 MET C . 27798 1 260 . 1 . 1 62 62 MET CA C 13 54.43 0.20 . 1 . . . . . 62 MET CA . 27798 1 261 . 1 . 1 62 62 MET CB C 13 37.26 0.20 . 1 . . . . . 62 MET CB . 27798 1 262 . 1 . 1 62 62 MET N N 15 123.97 0.20 . 1 . . . . . 62 MET N . 27798 1 263 . 1 . 1 63 63 LYS H H 1 9.07 0.03 . 1 . . . . . 63 LYS H . 27798 1 264 . 1 . 1 63 63 LYS C C 13 174.38 0.20 . 1 . . . . . 63 LYS C . 27798 1 265 . 1 . 1 63 63 LYS CA C 13 54.44 0.20 . 1 . . . . . 63 LYS CA . 27798 1 266 . 1 . 1 63 63 LYS CB C 13 36.15 0.20 . 1 . . . . . 63 LYS CB . 27798 1 267 . 1 . 1 63 63 LYS N N 15 120.24 0.20 . 1 . . . . . 63 LYS N . 27798 1 268 . 1 . 1 64 64 LEU H H 1 8.96 0.03 . 1 . . . . . 64 LEU H . 27798 1 269 . 1 . 1 64 64 LEU C C 13 174.63 0.20 . 1 . . . . . 64 LEU C . 27798 1 270 . 1 . 1 64 64 LEU CA C 13 52.83 0.20 . 1 . . . . . 64 LEU CA . 27798 1 271 . 1 . 1 64 64 LEU CB C 13 44.99 0.20 . 1 . . . . . 64 LEU CB . 27798 1 272 . 1 . 1 64 64 LEU N N 15 123.57 0.20 . 1 . . . . . 64 LEU N . 27798 1 273 . 1 . 1 65 65 LEU H H 1 8.99 0.03 . 1 . . . . . 65 LEU H . 27798 1 274 . 1 . 1 65 65 LEU C C 13 177.00 0.20 . 1 . . . . . 65 LEU C . 27798 1 275 . 1 . 1 65 65 LEU CA C 13 52.97 0.20 . 1 . . . . . 65 LEU CA . 27798 1 276 . 1 . 1 65 65 LEU CB C 13 43.72 0.20 . 1 . . . . . 65 LEU CB . 27798 1 277 . 1 . 1 65 65 LEU N N 15 122.87 0.20 . 1 . . . . . 65 LEU N . 27798 1 278 . 1 . 1 66 66 LEU H H 1 9.02 0.03 . 1 . . . . . 66 LEU H . 27798 1 279 . 1 . 1 66 66 LEU C C 13 175.93 0.20 . 1 . . . . . 66 LEU C . 27798 1 280 . 1 . 1 66 66 LEU CA C 13 55.36 0.20 . 1 . . . . . 66 LEU CA . 27798 1 281 . 1 . 1 66 66 LEU CB C 13 40.97 0.20 . 1 . . . . . 66 LEU CB . 27798 1 282 . 1 . 1 66 66 LEU N N 15 126.77 0.20 . 1 . . . . . 66 LEU N . 27798 1 283 . 1 . 1 67 67 GLY H H 1 7.97 0.03 . 1 . . . . . 67 GLY H . 27798 1 284 . 1 . 1 67 67 GLY C C 13 173.99 0.20 . 1 . . . . . 67 GLY C . 27798 1 285 . 1 . 1 67 67 GLY CA C 13 44.28 0.20 . 1 . . . . . 67 GLY CA . 27798 1 286 . 1 . 1 67 67 GLY N N 15 108.49 0.20 . 1 . . . . . 67 GLY N . 27798 1 287 . 1 . 1 68 68 LYS H H 1 8.37 0.03 . 1 . . . . . 68 LYS H . 27798 1 288 . 1 . 1 68 68 LYS C C 13 176.23 0.20 . 1 . . . . . 68 LYS C . 27798 1 289 . 1 . 1 68 68 LYS CA C 13 58.25 0.20 . 1 . . . . . 68 LYS CA . 27798 1 290 . 1 . 1 68 68 LYS CB C 13 32.26 0.20 . 1 . . . . . 68 LYS CB . 27798 1 291 . 1 . 1 68 68 LYS N N 15 116.68 0.20 . 1 . . . . . 68 LYS N . 27798 1 292 . 1 . 1 69 69 ASP H H 1 8.50 0.03 . 1 . . . . . 69 ASP H . 27798 1 293 . 1 . 1 69 69 ASP C C 13 175.74 0.20 . 1 . . . . . 69 ASP C . 27798 1 294 . 1 . 1 69 69 ASP CA C 13 52.89 0.20 . 1 . . . . . 69 ASP CA . 27798 1 295 . 1 . 1 69 69 ASP CB C 13 40.67 0.20 . 1 . . . . . 69 ASP CB . 27798 1 296 . 1 . 1 69 69 ASP N N 15 116.18 0.20 . 1 . . . . . 69 ASP N . 27798 1 297 . 1 . 1 70 70 PHE H H 1 7.69 0.03 . 1 . . . . . 70 PHE H . 27798 1 298 . 1 . 1 70 70 PHE CA C 13 56.76 0.20 . 1 . . . . . 70 PHE CA . 27798 1 299 . 1 . 1 70 70 PHE CB C 13 40.16 0.20 . 1 . . . . . 70 PHE CB . 27798 1 300 . 1 . 1 70 70 PHE N N 15 124.97 0.20 . 1 . . . . . 70 PHE N . 27798 1 301 . 1 . 1 71 71 PRO C C 13 175.13 0.20 . 1 . . . . . 71 PRO C . 27798 1 302 . 1 . 1 71 71 PRO CA C 13 63.96 0.20 . 1 . . . . . 71 PRO CA . 27798 1 303 . 1 . 1 71 71 PRO CB C 13 32.25 0.20 . 1 . . . . . 71 PRO CB . 27798 1 304 . 1 . 1 72 72 ALA H H 1 8.58 0.03 . 1 . . . . . 72 ALA H . 27798 1 305 . 1 . 1 72 72 ALA C C 13 178.77 0.20 . 1 . . . . . 72 ALA C . 27798 1 306 . 1 . 1 72 72 ALA CA C 13 55.76 0.20 . 1 . . . . . 72 ALA CA . 27798 1 307 . 1 . 1 72 72 ALA CB C 13 18.28 0.20 . 1 . . . . . 72 ALA CB . 27798 1 308 . 1 . 1 72 72 ALA N N 15 128.40 0.20 . 1 . . . . . 72 ALA N . 27798 1 309 . 1 . 1 73 73 SER H H 1 7.72 0.03 . 1 . . . . . 73 SER H . 27798 1 310 . 1 . 1 73 73 SER CA C 13 55.02 0.20 . 1 . . . . . 73 SER CA . 27798 1 311 . 1 . 1 73 73 SER CB C 13 63.96 0.20 . 1 . . . . . 73 SER CB . 27798 1 312 . 1 . 1 73 73 SER N N 15 111.57 0.20 . 1 . . . . . 73 SER N . 27798 1 313 . 1 . 1 75 75 PRO C C 13 174.42 0.20 . 1 . . . . . 75 PRO C . 27798 1 314 . 1 . 1 75 75 PRO CA C 13 62.00 0.20 . 1 . . . . . 75 PRO CA . 27798 1 315 . 1 . 1 75 75 PRO CB C 13 32.78 0.20 . 1 . . . . . 75 PRO CB . 27798 1 316 . 1 . 1 76 76 LYS H H 1 7.89 0.03 . 1 . . . . . 76 LYS H . 27798 1 317 . 1 . 1 76 76 LYS C C 13 175.90 0.20 . 1 . . . . . 76 LYS C . 27798 1 318 . 1 . 1 76 76 LYS CA C 13 55.38 0.20 . 1 . . . . . 76 LYS CA . 27798 1 319 . 1 . 1 76 76 LYS CB C 13 34.76 0.20 . 1 . . . . . 76 LYS CB . 27798 1 320 . 1 . 1 76 76 LYS N N 15 117.77 0.20 . 1 . . . . . 76 LYS N . 27798 1 321 . 1 . 1 77 77 GLY H H 1 8.33 0.03 . 1 . . . . . 77 GLY H . 27798 1 322 . 1 . 1 77 77 GLY C C 13 171.45 0.20 . 1 . . . . . 77 GLY C . 27798 1 323 . 1 . 1 77 77 GLY CA C 13 44.64 0.20 . 1 . . . . . 77 GLY CA . 27798 1 324 . 1 . 1 77 77 GLY N N 15 107.37 0.20 . 1 . . . . . 77 GLY N . 27798 1 325 . 1 . 1 78 78 TYR H H 1 8.63 0.03 . 1 . . . . . 78 TYR H . 27798 1 326 . 1 . 1 78 78 TYR C C 13 176.34 0.20 . 1 . . . . . 78 TYR C . 27798 1 327 . 1 . 1 78 78 TYR CA C 13 56.12 0.20 . 1 . . . . . 78 TYR CA . 27798 1 328 . 1 . 1 78 78 TYR CB C 13 41.66 0.20 . 1 . . . . . 78 TYR CB . 27798 1 329 . 1 . 1 78 78 TYR N N 15 118.84 0.20 . 1 . . . . . 78 TYR N . 27798 1 330 . 1 . 1 79 79 PHE H H 1 10.04 0.03 . 1 . . . . . 79 PHE H . 27798 1 331 . 1 . 1 79 79 PHE C C 13 176.46 0.20 . 1 . . . . . 79 PHE C . 27798 1 332 . 1 . 1 79 79 PHE CA C 13 60.58 0.20 . 1 . . . . . 79 PHE CA . 27798 1 333 . 1 . 1 79 79 PHE CB C 13 39.64 0.20 . 1 . . . . . 79 PHE CB . 27798 1 334 . 1 . 1 79 79 PHE N N 15 122.62 0.20 . 1 . . . . . 79 PHE N . 27798 1 335 . 1 . 1 80 80 LEU H H 1 9.40 0.03 . 1 . . . . . 80 LEU H . 27798 1 336 . 1 . 1 80 80 LEU C C 13 177.81 0.20 . 1 . . . . . 80 LEU C . 27798 1 337 . 1 . 1 80 80 LEU CA C 13 55.37 0.20 . 1 . . . . . 80 LEU CA . 27798 1 338 . 1 . 1 80 80 LEU CB C 13 41.80 0.20 . 1 . . . . . 80 LEU CB . 27798 1 339 . 1 . 1 80 80 LEU N N 15 125.22 0.20 . 1 . . . . . 80 LEU N . 27798 1 340 . 1 . 1 81 81 THR H H 1 7.49 0.03 . 1 . . . . . 81 THR H . 27798 1 341 . 1 . 1 81 81 THR C C 13 173.69 0.20 . 1 . . . . . 81 THR C . 27798 1 342 . 1 . 1 81 81 THR CA C 13 63.19 0.20 . 1 . . . . . 81 THR CA . 27798 1 343 . 1 . 1 81 81 THR CB C 13 71.38 0.20 . 1 . . . . . 81 THR CB . 27798 1 344 . 1 . 1 81 81 THR N N 15 118.59 0.20 . 1 . . . . . 81 THR N . 27798 1 345 . 1 . 1 82 82 LYS H H 1 8.49 0.03 . 1 . . . . . 82 LYS H . 27798 1 346 . 1 . 1 82 82 LYS C C 13 174.68 0.20 . 1 . . . . . 82 LYS C . 27798 1 347 . 1 . 1 82 82 LYS CA C 13 57.47 0.20 . 1 . . . . . 82 LYS CA . 27798 1 348 . 1 . 1 82 82 LYS CB C 13 31.95 0.20 . 1 . . . . . 82 LYS CB . 27798 1 349 . 1 . 1 82 82 LYS N N 15 127.74 0.20 . 1 . . . . . 82 LYS N . 27798 1 350 . 1 . 1 83 83 ILE H H 1 8.15 0.03 . 1 . . . . . 83 ILE H . 27798 1 351 . 1 . 1 83 83 ILE C C 13 171.65 0.20 . 1 . . . . . 83 ILE C . 27798 1 352 . 1 . 1 83 83 ILE CA C 13 60.04 0.20 . 1 . . . . . 83 ILE CA . 27798 1 353 . 1 . 1 83 83 ILE CB C 13 41.59 0.20 . 1 . . . . . 83 ILE CB . 27798 1 354 . 1 . 1 83 83 ILE N N 15 120.92 0.20 . 1 . . . . . 83 ILE N . 27798 1 355 . 1 . 1 84 84 PHE H H 1 8.42 0.03 . 1 . . . . . 84 PHE H . 27798 1 356 . 1 . 1 84 84 PHE C C 13 173.60 0.20 . 1 . . . . . 84 PHE C . 27798 1 357 . 1 . 1 84 84 PHE CA C 13 56.82 0.20 . 1 . . . . . 84 PHE CA . 27798 1 358 . 1 . 1 84 84 PHE CB C 13 39.97 0.20 . 1 . . . . . 84 PHE CB . 27798 1 359 . 1 . 1 84 84 PHE N N 15 128.06 0.20 . 1 . . . . . 84 PHE N . 27798 1 360 . 1 . 1 85 85 HIS H H 1 9.47 0.03 . 1 . . . . . 85 HIS H . 27798 1 361 . 1 . 1 85 85 HIS CA C 13 55.26 0.20 . 1 . . . . . 85 HIS CA . 27798 1 362 . 1 . 1 85 85 HIS CB C 13 35.18 0.20 . 1 . . . . . 85 HIS CB . 27798 1 363 . 1 . 1 85 85 HIS N N 15 129.88 0.20 . 1 . . . . . 85 HIS N . 27798 1 364 . 1 . 1 86 86 PRO C C 13 176.77 0.20 . 1 . . . . . 86 PRO C . 27798 1 365 . 1 . 1 87 87 ASN H H 1 11.50 0.03 . 1 . . . . . 87 ASN H . 27798 1 366 . 1 . 1 87 87 ASN C C 13 171.33 0.20 . 1 . . . . . 87 ASN C . 27798 1 367 . 1 . 1 87 87 ASN CA C 13 54.23 0.20 . 1 . . . . . 87 ASN CA . 27798 1 368 . 1 . 1 87 87 ASN CB C 13 41.03 0.20 . 1 . . . . . 87 ASN CB . 27798 1 369 . 1 . 1 87 87 ASN N N 15 116.37 0.20 . 1 . . . . . 87 ASN N . 27798 1 370 . 1 . 1 88 88 VAL H H 1 7.42 0.03 . 1 . . . . . 88 VAL H . 27798 1 371 . 1 . 1 88 88 VAL C C 13 176.24 0.20 . 1 . . . . . 88 VAL C . 27798 1 372 . 1 . 1 88 88 VAL CA C 13 60.83 0.20 . 1 . . . . . 88 VAL CA . 27798 1 373 . 1 . 1 88 88 VAL CB C 13 34.01 0.20 . 1 . . . . . 88 VAL CB . 27798 1 374 . 1 . 1 88 88 VAL N N 15 119.00 0.20 . 1 . . . . . 88 VAL N . 27798 1 375 . 1 . 1 89 89 GLY H H 1 9.44 0.03 . 1 . . . . . 89 GLY H . 27798 1 376 . 1 . 1 89 89 GLY CA C 13 44.66 0.20 . 1 . . . . . 89 GLY CA . 27798 1 377 . 1 . 1 89 89 GLY N N 15 112.99 0.20 . 1 . . . . . 89 GLY N . 27798 1 378 . 1 . 1 90 90 ALA C C 13 178.87 0.20 . 1 . . . . . 90 ALA C . 27798 1 379 . 1 . 1 90 90 ALA CA C 13 55.17 0.20 . 1 . . . . . 90 ALA CA . 27798 1 380 . 1 . 1 91 91 ASN H H 1 8.67 0.03 . 1 . . . . . 91 ASN H . 27798 1 381 . 1 . 1 91 91 ASN C C 13 175.66 0.20 . 1 . . . . . 91 ASN C . 27798 1 382 . 1 . 1 91 91 ASN CA C 13 52.42 0.20 . 1 . . . . . 91 ASN CA . 27798 1 383 . 1 . 1 91 91 ASN CB C 13 38.22 0.20 . 1 . . . . . 91 ASN CB . 27798 1 384 . 1 . 1 91 91 ASN N N 15 115.00 0.20 . 1 . . . . . 91 ASN N . 27798 1 385 . 1 . 1 92 92 GLY H H 1 8.20 0.03 . 1 . . . . . 92 GLY H . 27798 1 386 . 1 . 1 92 92 GLY C C 13 174.11 0.20 . 1 . . . . . 92 GLY C . 27798 1 387 . 1 . 1 92 92 GLY CA C 13 45.53 0.20 . 1 . . . . . 92 GLY CA . 27798 1 388 . 1 . 1 92 92 GLY N N 15 107.45 0.20 . 1 . . . . . 92 GLY N . 27798 1 389 . 1 . 1 93 93 GLU H H 1 8.77 0.03 . 1 . . . . . 93 GLU H . 27798 1 390 . 1 . 1 93 93 GLU C C 13 174.90 0.20 . 1 . . . . . 93 GLU C . 27798 1 391 . 1 . 1 93 93 GLU CA C 13 57.34 0.20 . 1 . . . . . 93 GLU CA . 27798 1 392 . 1 . 1 93 93 GLU CB C 13 30.09 0.20 . 1 . . . . . 93 GLU CB . 27798 1 393 . 1 . 1 93 93 GLU N N 15 122.85 0.20 . 1 . . . . . 93 GLU N . 27798 1 394 . 1 . 1 94 94 ILE H H 1 7.68 0.03 . 1 . . . . . 94 ILE H . 27798 1 395 . 1 . 1 94 94 ILE C C 13 176.04 0.20 . 1 . . . . . 94 ILE C . 27798 1 396 . 1 . 1 94 94 ILE CA C 13 60.57 0.20 . 1 . . . . . 94 ILE CA . 27798 1 397 . 1 . 1 94 94 ILE CB C 13 39.47 0.20 . 1 . . . . . 94 ILE CB . 27798 1 398 . 1 . 1 94 94 ILE N N 15 123.00 0.20 . 1 . . . . . 94 ILE N . 27798 1 399 . 1 . 1 95 95 SER H H 1 8.20 0.03 . 1 . . . . . 95 SER H . 27798 1 400 . 1 . 1 95 95 SER C C 13 175.63 0.20 . 1 . . . . . 95 SER C . 27798 1 401 . 1 . 1 95 95 SER CA C 13 58.43 0.20 . 1 . . . . . 95 SER CA . 27798 1 402 . 1 . 1 95 95 SER CB C 13 64.18 0.20 . 1 . . . . . 95 SER CB . 27798 1 403 . 1 . 1 95 95 SER N N 15 119.90 0.20 . 1 . . . . . 95 SER N . 27798 1 404 . 1 . 1 96 96 VAL H H 1 8.65 0.03 . 1 . . . . . 96 VAL H . 27798 1 405 . 1 . 1 96 96 VAL C C 13 177.33 0.20 . 1 . . . . . 96 VAL C . 27798 1 406 . 1 . 1 96 96 VAL CA C 13 64.69 0.20 . 1 . . . . . 96 VAL CA . 27798 1 407 . 1 . 1 96 96 VAL CB C 13 32.25 0.20 . 1 . . . . . 96 VAL CB . 27798 1 408 . 1 . 1 96 96 VAL N N 15 128.04 0.20 . 1 . . . . . 96 VAL N . 27798 1 409 . 1 . 1 97 97 ASN H H 1 8.26 0.03 . 1 . . . . . 97 ASN H . 27798 1 410 . 1 . 1 97 97 ASN C C 13 177.45 0.20 . 1 . . . . . 97 ASN C . 27798 1 411 . 1 . 1 97 97 ASN CA C 13 56.10 0.20 . 1 . . . . . 97 ASN CA . 27798 1 412 . 1 . 1 97 97 ASN CB C 13 37.73 0.20 . 1 . . . . . 97 ASN CB . 27798 1 413 . 1 . 1 97 97 ASN N N 15 118.30 0.20 . 1 . . . . . 97 ASN N . 27798 1 414 . 1 . 1 98 98 VAL H H 1 7.35 0.03 . 1 . . . . . 98 VAL H . 27798 1 415 . 1 . 1 98 98 VAL C C 13 176.92 0.20 . 1 . . . . . 98 VAL C . 27798 1 416 . 1 . 1 98 98 VAL CA C 13 64.39 0.20 . 1 . . . . . 98 VAL CA . 27798 1 417 . 1 . 1 98 98 VAL CB C 13 31.76 0.20 . 1 . . . . . 98 VAL CB . 27798 1 418 . 1 . 1 98 98 VAL N N 15 115.58 0.20 . 1 . . . . . 98 VAL N . 27798 1 419 . 1 . 1 99 99 LEU H H 1 7.44 0.03 . 1 . . . . . 99 LEU H . 27798 1 420 . 1 . 1 99 99 LEU C C 13 177.75 0.20 . 1 . . . . . 99 LEU C . 27798 1 421 . 1 . 1 99 99 LEU CA C 13 56.72 0.20 . 1 . . . . . 99 LEU CA . 27798 1 422 . 1 . 1 99 99 LEU CB C 13 41.75 0.20 . 1 . . . . . 99 LEU CB . 27798 1 423 . 1 . 1 99 99 LEU N N 15 118.13 0.20 . 1 . . . . . 99 LEU N . 27798 1 424 . 1 . 1 100 100 CYS H H 1 8.01 0.03 . 1 . . . . . 100 CYS H . 27798 1 425 . 1 . 1 100 100 CYS C C 13 175.75 0.20 . 1 . . . . . 100 CYS C . 27798 1 426 . 1 . 1 100 100 CYS CA C 13 59.52 0.20 . 1 . . . . . 100 CYS CA . 27798 1 427 . 1 . 1 100 100 CYS CB C 13 27.80 0.20 . 1 . . . . . 100 CYS CB . 27798 1 428 . 1 . 1 100 100 CYS N N 15 113.06 0.20 . 1 . . . . . 100 CYS N . 27798 1 429 . 1 . 1 101 101 ARG H H 1 7.48 0.03 . 1 . . . . . 101 ARG H . 27798 1 430 . 1 . 1 101 101 ARG C C 13 176.68 0.20 . 1 . . . . . 101 ARG C . 27798 1 431 . 1 . 1 101 101 ARG CA C 13 58.77 0.20 . 1 . . . . . 101 ARG CA . 27798 1 432 . 1 . 1 101 101 ARG CB C 13 30.09 0.20 . 1 . . . . . 101 ARG CB . 27798 1 433 . 1 . 1 101 101 ARG N N 15 123.07 0.20 . 1 . . . . . 101 ARG N . 27798 1 434 . 1 . 1 102 102 ASP H H 1 8.69 0.03 . 1 . . . . . 102 ASP H . 27798 1 435 . 1 . 1 102 102 ASP C C 13 174.77 0.20 . 1 . . . . . 102 ASP C . 27798 1 436 . 1 . 1 102 102 ASP CA C 13 54.41 0.20 . 1 . . . . . 102 ASP CA . 27798 1 437 . 1 . 1 102 102 ASP CB C 13 40.25 0.20 . 1 . . . . . 102 ASP CB . 27798 1 438 . 1 . 1 102 102 ASP N N 15 119.79 0.20 . 1 . . . . . 102 ASP N . 27798 1 439 . 1 . 1 103 103 TRP H H 1 7.49 0.03 . 1 . . . . . 103 TRP H . 27798 1 440 . 1 . 1 103 103 TRP CA C 13 59.35 0.20 . 1 . . . . . 103 TRP CA . 27798 1 441 . 1 . 1 103 103 TRP CB C 13 30.15 0.20 . 1 . . . . . 103 TRP CB . 27798 1 442 . 1 . 1 103 103 TRP N N 15 119.14 0.20 . 1 . . . . . 103 TRP N . 27798 1 443 . 1 . 1 104 104 THR H H 1 5.89 0.03 . 1 . . . . . 104 THR H . 27798 1 444 . 1 . 1 104 104 THR C C 13 172.20 0.20 . 1 . . . . . 104 THR C . 27798 1 445 . 1 . 1 104 104 THR CA C 13 59.42 0.20 . 1 . . . . . 104 THR CA . 27798 1 446 . 1 . 1 104 104 THR CB C 13 71.50 0.20 . 1 . . . . . 104 THR CB . 27798 1 447 . 1 . 1 104 104 THR N N 15 117.36 0.20 . 1 . . . . . 104 THR N . 27798 1 448 . 1 . 1 105 105 ALA H H 1 8.09 0.03 . 1 . . . . . 105 ALA H . 27798 1 449 . 1 . 1 105 105 ALA C C 13 178.00 0.20 . 1 . . . . . 105 ALA C . 27798 1 450 . 1 . 1 105 105 ALA CA C 13 53.81 0.20 . 1 . . . . . 105 ALA CA . 27798 1 451 . 1 . 1 105 105 ALA CB C 13 18.71 0.20 . 1 . . . . . 105 ALA CB . 27798 1 452 . 1 . 1 105 105 ALA N N 15 120.73 0.20 . 1 . . . . . 105 ALA N . 27798 1 453 . 1 . 1 106 106 GLU H H 1 7.82 0.03 . 1 . . . . . 106 GLU H . 27798 1 454 . 1 . 1 106 106 GLU C C 13 177.26 0.20 . 1 . . . . . 106 GLU C . 27798 1 455 . 1 . 1 106 106 GLU CA C 13 57.20 0.20 . 1 . . . . . 106 GLU CA . 27798 1 456 . 1 . 1 106 106 GLU CB C 13 29.52 0.20 . 1 . . . . . 106 GLU CB . 27798 1 457 . 1 . 1 106 106 GLU N N 15 114.78 0.20 . 1 . . . . . 106 GLU N . 27798 1 458 . 1 . 1 107 107 LEU H H 1 7.07 0.03 . 1 . . . . . 107 LEU H . 27798 1 459 . 1 . 1 107 107 LEU C C 13 177.51 0.20 . 1 . . . . . 107 LEU C . 27798 1 460 . 1 . 1 107 107 LEU CA C 13 55.80 0.20 . 1 . . . . . 107 LEU CA . 27798 1 461 . 1 . 1 107 107 LEU CB C 13 40.97 0.20 . 1 . . . . . 107 LEU CB . 27798 1 462 . 1 . 1 107 107 LEU N N 15 120.82 0.20 . 1 . . . . . 107 LEU N . 27798 1 463 . 1 . 1 108 108 GLY H H 1 7.36 0.03 . 1 . . . . . 108 GLY H . 27798 1 464 . 1 . 1 108 108 GLY C C 13 174.43 0.20 . 1 . . . . . 108 GLY C . 27798 1 465 . 1 . 1 108 108 GLY CA C 13 45.19 0.20 . 1 . . . . . 108 GLY CA . 27798 1 466 . 1 . 1 108 108 GLY N N 15 103.89 0.20 . 1 . . . . . 108 GLY N . 27798 1 467 . 1 . 1 109 109 ILE H H 1 10.15 0.03 . 1 . . . . . 109 ILE H . 27798 1 468 . 1 . 1 109 109 ILE C C 13 178.66 0.20 . 1 . . . . . 109 ILE C . 27798 1 469 . 1 . 1 109 109 ILE CA C 13 64.91 0.20 . 1 . . . . . 109 ILE CA . 27798 1 470 . 1 . 1 109 109 ILE CB C 13 37.74 0.20 . 1 . . . . . 109 ILE CB . 27798 1 471 . 1 . 1 109 109 ILE N N 15 121.18 0.20 . 1 . . . . . 109 ILE N . 27798 1 472 . 1 . 1 110 110 ARG H H 1 9.59 0.03 . 1 . . . . . 110 ARG H . 27798 1 473 . 1 . 1 110 110 ARG C C 13 177.18 0.20 . 1 . . . . . 110 ARG C . 27798 1 474 . 1 . 1 110 110 ARG CA C 13 61.11 0.20 . 1 . . . . . 110 ARG CA . 27798 1 475 . 1 . 1 110 110 ARG CB C 13 30.65 0.20 . 1 . . . . . 110 ARG CB . 27798 1 476 . 1 . 1 110 110 ARG N N 15 121.75 0.20 . 1 . . . . . 110 ARG N . 27798 1 477 . 1 . 1 111 111 HIS H H 1 7.73 0.03 . 1 . . . . . 111 HIS H . 27798 1 478 . 1 . 1 111 111 HIS C C 13 179.17 0.20 . 1 . . . . . 111 HIS C . 27798 1 479 . 1 . 1 111 111 HIS CA C 13 60.53 0.20 . 1 . . . . . 111 HIS CA . 27798 1 480 . 1 . 1 111 111 HIS CB C 13 32.19 0.20 . 1 . . . . . 111 HIS CB . 27798 1 481 . 1 . 1 111 111 HIS N N 15 115.79 0.20 . 1 . . . . . 111 HIS N . 27798 1 482 . 1 . 1 112 112 VAL H H 1 7.77 0.03 . 1 . . . . . 112 VAL H . 27798 1 483 . 1 . 1 112 112 VAL C C 13 177.36 0.20 . 1 . . . . . 112 VAL C . 27798 1 484 . 1 . 1 112 112 VAL CA C 13 66.48 0.20 . 1 . . . . . 112 VAL CA . 27798 1 485 . 1 . 1 112 112 VAL CB C 13 31.58 0.20 . 1 . . . . . 112 VAL CB . 27798 1 486 . 1 . 1 112 112 VAL N N 15 120.86 0.20 . 1 . . . . . 112 VAL N . 27798 1 487 . 1 . 1 113 113 LEU H H 1 8.06 0.03 . 1 . . . . . 113 LEU H . 27798 1 488 . 1 . 1 113 113 LEU C C 13 179.05 0.20 . 1 . . . . . 113 LEU C . 27798 1 489 . 1 . 1 113 113 LEU CA C 13 58.13 0.20 . 1 . . . . . 113 LEU CA . 27798 1 490 . 1 . 1 113 113 LEU CB C 13 41.01 0.20 . 1 . . . . . 113 LEU CB . 27798 1 491 . 1 . 1 113 113 LEU N N 15 118.11 0.20 . 1 . . . . . 113 LEU N . 27798 1 492 . 1 . 1 114 114 LEU H H 1 8.20 0.03 . 1 . . . . . 114 LEU H . 27798 1 493 . 1 . 1 114 114 LEU C C 13 179.77 0.20 . 1 . . . . . 114 LEU C . 27798 1 494 . 1 . 1 114 114 LEU CA C 13 57.94 0.20 . 1 . . . . . 114 LEU CA . 27798 1 495 . 1 . 1 114 114 LEU CB C 13 41.20 0.20 . 1 . . . . . 114 LEU CB . 27798 1 496 . 1 . 1 114 114 LEU N N 15 118.48 0.20 . 1 . . . . . 114 LEU N . 27798 1 497 . 1 . 1 115 115 THR H H 1 8.13 0.03 . 1 . . . . . 115 THR H . 27798 1 498 . 1 . 1 115 115 THR C C 13 176.50 0.20 . 1 . . . . . 115 THR C . 27798 1 499 . 1 . 1 115 115 THR CA C 13 67.30 0.20 . 1 . . . . . 115 THR CA . 27798 1 500 . 1 . 1 115 115 THR CB C 13 68.79 0.20 . 1 . . . . . 115 THR CB . 27798 1 501 . 1 . 1 115 115 THR N N 15 118.14 0.20 . 1 . . . . . 115 THR N . 27798 1 502 . 1 . 1 116 116 ILE H H 1 8.06 0.03 . 1 . . . . . 116 ILE H . 27798 1 503 . 1 . 1 116 116 ILE C C 13 176.63 0.20 . 1 . . . . . 116 ILE C . 27798 1 504 . 1 . 1 116 116 ILE CA C 13 65.90 0.20 . 1 . . . . . 116 ILE CA . 27798 1 505 . 1 . 1 116 116 ILE CB C 13 37.44 0.20 . 1 . . . . . 116 ILE CB . 27798 1 506 . 1 . 1 116 116 ILE N N 15 122.96 0.20 . 1 . . . . . 116 ILE N . 27798 1 507 . 1 . 1 117 117 LYS H H 1 7.91 0.03 . 1 . . . . . 117 LYS H . 27798 1 508 . 1 . 1 117 117 LYS C C 13 178.31 0.20 . 1 . . . . . 117 LYS C . 27798 1 509 . 1 . 1 117 117 LYS CA C 13 61.13 0.20 . 1 . . . . . 117 LYS CA . 27798 1 510 . 1 . 1 117 117 LYS CB C 13 32.43 0.20 . 1 . . . . . 117 LYS CB . 27798 1 511 . 1 . 1 117 117 LYS N N 15 119.34 0.20 . 1 . . . . . 117 LYS N . 27798 1 512 . 1 . 1 118 118 MET H H 1 8.06 0.03 . 1 . . . . . 118 MET H . 27798 1 513 . 1 . 1 118 118 MET C C 13 178.66 0.20 . 1 . . . . . 118 MET C . 27798 1 514 . 1 . 1 118 118 MET CA C 13 57.68 0.20 . 1 . . . . . 118 MET CA . 27798 1 515 . 1 . 1 118 118 MET CB C 13 31.26 0.20 . 1 . . . . . 118 MET CB . 27798 1 516 . 1 . 1 118 118 MET N N 15 115.23 0.20 . 1 . . . . . 118 MET N . 27798 1 517 . 1 . 1 119 119 LEU H H 1 8.08 0.03 . 1 . . . . . 119 LEU H . 27798 1 518 . 1 . 1 119 119 LEU C C 13 180.47 0.20 . 1 . . . . . 119 LEU C . 27798 1 519 . 1 . 1 119 119 LEU CA C 13 56.56 0.20 . 1 . . . . . 119 LEU CA . 27798 1 520 . 1 . 1 119 119 LEU CB C 13 42.69 0.20 . 1 . . . . . 119 LEU CB . 27798 1 521 . 1 . 1 119 119 LEU N N 15 121.64 0.20 . 1 . . . . . 119 LEU N . 27798 1 522 . 1 . 1 120 120 LEU H H 1 7.71 0.03 . 1 . . . . . 120 LEU H . 27798 1 523 . 1 . 1 120 120 LEU C C 13 176.55 0.20 . 1 . . . . . 120 LEU C . 27798 1 524 . 1 . 1 120 120 LEU CA C 13 58.25 0.20 . 1 . . . . . 120 LEU CA . 27798 1 525 . 1 . 1 120 120 LEU CB C 13 41.10 0.20 . 1 . . . . . 120 LEU CB . 27798 1 526 . 1 . 1 120 120 LEU N N 15 118.82 0.20 . 1 . . . . . 120 LEU N . 27798 1 527 . 1 . 1 121 121 ILE H H 1 7.15 0.03 . 1 . . . . . 121 ILE H . 27798 1 528 . 1 . 1 121 121 ILE C C 13 175.89 0.20 . 1 . . . . . 121 ILE C . 27798 1 529 . 1 . 1 121 121 ILE CA C 13 63.87 0.20 . 1 . . . . . 121 ILE CA . 27798 1 530 . 1 . 1 121 121 ILE CB C 13 39.52 0.20 . 1 . . . . . 121 ILE CB . 27798 1 531 . 1 . 1 121 121 ILE N N 15 117.32 0.20 . 1 . . . . . 121 ILE N . 27798 1 532 . 1 . 1 122 122 HIS H H 1 8.66 0.03 . 1 . . . . . 122 HIS H . 27798 1 533 . 1 . 1 122 122 HIS CA C 13 52.38 0.20 . 1 . . . . . 122 HIS CA . 27798 1 534 . 1 . 1 122 122 HIS CB C 13 30.59 0.20 . 1 . . . . . 122 HIS CB . 27798 1 535 . 1 . 1 122 122 HIS N N 15 117.11 0.20 . 1 . . . . . 122 HIS N . 27798 1 536 . 1 . 1 123 123 PRO C C 13 174.99 0.20 . 1 . . . . . 123 PRO C . 27798 1 537 . 1 . 1 123 123 PRO CA C 13 62.67 0.20 . 1 . . . . . 123 PRO CA . 27798 1 538 . 1 . 1 123 123 PRO CB C 13 32.30 0.20 . 1 . . . . . 123 PRO CB . 27798 1 539 . 1 . 1 124 124 ASN H H 1 9.02 0.03 . 1 . . . . . 124 ASN H . 27798 1 540 . 1 . 1 124 124 ASN CA C 13 50.04 0.20 . 1 . . . . . 124 ASN CA . 27798 1 541 . 1 . 1 124 124 ASN CB C 13 40.46 0.20 . 1 . . . . . 124 ASN CB . 27798 1 542 . 1 . 1 124 124 ASN N N 15 120.13 0.20 . 1 . . . . . 124 ASN N . 27798 1 543 . 1 . 1 125 125 PRO C C 13 176.33 0.20 . 1 . . . . . 125 PRO C . 27798 1 544 . 1 . 1 125 125 PRO CA C 13 64.30 0.20 . 1 . . . . . 125 PRO CA . 27798 1 545 . 1 . 1 125 125 PRO CB C 13 32.31 0.20 . 1 . . . . . 125 PRO CB . 27798 1 546 . 1 . 1 126 126 GLU H H 1 8.23 0.03 . 1 . . . . . 126 GLU H . 27798 1 547 . 1 . 1 126 126 GLU C C 13 176.23 0.20 . 1 . . . . . 126 GLU C . 27798 1 548 . 1 . 1 126 126 GLU CA C 13 57.63 0.20 . 1 . . . . . 126 GLU CA . 27798 1 549 . 1 . 1 126 126 GLU CB C 13 29.58 0.20 . 1 . . . . . 126 GLU CB . 27798 1 550 . 1 . 1 126 126 GLU N N 15 118.86 0.20 . 1 . . . . . 126 GLU N . 27798 1 551 . 1 . 1 127 127 SER H H 1 7.59 0.03 . 1 . . . . . 127 SER H . 27798 1 552 . 1 . 1 127 127 SER C C 13 174.57 0.20 . 1 . . . . . 127 SER C . 27798 1 553 . 1 . 1 127 127 SER CA C 13 56.53 0.20 . 1 . . . . . 127 SER CA . 27798 1 554 . 1 . 1 127 127 SER CB C 13 62.65 0.20 . 1 . . . . . 127 SER CB . 27798 1 555 . 1 . 1 127 127 SER N N 15 115.23 0.20 . 1 . . . . . 127 SER N . 27798 1 556 . 1 . 1 128 128 ALA H H 1 7.80 0.03 . 1 . . . . . 128 ALA H . 27798 1 557 . 1 . 1 128 128 ALA C C 13 177.33 0.20 . 1 . . . . . 128 ALA C . 27798 1 558 . 1 . 1 128 128 ALA CA C 13 52.57 0.20 . 1 . . . . . 128 ALA CA . 27798 1 559 . 1 . 1 128 128 ALA CB C 13 18.85 0.20 . 1 . . . . . 128 ALA CB . 27798 1 560 . 1 . 1 128 128 ALA N N 15 124.36 0.20 . 1 . . . . . 128 ALA N . 27798 1 561 . 1 . 1 129 129 LEU H H 1 8.02 0.03 . 1 . . . . . 129 LEU H . 27798 1 562 . 1 . 1 129 129 LEU C C 13 177.42 0.20 . 1 . . . . . 129 LEU C . 27798 1 563 . 1 . 1 129 129 LEU CA C 13 55.70 0.20 . 1 . . . . . 129 LEU CA . 27798 1 564 . 1 . 1 129 129 LEU CB C 13 43.83 0.20 . 1 . . . . . 129 LEU CB . 27798 1 565 . 1 . 1 129 129 LEU N N 15 122.58 0.20 . 1 . . . . . 129 LEU N . 27798 1 566 . 1 . 1 130 130 ASN H H 1 7.79 0.03 . 1 . . . . . 130 ASN H . 27798 1 567 . 1 . 1 130 130 ASN C C 13 175.66 0.20 . 1 . . . . . 130 ASN C . 27798 1 568 . 1 . 1 130 130 ASN CA C 13 51.62 0.20 . 1 . . . . . 130 ASN CA . 27798 1 569 . 1 . 1 130 130 ASN CB C 13 37.80 0.20 . 1 . . . . . 130 ASN CB . 27798 1 570 . 1 . 1 130 130 ASN N N 15 117.40 0.20 . 1 . . . . . 130 ASN N . 27798 1 571 . 1 . 1 131 131 GLU H H 1 8.84 0.03 . 1 . . . . . 131 GLU H . 27798 1 572 . 1 . 1 131 131 GLU C C 13 178.65 0.20 . 1 . . . . . 131 GLU C . 27798 1 573 . 1 . 1 131 131 GLU CA C 13 59.62 0.20 . 1 . . . . . 131 GLU CA . 27798 1 574 . 1 . 1 131 131 GLU CB C 13 29.55 0.20 . 1 . . . . . 131 GLU CB . 27798 1 575 . 1 . 1 131 131 GLU N N 15 124.26 0.20 . 1 . . . . . 131 GLU N . 27798 1 576 . 1 . 1 132 132 GLU H H 1 8.33 0.03 . 1 . . . . . 132 GLU H . 27798 1 577 . 1 . 1 132 132 GLU C C 13 178.32 0.20 . 1 . . . . . 132 GLU C . 27798 1 578 . 1 . 1 132 132 GLU CA C 13 59.36 0.20 . 1 . . . . . 132 GLU CA . 27798 1 579 . 1 . 1 132 132 GLU CB C 13 29.72 0.20 . 1 . . . . . 132 GLU CB . 27798 1 580 . 1 . 1 132 132 GLU N N 15 121.04 0.20 . 1 . . . . . 132 GLU N . 27798 1 581 . 1 . 1 133 133 ALA H H 1 7.23 0.03 . 1 . . . . . 133 ALA H . 27798 1 582 . 1 . 1 133 133 ALA C C 13 179.05 0.20 . 1 . . . . . 133 ALA C . 27798 1 583 . 1 . 1 133 133 ALA CA C 13 54.91 0.20 . 1 . . . . . 133 ALA CA . 27798 1 584 . 1 . 1 133 133 ALA CB C 13 16.42 0.20 . 1 . . . . . 133 ALA CB . 27798 1 585 . 1 . 1 133 133 ALA N N 15 119.25 0.20 . 1 . . . . . 133 ALA N . 27798 1 586 . 1 . 1 134 134 GLY H H 1 8.26 0.03 . 1 . . . . . 134 GLY H . 27798 1 587 . 1 . 1 134 134 GLY C C 13 174.00 0.20 . 1 . . . . . 134 GLY C . 27798 1 588 . 1 . 1 134 134 GLY CA C 13 47.45 0.20 . 1 . . . . . 134 GLY CA . 27798 1 589 . 1 . 1 134 134 GLY N N 15 102.85 0.20 . 1 . . . . . 134 GLY N . 27798 1 590 . 1 . 1 135 135 ARG H H 1 8.13 0.03 . 1 . . . . . 135 ARG H . 27798 1 591 . 1 . 1 135 135 ARG C C 13 178.47 0.20 . 1 . . . . . 135 ARG C . 27798 1 592 . 1 . 1 135 135 ARG CA C 13 59.42 0.20 . 1 . . . . . 135 ARG CA . 27798 1 593 . 1 . 1 135 135 ARG CB C 13 30.03 0.20 . 1 . . . . . 135 ARG CB . 27798 1 594 . 1 . 1 135 135 ARG N N 15 120.38 0.20 . 1 . . . . . 135 ARG N . 27798 1 595 . 1 . 1 136 136 LEU H H 1 8.19 0.03 . 1 . . . . . 136 LEU H . 27798 1 596 . 1 . 1 136 136 LEU C C 13 177.82 0.20 . 1 . . . . . 136 LEU C . 27798 1 597 . 1 . 1 136 136 LEU CA C 13 57.78 0.20 . 1 . . . . . 136 LEU CA . 27798 1 598 . 1 . 1 136 136 LEU CB C 13 43.21 0.20 . 1 . . . . . 136 LEU CB . 27798 1 599 . 1 . 1 136 136 LEU N N 15 118.60 0.20 . 1 . . . . . 136 LEU N . 27798 1 600 . 1 . 1 137 137 LEU H H 1 7.84 0.03 . 1 . . . . . 137 LEU H . 27798 1 601 . 1 . 1 137 137 LEU C C 13 177.23 0.20 . 1 . . . . . 137 LEU C . 27798 1 602 . 1 . 1 137 137 LEU CA C 13 59.06 0.20 . 1 . . . . . 137 LEU CA . 27798 1 603 . 1 . 1 137 137 LEU CB C 13 41.85 0.20 . 1 . . . . . 137 LEU CB . 27798 1 604 . 1 . 1 137 137 LEU N N 15 118.25 0.20 . 1 . . . . . 137 LEU N . 27798 1 605 . 1 . 1 138 138 LEU H H 1 6.83 0.03 . 1 . . . . . 138 LEU H . 27798 1 606 . 1 . 1 138 138 LEU C C 13 179.39 0.20 . 1 . . . . . 138 LEU C . 27798 1 607 . 1 . 1 138 138 LEU CA C 13 56.37 0.20 . 1 . . . . . 138 LEU CA . 27798 1 608 . 1 . 1 138 138 LEU CB C 13 43.32 0.20 . 1 . . . . . 138 LEU CB . 27798 1 609 . 1 . 1 138 138 LEU N N 15 112.98 0.20 . 1 . . . . . 138 LEU N . 27798 1 610 . 1 . 1 139 139 GLU H H 1 8.53 0.03 . 1 . . . . . 139 GLU H . 27798 1 611 . 1 . 1 139 139 GLU C C 13 177.54 0.20 . 1 . . . . . 139 GLU C . 27798 1 612 . 1 . 1 139 139 GLU CA C 13 58.05 0.20 . 1 . . . . . 139 GLU CA . 27798 1 613 . 1 . 1 139 139 GLU CB C 13 31.68 0.20 . 1 . . . . . 139 GLU CB . 27798 1 614 . 1 . 1 139 139 GLU N N 15 117.73 0.20 . 1 . . . . . 139 GLU N . 27798 1 615 . 1 . 1 140 140 ASN H H 1 9.16 0.03 . 1 . . . . . 140 ASN H . 27798 1 616 . 1 . 1 140 140 ASN C C 13 173.69 0.20 . 1 . . . . . 140 ASN C . 27798 1 617 . 1 . 1 140 140 ASN CA C 13 52.55 0.20 . 1 . . . . . 140 ASN CA . 27798 1 618 . 1 . 1 140 140 ASN CB C 13 37.69 0.20 . 1 . . . . . 140 ASN CB . 27798 1 619 . 1 . 1 140 140 ASN N N 15 118.52 0.20 . 1 . . . . . 140 ASN N . 27798 1 620 . 1 . 1 141 141 TYR H H 1 9.13 0.03 . 1 . . . . . 141 TYR H . 27798 1 621 . 1 . 1 141 141 TYR C C 13 176.98 0.20 . 1 . . . . . 141 TYR C . 27798 1 622 . 1 . 1 141 141 TYR CA C 13 63.47 0.20 . 1 . . . . . 141 TYR CA . 27798 1 623 . 1 . 1 141 141 TYR CB C 13 38.55 0.20 . 1 . . . . . 141 TYR CB . 27798 1 624 . 1 . 1 141 141 TYR N N 15 126.82 0.20 . 1 . . . . . 141 TYR N . 27798 1 625 . 1 . 1 142 142 GLU H H 1 8.74 0.03 . 1 . . . . . 142 GLU H . 27798 1 626 . 1 . 1 142 142 GLU C C 13 179.50 0.20 . 1 . . . . . 142 GLU C . 27798 1 627 . 1 . 1 142 142 GLU CA C 13 59.81 0.20 . 1 . . . . . 142 GLU CA . 27798 1 628 . 1 . 1 142 142 GLU CB C 13 29.14 0.20 . 1 . . . . . 142 GLU CB . 27798 1 629 . 1 . 1 142 142 GLU N N 15 115.64 0.20 . 1 . . . . . 142 GLU N . 27798 1 630 . 1 . 1 143 143 GLU H H 1 7.59 0.03 . 1 . . . . . 143 GLU H . 27798 1 631 . 1 . 1 143 143 GLU C C 13 178.98 0.20 . 1 . . . . . 143 GLU C . 27798 1 632 . 1 . 1 143 143 GLU CA C 13 58.49 0.20 . 1 . . . . . 143 GLU CA . 27798 1 633 . 1 . 1 143 143 GLU CB C 13 29.67 0.20 . 1 . . . . . 143 GLU CB . 27798 1 634 . 1 . 1 143 143 GLU N N 15 121.11 0.20 . 1 . . . . . 143 GLU N . 27798 1 635 . 1 . 1 144 144 TYR H H 1 7.81 0.03 . 1 . . . . . 144 TYR H . 27798 1 636 . 1 . 1 144 144 TYR C C 13 175.64 0.20 . 1 . . . . . 144 TYR C . 27798 1 637 . 1 . 1 144 144 TYR CA C 13 61.33 0.20 . 1 . . . . . 144 TYR CA . 27798 1 638 . 1 . 1 144 144 TYR CB C 13 36.69 0.20 . 1 . . . . . 144 TYR CB . 27798 1 639 . 1 . 1 144 144 TYR N N 15 121.23 0.20 . 1 . . . . . 144 TYR N . 27798 1 640 . 1 . 1 145 145 ALA H H 1 8.67 0.03 . 1 . . . . . 145 ALA H . 27798 1 641 . 1 . 1 145 145 ALA C C 13 179.24 0.20 . 1 . . . . . 145 ALA C . 27798 1 642 . 1 . 1 145 145 ALA CA C 13 54.94 0.20 . 1 . . . . . 145 ALA CA . 27798 1 643 . 1 . 1 145 145 ALA CB C 13 17.56 0.20 . 1 . . . . . 145 ALA CB . 27798 1 644 . 1 . 1 145 145 ALA N N 15 121.51 0.20 . 1 . . . . . 145 ALA N . 27798 1 645 . 1 . 1 146 146 ALA H H 1 7.83 0.03 . 1 . . . . . 146 ALA H . 27798 1 646 . 1 . 1 146 146 ALA C C 13 180.76 0.20 . 1 . . . . . 146 ALA C . 27798 1 647 . 1 . 1 146 146 ALA CA C 13 55.00 0.20 . 1 . . . . . 146 ALA CA . 27798 1 648 . 1 . 1 146 146 ALA CB C 13 18.09 0.20 . 1 . . . . . 146 ALA CB . 27798 1 649 . 1 . 1 146 146 ALA N N 15 119.66 0.20 . 1 . . . . . 146 ALA N . 27798 1 650 . 1 . 1 147 147 ARG H H 1 7.84 0.03 . 1 . . . . . 147 ARG H . 27798 1 651 . 1 . 1 147 147 ARG C C 13 178.50 0.20 . 1 . . . . . 147 ARG C . 27798 1 652 . 1 . 1 147 147 ARG CA C 13 58.47 0.20 . 1 . . . . . 147 ARG CA . 27798 1 653 . 1 . 1 147 147 ARG CB C 13 29.16 0.20 . 1 . . . . . 147 ARG CB . 27798 1 654 . 1 . 1 147 147 ARG N N 15 119.63 0.20 . 1 . . . . . 147 ARG N . 27798 1 655 . 1 . 1 148 148 ALA H H 1 8.46 0.03 . 1 . . . . . 148 ALA H . 27798 1 656 . 1 . 1 148 148 ALA C C 13 180.76 0.20 . 1 . . . . . 148 ALA C . 27798 1 657 . 1 . 1 148 148 ALA CA C 13 55.02 0.20 . 1 . . . . . 148 ALA CA . 27798 1 658 . 1 . 1 148 148 ALA CB C 13 17.75 0.20 . 1 . . . . . 148 ALA CB . 27798 1 659 . 1 . 1 148 148 ALA N N 15 120.49 0.20 . 1 . . . . . 148 ALA N . 27798 1 660 . 1 . 1 149 149 ARG H H 1 8.52 0.03 . 1 . . . . . 149 ARG H . 27798 1 661 . 1 . 1 149 149 ARG C C 13 178.50 0.20 . 1 . . . . . 149 ARG C . 27798 1 662 . 1 . 1 149 149 ARG CA C 13 59.01 0.20 . 1 . . . . . 149 ARG CA . 27798 1 663 . 1 . 1 149 149 ARG CB C 13 30.59 0.20 . 1 . . . . . 149 ARG CB . 27798 1 664 . 1 . 1 149 149 ARG N N 15 121.05 0.20 . 1 . . . . . 149 ARG N . 27798 1 665 . 1 . 1 150 150 LEU H H 1 7.87 0.03 . 1 . . . . . 150 LEU H . 27798 1 666 . 1 . 1 150 150 LEU C C 13 179.03 0.20 . 1 . . . . . 150 LEU C . 27798 1 667 . 1 . 1 150 150 LEU CA C 13 57.93 0.20 . 1 . . . . . 150 LEU CA . 27798 1 668 . 1 . 1 150 150 LEU CB C 13 41.73 0.20 . 1 . . . . . 150 LEU CB . 27798 1 669 . 1 . 1 150 150 LEU N N 15 121.42 0.20 . 1 . . . . . 150 LEU N . 27798 1 670 . 1 . 1 151 151 LEU H H 1 7.71 0.03 . 1 . . . . . 151 LEU H . 27798 1 671 . 1 . 1 151 151 LEU C C 13 180.23 0.20 . 1 . . . . . 151 LEU C . 27798 1 672 . 1 . 1 151 151 LEU CA C 13 57.60 0.20 . 1 . . . . . 151 LEU CA . 27798 1 673 . 1 . 1 151 151 LEU CB C 13 41.32 0.20 . 1 . . . . . 151 LEU CB . 27798 1 674 . 1 . 1 151 151 LEU N N 15 116.14 0.20 . 1 . . . . . 151 LEU N . 27798 1 675 . 1 . 1 152 152 THR H H 1 7.95 0.03 . 1 . . . . . 152 THR H . 27798 1 676 . 1 . 1 152 152 THR C C 13 175.79 0.20 . 1 . . . . . 152 THR C . 27798 1 677 . 1 . 1 152 152 THR CA C 13 67.31 0.20 . 1 . . . . . 152 THR CA . 27798 1 678 . 1 . 1 152 152 THR CB C 13 68.61 0.20 . 1 . . . . . 152 THR CB . 27798 1 679 . 1 . 1 152 152 THR N N 15 121.31 0.20 . 1 . . . . . 152 THR N . 27798 1 680 . 1 . 1 153 153 GLU H H 1 8.29 0.03 . 1 . . . . . 153 GLU H . 27798 1 681 . 1 . 1 153 153 GLU C C 13 177.84 0.20 . 1 . . . . . 153 GLU C . 27798 1 682 . 1 . 1 153 153 GLU CA C 13 58.56 0.20 . 1 . . . . . 153 GLU CA . 27798 1 683 . 1 . 1 153 153 GLU CB C 13 29.56 0.20 . 1 . . . . . 153 GLU CB . 27798 1 684 . 1 . 1 153 153 GLU N N 15 124.22 0.20 . 1 . . . . . 153 GLU N . 27798 1 685 . 1 . 1 154 154 ILE H H 1 7.87 0.03 . 1 . . . . . 154 ILE H . 27798 1 686 . 1 . 1 154 154 ILE C C 13 177.35 0.20 . 1 . . . . . 154 ILE C . 27798 1 687 . 1 . 1 154 154 ILE CA C 13 63.42 0.20 . 1 . . . . . 154 ILE CA . 27798 1 688 . 1 . 1 154 154 ILE CB C 13 39.47 0.20 . 1 . . . . . 154 ILE CB . 27798 1 689 . 1 . 1 154 154 ILE N N 15 118.62 0.20 . 1 . . . . . 154 ILE N . 27798 1 690 . 1 . 1 155 155 HIS H H 1 8.20 0.03 . 1 . . . . . 155 HIS H . 27798 1 691 . 1 . 1 155 155 HIS C C 13 175.43 0.20 . 1 . . . . . 155 HIS C . 27798 1 692 . 1 . 1 155 155 HIS CA C 13 56.92 0.20 . 1 . . . . . 155 HIS CA . 27798 1 693 . 1 . 1 155 155 HIS CB C 13 32.22 0.20 . 1 . . . . . 155 HIS CB . 27798 1 694 . 1 . 1 155 155 HIS N N 15 118.02 0.20 . 1 . . . . . 155 HIS N . 27798 1 695 . 1 . 1 156 156 GLY H H 1 8.23 0.03 . 1 . . . . . 156 GLY H . 27798 1 696 . 1 . 1 156 156 GLY CA C 13 45.98 0.20 . 1 . . . . . 156 GLY CA . 27798 1 697 . 1 . 1 156 156 GLY N N 15 115.67 0.20 . 1 . . . . . 156 GLY N . 27798 1 stop_ save_