################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30957 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.07 _Assigned_chem_shift_list.Chem_shift_13C_err 0.25 _Assigned_chem_shift_list.Chem_shift_15N_err 0.3 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err 0.4 _Assigned_chem_shift_list.Error_derivation_method linewidth _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 solid-state hNH' . . . 30957 1 2 '3D solid-state hCANH' . . . 30957 1 3 '3D solid-state hCONH' . . . 30957 1 4 '3D solid-state hCA(CO)NH' . . . 30957 1 5 '3D solid-state hCO(CA)NH' . . . 30957 1 6 '2D hNH-resolved 1H-19F REDOR' . . . 30957 1 7 '3D solid-state H(NCACO)NH' . . . 30957 1 8 '3D solid-state hN(CACO)NH' . . . 30957 1 9 '3D solid-state h(CA)CB(CACO)NH' . . . 30957 1 10 '3D solid-state h(CA)CB(CA)NH' . . . 30957 1 11 '2D FF Exchange' . . . 30957 1 12 '2D water-edited solid-state hNH' . . . 30957 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 7 7 LEU H H 1 7.69 0.07 . 1 . . . . A 7 LEU H . 30957 1 2 . 1 . 1 7 7 LEU C C 13 177.90 0.25 . 1 . . . . A 7 LEU C . 30957 1 3 . 1 . 1 7 7 LEU CA C 13 57.41 0.25 . 1 . . . . A 7 LEU CA . 30957 1 4 . 1 . 1 7 7 LEU CB C 13 40.19 0.25 . 1 . . . . A 7 LEU CB . 30957 1 5 . 1 . 1 7 7 LEU N N 15 117.80 0.30 . 1 . . . . A 7 LEU N . 30957 1 6 . 1 . 1 8 8 GLY H H 1 8.28 0.07 . 1 . . . . A 8 GLY H . 30957 1 7 . 1 . 1 8 8 GLY C C 13 174.90 0.25 . 1 . . . . A 8 GLY C . 30957 1 8 . 1 . 1 8 8 GLY CA C 13 47.33 0.25 . 1 . . . . A 8 GLY CA . 30957 1 9 . 1 . 1 8 8 GLY N N 15 104.90 0.30 . 1 . . . . A 8 GLY N . 30957 1 10 . 1 . 1 9 9 GLY H H 1 8.09 0.07 . 1 . . . . A 9 GLY H . 30957 1 11 . 1 . 1 9 9 GLY C C 13 173.50 0.25 . 1 . . . . A 9 GLY C . 30957 1 12 . 1 . 1 9 9 GLY CA C 13 47.65 0.25 . 1 . . . . A 9 GLY CA . 30957 1 13 . 1 . 1 9 9 GLY N N 15 107.10 0.30 . 1 . . . . A 9 GLY N . 30957 1 14 . 1 . 1 10 10 ALA H H 1 8.34 0.07 . 1 . . . . A 10 ALA H . 30957 1 15 . 1 . 1 10 10 ALA C C 13 180.70 0.25 . 1 . . . . A 10 ALA C . 30957 1 16 . 1 . 1 10 10 ALA CA C 13 55.23 0.25 . 1 . . . . A 10 ALA CA . 30957 1 17 . 1 . 1 10 10 ALA CB C 13 16.95 0.25 . 1 . . . . A 10 ALA CB . 30957 1 18 . 1 . 1 10 10 ALA N N 15 125.20 0.30 . 1 . . . . A 10 ALA N . 30957 1 19 . 1 . 1 11 11 ILE H H 1 7.55 0.07 . 1 . . . . A 11 ILE H . 30957 1 20 . 1 . 1 11 11 ILE C C 13 177.40 0.25 . 1 . . . . A 11 ILE C . 30957 1 21 . 1 . 1 11 11 ILE CA C 13 64.27 0.25 . 1 . . . . A 11 ILE CA . 30957 1 22 . 1 . 1 11 11 ILE CB C 13 36.77 0.25 . 1 . . . . A 11 ILE CB . 30957 1 23 . 1 . 1 11 11 ILE N N 15 120.80 0.30 . 1 . . . . A 11 ILE N . 30957 1 24 . 1 . 1 12 12 LEU H H 1 7.50 0.07 . 1 . . . . A 12 LEU H . 30957 1 25 . 1 . 1 12 12 LEU C C 13 177.60 0.25 . 1 . . . . A 12 LEU C . 30957 1 26 . 1 . 1 12 12 LEU CA C 13 57.30 0.25 . 1 . . . . A 12 LEU CA . 30957 1 27 . 1 . 1 12 12 LEU CB C 13 40.44 0.25 . 1 . . . . A 12 LEU CB . 30957 1 28 . 1 . 1 12 12 LEU N N 15 118.20 0.30 . 1 . . . . A 12 LEU N . 30957 1 29 . 1 . 1 13 13 ALA H H 1 8.23 0.07 . 1 . . . . A 13 ALA H . 30957 1 30 . 1 . 1 13 13 ALA C C 13 179.10 0.25 . 1 . . . . A 13 ALA C . 30957 1 31 . 1 . 1 13 13 ALA CA C 13 55.26 0.25 . 1 . . . . A 13 ALA CA . 30957 1 32 . 1 . 1 13 13 ALA CB C 13 16.29 0.25 . 1 . . . . A 13 ALA CB . 30957 1 33 . 1 . 1 13 13 ALA N N 15 117.50 0.30 . 1 . . . . A 13 ALA N . 30957 1 34 . 1 . 1 14 14 GLU H H 1 7.53 0.07 . 1 . . . . A 14 GLU H . 30957 1 35 . 1 . 1 14 14 GLU C C 13 177.60 0.25 . 1 . . . . A 14 GLU C . 30957 1 36 . 1 . 1 14 14 GLU CA C 13 60.64 0.25 . 1 . . . . A 14 GLU CA . 30957 1 37 . 1 . 1 14 14 GLU CB C 13 28.97 0.25 . 1 . . . . A 14 GLU CB . 30957 1 38 . 1 . 1 14 14 GLU N N 15 118.60 0.30 . 1 . . . . A 14 GLU N . 30957 1 39 . 1 . 1 15 15 VAL H H 1 8.51 0.07 . 1 . . . . A 15 VAL H . 30957 1 40 . 1 . 1 15 15 VAL C C 13 180.30 0.25 . 1 . . . . A 15 VAL C . 30957 1 41 . 1 . 1 15 15 VAL CA C 13 65.41 0.25 . 1 . . . . A 15 VAL CA . 30957 1 42 . 1 . 1 15 15 VAL CB C 13 30.37 0.25 . 1 . . . . A 15 VAL CB . 30957 1 43 . 1 . 1 15 15 VAL N N 15 115.50 0.30 . 1 . . . . A 15 VAL N . 30957 1 44 . 1 . 1 16 16 ILE H H 1 7.95 0.07 . 1 . . . . A 16 ILE H . 30957 1 45 . 1 . 1 16 16 ILE C C 13 177.70 0.25 . 1 . . . . A 16 ILE C . 30957 1 46 . 1 . 1 16 16 ILE CA C 13 65.71 0.25 . 1 . . . . A 16 ILE CA . 30957 1 47 . 1 . 1 16 16 ILE N N 15 122.80 0.30 . 1 . . . . A 16 ILE N . 30957 1 48 . 1 . 1 17 17 GLY H H 1 8.31 0.07 . 1 . . . . A 17 GLY H . 30957 1 49 . 1 . 1 17 17 GLY C C 13 175.60 0.25 . 1 . . . . A 17 GLY C . 30957 1 50 . 1 . 1 17 17 GLY CA C 13 47.95 0.25 . 1 . . . . A 17 GLY CA . 30957 1 51 . 1 . 1 17 17 GLY N N 15 110.20 0.30 . 1 . . . . A 17 GLY N . 30957 1 52 . 1 . 1 18 18 THR H H 1 10.11 0.07 . 1 . . . . A 18 THR H . 30957 1 53 . 1 . 1 18 18 THR C C 13 175.60 0.25 . 1 . . . . A 18 THR C . 30957 1 54 . 1 . 1 18 18 THR CA C 13 65.54 0.25 . 1 . . . . A 18 THR CA . 30957 1 55 . 1 . 1 18 18 THR CB C 13 67.26 0.25 . 1 . . . . A 18 THR CB . 30957 1 56 . 1 . 1 18 18 THR N N 15 124.00 0.30 . 1 . . . . A 18 THR N . 30957 1 57 . 1 . 1 19 19 THR H H 1 7.56 0.07 . 1 . . . . A 19 THR H . 30957 1 58 . 1 . 1 19 19 THR C C 13 177.80 0.25 . 1 . . . . A 19 THR C . 30957 1 59 . 1 . 1 19 19 THR CA C 13 67.53 0.25 . 1 . . . . A 19 THR CA . 30957 1 60 . 1 . 1 19 19 THR CB C 13 67.52 0.25 . 1 . . . . A 19 THR CB . 30957 1 61 . 1 . 1 19 19 THR N N 15 121.10 0.30 . 1 . . . . A 19 THR N . 30957 1 62 . 1 . 1 20 20 LEU H H 1 8.08 0.07 . 1 . . . . A 20 LEU H . 30957 1 63 . 1 . 1 20 20 LEU C C 13 178.20 0.25 . 1 . . . . A 20 LEU C . 30957 1 64 . 1 . 1 20 20 LEU CA C 13 57.66 0.25 . 1 . . . . A 20 LEU CA . 30957 1 65 . 1 . 1 20 20 LEU CB C 13 39.83 0.25 . 1 . . . . A 20 LEU CB . 30957 1 66 . 1 . 1 20 20 LEU N N 15 121.90 0.30 . 1 . . . . A 20 LEU N . 30957 1 67 . 1 . 1 21 21 MET H H 1 8.27 0.07 . 1 . . . . A 21 MET H . 30957 1 68 . 1 . 1 21 21 MET C C 13 182.00 0.25 . 1 . . . . A 21 MET C . 30957 1 69 . 1 . 1 21 21 MET CA C 13 58.38 0.25 . 1 . . . . A 21 MET CA . 30957 1 70 . 1 . 1 21 21 MET CB C 13 32.28 0.25 . 1 . . . . A 21 MET CB . 30957 1 71 . 1 . 1 21 21 MET N N 15 121.80 0.30 . 1 . . . . A 21 MET N . 30957 1 72 . 1 . 1 22 22 LYS H H 1 7.42 0.07 . 1 . . . . A 22 LYS H . 30957 1 73 . 1 . 1 22 22 LYS C C 13 178.40 0.25 . 1 . . . . A 22 LYS C . 30957 1 74 . 1 . 1 22 22 LYS CA C 13 59.97 0.25 . 1 . . . . A 22 LYS CA . 30957 1 75 . 1 . 1 22 22 LYS CB C 13 29.93 0.25 . 1 . . . . A 22 LYS CB . 30957 1 76 . 1 . 1 22 22 LYS N N 15 125.50 0.30 . 1 . . . . A 22 LYS N . 30957 1 77 . 1 . 1 23 23 PHE H H 1 7.02 0.07 . 1 . . . . A 23 PHE H . 30957 1 78 . 1 . 1 23 23 PHE C C 13 175.00 0.25 . 1 . . . . A 23 PHE C . 30957 1 79 . 1 . 1 23 23 PHE CA C 13 60.14 0.25 . 1 . . . . A 23 PHE CA . 30957 1 80 . 1 . 1 23 23 PHE CB C 13 40.53 0.25 . 1 . . . . A 23 PHE CB . 30957 1 81 . 1 . 1 23 23 PHE N N 15 119.90 0.30 . 1 . . . . A 23 PHE N . 30957 1 82 . 1 . 1 24 24 SER H H 1 7.75 0.07 . 1 . . . . A 24 SER H . 30957 1 83 . 1 . 1 24 24 SER C C 13 173.20 0.25 . 1 . . . . A 24 SER C . 30957 1 84 . 1 . 1 24 24 SER CA C 13 60.16 0.25 . 1 . . . . A 24 SER CA . 30957 1 85 . 1 . 1 24 24 SER CB C 13 63.70 0.25 . 1 . . . . A 24 SER CB . 30957 1 86 . 1 . 1 24 24 SER N N 15 112.40 0.30 . 1 . . . . A 24 SER N . 30957 1 87 . 1 . 1 25 25 GLU H H 1 7.41 0.07 . 1 . . . . A 25 GLU H . 30957 1 88 . 1 . 1 25 25 GLU C C 13 177.90 0.25 . 1 . . . . A 25 GLU C . 30957 1 89 . 1 . 1 25 25 GLU CA C 13 55.90 0.25 . 1 . . . . A 25 GLU CA . 30957 1 90 . 1 . 1 25 25 GLU CB C 13 25.50 0.25 . 1 . . . . A 25 GLU CB . 30957 1 91 . 1 . 1 25 25 GLU N N 15 120.30 0.30 . 1 . . . . A 25 GLU N . 30957 1 92 . 1 . 1 26 26 GLY H H 1 9.24 0.07 . 1 . . . . A 26 GLY H . 30957 1 93 . 1 . 1 26 26 GLY C C 13 175.00 0.25 . 1 . . . . A 26 GLY C . 30957 1 94 . 1 . 1 26 26 GLY CA C 13 45.75 0.25 . 1 . . . . A 26 GLY CA . 30957 1 95 . 1 . 1 26 26 GLY N N 15 111.90 0.30 . 1 . . . . A 26 GLY N . 30957 1 96 . 1 . 1 27 27 PHE H H 1 7.70 0.07 . 1 . . . . A 27 PHE H . 30957 1 97 . 1 . 1 27 27 PHE C C 13 173.10 0.25 . 1 . . . . A 27 PHE C . 30957 1 98 . 1 . 1 27 27 PHE CA C 13 59.86 0.25 . 1 . . . . A 27 PHE CA . 30957 1 99 . 1 . 1 27 27 PHE CB C 13 34.74 0.25 . 1 . . . . A 27 PHE CB . 30957 1 100 . 1 . 1 27 27 PHE N N 15 112.40 0.30 . 1 . . . . A 27 PHE N . 30957 1 101 . 1 . 1 28 28 THR H H 1 7.09 0.07 . 1 . . . . A 28 THR H . 30957 1 102 . 1 . 1 28 28 THR C C 13 174.40 0.25 . 1 . . . . A 28 THR C . 30957 1 103 . 1 . 1 28 28 THR CA C 13 61.66 0.25 . 1 . . . . A 28 THR CA . 30957 1 104 . 1 . 1 28 28 THR CB C 13 70.22 0.25 . 1 . . . . A 28 THR CB . 30957 1 105 . 1 . 1 28 28 THR N N 15 100.60 0.30 . 1 . . . . A 28 THR N . 30957 1 106 . 1 . 1 29 29 ARG H H 1 7.08 0.07 . 1 . . . . A 29 ARG H . 30957 1 107 . 1 . 1 29 29 ARG C C 13 176.80 0.25 . 1 . . . . A 29 ARG C . 30957 1 108 . 1 . 1 29 29 ARG CA C 13 54.12 0.25 . 1 . . . . A 29 ARG CA . 30957 1 109 . 1 . 1 29 29 ARG CB C 13 30.79 0.25 . 1 . . . . A 29 ARG CB . 30957 1 110 . 1 . 1 29 29 ARG N N 15 118.50 0.30 . 1 . . . . A 29 ARG N . 30957 1 111 . 1 . 1 30 30 LEU H H 1 9.00 0.07 . 1 . . . . A 30 LEU H . 30957 1 112 . 1 . 1 30 30 LEU C C 13 177.30 0.25 . 1 . . . . A 30 LEU C . 30957 1 113 . 1 . 1 30 30 LEU CA C 13 59.60 0.25 . 1 . . . . A 30 LEU CA . 30957 1 114 . 1 . 1 30 30 LEU N N 15 130.70 0.30 . 1 . . . . A 30 LEU N . 30957 1 115 . 1 . 1 31 31 TRP H H 1 9.22 0.07 . 1 . . . . A 31 TRP H . 30957 1 116 . 1 . 1 31 31 TRP C C 13 177.10 0.25 . 1 . . . . A 31 TRP C . 30957 1 117 . 1 . 1 31 31 TRP CA C 13 61.23 0.25 . 1 . . . . A 31 TRP CA . 30957 1 118 . 1 . 1 31 31 TRP CB C 13 26.19 0.25 . 1 . . . . A 31 TRP CB . 30957 1 119 . 1 . 1 31 31 TRP N N 15 118.50 0.30 . 1 . . . . A 31 TRP N . 30957 1 120 . 1 . 1 32 32 PRO C C 13 178.20 0.25 . 1 . . . . A 32 PRO C . 30957 1 121 . 1 . 1 32 32 PRO CA C 13 65.64 0.25 . 1 . . . . A 32 PRO CA . 30957 1 122 . 1 . 1 32 32 PRO CB C 13 30.41 0.25 . 1 . . . . A 32 PRO CB . 30957 1 123 . 1 . 1 33 33 SER H H 1 6.87 0.07 . 1 . . . . A 33 SER H . 30957 1 124 . 1 . 1 33 33 SER C C 13 175.20 0.25 . 1 . . . . A 33 SER C . 30957 1 125 . 1 . 1 33 33 SER CA C 13 63.76 0.25 . 1 . . . . A 33 SER CA . 30957 1 126 . 1 . 1 33 33 SER CB C 13 61.91 0.25 . 1 . . . . A 33 SER CB . 30957 1 127 . 1 . 1 33 33 SER N N 15 112.90 0.30 . 1 . . . . A 33 SER N . 30957 1 128 . 1 . 1 34 34 VAL H H 1 8.20 0.07 . 1 . . . . A 34 VAL H . 30957 1 129 . 1 . 1 34 34 VAL C C 13 178.20 0.25 . 1 . . . . A 34 VAL C . 30957 1 130 . 1 . 1 34 34 VAL CA C 13 66.58 0.25 . 1 . . . . A 34 VAL CA . 30957 1 131 . 1 . 1 34 34 VAL CB C 13 30.60 0.25 . 1 . . . . A 34 VAL CB . 30957 1 132 . 1 . 1 34 34 VAL N N 15 121.80 0.30 . 1 . . . . A 34 VAL N . 30957 1 133 . 1 . 1 35 35 GLY H H 1 8.46 0.07 . 1 . . . . A 35 GLY H . 30957 1 134 . 1 . 1 35 35 GLY C C 13 174.90 0.25 . 1 . . . . A 35 GLY C . 30957 1 135 . 1 . 1 35 35 GLY CA C 13 48.18 0.25 . 1 . . . . A 35 GLY CA . 30957 1 136 . 1 . 1 35 35 GLY N N 15 105.20 0.30 . 1 . . . . A 35 GLY N . 30957 1 137 . 1 . 1 36 36 THR H H 1 8.16 0.07 . 1 . . . . A 36 THR H . 30957 1 138 . 1 . 1 36 36 THR C C 13 174.90 0.25 . 1 . . . . A 36 THR C . 30957 1 139 . 1 . 1 36 36 THR CA C 13 68.65 0.25 . 1 . . . . A 36 THR CA . 30957 1 140 . 1 . 1 36 36 THR N N 15 120.90 0.30 . 1 . . . . A 36 THR N . 30957 1 141 . 1 . 1 37 37 ILE H H 1 7.46 0.07 . 1 . . . . A 37 ILE H . 30957 1 142 . 1 . 1 37 37 ILE C C 13 178.20 0.25 . 1 . . . . A 37 ILE C . 30957 1 143 . 1 . 1 37 37 ILE CA C 13 65.67 0.25 . 1 . . . . A 37 ILE CA . 30957 1 144 . 1 . 1 37 37 ILE CB C 13 37.14 0.25 . 1 . . . . A 37 ILE CB . 30957 1 145 . 1 . 1 37 37 ILE N N 15 118.70 0.30 . 1 . . . . A 37 ILE N . 30957 1 146 . 1 . 1 38 38 ILE H H 1 8.32 0.07 . 1 . . . . A 38 ILE H . 30957 1 147 . 1 . 1 38 38 ILE C C 13 177.90 0.25 . 1 . . . . A 38 ILE C . 30957 1 148 . 1 . 1 38 38 ILE CA C 13 65.49 0.25 . 1 . . . . A 38 ILE CA . 30957 1 149 . 1 . 1 38 38 ILE CB C 13 37.12 0.25 . 1 . . . . A 38 ILE CB . 30957 1 150 . 1 . 1 38 38 ILE N N 15 119.10 0.30 . 1 . . . . A 38 ILE N . 30957 1 151 . 1 . 1 39 39 CYS H H 1 7.91 0.07 . 1 . . . . A 39 CYS H . 30957 1 152 . 1 . 1 39 39 CYS C C 13 177.40 0.25 . 1 . . . . A 39 CYS C . 30957 1 153 . 1 . 1 39 39 CYS CA C 13 65.02 0.25 . 1 . . . . A 39 CYS CA . 30957 1 154 . 1 . 1 39 39 CYS CB C 13 25.75 0.25 . 1 . . . . A 39 CYS CB . 30957 1 155 . 1 . 1 39 39 CYS N N 15 117.00 0.30 . 1 . . . . A 39 CYS N . 30957 1 156 . 1 . 1 40 40 TYR H H 1 8.79 0.07 . 1 . . . . A 40 TYR H . 30957 1 157 . 1 . 1 40 40 TYR C C 13 178.70 0.25 . 1 . . . . A 40 TYR C . 30957 1 158 . 1 . 1 40 40 TYR CA C 13 57.08 0.25 . 1 . . . . A 40 TYR CA . 30957 1 159 . 1 . 1 40 40 TYR CB C 13 37.37 0.25 . 1 . . . . A 40 TYR CB . 30957 1 160 . 1 . 1 40 40 TYR N N 15 118.80 0.30 . 1 . . . . A 40 TYR N . 30957 1 161 . 1 . 1 41 41 CYS H H 1 8.24 0.07 . 1 . . . . A 41 CYS H . 30957 1 162 . 1 . 1 41 41 CYS C C 13 176.70 0.25 . 1 . . . . A 41 CYS C . 30957 1 163 . 1 . 1 41 41 CYS CA C 13 65.68 0.25 . 1 . . . . A 41 CYS CA . 30957 1 164 . 1 . 1 41 41 CYS CB C 13 26.07 0.25 . 1 . . . . A 41 CYS CB . 30957 1 165 . 1 . 1 41 41 CYS N N 15 116.80 0.30 . 1 . . . . A 41 CYS N . 30957 1 166 . 1 . 1 42 42 ALA H H 1 7.97 0.07 . 1 . . . . A 42 ALA H . 30957 1 167 . 1 . 1 42 42 ALA C C 13 178.40 0.25 . 1 . . . . A 42 ALA C . 30957 1 168 . 1 . 1 42 42 ALA CA C 13 55.26 0.25 . 1 . . . . A 42 ALA CA . 30957 1 169 . 1 . 1 42 42 ALA CB C 13 16.58 0.25 . 1 . . . . A 42 ALA CB . 30957 1 170 . 1 . 1 42 42 ALA N N 15 119.20 0.30 . 1 . . . . A 42 ALA N . 30957 1 171 . 1 . 1 43 43 SER H H 1 8.43 0.07 . 1 . . . . A 43 SER H . 30957 1 172 . 1 . 1 43 43 SER C C 13 178.00 0.25 . 1 . . . . A 43 SER C . 30957 1 173 . 1 . 1 43 43 SER CA C 13 62.67 0.25 . 1 . . . . A 43 SER CA . 30957 1 174 . 1 . 1 43 43 SER N N 15 111.10 0.30 . 1 . . . . A 43 SER N . 30957 1 175 . 1 . 1 44 44 PHE H H 1 8.98 0.07 . 1 . . . . A 44 PHE H . 30957 1 176 . 1 . 1 44 44 PHE C C 13 178.10 0.25 . 1 . . . . A 44 PHE C . 30957 1 177 . 1 . 1 44 44 PHE CA C 13 63.29 0.25 . 1 . . . . A 44 PHE CA . 30957 1 178 . 1 . 1 44 44 PHE N N 15 114.80 0.30 . 1 . . . . A 44 PHE N . 30957 1 179 . 1 . 1 46 46 LEU C C 13 179.40 0.25 . 1 . . . . A 46 LEU C . 30957 1 180 . 1 . 1 46 46 LEU CA C 13 58.34 0.25 . 1 . . . . A 46 LEU CA . 30957 1 181 . 1 . 1 46 46 LEU CB C 13 40.24 0.25 . 1 . . . . A 46 LEU CB . 30957 1 182 . 1 . 1 47 47 LEU H H 1 8.77 0.07 . 1 . . . . A 47 LEU H . 30957 1 183 . 1 . 1 47 47 LEU C C 13 179.20 0.25 . 1 . . . . A 47 LEU C . 30957 1 184 . 1 . 1 47 47 LEU CA C 13 57.44 0.25 . 1 . . . . A 47 LEU CA . 30957 1 185 . 1 . 1 47 47 LEU CB C 13 40.43 0.25 . 1 . . . . A 47 LEU CB . 30957 1 186 . 1 . 1 47 47 LEU N N 15 120.90 0.30 . 1 . . . . A 47 LEU N . 30957 1 187 . 1 . 1 48 48 ALA H H 1 8.13 0.07 . 1 . . . . A 48 ALA H . 30957 1 188 . 1 . 1 48 48 ALA C C 13 178.90 0.25 . 1 . . . . A 48 ALA C . 30957 1 189 . 1 . 1 48 48 ALA CA C 13 54.71 0.25 . 1 . . . . A 48 ALA CA . 30957 1 190 . 1 . 1 48 48 ALA CB C 13 16.31 0.25 . 1 . . . . A 48 ALA CB . 30957 1 191 . 1 . 1 48 48 ALA N N 15 122.60 0.30 . 1 . . . . A 48 ALA N . 30957 1 192 . 1 . 1 49 49 GLN H H 1 6.82 0.07 . 1 . . . . A 49 GLN H . 30957 1 193 . 1 . 1 49 49 GLN C C 13 178.30 0.25 . 1 . . . . A 49 GLN C . 30957 1 194 . 1 . 1 49 49 GLN CA C 13 55.03 0.25 . 1 . . . . A 49 GLN CA . 30957 1 195 . 1 . 1 49 49 GLN N N 15 113.10 0.30 . 1 . . . . A 49 GLN N . 30957 1 196 . 1 . 1 55 55 PRO C C 13 177.80 0.25 . 1 . . . . A 55 PRO C . 30957 1 197 . 1 . 1 55 55 PRO CA C 13 62.78 0.25 . 1 . . . . A 55 PRO CA . 30957 1 198 . 1 . 1 56 56 THR H H 1 8.32 0.07 . 1 . . . . A 56 THR H . 30957 1 199 . 1 . 1 56 56 THR C C 13 176.30 0.25 . 1 . . . . A 56 THR C . 30957 1 200 . 1 . 1 56 56 THR CA C 13 66.14 0.25 . 1 . . . . A 56 THR CA . 30957 1 201 . 1 . 1 56 56 THR CB C 13 68.37 0.25 . 1 . . . . A 56 THR CB . 30957 1 202 . 1 . 1 56 56 THR N N 15 120.10 0.30 . 1 . . . . A 56 THR N . 30957 1 203 . 1 . 1 57 57 GLY H H 1 8.81 0.07 . 1 . . . . A 57 GLY H . 30957 1 204 . 1 . 1 57 57 GLY C C 13 176.50 0.25 . 1 . . . . A 57 GLY C . 30957 1 205 . 1 . 1 57 57 GLY CA C 13 46.93 0.25 . 1 . . . . A 57 GLY CA . 30957 1 206 . 1 . 1 57 57 GLY N N 15 107.30 0.30 . 1 . . . . A 57 GLY N . 30957 1 207 . 1 . 1 58 58 ILE H H 1 6.69 0.07 . 1 . . . . A 58 ILE H . 30957 1 208 . 1 . 1 58 58 ILE C C 13 177.20 0.25 . 1 . . . . A 58 ILE C . 30957 1 209 . 1 . 1 58 58 ILE CA C 13 64.12 0.25 . 1 . . . . A 58 ILE CA . 30957 1 210 . 1 . 1 58 58 ILE CB C 13 36.31 0.25 . 1 . . . . A 58 ILE CB . 30957 1 211 . 1 . 1 58 58 ILE N N 15 121.10 0.30 . 1 . . . . A 58 ILE N . 30957 1 212 . 1 . 1 59 59 ALA H H 1 7.58 0.07 . 1 . . . . A 59 ALA H . 30957 1 213 . 1 . 1 59 59 ALA C C 13 178.70 0.25 . 1 . . . . A 59 ALA C . 30957 1 214 . 1 . 1 59 59 ALA CA C 13 55.50 0.25 . 1 . . . . A 59 ALA CA . 30957 1 215 . 1 . 1 59 59 ALA CB C 13 16.51 0.25 . 1 . . . . A 59 ALA CB . 30957 1 216 . 1 . 1 59 59 ALA N N 15 120.70 0.30 . 1 . . . . A 59 ALA N . 30957 1 217 . 1 . 1 60 60 TYR H H 1 8.58 0.07 . 1 . . . . A 60 TYR H . 30957 1 218 . 1 . 1 60 60 TYR C C 13 177.70 0.25 . 1 . . . . A 60 TYR C . 30957 1 219 . 1 . 1 60 60 TYR CA C 13 62.10 0.25 . 1 . . . . A 60 TYR CA . 30957 1 220 . 1 . 1 60 60 TYR CB C 13 37.40 0.25 . 1 . . . . A 60 TYR CB . 30957 1 221 . 1 . 1 60 60 TYR N N 15 115.40 0.30 . 1 . . . . A 60 TYR N . 30957 1 222 . 1 . 1 61 61 ALA H H 1 7.57 0.07 . 1 . . . . A 61 ALA H . 30957 1 223 . 1 . 1 61 61 ALA C C 13 178.70 0.25 . 1 . . . . A 61 ALA C . 30957 1 224 . 1 . 1 61 61 ALA CA C 13 55.19 0.25 . 1 . . . . A 61 ALA CA . 30957 1 225 . 1 . 1 61 61 ALA CB C 13 17.79 0.25 . 1 . . . . A 61 ALA CB . 30957 1 226 . 1 . 1 61 61 ALA N N 15 118.80 0.30 . 1 . . . . A 61 ALA N . 30957 1 227 . 1 . 1 62 62 ILE H H 1 7.71 0.07 . 1 . . . . A 62 ILE H . 30957 1 228 . 1 . 1 62 62 ILE C C 13 176.30 0.25 . 1 . . . . A 62 ILE C . 30957 1 229 . 1 . 1 62 62 ILE CA C 13 65.26 0.25 . 1 . . . . A 62 ILE CA . 30957 1 230 . 1 . 1 62 62 ILE CB C 13 37.55 0.25 . 1 . . . . A 62 ILE CB . 30957 1 231 . 1 . 1 62 62 ILE N N 15 114.70 0.30 . 1 . . . . A 62 ILE N . 30957 1 232 . 1 . 1 63 63 TRP H H 1 8.05 0.07 . 1 . . . . A 63 TRP H . 30957 1 233 . 1 . 1 63 63 TRP C C 13 179.70 0.25 . 1 . . . . A 63 TRP C . 30957 1 234 . 1 . 1 63 63 TRP CA C 13 60.43 0.25 . 1 . . . . A 63 TRP CA . 30957 1 235 . 1 . 1 63 63 TRP CB C 13 27.33 0.25 . 1 . . . . A 63 TRP CB . 30957 1 236 . 1 . 1 63 63 TRP N N 15 120.70 0.30 . 1 . . . . A 63 TRP N . 30957 1 237 . 1 . 1 64 64 VAL H H 1 8.47 0.07 . 1 . . . . A 64 VAL H . 30957 1 238 . 1 . 1 64 64 VAL C C 13 177.60 0.25 . 1 . . . . A 64 VAL C . 30957 1 239 . 1 . 1 64 64 VAL CA C 13 66.71 0.25 . 1 . . . . A 64 VAL CA . 30957 1 240 . 1 . 1 64 64 VAL CB C 13 30.54 0.25 . 1 . . . . A 64 VAL CB . 30957 1 241 . 1 . 1 64 64 VAL N N 15 116.00 0.30 . 1 . . . . A 64 VAL N . 30957 1 242 . 1 . 1 65 65 GLY H H 1 7.45 0.07 . 1 . . . . A 65 GLY H . 30957 1 243 . 1 . 1 65 65 GLY C C 13 173.50 0.25 . 1 . . . . A 65 GLY C . 30957 1 244 . 1 . 1 65 65 GLY CA C 13 47.99 0.25 . 1 . . . . A 65 GLY CA . 30957 1 245 . 1 . 1 65 65 GLY N N 15 103.20 0.30 . 1 . . . . A 65 GLY N . 30957 1 246 . 1 . 1 66 66 VAL H H 1 8.29 0.07 . 1 . . . . A 66 VAL H . 30957 1 247 . 1 . 1 66 66 VAL C C 13 178.00 0.25 . 1 . . . . A 66 VAL C . 30957 1 248 . 1 . 1 66 66 VAL CA C 13 65.92 0.25 . 1 . . . . A 66 VAL CA . 30957 1 249 . 1 . 1 66 66 VAL CB C 13 30.83 0.25 . 1 . . . . A 66 VAL CB . 30957 1 250 . 1 . 1 66 66 VAL N N 15 116.80 0.30 . 1 . . . . A 66 VAL N . 30957 1 251 . 1 . 1 67 67 GLY H H 1 8.87 0.07 . 1 . . . . A 67 GLY H . 30957 1 252 . 1 . 1 67 67 GLY C C 13 175.90 0.25 . 1 . . . . A 67 GLY C . 30957 1 253 . 1 . 1 67 67 GLY CA C 13 47.10 0.25 . 1 . . . . A 67 GLY CA . 30957 1 254 . 1 . 1 67 67 GLY N N 15 109.90 0.30 . 1 . . . . A 67 GLY N . 30957 1 255 . 1 . 1 68 68 ILE H H 1 8.33 0.07 . 1 . . . . A 68 ILE H . 30957 1 256 . 1 . 1 68 68 ILE C C 13 179.00 0.25 . 1 . . . . A 68 ILE C . 30957 1 257 . 1 . 1 68 68 ILE CA C 13 66.41 0.25 . 1 . . . . A 68 ILE CA . 30957 1 258 . 1 . 1 68 68 ILE CB C 13 36.78 0.25 . 1 . . . . A 68 ILE CB . 30957 1 259 . 1 . 1 68 68 ILE N N 15 119.00 0.30 . 1 . . . . A 68 ILE N . 30957 1 260 . 1 . 1 69 69 VAL H H 1 6.91 0.07 . 1 . . . . A 69 VAL H . 30957 1 261 . 1 . 1 69 69 VAL C C 13 177.60 0.25 . 1 . . . . A 69 VAL C . 30957 1 262 . 1 . 1 69 69 VAL CA C 13 66.62 0.25 . 1 . . . . A 69 VAL CA . 30957 1 263 . 1 . 1 69 69 VAL CB C 13 30.68 0.25 . 1 . . . . A 69 VAL CB . 30957 1 264 . 1 . 1 69 69 VAL N N 15 118.80 0.30 . 1 . . . . A 69 VAL N . 30957 1 265 . 1 . 1 70 70 LEU C C 13 179.40 0.25 . 1 . . . . A 70 LEU C . 30957 1 266 . 1 . 1 70 70 LEU CA C 13 58.19 0.25 . 1 . . . . A 70 LEU CA . 30957 1 267 . 1 . 1 70 70 LEU CB C 13 41.06 0.25 . 1 . . . . A 70 LEU CB . 30957 1 268 . 1 . 1 71 71 ILE H H 1 9.31 0.07 . 1 . . . . A 71 ILE H . 30957 1 269 . 1 . 1 71 71 ILE C C 13 179.80 0.25 . 1 . . . . A 71 ILE C . 30957 1 270 . 1 . 1 71 71 ILE CA C 13 61.64 0.25 . 1 . . . . A 71 ILE CA . 30957 1 271 . 1 . 1 71 71 ILE CB C 13 34.88 0.25 . 1 . . . . A 71 ILE CB . 30957 1 272 . 1 . 1 71 71 ILE N N 15 119.30 0.30 . 1 . . . . A 71 ILE N . 30957 1 273 . 1 . 1 72 72 SER H H 1 7.29 0.07 . 1 . . . . A 72 SER H . 30957 1 274 . 1 . 1 72 72 SER CA C 13 62.86 0.25 . 1 . . . . A 72 SER CA . 30957 1 275 . 1 . 1 72 72 SER CB C 13 61.90 0.25 . 1 . . . . A 72 SER CB . 30957 1 276 . 1 . 1 72 72 SER N N 15 119.50 0.30 . 1 . . . . A 72 SER N . 30957 1 277 . 1 . 1 73 73 LEU C C 13 178.60 0.25 . 1 . . . . A 73 LEU C . 30957 1 278 . 1 . 1 73 73 LEU CA C 13 58.34 0.25 . 1 . . . . A 73 LEU CA . 30957 1 279 . 1 . 1 73 73 LEU CB C 13 41.30 0.25 . 1 . . . . A 73 LEU CB . 30957 1 280 . 1 . 1 74 74 LEU H H 1 8.60 0.07 . 1 . . . . A 74 LEU H . 30957 1 281 . 1 . 1 74 74 LEU C C 13 178.90 0.25 . 1 . . . . A 74 LEU C . 30957 1 282 . 1 . 1 74 74 LEU CA C 13 58.18 0.25 . 1 . . . . A 74 LEU CA . 30957 1 283 . 1 . 1 74 74 LEU CB C 13 41.06 0.25 . 1 . . . . A 74 LEU CB . 30957 1 284 . 1 . 1 74 74 LEU N N 15 118.30 0.30 . 1 . . . . A 74 LEU N . 30957 1 285 . 1 . 1 75 75 SER H H 1 8.05 0.07 . 1 . . . . A 75 SER H . 30957 1 286 . 1 . 1 75 75 SER C C 13 177.50 0.25 . 1 . . . . A 75 SER C . 30957 1 287 . 1 . 1 75 75 SER CA C 13 62.70 0.25 . 1 . . . . A 75 SER CA . 30957 1 288 . 1 . 1 75 75 SER N N 15 114.90 0.30 . 1 . . . . A 75 SER N . 30957 1 289 . 1 . 1 76 76 TRP H H 1 7.57 0.07 . 1 . . . . A 76 TRP H . 30957 1 290 . 1 . 1 76 76 TRP C C 13 177.50 0.25 . 1 . . . . A 76 TRP C . 30957 1 291 . 1 . 1 76 76 TRP CA C 13 58.14 0.25 . 1 . . . . A 76 TRP CA . 30957 1 292 . 1 . 1 76 76 TRP CB C 13 28.00 0.25 . 1 . . . . A 76 TRP CB . 30957 1 293 . 1 . 1 76 76 TRP N N 15 125.70 0.30 . 1 . . . . A 76 TRP N . 30957 1 294 . 1 . 1 77 77 GLY H H 1 7.88 0.07 . 1 . . . . A 77 GLY H . 30957 1 295 . 1 . 1 77 77 GLY C C 13 173.00 0.25 . 1 . . . . A 77 GLY C . 30957 1 296 . 1 . 1 77 77 GLY CA C 13 47.62 0.25 . 1 . . . . A 77 GLY CA . 30957 1 297 . 1 . 1 77 77 GLY N N 15 102.30 0.30 . 1 . . . . A 77 GLY N . 30957 1 298 . 1 . 1 78 78 PHE H H 1 8.11 0.07 . 1 . . . . A 78 PHE H . 30957 1 299 . 1 . 1 78 78 PHE C C 13 176.30 0.25 . 1 . . . . A 78 PHE C . 30957 1 300 . 1 . 1 78 78 PHE CA C 13 60.81 0.25 . 1 . . . . A 78 PHE CA . 30957 1 301 . 1 . 1 78 78 PHE CB C 13 37.26 0.25 . 1 . . . . A 78 PHE CB . 30957 1 302 . 1 . 1 78 78 PHE N N 15 112.10 0.30 . 1 . . . . A 78 PHE N . 30957 1 303 . 1 . 1 79 79 PHE H H 1 6.54 0.07 . 1 . . . . A 79 PHE H . 30957 1 304 . 1 . 1 79 79 PHE C C 13 176.50 0.25 . 1 . . . . A 79 PHE C . 30957 1 305 . 1 . 1 79 79 PHE CA C 13 55.17 0.25 . 1 . . . . A 79 PHE CA . 30957 1 306 . 1 . 1 79 79 PHE CB C 13 38.98 0.25 . 1 . . . . A 79 PHE CB . 30957 1 307 . 1 . 1 79 79 PHE N N 15 110.60 0.30 . 1 . . . . A 79 PHE N . 30957 1 308 . 1 . 1 80 80 GLY H H 1 7.21 0.07 . 1 . . . . A 80 GLY H . 30957 1 309 . 1 . 1 80 80 GLY C C 13 174.70 0.25 . 1 . . . . A 80 GLY C . 30957 1 310 . 1 . 1 80 80 GLY CA C 13 46.31 0.25 . 1 . . . . A 80 GLY CA . 30957 1 311 . 1 . 1 80 80 GLY N N 15 109.40 0.30 . 1 . . . . A 80 GLY N . 30957 1 312 . 1 . 1 81 81 GLN H H 1 7.20 0.07 . 1 . . . . A 81 GLN H . 30957 1 313 . 1 . 1 81 81 GLN C C 13 174.90 0.25 . 1 . . . . A 81 GLN C . 30957 1 314 . 1 . 1 81 81 GLN CA C 13 56.57 0.25 . 1 . . . . A 81 GLN CA . 30957 1 315 . 1 . 1 81 81 GLN CB C 13 25.72 0.25 . 1 . . . . A 81 GLN CB . 30957 1 316 . 1 . 1 81 81 GLN N N 15 118.80 0.30 . 1 . . . . A 81 GLN N . 30957 1 317 . 1 . 1 82 82 ARG H H 1 8.00 0.07 . 1 . . . . A 82 ARG H . 30957 1 318 . 1 . 1 82 82 ARG C C 13 176.00 0.25 . 1 . . . . A 82 ARG C . 30957 1 319 . 1 . 1 82 82 ARG CA C 13 55.10 0.25 . 1 . . . . A 82 ARG CA . 30957 1 320 . 1 . 1 82 82 ARG CB C 13 30.01 0.25 . 1 . . . . A 82 ARG CB . 30957 1 321 . 1 . 1 82 82 ARG N N 15 126.60 0.30 . 1 . . . . A 82 ARG N . 30957 1 322 . 1 . 1 83 83 LEU H H 1 7.06 0.07 . 1 . . . . A 83 LEU H . 30957 1 323 . 1 . 1 83 83 LEU C C 13 174.70 0.25 . 1 . . . . A 83 LEU C . 30957 1 324 . 1 . 1 83 83 LEU CA C 13 52.46 0.25 . 1 . . . . A 83 LEU CA . 30957 1 325 . 1 . 1 83 83 LEU CB C 13 43.64 0.25 . 1 . . . . A 83 LEU CB . 30957 1 326 . 1 . 1 83 83 LEU N N 15 121.00 0.30 . 1 . . . . A 83 LEU N . 30957 1 327 . 1 . 1 84 84 ASP H H 1 6.89 0.07 . 1 . . . . A 84 ASP H . 30957 1 328 . 1 . 1 84 84 ASP C C 13 175.20 0.25 . 1 . . . . A 84 ASP C . 30957 1 329 . 1 . 1 84 84 ASP CA C 13 50.52 0.25 . 1 . . . . A 84 ASP CA . 30957 1 330 . 1 . 1 84 84 ASP CB C 13 41.39 0.25 . 1 . . . . A 84 ASP CB . 30957 1 331 . 1 . 1 84 84 ASP N N 15 117.30 0.30 . 1 . . . . A 84 ASP N . 30957 1 332 . 1 . 1 85 85 LEU H H 1 8.54 0.07 . 1 . . . . A 85 LEU H . 30957 1 333 . 1 . 1 85 85 LEU C C 13 177.30 0.25 . 1 . . . . A 85 LEU C . 30957 1 334 . 1 . 1 85 85 LEU CA C 13 59.36 0.25 . 1 . . . . A 85 LEU CA . 30957 1 335 . 1 . 1 85 85 LEU CB C 13 37.81 0.25 . 1 . . . . A 85 LEU CB . 30957 1 336 . 1 . 1 85 85 LEU N N 15 118.30 0.30 . 1 . . . . A 85 LEU N . 30957 1 337 . 1 . 1 86 86 PRO C C 13 178.00 0.25 . 1 . . . . A 86 PRO C . 30957 1 338 . 1 . 1 86 86 PRO CB C 13 30.79 0.25 . 1 . . . . A 86 PRO CB . 30957 1 339 . 1 . 1 87 87 ALA H H 1 7.17 0.07 . 1 . . . . A 87 ALA H . 30957 1 340 . 1 . 1 87 87 ALA C C 13 178.70 0.25 . 1 . . . . A 87 ALA C . 30957 1 341 . 1 . 1 87 87 ALA CA C 13 55.37 0.25 . 1 . . . . A 87 ALA CA . 30957 1 342 . 1 . 1 87 87 ALA CB C 13 17.10 0.25 . 1 . . . . A 87 ALA CB . 30957 1 343 . 1 . 1 87 87 ALA N N 15 116.30 0.30 . 1 . . . . A 87 ALA N . 30957 1 344 . 1 . 1 89 89 ILE C C 13 178.40 0.25 . 1 . . . . A 89 ILE C . 30957 1 345 . 1 . 1 89 89 ILE CA C 13 64.62 0.25 . 1 . . . . A 89 ILE CA . 30957 1 346 . 1 . 1 89 89 ILE CB C 13 36.16 0.25 . 1 . . . . A 89 ILE CB . 30957 1 347 . 1 . 1 90 90 GLY H H 1 8.48 0.07 . 1 . . . . A 90 GLY H . 30957 1 348 . 1 . 1 90 90 GLY C C 13 176.10 0.25 . 1 . . . . A 90 GLY C . 30957 1 349 . 1 . 1 90 90 GLY CA C 13 47.49 0.25 . 1 . . . . A 90 GLY CA . 30957 1 350 . 1 . 1 90 90 GLY N N 15 107.30 0.30 . 1 . . . . A 90 GLY N . 30957 1 351 . 1 . 1 91 91 MET H H 1 8.57 0.07 . 1 . . . . A 91 MET H . 30957 1 352 . 1 . 1 91 91 MET C C 13 178.40 0.25 . 1 . . . . A 91 MET C . 30957 1 353 . 1 . 1 91 91 MET CA C 13 59.97 0.25 . 1 . . . . A 91 MET CA . 30957 1 354 . 1 . 1 91 91 MET CB C 13 32.59 0.25 . 1 . . . . A 91 MET CB . 30957 1 355 . 1 . 1 91 91 MET N N 15 120.40 0.30 . 1 . . . . A 91 MET N . 30957 1 356 . 1 . 1 94 94 ILE CA C 13 65.61 0.25 . 1 . . . . A 94 ILE CA . 30957 1 357 . 1 . 1 95 95 CYS H H 1 7.86 0.07 . 1 . . . . A 95 CYS H . 30957 1 358 . 1 . 1 95 95 CYS CA C 13 64.91 0.25 . 1 . . . . A 95 CYS CA . 30957 1 359 . 1 . 1 95 95 CYS CB C 13 25.91 0.25 . 1 . . . . A 95 CYS CB . 30957 1 360 . 1 . 1 95 95 CYS N N 15 116.20 0.30 . 1 . . . . A 95 CYS N . 30957 1 361 . 1 . 1 96 96 ALA H H 1 8.62 0.07 . 1 . . . . A 96 ALA H . 30957 1 362 . 1 . 1 96 96 ALA C C 13 178.70 0.25 . 1 . . . . A 96 ALA C . 30957 1 363 . 1 . 1 96 96 ALA CA C 13 55.08 0.25 . 1 . . . . A 96 ALA CA . 30957 1 364 . 1 . 1 96 96 ALA CB C 13 17.52 0.25 . 1 . . . . A 96 ALA CB . 30957 1 365 . 1 . 1 96 96 ALA N N 15 118.60 0.30 . 1 . . . . A 96 ALA N . 30957 1 366 . 1 . 1 97 97 GLY H H 1 8.37 0.07 . 1 . . . . A 97 GLY H . 30957 1 367 . 1 . 1 97 97 GLY C C 13 174.90 0.25 . 1 . . . . A 97 GLY C . 30957 1 368 . 1 . 1 97 97 GLY CA C 13 48.31 0.25 . 1 . . . . A 97 GLY CA . 30957 1 369 . 1 . 1 97 97 GLY N N 15 104.10 0.30 . 1 . . . . A 97 GLY N . 30957 1 370 . 1 . 1 98 98 VAL H H 1 8.10 0.07 . 1 . . . . A 98 VAL H . 30957 1 371 . 1 . 1 98 98 VAL C C 13 177.80 0.25 . 1 . . . . A 98 VAL C . 30957 1 372 . 1 . 1 98 98 VAL CA C 13 66.89 0.25 . 1 . . . . A 98 VAL CA . 30957 1 373 . 1 . 1 98 98 VAL N N 15 120.50 0.30 . 1 . . . . A 98 VAL N . 30957 1 374 . 1 . 1 102 102 ASN C C 13 176.60 0.25 . 1 . . . . A 102 ASN C . 30957 1 375 . 1 . 1 102 102 ASN CA C 13 55.74 0.25 . 1 . . . . A 102 ASN CA . 30957 1 376 . 1 . 1 102 102 ASN CB C 13 37.61 0.25 . 1 . . . . A 102 ASN CB . 30957 1 377 . 1 . 1 103 103 LEU H H 1 8.12 0.07 . 1 . . . . A 103 LEU H . 30957 1 378 . 1 . 1 103 103 LEU C C 13 177.00 0.25 . 1 . . . . A 103 LEU C . 30957 1 379 . 1 . 1 103 103 LEU CA C 13 55.06 0.25 . 1 . . . . A 103 LEU CA . 30957 1 380 . 1 . 1 103 103 LEU CB C 13 41.45 0.25 . 1 . . . . A 103 LEU CB . 30957 1 381 . 1 . 1 103 103 LEU N N 15 113.90 0.30 . 1 . . . . A 103 LEU N . 30957 1 382 . 1 . 1 104 104 LEU H H 1 7.31 0.07 . 1 . . . . A 104 LEU H . 30957 1 383 . 1 . 1 104 104 LEU C C 13 176.60 0.25 . 1 . . . . A 104 LEU C . 30957 1 384 . 1 . 1 104 104 LEU CA C 13 54.27 0.25 . 1 . . . . A 104 LEU CA . 30957 1 385 . 1 . 1 104 104 LEU CB C 13 42.86 0.25 . 1 . . . . A 104 LEU CB . 30957 1 386 . 1 . 1 104 104 LEU N N 15 114.50 0.30 . 1 . . . . A 104 LEU N . 30957 1 387 . 1 . 1 105 105 SER H H 1 6.84 0.07 . 1 . . . . A 105 SER H . 30957 1 388 . 1 . 1 105 105 SER C C 13 175.80 0.25 . 1 . . . . A 105 SER C . 30957 1 389 . 1 . 1 105 105 SER CA C 13 57.36 0.25 . 1 . . . . A 105 SER CA . 30957 1 390 . 1 . 1 105 105 SER N N 15 111.20 0.30 . 1 . . . . A 105 SER N . 30957 1 391 . 2 . 1 5 5 ILE H H 1 7.66 0.07 . 1 . . . . B 5 ILE H . 30957 1 392 . 2 . 1 5 5 ILE C C 13 177.4 0.25 . 1 . . . . B 5 ILE C . 30957 1 393 . 2 . 1 5 5 ILE CA C 13 64.54 0.25 . 1 . . . . B 5 ILE CA . 30957 1 394 . 2 . 1 5 5 ILE N N 15 121.4 0.3 . 1 . . . . B 5 ILE N . 30957 1 395 . 2 . 1 6 6 TYR H H 1 6.3 0.07 . 1 . . . . B 6 TYR H . 30957 1 396 . 2 . 1 6 6 TYR C C 13 177.7 0.25 . 1 . . . . B 6 TYR C . 30957 1 397 . 2 . 1 6 6 TYR CA C 13 61.24 0.25 . 1 . . . . B 6 TYR CA . 30957 1 398 . 2 . 1 6 6 TYR N N 15 119.1 0.3 . 1 . . . . B 6 TYR N . 30957 1 399 . 2 . 1 7 7 LEU H H 1 7.67 0.07 . 1 . . . . B 7 LEU H . 30957 1 400 . 2 . 1 7 7 LEU C C 13 178.1 0.25 . 1 . . . . B 7 LEU C . 30957 1 401 . 2 . 1 7 7 LEU CA C 13 57.2 0.25 . 1 . . . . B 7 LEU CA . 30957 1 402 . 2 . 1 7 7 LEU CB C 13 41.03 0.25 . 1 . . . . B 7 LEU CB . 30957 1 403 . 2 . 1 7 7 LEU N N 15 119.2 0.3 . 1 . . . . B 7 LEU N . 30957 1 404 . 2 . 1 8 8 GLY H H 1 8.5 0.07 . 1 . . . . B 8 GLY H . 30957 1 405 . 2 . 1 8 8 GLY C C 13 175.1 0.25 . 1 . . . . B 8 GLY C . 30957 1 406 . 2 . 1 8 8 GLY CA C 13 47.25 0.25 . 1 . . . . B 8 GLY CA . 30957 1 407 . 2 . 1 8 8 GLY N N 15 105 0.3 . 1 . . . . B 8 GLY N . 30957 1 408 . 2 . 1 9 9 GLY H H 1 8.33 0.07 . 1 . . . . B 9 GLY H . 30957 1 409 . 2 . 1 9 9 GLY C C 13 173.9 0.25 . 1 . . . . B 9 GLY C . 30957 1 410 . 2 . 1 9 9 GLY CA C 13 47.52 0.25 . 1 . . . . B 9 GLY CA . 30957 1 411 . 2 . 1 9 9 GLY N N 15 108.7 0.3 . 1 . . . . B 9 GLY N . 30957 1 412 . 2 . 1 10 10 ALA H H 1 8.53 0.07 . 1 . . . . B 10 ALA H . 30957 1 413 . 2 . 1 10 10 ALA C C 13 182.1 0.25 . 1 . . . . B 10 ALA C . 30957 1 414 . 2 . 1 10 10 ALA CA C 13 55.29 0.25 . 1 . . . . B 10 ALA CA . 30957 1 415 . 2 . 1 10 10 ALA CB C 13 16.79 0.25 . 1 . . . . B 10 ALA CB . 30957 1 416 . 2 . 1 10 10 ALA N N 15 124.4 0.3 . 1 . . . . B 10 ALA N . 30957 1 417 . 2 . 1 11 11 ILE H H 1 8.09 0.07 . 1 . . . . B 11 ILE H . 30957 1 418 . 2 . 1 11 11 ILE C C 13 176.8 0.25 . 1 . . . . B 11 ILE C . 30957 1 419 . 2 . 1 11 11 ILE CA C 13 63.47 0.25 . 1 . . . . B 11 ILE CA . 30957 1 420 . 2 . 1 11 11 ILE CB C 13 37.73 0.25 . 1 . . . . B 11 ILE CB . 30957 1 421 . 2 . 1 11 11 ILE N N 15 122.4 0.3 . 1 . . . . B 11 ILE N . 30957 1 422 . 2 . 1 16 16 ILE H H 1 8.22 0.07 . 1 . . . . B 16 ILE H . 30957 1 423 . 2 . 1 16 16 ILE C C 13 177.7 0.25 . 1 . . . . B 16 ILE C . 30957 1 424 . 2 . 1 16 16 ILE CA C 13 65.52 0.25 . 1 . . . . B 16 ILE CA . 30957 1 425 . 2 . 1 16 16 ILE CB C 13 36.16 0.25 . 1 . . . . B 16 ILE CB . 30957 1 426 . 2 . 1 16 16 ILE N N 15 120 0.3 . 1 . . . . B 16 ILE N . 30957 1 427 . 2 . 1 17 17 GLY H H 1 8.24 0.07 . 1 . . . . B 17 GLY H . 30957 1 428 . 2 . 1 17 17 GLY C C 13 174.5 0.25 . 1 . . . . B 17 GLY C . 30957 1 429 . 2 . 1 17 17 GLY CA C 13 47.97 0.25 . 1 . . . . B 17 GLY CA . 30957 1 430 . 2 . 1 17 17 GLY N N 15 108.5 0.3 . 1 . . . . B 17 GLY N . 30957 1 431 . 2 . 1 18 18 THR H H 1 9.72 0.07 . 1 . . . . B 18 THR H . 30957 1 432 . 2 . 1 18 18 THR C C 13 176.3 0.25 . 1 . . . . B 18 THR C . 30957 1 433 . 2 . 1 18 18 THR CA C 13 65.47 0.25 . 1 . . . . B 18 THR CA . 30957 1 434 . 2 . 1 18 18 THR CB C 13 67.52 0.25 . 1 . . . . B 18 THR CB . 30957 1 435 . 2 . 1 18 18 THR N N 15 122 0.3 . 1 . . . . B 18 THR N . 30957 1 436 . 2 . 1 19 19 THR H H 1 7.54 0.07 . 1 . . . . B 19 THR H . 30957 1 437 . 2 . 1 19 19 THR C C 13 175.8 0.25 . 1 . . . . B 19 THR C . 30957 1 438 . 2 . 1 19 19 THR CA C 13 67.34 0.25 . 1 . . . . B 19 THR CA . 30957 1 439 . 2 . 1 19 19 THR CB C 13 67.38 0.25 . 1 . . . . B 19 THR CB . 30957 1 440 . 2 . 1 19 19 THR N N 15 120.8 0.3 . 1 . . . . B 19 THR N . 30957 1 441 . 2 . 1 20 20 LEU H H 1 8.03 0.07 . 1 . . . . B 20 LEU H . 30957 1 442 . 2 . 1 20 20 LEU C C 13 179.3 0.25 . 1 . . . . B 20 LEU C . 30957 1 443 . 2 . 1 20 20 LEU CA C 13 58.31 0.25 . 1 . . . . B 20 LEU CA . 30957 1 444 . 2 . 1 20 20 LEU CB C 13 39.76 0.25 . 1 . . . . B 20 LEU CB . 30957 1 445 . 2 . 1 20 20 LEU N N 15 120.8 0.3 . 1 . . . . B 20 LEU N . 30957 1 446 . 2 . 1 21 21 MET H H 1 8.15 0.07 . 1 . . . . B 21 MET H . 30957 1 447 . 2 . 1 21 21 MET C C 13 181 0.25 . 1 . . . . B 21 MET C . 30957 1 448 . 2 . 1 21 21 MET CA C 13 59.06 0.25 . 1 . . . . B 21 MET CA . 30957 1 449 . 2 . 1 21 21 MET CB C 13 30.58 0.25 . 1 . . . . B 21 MET CB . 30957 1 450 . 2 . 1 21 21 MET N N 15 120.8 0.3 . 1 . . . . B 21 MET N . 30957 1 451 . 2 . 1 22 22 LYS H H 1 7.26 0.07 . 1 . . . . B 22 LYS H . 30957 1 452 . 2 . 1 22 22 LYS C C 13 179.2 0.25 . 1 . . . . B 22 LYS C . 30957 1 453 . 2 . 1 22 22 LYS CA C 13 58.81 0.25 . 1 . . . . B 22 LYS CA . 30957 1 454 . 2 . 1 22 22 LYS CB C 13 30.38 0.25 . 1 . . . . B 22 LYS CB . 30957 1 455 . 2 . 1 22 22 LYS N N 15 122.5 0.3 . 1 . . . . B 22 LYS N . 30957 1 456 . 2 . 1 24 24 SER C C 13 173.7 0.25 . 1 . . . . B 24 SER C . 30957 1 457 . 2 . 1 24 24 SER CA C 13 60.11 0.25 . 1 . . . . B 24 SER CA . 30957 1 458 . 2 . 1 25 25 GLU H H 1 7.97 0.07 . 1 . . . . B 25 GLU H . 30957 1 459 . 2 . 1 25 25 GLU C C 13 178.2 0.25 . 1 . . . . B 25 GLU C . 30957 1 460 . 2 . 1 25 25 GLU CA C 13 55.79 0.25 . 1 . . . . B 25 GLU CA . 30957 1 461 . 2 . 1 25 25 GLU CB C 13 25.78 0.25 . 1 . . . . B 25 GLU CB . 30957 1 462 . 2 . 1 25 25 GLU N N 15 121.9 0.3 . 1 . . . . B 25 GLU N . 30957 1 463 . 2 . 1 26 26 GLY H H 1 9.09 0.07 . 1 . . . . B 26 GLY H . 30957 1 464 . 2 . 1 26 26 GLY C C 13 174.8 0.25 . 1 . . . . B 26 GLY C . 30957 1 465 . 2 . 1 26 26 GLY CA C 13 46.87 0.25 . 1 . . . . B 26 GLY CA . 30957 1 466 . 2 . 1 26 26 GLY N N 15 113 0.3 . 1 . . . . B 26 GLY N . 30957 1 467 . 2 . 1 27 27 PHE C C 13 173.2 0.25 . 1 . . . . B 27 PHE C . 30957 1 468 . 2 . 1 27 27 PHE CA C 13 59.92 0.25 . 1 . . . . B 27 PHE CA . 30957 1 469 . 2 . 1 28 28 THR H H 1 7.17 0.07 . 1 . . . . B 28 THR H . 30957 1 470 . 2 . 1 28 28 THR CA C 13 61.83 0.25 . 1 . . . . B 28 THR CA . 30957 1 471 . 2 . 1 28 28 THR CB C 13 70.36 0.25 . 1 . . . . B 28 THR CB . 30957 1 472 . 2 . 1 28 28 THR N N 15 100.7 0.3 . 1 . . . . B 28 THR N . 30957 1 473 . 2 . 1 29 29 ARG H H 1 7.34 0.07 . 1 . . . . B 29 ARG H . 30957 1 474 . 2 . 1 29 29 ARG C C 13 177.7 0.25 . 1 . . . . B 29 ARG C . 30957 1 475 . 2 . 1 29 29 ARG CA C 13 54.15 0.25 . 1 . . . . B 29 ARG CA . 30957 1 476 . 2 . 1 29 29 ARG CB C 13 29.83 0.25 . 1 . . . . B 29 ARG CB . 30957 1 477 . 2 . 1 29 29 ARG N N 15 120.5 0.3 . 1 . . . . B 29 ARG N . 30957 1 478 . 2 . 1 30 30 LEU H H 1 8.81 0.07 . 1 . . . . B 30 LEU H . 30957 1 479 . 2 . 1 30 30 LEU C C 13 177.1 0.25 . 1 . . . . B 30 LEU C . 30957 1 480 . 2 . 1 30 30 LEU CA C 13 59.56 0.25 . 1 . . . . B 30 LEU CA . 30957 1 481 . 2 . 1 30 30 LEU CB C 13 40.86 0.25 . 1 . . . . B 30 LEU CB . 30957 1 482 . 2 . 1 30 30 LEU N N 15 130.4 0.3 . 1 . . . . B 30 LEU N . 30957 1 483 . 2 . 1 31 31 TRP H H 1 9.05 0.07 . 1 . . . . B 31 TRP H . 30957 1 484 . 2 . 1 31 31 TRP C C 13 177.3 0.25 . 1 . . . . B 31 TRP C . 30957 1 485 . 2 . 1 31 31 TRP CA C 13 61.54 0.25 . 1 . . . . B 31 TRP CA . 30957 1 486 . 2 . 1 31 31 TRP CB C 13 25.88 0.25 . 1 . . . . B 31 TRP CB . 30957 1 487 . 2 . 1 31 31 TRP N N 15 118.5 0.3 . 1 . . . . B 31 TRP N . 30957 1 488 . 2 . 1 32 32 PRO C C 13 178.9 0.25 . 1 . . . . B 32 PRO C . 30957 1 489 . 2 . 1 32 32 PRO CA C 13 65.73 0.25 . 1 . . . . B 32 PRO CA . 30957 1 490 . 2 . 1 33 33 SER H H 1 6.77 0.07 . 1 . . . . B 33 SER H . 30957 1 491 . 2 . 1 33 33 SER C C 13 175.1 0.25 . 1 . . . . B 33 SER C . 30957 1 492 . 2 . 1 33 33 SER CA C 13 63.58 0.25 . 1 . . . . B 33 SER CA . 30957 1 493 . 2 . 1 33 33 SER N N 15 114 0.3 . 1 . . . . B 33 SER N . 30957 1 494 . 2 . 1 34 34 VAL H H 1 8.2 0.07 . 1 . . . . B 34 VAL H . 30957 1 495 . 2 . 1 34 34 VAL C C 13 178.3 0.25 . 1 . . . . B 34 VAL C . 30957 1 496 . 2 . 1 34 34 VAL CA C 13 66.55 0.25 . 1 . . . . B 34 VAL CA . 30957 1 497 . 2 . 1 34 34 VAL CB C 13 30.61 0.25 . 1 . . . . B 34 VAL CB . 30957 1 498 . 2 . 1 34 34 VAL N N 15 121.7 0.3 . 1 . . . . B 34 VAL N . 30957 1 499 . 2 . 1 35 35 GLY H H 1 8.45 0.07 . 1 . . . . B 35 GLY H . 30957 1 500 . 2 . 1 35 35 GLY C C 13 174.7 0.25 . 1 . . . . B 35 GLY C . 30957 1 501 . 2 . 1 35 35 GLY CA C 13 48.08 0.25 . 1 . . . . B 35 GLY CA . 30957 1 502 . 2 . 1 35 35 GLY N N 15 104.1 0.3 . 1 . . . . B 35 GLY N . 30957 1 503 . 2 . 1 36 36 THR H H 1 8.06 0.07 . 1 . . . . B 36 THR H . 30957 1 504 . 2 . 1 36 36 THR C C 13 175 0.25 . 1 . . . . B 36 THR C . 30957 1 505 . 2 . 1 36 36 THR CA C 13 68.26 0.25 . 1 . . . . B 36 THR CA . 30957 1 506 . 2 . 1 36 36 THR N N 15 120.7 0.3 . 1 . . . . B 36 THR N . 30957 1 507 . 2 . 1 41 41 CYS C C 13 176.7 0.25 . 1 . . . . B 41 CYS C . 30957 1 508 . 2 . 1 41 41 CYS CA C 13 65.79 0.25 . 1 . . . . B 41 CYS CA . 30957 1 509 . 2 . 1 41 41 CYS CB C 13 26.11 0.25 . 1 . . . . B 41 CYS CB . 30957 1 510 . 2 . 1 42 42 ALA H H 1 8.07 0.07 . 1 . . . . B 42 ALA H . 30957 1 511 . 2 . 1 42 42 ALA C C 13 178.3 0.25 . 1 . . . . B 42 ALA C . 30957 1 512 . 2 . 1 42 42 ALA CA C 13 55.03 0.25 . 1 . . . . B 42 ALA CA . 30957 1 513 . 2 . 1 42 42 ALA CB C 13 16.5 0.25 . 1 . . . . B 42 ALA CB . 30957 1 514 . 2 . 1 42 42 ALA N N 15 119.7 0.3 . 1 . . . . B 42 ALA N . 30957 1 515 . 2 . 1 43 43 SER H H 1 8.2 0.07 . 1 . . . . B 43 SER H . 30957 1 516 . 2 . 1 43 43 SER C C 13 177.6 0.25 . 1 . . . . B 43 SER C . 30957 1 517 . 2 . 1 43 43 SER CA C 13 63.34 0.25 . 1 . . . . B 43 SER CA . 30957 1 518 . 2 . 1 43 43 SER N N 15 112.2 0.3 . 1 . . . . B 43 SER N . 30957 1 519 . 2 . 1 46 46 LEU C C 13 179.5 0.25 . 1 . . . . B 46 LEU C . 30957 1 520 . 2 . 1 46 46 LEU CA C 13 58.13 0.25 . 1 . . . . B 46 LEU CA . 30957 1 521 . 2 . 1 46 46 LEU CB C 13 40.91 0.25 . 1 . . . . B 46 LEU CB . 30957 1 522 . 2 . 1 47 47 LEU H H 1 8.67 0.07 . 1 . . . . B 47 LEU H . 30957 1 523 . 2 . 1 47 47 LEU C C 13 179.1 0.25 . 1 . . . . B 47 LEU C . 30957 1 524 . 2 . 1 47 47 LEU CA C 13 57.71 0.25 . 1 . . . . B 47 LEU CA . 30957 1 525 . 2 . 1 47 47 LEU CB C 13 40.42 0.25 . 1 . . . . B 47 LEU CB . 30957 1 526 . 2 . 1 47 47 LEU N N 15 120.7 0.3 . 1 . . . . B 47 LEU N . 30957 1 527 . 2 . 1 48 48 ALA H H 1 8.19 0.07 . 1 . . . . B 48 ALA H . 30957 1 528 . 2 . 1 48 48 ALA C C 13 180.2 0.25 . 1 . . . . B 48 ALA C . 30957 1 529 . 2 . 1 48 48 ALA CA C 13 55.07 0.25 . 1 . . . . B 48 ALA CA . 30957 1 530 . 2 . 1 48 48 ALA CB C 13 16.93 0.25 . 1 . . . . B 48 ALA CB . 30957 1 531 . 2 . 1 48 48 ALA N N 15 120.4 0.3 . 1 . . . . B 48 ALA N . 30957 1 532 . 2 . 1 49 49 GLN H H 1 6.89 0.07 . 1 . . . . B 49 GLN H . 30957 1 533 . 2 . 1 49 49 GLN C C 13 177.2 0.25 . 1 . . . . B 49 GLN C . 30957 1 534 . 2 . 1 49 49 GLN CA C 13 55.28 0.25 . 1 . . . . B 49 GLN CA . 30957 1 535 . 2 . 1 49 49 GLN CB C 13 25.42 0.25 . 1 . . . . B 49 GLN CB . 30957 1 536 . 2 . 1 49 49 GLN N N 15 114 0.3 . 1 . . . . B 49 GLN N . 30957 1 537 . 2 . 1 50 50 THR C C 13 177.3 0.25 . 1 . . . . B 50 THR C . 30957 1 538 . 2 . 1 50 50 THR CA C 13 64.43 0.25 . 1 . . . . B 50 THR CA . 30957 1 539 . 2 . 1 51 51 LEU H H 1 6.38 0.07 . 1 . . . . B 51 LEU H . 30957 1 540 . 2 . 1 51 51 LEU C C 13 176.8 0.25 . 1 . . . . B 51 LEU C . 30957 1 541 . 2 . 1 51 51 LEU CA C 13 55.65 0.25 . 1 . . . . B 51 LEU CA . 30957 1 542 . 2 . 1 51 51 LEU CB C 13 38.52 0.25 . 1 . . . . B 51 LEU CB . 30957 1 543 . 2 . 1 51 51 LEU N N 15 117.3 0.3 . 1 . . . . B 51 LEU N . 30957 1 544 . 2 . 1 52 52 ALA H H 1 6.79 0.07 . 1 . . . . B 52 ALA H . 30957 1 545 . 2 . 1 52 52 ALA C C 13 177.3 0.25 . 1 . . . . B 52 ALA C . 30957 1 546 . 2 . 1 52 52 ALA CA C 13 52.55 0.25 . 1 . . . . B 52 ALA CA . 30957 1 547 . 2 . 1 52 52 ALA CB C 13 16.76 0.25 . 1 . . . . B 52 ALA CB . 30957 1 548 . 2 . 1 52 52 ALA N N 15 119.1 0.3 . 1 . . . . B 52 ALA N . 30957 1 549 . 2 . 1 53 53 TYR H H 1 7.34 0.07 . 1 . . . . B 53 TYR H . 30957 1 550 . 2 . 1 53 53 TYR C C 13 174.5 0.25 . 1 . . . . B 53 TYR C . 30957 1 551 . 2 . 1 53 53 TYR CA C 13 57.86 0.25 . 1 . . . . B 53 TYR CA . 30957 1 552 . 2 . 1 53 53 TYR CB C 13 41.24 0.25 . 1 . . . . B 53 TYR CB . 30957 1 553 . 2 . 1 53 53 TYR N N 15 112.6 0.3 . 1 . . . . B 53 TYR N . 30957 1 554 . 2 . 1 56 56 THR C C 13 176.1 0.25 . 1 . . . . B 56 THR C . 30957 1 555 . 2 . 1 57 57 GLY H H 1 9.93 0.07 . 1 . . . . B 57 GLY H . 30957 1 556 . 2 . 1 57 57 GLY C C 13 175.2 0.25 . 1 . . . . B 57 GLY C . 30957 1 557 . 2 . 1 57 57 GLY CA C 13 47.17 0.25 . 1 . . . . B 57 GLY CA . 30957 1 558 . 2 . 1 57 57 GLY N N 15 106.2 0.3 . 1 . . . . B 57 GLY N . 30957 1 559 . 2 . 1 58 58 ILE H H 1 6.16 0.07 . 1 . . . . B 58 ILE H . 30957 1 560 . 2 . 1 58 58 ILE C C 13 176.6 0.25 . 1 . . . . B 58 ILE C . 30957 1 561 . 2 . 1 58 58 ILE CA C 13 64.99 0.25 . 1 . . . . B 58 ILE CA . 30957 1 562 . 2 . 1 58 58 ILE CB C 13 37.62 0.25 . 1 . . . . B 58 ILE CB . 30957 1 563 . 2 . 1 58 58 ILE N N 15 117.3 0.3 . 1 . . . . B 58 ILE N . 30957 1 564 . 2 . 1 59 59 ALA H H 1 7.85 0.07 . 1 . . . . B 59 ALA H . 30957 1 565 . 2 . 1 59 59 ALA C C 13 178 0.25 . 1 . . . . B 59 ALA C . 30957 1 566 . 2 . 1 59 59 ALA CA C 13 55.48 0.25 . 1 . . . . B 59 ALA CA . 30957 1 567 . 2 . 1 59 59 ALA CB C 13 16.57 0.25 . 1 . . . . B 59 ALA CB . 30957 1 568 . 2 . 1 59 59 ALA N N 15 121.2 0.3 . 1 . . . . B 59 ALA N . 30957 1 569 . 2 . 1 60 60 TYR H H 1 8.47 0.07 . 1 . . . . B 60 TYR H . 30957 1 570 . 2 . 1 60 60 TYR C C 13 176.9 0.25 . 1 . . . . B 60 TYR C . 30957 1 571 . 2 . 1 60 60 TYR CA C 13 61.52 0.25 . 1 . . . . B 60 TYR CA . 30957 1 572 . 2 . 1 60 60 TYR CB C 13 40.32 0.25 . 1 . . . . B 60 TYR CB . 30957 1 573 . 2 . 1 60 60 TYR N N 15 116.2 0.3 . 1 . . . . B 60 TYR N . 30957 1 574 . 2 . 1 61 61 ALA H H 1 7.76 0.07 . 1 . . . . B 61 ALA H . 30957 1 575 . 2 . 1 61 61 ALA C C 13 179.4 0.25 . 1 . . . . B 61 ALA C . 30957 1 576 . 2 . 1 61 61 ALA CA C 13 55.32 0.25 . 1 . . . . B 61 ALA CA . 30957 1 577 . 2 . 1 61 61 ALA CB C 13 17.5 0.25 . 1 . . . . B 61 ALA CB . 30957 1 578 . 2 . 1 61 61 ALA N N 15 117.2 0.3 . 1 . . . . B 61 ALA N . 30957 1 579 . 2 . 1 62 62 ILE H H 1 8.3 0.07 . 1 . . . . B 62 ILE H . 30957 1 580 . 2 . 1 62 62 ILE C C 13 176.9 0.25 . 1 . . . . B 62 ILE C . 30957 1 581 . 2 . 1 62 62 ILE CA C 13 66.31 0.25 . 1 . . . . B 62 ILE CA . 30957 1 582 . 2 . 1 62 62 ILE CB C 13 37.12 0.25 . 1 . . . . B 62 ILE CB . 30957 1 583 . 2 . 1 62 62 ILE N N 15 116.5 0.3 . 1 . . . . B 62 ILE N . 30957 1 584 . 2 . 1 63 63 TRP H H 1 8.4 0.07 . 1 . . . . B 63 TRP H . 30957 1 585 . 2 . 1 63 63 TRP C C 13 180 0.25 . 1 . . . . B 63 TRP C . 30957 1 586 . 2 . 1 63 63 TRP CA C 13 58.23 0.25 . 1 . . . . B 63 TRP CA . 30957 1 587 . 2 . 1 63 63 TRP CB C 13 28.13 0.25 . 1 . . . . B 63 TRP CB . 30957 1 588 . 2 . 1 63 63 TRP N N 15 120 0.3 . 1 . . . . B 63 TRP N . 30957 1 589 . 2 . 1 64 64 VAL C C 13 177.6 0.25 . 1 . . . . B 64 VAL C . 30957 1 590 . 2 . 1 65 65 GLY C C 13 175.2 0.25 . 1 . . . . B 65 GLY C . 30957 1 591 . 2 . 1 65 65 GLY CA C 13 47.09 0.25 . 1 . . . . B 65 GLY CA . 30957 1 592 . 2 . 1 66 66 VAL H H 1 8.81 0.07 . 1 . . . . B 66 VAL H . 30957 1 593 . 2 . 1 66 66 VAL C C 13 178.2 0.25 . 1 . . . . B 66 VAL C . 30957 1 594 . 2 . 1 66 66 VAL CA C 13 66.5 0.25 . 1 . . . . B 66 VAL CA . 30957 1 595 . 2 . 1 66 66 VAL CB C 13 29.07 0.25 . 1 . . . . B 66 VAL CB . 30957 1 596 . 2 . 1 66 66 VAL N N 15 120.2 0.3 . 1 . . . . B 66 VAL N . 30957 1 597 . 2 . 1 67 67 GLY H H 1 7.22 0.07 . 1 . . . . B 67 GLY H . 30957 1 598 . 2 . 1 67 67 GLY C C 13 175.9 0.25 . 1 . . . . B 67 GLY C . 30957 1 599 . 2 . 1 67 67 GLY CA C 13 47.79 0.25 . 1 . . . . B 67 GLY CA . 30957 1 600 . 2 . 1 67 67 GLY N N 15 106.7 0.3 . 1 . . . . B 67 GLY N . 30957 1 601 . 2 . 1 68 68 ILE H H 1 7.09 0.07 . 1 . . . . B 68 ILE H . 30957 1 602 . 2 . 1 68 68 ILE C C 13 178.9 0.25 . 1 . . . . B 68 ILE C . 30957 1 603 . 2 . 1 68 68 ILE CA C 13 62.77 0.25 . 1 . . . . B 68 ILE CA . 30957 1 604 . 2 . 1 68 68 ILE N N 15 121.8 0.3 . 1 . . . . B 68 ILE N . 30957 1 605 . 2 . 1 69 69 VAL H H 1 7.29 0.07 . 1 . . . . B 69 VAL H . 30957 1 606 . 2 . 1 69 69 VAL CA C 13 66.89 0.25 . 1 . . . . B 69 VAL CA . 30957 1 607 . 2 . 1 69 69 VAL N N 15 122.4 0.3 . 1 . . . . B 69 VAL N . 30957 1 608 . 2 . 1 74 74 LEU C C 13 178.9 0.25 . 1 . . . . B 74 LEU C . 30957 1 609 . 2 . 1 74 74 LEU CA C 13 58.42 0.25 . 1 . . . . B 74 LEU CA . 30957 1 610 . 2 . 1 74 74 LEU CB C 13 41.29 0.25 . 1 . . . . B 74 LEU CB . 30957 1 611 . 2 . 1 75 75 SER H H 1 8.24 0.07 . 1 . . . . B 75 SER H . 30957 1 612 . 2 . 1 75 75 SER C C 13 177.7 0.25 . 1 . . . . B 75 SER C . 30957 1 613 . 2 . 1 75 75 SER CA C 13 61.88 0.25 . 1 . . . . B 75 SER CA . 30957 1 614 . 2 . 1 75 75 SER N N 15 115.9 0.3 . 1 . . . . B 75 SER N . 30957 1 615 . 2 . 1 76 76 TRP H H 1 7.71 0.07 . 1 . . . . B 76 TRP H . 30957 1 616 . 2 . 1 76 76 TRP C C 13 177.9 0.25 . 1 . . . . B 76 TRP C . 30957 1 617 . 2 . 1 76 76 TRP CA C 13 58.66 0.25 . 1 . . . . B 76 TRP CA . 30957 1 618 . 2 . 1 76 76 TRP CB C 13 28.06 0.25 . 1 . . . . B 76 TRP CB . 30957 1 619 . 2 . 1 76 76 TRP N N 15 124.6 0.3 . 1 . . . . B 76 TRP N . 30957 1 620 . 2 . 1 77 77 GLY H H 1 8.57 0.07 . 1 . . . . B 77 GLY H . 30957 1 621 . 2 . 1 77 77 GLY C C 13 173.6 0.25 . 1 . . . . B 77 GLY C . 30957 1 622 . 2 . 1 77 77 GLY CA C 13 46.72 0.25 . 1 . . . . B 77 GLY CA . 30957 1 623 . 2 . 1 77 77 GLY N N 15 105.6 0.3 . 1 . . . . B 77 GLY N . 30957 1 624 . 2 . 1 78 78 PHE H H 1 7.58 0.07 . 1 . . . . B 78 PHE H . 30957 1 625 . 2 . 1 78 78 PHE C C 13 175.6 0.25 . 1 . . . . B 78 PHE C . 30957 1 626 . 2 . 1 78 78 PHE CA C 13 58.04 0.25 . 1 . . . . B 78 PHE CA . 30957 1 627 . 2 . 1 78 78 PHE CB C 13 40.81 0.25 . 1 . . . . B 78 PHE CB . 30957 1 628 . 2 . 1 78 78 PHE N N 15 110.1 0.3 . 1 . . . . B 78 PHE N . 30957 1 629 . 2 . 1 79 79 PHE H H 1 7.07 0.07 . 1 . . . . B 79 PHE H . 30957 1 630 . 2 . 1 79 79 PHE C C 13 177 0.25 . 1 . . . . B 79 PHE C . 30957 1 631 . 2 . 1 79 79 PHE CA C 13 56.13 0.25 . 1 . . . . B 79 PHE CA . 30957 1 632 . 2 . 1 79 79 PHE CB C 13 39.04 0.25 . 1 . . . . B 79 PHE CB . 30957 1 633 . 2 . 1 79 79 PHE N N 15 115.1 0.3 . 1 . . . . B 79 PHE N . 30957 1 634 . 2 . 1 80 80 GLY H H 1 8.4 0.07 . 1 . . . . B 80 GLY H . 30957 1 635 . 2 . 1 80 80 GLY C C 13 174.8 0.25 . 1 . . . . B 80 GLY C . 30957 1 636 . 2 . 1 80 80 GLY CA C 13 46.25 0.25 . 1 . . . . B 80 GLY CA . 30957 1 637 . 2 . 1 80 80 GLY N N 15 109.3 0.3 . 1 . . . . B 80 GLY N . 30957 1 638 . 2 . 1 81 81 GLN H H 1 7.24 0.07 . 1 . . . . B 81 GLN H . 30957 1 639 . 2 . 1 81 81 GLN C C 13 175.5 0.25 . 1 . . . . B 81 GLN C . 30957 1 640 . 2 . 1 81 81 GLN CA C 13 55.13 0.25 . 1 . . . . B 81 GLN CA . 30957 1 641 . 2 . 1 81 81 GLN CB C 13 28.45 0.25 . 1 . . . . B 81 GLN CB . 30957 1 642 . 2 . 1 81 81 GLN N N 15 119.6 0.3 . 1 . . . . B 81 GLN N . 30957 1 643 . 2 . 1 82 82 ARG H H 1 8.29 0.07 . 1 . . . . B 82 ARG H . 30957 1 644 . 2 . 1 82 82 ARG C C 13 176.8 0.25 . 1 . . . . B 82 ARG C . 30957 1 645 . 2 . 1 82 82 ARG CA C 13 54.9 0.25 . 1 . . . . B 82 ARG CA . 30957 1 646 . 2 . 1 82 82 ARG CB C 13 29.59 0.25 . 1 . . . . B 82 ARG CB . 30957 1 647 . 2 . 1 82 82 ARG N N 15 123.9 0.3 . 1 . . . . B 82 ARG N . 30957 1 648 . 2 . 1 83 83 LEU H H 1 8.38 0.07 . 1 . . . . B 83 LEU H . 30957 1 649 . 2 . 1 83 83 LEU C C 13 173.7 0.25 . 1 . . . . B 83 LEU C . 30957 1 650 . 2 . 1 83 83 LEU CA C 13 54.02 0.25 . 1 . . . . B 83 LEU CA . 30957 1 651 . 2 . 1 83 83 LEU CB C 13 41.63 0.25 . 1 . . . . B 83 LEU CB . 30957 1 652 . 2 . 1 83 83 LEU N N 15 124.5 0.3 . 1 . . . . B 83 LEU N . 30957 1 653 . 2 . 1 84 84 ASP H H 1 6.91 0.07 . 1 . . . . B 84 ASP H . 30957 1 654 . 2 . 1 84 84 ASP C C 13 175.1 0.25 . 1 . . . . B 84 ASP C . 30957 1 655 . 2 . 1 84 84 ASP CA C 13 50.65 0.25 . 1 . . . . B 84 ASP CA . 30957 1 656 . 2 . 1 84 84 ASP CB C 13 41.75 0.25 . 1 . . . . B 84 ASP CB . 30957 1 657 . 2 . 1 84 84 ASP N N 15 119 0.3 . 1 . . . . B 84 ASP N . 30957 1 658 . 2 . 1 85 85 LEU H H 1 8.97 0.07 . 1 . . . . B 85 LEU H . 30957 1 659 . 2 . 1 85 85 LEU C C 13 175.9 0.25 . 1 . . . . B 85 LEU C . 30957 1 660 . 2 . 1 85 85 LEU CA C 13 59.1 0.25 . 1 . . . . B 85 LEU CA . 30957 1 661 . 2 . 1 85 85 LEU CB C 13 37.63 0.25 . 1 . . . . B 85 LEU CB . 30957 1 662 . 2 . 1 85 85 LEU N N 15 118.5 0.3 . 1 . . . . B 85 LEU N . 30957 1 663 . 2 . 1 86 86 PRO C C 13 177.5 0.25 . 1 . . . . B 86 PRO C . 30957 1 664 . 2 . 1 86 86 PRO CA C 13 66.32 0.25 . 1 . . . . B 86 PRO CA . 30957 1 665 . 2 . 1 86 86 PRO CB C 13 30.06 0.25 . 1 . . . . B 86 PRO CB . 30957 1 666 . 2 . 1 87 87 ALA H H 1 7.27 0.07 . 1 . . . . B 87 ALA H . 30957 1 667 . 2 . 1 87 87 ALA C C 13 179.1 0.25 . 1 . . . . B 87 ALA C . 30957 1 668 . 2 . 1 87 87 ALA CA C 13 55.45 0.25 . 1 . . . . B 87 ALA CA . 30957 1 669 . 2 . 1 87 87 ALA CB C 13 16.92 0.25 . 1 . . . . B 87 ALA CB . 30957 1 670 . 2 . 1 87 87 ALA N N 15 117.2 0.3 . 1 . . . . B 87 ALA N . 30957 1 671 . 2 . 1 88 88 ILE H H 1 7.75 0.07 . 1 . . . . B 88 ILE H . 30957 1 672 . 2 . 1 88 88 ILE C C 13 178.3 0.25 . 1 . . . . B 88 ILE C . 30957 1 673 . 2 . 1 88 88 ILE CA C 13 64.61 0.25 . 1 . . . . B 88 ILE CA . 30957 1 674 . 2 . 1 88 88 ILE CB C 13 36.8 0.25 . 1 . . . . B 88 ILE CB . 30957 1 675 . 2 . 1 88 88 ILE N N 15 117.2 0.3 . 1 . . . . B 88 ILE N . 30957 1 676 . 2 . 1 89 89 ILE H H 1 8.47 0.07 . 1 . . . . B 89 ILE H . 30957 1 677 . 2 . 1 89 89 ILE C C 13 178.3 0.25 . 1 . . . . B 89 ILE C . 30957 1 678 . 2 . 1 89 89 ILE CA C 13 64.5 0.25 . 1 . . . . B 89 ILE CA . 30957 1 679 . 2 . 1 89 89 ILE CB C 13 36.14 0.25 . 1 . . . . B 89 ILE CB . 30957 1 680 . 2 . 1 89 89 ILE N N 15 119.1 0.3 . 1 . . . . B 89 ILE N . 30957 1 681 . 2 . 1 90 90 GLY H H 1 8.68 0.07 . 1 . . . . B 90 GLY H . 30957 1 682 . 2 . 1 90 90 GLY C C 13 175.8 0.25 . 1 . . . . B 90 GLY C . 30957 1 683 . 2 . 1 90 90 GLY CA C 13 47.37 0.25 . 1 . . . . B 90 GLY CA . 30957 1 684 . 2 . 1 90 90 GLY N N 15 107.1 0.3 . 1 . . . . B 90 GLY N . 30957 1 685 . 2 . 1 91 91 MET H H 1 8.3 0.07 . 1 . . . . B 91 MET H . 30957 1 686 . 2 . 1 91 91 MET C C 13 178.3 0.25 . 1 . . . . B 91 MET C . 30957 1 687 . 2 . 1 91 91 MET CA C 13 60.02 0.25 . 1 . . . . B 91 MET CA . 30957 1 688 . 2 . 1 91 91 MET CB C 13 32.98 0.25 . 1 . . . . B 91 MET CB . 30957 1 689 . 2 . 1 91 91 MET N N 15 119.2 0.3 . 1 . . . . B 91 MET N . 30957 1 690 . 2 . 1 92 92 MET H H 1 8.06 0.07 . 1 . . . . B 92 MET H . 30957 1 691 . 2 . 1 92 92 MET C C 13 178.2 0.25 . 1 . . . . B 92 MET C . 30957 1 692 . 2 . 1 92 92 MET CA C 13 59.55 0.25 . 1 . . . . B 92 MET CA . 30957 1 693 . 2 . 1 92 92 MET CB C 13 33.12 0.25 . 1 . . . . B 92 MET CB . 30957 1 694 . 2 . 1 92 92 MET N N 15 118.8 0.3 . 1 . . . . B 92 MET N . 30957 1 695 . 2 . 1 96 96 ALA C C 13 178.3 0.25 . 1 . . . . B 96 ALA C . 30957 1 696 . 2 . 1 96 96 ALA CA C 13 55.09 0.25 . 1 . . . . B 96 ALA CA . 30957 1 697 . 2 . 1 96 96 ALA CB C 13 17.1 0.25 . 1 . . . . B 96 ALA CB . 30957 1 698 . 2 . 1 97 97 GLY H H 1 8.22 0.07 . 1 . . . . B 97 GLY H . 30957 1 699 . 2 . 1 97 97 GLY C C 13 175 0.25 . 1 . . . . B 97 GLY C . 30957 1 700 . 2 . 1 97 97 GLY CA C 13 48.59 0.25 . 1 . . . . B 97 GLY CA . 30957 1 701 . 2 . 1 97 97 GLY N N 15 105.5 0.3 . 1 . . . . B 97 GLY N . 30957 1 702 . 2 . 1 98 98 VAL H H 1 7.99 0.07 . 1 . . . . B 98 VAL H . 30957 1 703 . 2 . 1 98 98 VAL C C 13 178.1 0.25 . 1 . . . . B 98 VAL C . 30957 1 704 . 2 . 1 98 98 VAL CA C 13 66.9 0.25 . 1 . . . . B 98 VAL CA . 30957 1 705 . 2 . 1 98 98 VAL CB C 13 30.61 0.25 . 1 . . . . B 98 VAL CB . 30957 1 706 . 2 . 1 98 98 VAL N N 15 120.5 0.3 . 1 . . . . B 98 VAL N . 30957 1 707 . 2 . 1 102 102 ASN C C 13 177.5 0.25 . 1 . . . . B 102 ASN C . 30957 1 708 . 2 . 1 102 102 ASN CA C 13 56.12 0.25 . 1 . . . . B 102 ASN CA . 30957 1 709 . 2 . 1 102 102 ASN CB C 13 37.68 0.25 . 1 . . . . B 102 ASN CB . 30957 1 710 . 2 . 1 103 103 LEU H H 1 8.38 0.07 . 1 . . . . B 103 LEU H . 30957 1 711 . 2 . 1 103 103 LEU C C 13 178.4 0.25 . 1 . . . . B 103 LEU C . 30957 1 712 . 2 . 1 103 103 LEU CA C 13 56.1 0.25 . 1 . . . . B 103 LEU CA . 30957 1 713 . 2 . 1 103 103 LEU CB C 13 41.91 0.25 . 1 . . . . B 103 LEU CB . 30957 1 714 . 2 . 1 103 103 LEU N N 15 114.7 0.3 . 1 . . . . B 103 LEU N . 30957 1 715 . 2 . 1 104 104 LEU H H 1 7.58 0.07 . 1 . . . . B 104 LEU H . 30957 1 716 . 2 . 1 104 104 LEU C C 13 176.9 0.25 . 1 . . . . B 104 LEU C . 30957 1 717 . 2 . 1 104 104 LEU CA C 13 54.55 0.25 . 1 . . . . B 104 LEU CA . 30957 1 718 . 2 . 1 104 104 LEU CB C 13 43.85 0.25 . 1 . . . . B 104 LEU CB . 30957 1 719 . 2 . 1 104 104 LEU N N 15 113.8 0.3 . 1 . . . . B 104 LEU N . 30957 1 720 . 2 . 1 105 105 SER H H 1 7.51 0.07 . 1 . . . . B 105 SER H . 30957 1 721 . 2 . 1 105 105 SER C C 13 176.7 0.25 . 1 . . . . B 105 SER C . 30957 1 722 . 2 . 1 105 105 SER CA C 13 58.4 0.25 . 1 . . . . B 105 SER CA . 30957 1 723 . 2 . 1 105 105 SER CB C 13 63.75 0.25 . 1 . . . . B 105 SER CB . 30957 1 724 . 2 . 1 105 105 SER N N 15 112.1 0.3 . 1 . . . . B 105 SER N . 30957 1 stop_ save_