################################### # 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 50940 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'shift list' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 2 '3D CBCA(CO)NH' . . . 50940 1 3 '3D HNCA' . . . 50940 1 4 '3D HNCO' . . . 50940 1 5 '3D HNCACB' . . . 50940 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 50940 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 6 6 ASP H H 1 7.890 0.020 . 1 . . . . . 5 ASP H . 50940 1 2 . 1 . 1 6 6 ASP CA C 13 54.873 0.3 . 1 . . . . . 5 ASP CA . 50940 1 3 . 1 . 1 6 6 ASP CB C 13 40.634 0.3 . 1 . . . . . 5 ASP CB . 50940 1 4 . 1 . 1 6 6 ASP N N 15 124.040 0.3 . 1 . . . . . 5 ASP N . 50940 1 5 . 1 . 1 7 7 SER H H 1 8.405 0.020 . 1 . . . . . 6 SER H . 50940 1 6 . 1 . 1 7 7 SER CA C 13 59.052 0.3 . 1 . . . . . 6 SER CA . 50940 1 7 . 1 . 1 7 7 SER CB C 13 63.618 0.3 . 1 . . . . . 6 SER CB . 50940 1 8 . 1 . 1 7 7 SER N N 15 116.528 0.3 . 1 . . . . . 6 SER N . 50940 1 9 . 1 . 1 8 8 SER H H 1 8.351 0.020 . 1 . . . . . 7 SER H . 50940 1 10 . 1 . 1 8 8 SER CA C 13 59.053 0.3 . 1 . . . . . 7 SER CA . 50940 1 11 . 1 . 1 8 8 SER CB C 13 63.678 0.3 . 1 . . . . . 7 SER CB . 50940 1 12 . 1 . 1 8 8 SER N N 15 117.469 0.3 . 1 . . . . . 7 SER N . 50940 1 13 . 1 . 1 9 9 THR H H 1 8.088 0.020 . 1 . . . . . 8 THR H . 50940 1 14 . 1 . 1 9 9 THR CA C 13 61.993 0.3 . 1 . . . . . 8 THR CA . 50940 1 15 . 1 . 1 9 9 THR CB C 13 69.577 0.3 . 1 . . . . . 8 THR CB . 50940 1 16 . 1 . 1 9 9 THR N N 15 114.726 0.3 . 1 . . . . . 8 THR N . 50940 1 17 . 1 . 1 10 10 SER H H 1 8.206 0.020 . 1 . . . . . 9 SER H . 50940 1 18 . 1 . 1 10 10 SER CA C 13 58.665 0.3 . 1 . . . . . 9 SER CA . 50940 1 19 . 1 . 1 10 10 SER CB C 13 63.773 0.3 . 1 . . . . . 9 SER CB . 50940 1 20 . 1 . 1 10 10 SER N N 15 117.696 0.3 . 1 . . . . . 9 SER N . 50940 1 21 . 1 . 1 11 11 GLY H H 1 8.405 0.020 . 1 . . . . . 10 GLY H . 50940 1 22 . 1 . 1 11 11 GLY CA C 13 45.432 0.3 . 1 . . . . . 10 GLY CA . 50940 1 23 . 1 . 1 11 11 GLY N N 15 110.829 0.3 . 1 . . . . . 10 GLY N . 50940 1 24 . 1 . 1 12 12 THR H H 1 8.125 0.020 . 1 . . . . . 11 THR H . 50940 1 25 . 1 . 1 12 12 THR CA C 13 61.998 0.3 . 1 . . . . . 11 THR CA . 50940 1 26 . 1 . 1 12 12 THR CB C 13 69.732 0.3 . 1 . . . . . 11 THR CB . 50940 1 27 . 1 . 1 12 12 THR N N 15 113.008 0.3 . 1 . . . . . 11 THR N . 50940 1 28 . 1 . 1 13 13 GLY H H 1 8.450 0.020 . 1 . . . . . 12 GLY H . 50940 1 29 . 1 . 1 13 13 GLY CA C 13 45.355 0.3 . 1 . . . . . 12 GLY CA . 50940 1 30 . 1 . 1 13 13 GLY N N 15 111.216 0.3 . 1 . . . . . 12 GLY N . 50940 1 31 . 1 . 1 14 14 SER H H 1 8.168 0.020 . 1 . . . . . 13 SER H . 50940 1 32 . 1 . 1 14 14 SER CA C 13 58.355 0.3 . 1 . . . . . 13 SER CA . 50940 1 33 . 1 . 1 14 14 SER CB C 13 63.696 0.3 . 1 . . . . . 13 SER CB . 50940 1 34 . 1 . 1 14 14 SER N N 15 115.389 0.3 . 1 . . . . . 13 SER N . 50940 1 35 . 1 . 1 15 15 HIS H H 1 8.474 0.020 . 1 . . . . . 14 HIS H . 50940 1 36 . 1 . 1 15 15 HIS CA C 13 55.881 0.3 . 1 . . . . . 14 HIS CA . 50940 1 37 . 1 . 1 15 15 HIS CB C 13 29.625 0.3 . 1 . . . . . 14 HIS CB . 50940 1 38 . 1 . 1 15 15 HIS N N 15 120.560 0.3 . 1 . . . . . 14 HIS N . 50940 1 39 . 1 . 1 16 16 THR H H 1 8.106 0.020 . 1 . . . . . 15 THR H . 50940 1 40 . 1 . 1 16 16 THR CA C 13 61.916 0.3 . 1 . . . . . 15 THR CA . 50940 1 41 . 1 . 1 16 16 THR CB C 13 69.809 0.3 . 1 . . . . . 15 THR CB . 50940 1 42 . 1 . 1 16 16 THR N N 15 115.604 0.3 . 1 . . . . . 15 THR N . 50940 1 43 . 1 . 1 17 17 ALA H H 1 8.375 0.020 . 1 . . . . . 16 ALA H . 50940 1 44 . 1 . 1 17 17 ALA CA C 13 52.581 0.3 . 1 . . . . . 16 ALA CA . 50940 1 45 . 1 . 1 17 17 ALA CB C 13 19.043 0.3 . 1 . . . . . 16 ALA CB . 50940 1 46 . 1 . 1 17 17 ALA N N 15 126.711 0.3 . 1 . . . . . 16 ALA N . 50940 1 47 . 1 . 1 18 18 SER H H 1 8.286 0.020 . 1 . . . . . 17 SER H . 50940 1 48 . 1 . 1 18 18 SER CA C 13 58.433 0.3 . 1 . . . . . 17 SER CA . 50940 1 49 . 1 . 1 18 18 SER CB C 13 63.773 0.3 . 1 . . . . . 17 SER CB . 50940 1 50 . 1 . 1 18 18 SER N N 15 115.048 0.3 . 1 . . . . . 17 SER N . 50940 1 51 . 1 . 1 19 19 ASN H H 1 8.429 0.020 . 1 . . . . . 18 ASN H . 50940 1 52 . 1 . 1 19 19 ASN CA C 13 53.326 0.3 . 1 . . . . . 18 ASN CA . 50940 1 53 . 1 . 1 19 19 ASN CB C 13 38.854 0.3 . 1 . . . . . 18 ASN CB . 50940 1 54 . 1 . 1 19 19 ASN N N 15 121.084 0.3 . 1 . . . . . 18 ASN N . 50940 1 55 . 1 . 1 20 20 THR H H 1 8.115 0.020 . 1 . . . . . 19 THR H . 50940 1 56 . 1 . 1 20 20 THR CA C 13 62.148 0.3 . 1 . . . . . 19 THR CA . 50940 1 57 . 1 . 1 20 20 THR CB C 13 69.577 0.3 . 1 . . . . . 19 THR CB . 50940 1 58 . 1 . 1 20 20 THR N N 15 114.096 0.3 . 1 . . . . . 19 THR N . 50940 1 59 . 1 . 1 21 21 SER H H 1 8.251 0.020 . 1 . . . . . 20 SER H . 50940 1 60 . 1 . 1 21 21 SER CA C 13 58.588 0.3 . 1 . . . . . 20 SER CA . 50940 1 61 . 1 . 1 21 21 SER CB C 13 63.696 0.3 . 1 . . . . . 20 SER CB . 50940 1 62 . 1 . 1 21 21 SER N N 15 117.994 0.3 . 1 . . . . . 20 SER N . 50940 1 63 . 1 . 1 22 22 LEU H H 1 8.163 0.020 . 1 . . . . . 21 LEU H . 50940 1 64 . 1 . 1 22 22 LEU CA C 13 55.187 0.3 . 1 . . . . . 21 LEU CA . 50940 1 65 . 1 . 1 22 22 LEU CB C 13 42.182 0.3 . 1 . . . . . 21 LEU CB . 50940 1 66 . 1 . 1 22 22 LEU N N 15 124.009 0.3 . 1 . . . . . 21 LEU N . 50940 1 67 . 1 . 1 23 23 VAL H H 1 8.038 0.020 . 1 . . . . . 22 VAL H . 50940 1 68 . 1 . 1 23 23 VAL CA C 13 59.904 0.3 . 1 . . . . . 22 VAL CA . 50940 1 69 . 1 . 1 23 23 VAL CB C 13 32.508 0.3 . 1 . . . . . 22 VAL CB . 50940 1 70 . 1 . 1 23 23 VAL N N 15 122.582 0.3 . 1 . . . . . 22 VAL N . 50940 1 71 . 1 . 1 25 25 ALA H H 1 8.426 0.020 . 1 . . . . . 24 ALA H . 50940 1 72 . 1 . 1 25 25 ALA CA C 13 53.248 0.3 . 1 . . . . . 24 ALA CA . 50940 1 73 . 1 . 1 25 25 ALA CB C 13 18.888 0.3 . 1 . . . . . 24 ALA CB . 50940 1 74 . 1 . 1 25 25 ALA N N 15 124.148 0.3 . 1 . . . . . 24 ALA N . 50940 1 75 . 1 . 1 26 26 SER H H 1 8.187 0.020 . 1 . . . . . 25 SER H . 50940 1 76 . 1 . 1 26 26 SER CA C 13 58.635 0.3 . 1 . . . . . 25 SER CA . 50940 1 77 . 1 . 1 26 26 SER CB C 13 63.463 0.3 . 1 . . . . . 25 SER CB . 50940 1 78 . 1 . 1 26 26 SER N N 15 113.690 0.3 . 1 . . . . . 25 SER N . 50940 1 79 . 1 . 1 27 27 LEU H H 1 8.031 0.020 . 1 . . . . . 26 LEU H . 50940 1 80 . 1 . 1 27 27 LEU CA C 13 55.338 0.3 . 1 . . . . . 26 LEU CA . 50940 1 81 . 1 . 1 27 27 LEU CB C 13 42.182 0.3 . 1 . . . . . 26 LEU CB . 50940 1 82 . 1 . 1 27 27 LEU N N 15 123.621 0.3 . 1 . . . . . 26 LEU N . 50940 1 83 . 1 . 1 28 28 LYS H H 1 8.048 0.020 . 1 . . . . . 27 LYS H . 50940 1 84 . 1 . 1 28 28 LYS CA C 13 56.499 0.3 . 1 . . . . . 27 LYS CA . 50940 1 85 . 1 . 1 28 28 LYS CB C 13 32.741 0.3 . 1 . . . . . 27 LYS CB . 50940 1 86 . 1 . 1 28 28 LYS N N 15 121.380 0.3 . 1 . . . . . 27 LYS N . 50940 1 87 . 1 . 1 29 29 ARG H H 1 8.182 0.020 . 1 . . . . . 28 ARG H . 50940 1 88 . 1 . 1 29 29 ARG CA C 13 56.237 0.3 . 1 . . . . . 28 ARG CA . 50940 1 89 . 1 . 1 29 29 ARG CB C 13 30.660 0.3 . 1 . . . . . 28 ARG CB . 50940 1 90 . 1 . 1 29 29 ARG N N 15 121.644 0.3 . 1 . . . . . 28 ARG N . 50940 1 91 . 1 . 1 30 30 ARG H H 1 8.330 0.020 . 1 . . . . . 29 ARG H . 50940 1 92 . 1 . 1 30 30 ARG N N 15 122.281 0.3 . 1 . . . . . 29 ARG N . 50940 1 93 . 1 . 1 31 31 GLY H H 1 8.412 0.020 . 1 . . . . . 30 GLY H . 50940 1 94 . 1 . 1 31 31 GLY CA C 13 45.123 0.3 . 1 . . . . . 30 GLY CA . 50940 1 95 . 1 . 1 31 31 GLY N N 15 109.882 0.3 . 1 . . . . . 30 GLY N . 50940 1 96 . 1 . 1 32 32 HIS H H 1 8.297 0.020 . 1 . . . . . 31 HIS H . 50940 1 97 . 1 . 1 32 32 HIS CA C 13 55.879 0.3 . 1 . . . . . 31 HIS CA . 50940 1 98 . 1 . 1 32 32 HIS CB C 13 29.955 0.3 . 1 . . . . . 31 HIS CB . 50940 1 99 . 1 . 1 32 32 HIS N N 15 118.879 0.3 . 1 . . . . . 31 HIS N . 50940 1 100 . 1 . 1 34 34 HIS H H 1 8.361 0.020 . 1 . . . . . 33 HIS H . 50940 1 101 . 1 . 1 34 34 HIS CA C 13 55.453 0.3 . 1 . . . . . 33 HIS CA . 50940 1 102 . 1 . 1 34 34 HIS CB C 13 29.753 0.3 . 1 . . . . . 33 HIS CB . 50940 1 103 . 1 . 1 34 34 HIS N N 15 118.798 0.3 . 1 . . . . . 33 HIS N . 50940 1 104 . 1 . 1 35 35 HIS H H 1 8.331 0.020 . 1 . . . . . 34 HIS H . 50940 1 105 . 1 . 1 35 35 HIS CA C 13 56.311 0.3 . 1 . . . . . 34 HIS CA . 50940 1 106 . 1 . 1 35 35 HIS CB C 13 32.803 0.3 . 1 . . . . . 34 HIS CB . 50940 1 107 . 1 . 1 35 35 HIS N N 15 122.060 0.3 . 1 . . . . . 34 HIS N . 50940 1 108 . 1 . 1 37 37 ARG H H 1 8.620 0.020 . 1 . . . . . 36 ARG H . 50940 1 109 . 1 . 1 37 37 ARG CA C 13 56.266 0.3 . 1 . . . . . 36 ARG CA . 50940 1 110 . 1 . 1 37 37 ARG CB C 13 30.806 0.3 . 1 . . . . . 36 ARG CB . 50940 1 111 . 1 . 1 37 37 ARG N N 15 121.500 0.3 . 1 . . . . . 36 ARG N . 50940 1 112 . 1 . 1 38 38 PHE H H 1 8.296 0.020 . 1 . . . . . 37 PHE H . 50940 1 113 . 1 . 1 38 38 PHE CA C 13 57.118 0.3 . 1 . . . . . 37 PHE CA . 50940 1 114 . 1 . 1 38 38 PHE CB C 13 39.628 0.3 . 1 . . . . . 37 PHE CB . 50940 1 115 . 1 . 1 38 38 PHE N N 15 121.131 0.3 . 1 . . . . . 37 PHE N . 50940 1 116 . 1 . 1 39 39 SER H H 1 8.305 0.020 . 1 . . . . . 38 SER H . 50940 1 117 . 1 . 1 39 39 SER CA C 13 58.278 0.3 . 1 . . . . . 38 SER CA . 50940 1 118 . 1 . 1 39 39 SER CB C 13 63.928 0.3 . 1 . . . . . 38 SER CB . 50940 1 119 . 1 . 1 39 39 SER N N 15 118.111 0.3 . 1 . . . . . 38 SER N . 50940 1 120 . 1 . 1 40 40 GLY H H 1 7.895 0.020 . 1 . . . . . 39 GLY H . 50940 1 121 . 1 . 1 40 40 GLY CA C 13 45.355 0.3 . 1 . . . . . 39 GLY CA . 50940 1 122 . 1 . 1 40 40 GLY N N 15 110.436 0.3 . 1 . . . . . 39 GLY N . 50940 1 123 . 1 . 1 41 41 THR H H 1 8.070 0.020 . 1 . . . . . 40 THR H . 50940 1 124 . 1 . 1 41 41 THR CA C 13 61.993 0.3 . 1 . . . . . 40 THR CA . 50940 1 125 . 1 . 1 41 41 THR CB C 13 69.809 0.3 . 1 . . . . . 40 THR CB . 50940 1 126 . 1 . 1 41 41 THR N N 15 113.980 0.3 . 1 . . . . . 40 THR N . 50940 1 127 . 1 . 1 42 42 ARG H H 1 8.352 0.020 . 1 . . . . . 41 ARG H . 50940 1 128 . 1 . 1 42 42 ARG CA C 13 56.034 0.3 . 1 . . . . . 41 ARG CA . 50940 1 129 . 1 . 1 42 42 ARG CB C 13 30.729 0.3 . 1 . . . . . 41 ARG CB . 50940 1 130 . 1 . 1 42 42 ARG N N 15 123.858 0.3 . 1 . . . . . 41 ARG N . 50940 1 131 . 1 . 1 43 43 ARG H H 1 8.394 0.020 . 1 . . . . . 42 ARG H . 50940 1 132 . 1 . 1 43 43 ARG CA C 13 53.713 0.3 . 1 . . . . . 42 ARG CA . 50940 1 133 . 1 . 1 43 43 ARG CB C 13 29.645 0.3 . 1 . . . . . 42 ARG CB . 50940 1 134 . 1 . 1 43 43 ARG N N 15 124.017 0.3 . 1 . . . . . 42 ARG N . 50940 1 135 . 1 . 1 45 45 ASN H H 1 8.495 0.020 . 1 . . . . . 44 ASN H . 50940 1 136 . 1 . 1 45 45 ASN CA C 13 53.248 0.3 . 1 . . . . . 44 ASN CA . 50940 1 137 . 1 . 1 45 45 ASN CB C 13 38.622 0.3 . 1 . . . . . 44 ASN CB . 50940 1 138 . 1 . 1 45 45 ASN N N 15 118.675 0.3 . 1 . . . . . 44 ASN N . 50940 1 139 . 1 . 1 46 46 VAL H H 1 7.930 0.020 . 1 . . . . . 45 VAL H . 50940 1 140 . 1 . 1 46 46 VAL CA C 13 59.517 0.3 . 1 . . . . . 45 VAL CA . 50940 1 141 . 1 . 1 46 46 VAL CB C 13 32.663 0.3 . 1 . . . . . 45 VAL CB . 50940 1 142 . 1 . 1 46 46 VAL N N 15 120.899 0.3 . 1 . . . . . 45 VAL N . 50940 1 143 . 1 . 1 48 48 ASN H H 1 8.511 0.020 . 1 . . . . . 47 ASN H . 50940 1 144 . 1 . 1 48 48 ASN CA C 13 53.094 0.3 . 1 . . . . . 47 ASN CA . 50940 1 145 . 1 . 1 48 48 ASN CB C 13 38.699 0.3 . 1 . . . . . 47 ASN CB . 50940 1 146 . 1 . 1 48 48 ASN N N 15 119.012 0.3 . 1 . . . . . 47 ASN N . 50940 1 147 . 1 . 1 49 49 VAL H H 1 8.095 0.020 . 1 . . . . . 48 VAL H . 50940 1 148 . 1 . 1 49 49 VAL CA C 13 64.083 0.3 . 1 . . . . . 48 VAL CA . 50940 1 149 . 1 . 1 49 49 VAL CB C 13 32.121 0.3 . 1 . . . . . 48 VAL CB . 50940 1 150 . 1 . 1 49 49 VAL N N 15 120.450 0.3 . 1 . . . . . 48 VAL N . 50940 1 151 . 1 . 1 55 55 ALA H H 1 7.814 0.020 . 1 . . . . . 54 ALA H . 50940 1 152 . 1 . 1 55 55 ALA CA C 13 53.480 0.3 . 1 . . . . . 54 ALA CA . 50940 1 153 . 1 . 1 55 55 ALA CB C 13 18.579 0.3 . 1 . . . . . 54 ALA CB . 50940 1 154 . 1 . 1 55 55 ALA N N 15 120.814 0.3 . 1 . . . . . 54 ALA N . 50940 1 155 . 1 . 1 56 56 LEU H H 1 7.836 0.020 . 1 . . . . . 55 LEU H . 50940 1 156 . 1 . 1 56 56 LEU CA C 13 56.034 0.3 . 1 . . . . . 55 LEU CA . 50940 1 157 . 1 . 1 56 56 LEU CB C 13 42.259 0.3 . 1 . . . . . 55 LEU CB . 50940 1 158 . 1 . 1 56 56 LEU N N 15 119.655 0.3 . 1 . . . . . 55 LEU N . 50940 1 159 . 1 . 1 57 57 TYR H H 1 7.966 0.020 . 1 . . . . . 56 TYR H . 50940 1 160 . 1 . 1 57 57 TYR CA C 13 58.433 0.3 . 1 . . . . . 56 TYR CA . 50940 1 161 . 1 . 1 57 57 TYR CB C 13 38.312 0.3 . 1 . . . . . 56 TYR CB . 50940 1 162 . 1 . 1 57 57 TYR N N 15 119.587 0.3 . 1 . . . . . 56 TYR N . 50940 1 163 . 1 . 1 58 58 ARG H H 1 7.989 0.020 . 1 . . . . . 57 ARG H . 50940 1 164 . 1 . 1 58 58 ARG CA C 13 56.281 0.3 . 1 . . . . . 57 ARG CA . 50940 1 165 . 1 . 1 58 58 ARG CB C 13 30.651 0.3 . 1 . . . . . 57 ARG CB . 50940 1 166 . 1 . 1 58 58 ARG N N 15 121.721 0.3 . 1 . . . . . 57 ARG N . 50940 1 167 . 1 . 1 59 59 GLY H H 1 7.778 0.020 . 1 . . . . . 58 GLY H . 50940 1 168 . 1 . 1 59 59 GLY CA C 13 45.510 0.3 . 1 . . . . . 58 GLY CA . 50940 1 169 . 1 . 1 59 59 GLY N N 15 108.625 0.3 . 1 . . . . . 58 GLY N . 50940 1 170 . 1 . 1 60 60 ASP H H 1 8.190 0.020 . 1 . . . . . 59 ASP H . 50940 1 171 . 1 . 1 60 60 ASP CA C 13 53.867 0.3 . 1 . . . . . 59 ASP CA . 50940 1 172 . 1 . 1 60 60 ASP CB C 13 41.176 0.3 . 1 . . . . . 59 ASP CB . 50940 1 173 . 1 . 1 60 60 ASP N N 15 120.132 0.3 . 1 . . . . . 59 ASP N . 50940 1 174 . 1 . 1 63 63 SER H H 1 8.390 0.020 . 1 . . . . . 62 SER H . 50940 1 175 . 1 . 1 63 63 SER CA C 13 58.467 0.3 . 1 . . . . . 62 SER CA . 50940 1 176 . 1 . 1 63 63 SER CB C 13 63.696 0.3 . 1 . . . . . 62 SER CB . 50940 1 177 . 1 . 1 63 63 SER N N 15 115.949 0.3 . 1 . . . . . 62 SER N . 50940 1 178 . 1 . 1 64 64 ALA H H 1 8.231 0.020 . 1 . . . . . 63 ALA H . 50940 1 179 . 1 . 1 64 64 ALA CA C 13 53.057 0.3 . 1 . . . . . 63 ALA CA . 50940 1 180 . 1 . 1 64 64 ALA N N 15 125.820 0.3 . 1 . . . . . 63 ALA N . 50940 1 181 . 1 . 1 65 65 LEU H H 1 8.056 0.020 . 1 . . . . . 64 LEU H . 50940 1 182 . 1 . 1 65 65 LEU CA C 13 55.415 0.3 . 1 . . . . . 64 LEU CA . 50940 1 183 . 1 . 1 65 65 LEU CB C 13 42.027 0.3 . 1 . . . . . 64 LEU CB . 50940 1 184 . 1 . 1 65 65 LEU N N 15 119.814 0.3 . 1 . . . . . 64 LEU N . 50940 1 185 . 1 . 1 66 66 SER H H 1 8.068 0.020 . 1 . . . . . 65 SER H . 50940 1 186 . 1 . 1 66 66 SER CA C 13 58.898 0.3 . 1 . . . . . 65 SER CA . 50940 1 187 . 1 . 1 66 66 SER CB C 13 63.541 0.3 . 1 . . . . . 65 SER CB . 50940 1 188 . 1 . 1 66 66 SER N N 15 115.306 0.3 . 1 . . . . . 65 SER N . 50940 1 189 . 1 . 1 67 67 ASN H H 1 8.269 0.020 . 1 . . . . . 66 ASN H . 50940 1 190 . 1 . 1 67 67 ASN CA C 13 53.618 0.3 . 1 . . . . . 66 ASN CA . 50940 1 191 . 1 . 1 67 67 ASN CB C 13 38.622 0.3 . 1 . . . . . 66 ASN CB . 50940 1 192 . 1 . 1 67 67 ASN N N 15 120.049 0.3 . 1 . . . . . 66 ASN N . 50940 1 193 . 1 . 1 68 68 LEU H H 1 8.057 0.020 . 1 . . . . . 67 LEU H . 50940 1 194 . 1 . 1 68 68 LEU CA C 13 55.636 0.3 . 1 . . . . . 67 LEU CA . 50940 1 195 . 1 . 1 68 68 LEU CB C 13 42.104 0.3 . 1 . . . . . 67 LEU CB . 50940 1 196 . 1 . 1 68 68 LEU N N 15 121.721 0.3 . 1 . . . . . 67 LEU N . 50940 1 197 . 1 . 1 69 69 ARG H H 1 8.208 0.020 . 1 . . . . . 68 ARG H . 50940 1 198 . 1 . 1 69 69 ARG CA C 13 56.337 0.3 . 1 . . . . . 68 ARG CA . 50940 1 199 . 1 . 1 69 69 ARG CB C 13 30.574 0.3 . 1 . . . . . 68 ARG CB . 50940 1 200 . 1 . 1 69 69 ARG N N 15 120.394 0.3 . 1 . . . . . 68 ARG N . 50940 1 201 . 1 . 1 70 70 GLY H H 1 8.261 0.020 . 1 . . . . . 69 GLY H . 50940 1 202 . 1 . 1 70 70 GLY CA C 13 45.377 0.3 . 1 . . . . . 69 GLY CA . 50940 1 203 . 1 . 1 70 70 GLY N N 15 109.518 0.3 . 1 . . . . . 69 GLY N . 50940 1 204 . 1 . 1 71 71 GLU H H 1 8.280 0.020 . 1 . . . . . 70 GLU H . 50940 1 205 . 1 . 1 71 71 GLU CA C 13 56.653 0.3 . 1 . . . . . 70 GLU CA . 50940 1 206 . 1 . 1 71 71 GLU CB C 13 30.264 0.3 . 1 . . . . . 70 GLU CB . 50940 1 207 . 1 . 1 71 71 GLU N N 15 120.418 0.3 . 1 . . . . . 70 GLU N . 50940 1 208 . 1 . 1 72 72 THR H H 1 8.185 0.020 . 1 . . . . . 71 THR H . 50940 1 209 . 1 . 1 72 72 THR CA C 13 61.802 0.3 . 1 . . . . . 71 THR CA . 50940 1 210 . 1 . 1 72 72 THR CB C 13 69.887 0.3 . 1 . . . . . 71 THR CB . 50940 1 211 . 1 . 1 72 72 THR N N 15 115.273 0.3 . 1 . . . . . 71 THR N . 50940 1 212 . 1 . 1 73 73 GLN H H 1 8.454 0.020 . 1 . . . . . 72 GLN H . 50940 1 213 . 1 . 1 73 73 GLN CA C 13 53.480 0.3 . 1 . . . . . 72 GLN CA . 50940 1 214 . 1 . 1 73 73 GLN CB C 13 28.949 0.3 . 1 . . . . . 72 GLN CB . 50940 1 215 . 1 . 1 73 73 GLN N N 15 124.082 0.3 . 1 . . . . . 72 GLN N . 50940 1 216 . 1 . 1 75 75 GLU H H 1 8.559 0.020 . 1 . . . . . 74 GLU H . 50940 1 217 . 1 . 1 75 75 GLU CA C 13 56.808 0.3 . 1 . . . . . 74 GLU CA . 50940 1 218 . 1 . 1 75 75 GLU CB C 13 30.109 0.3 . 1 . . . . . 74 GLU CB . 50940 1 219 . 1 . 1 75 75 GLU N N 15 121.048 0.3 . 1 . . . . . 74 GLU N . 50940 1 220 . 1 . 1 76 76 GLU H H 1 8.389 0.020 . 1 . . . . . 75 GLU H . 50940 1 221 . 1 . 1 76 76 GLU CA C 13 56.499 0.3 . 1 . . . . . 75 GLU CA . 50940 1 222 . 1 . 1 76 76 GLU CB C 13 30.264 0.3 . 1 . . . . . 75 GLU CB . 50940 1 223 . 1 . 1 76 76 GLU N N 15 121.465 0.3 . 1 . . . . . 75 GLU N . 50940 1 224 . 1 . 1 77 77 GLU H H 1 8.330 0.020 . 1 . . . . . 76 GLU H . 50940 1 225 . 1 . 1 77 77 GLU CA C 13 56.112 0.3 . 1 . . . . . 76 GLU CA . 50940 1 226 . 1 . 1 77 77 GLU CB C 13 30.496 0.3 . 1 . . . . . 76 GLU CB . 50940 1 227 . 1 . 1 77 77 GLU N N 15 122.421 0.3 . 1 . . . . . 76 GLU N . 50940 1 228 . 1 . 1 80 80 GLN H H 1 8.523 0.020 . 1 . . . . . 79 GLN H . 50940 1 229 . 1 . 1 80 80 GLN CA C 13 55.725 0.3 . 1 . . . . . 79 GLN CA . 50940 1 230 . 1 . 1 80 80 GLN CB C 13 29.413 0.3 . 1 . . . . . 79 GLN CB . 50940 1 231 . 1 . 1 80 80 GLN N N 15 120.858 0.3 . 1 . . . . . 79 GLN N . 50940 1 232 . 1 . 1 81 81 GLN H H 1 8.441 0.020 . 1 . . . . . 80 GLN H . 50940 1 233 . 1 . 1 81 81 GLN CA C 13 55.794 0.3 . 1 . . . . . 80 GLN CA . 50940 1 234 . 1 . 1 81 81 GLN CB C 13 29.800 0.3 . 1 . . . . . 80 GLN CB . 50940 1 235 . 1 . 1 81 81 GLN N N 15 121.852 0.3 . 1 . . . . . 80 GLN N . 50940 1 236 . 1 . 1 82 82 GLN H H 1 8.528 0.020 . 1 . . . . . 81 GLN H . 50940 1 237 . 1 . 1 82 82 GLN CA C 13 55.725 0.3 . 1 . . . . . 81 GLN CA . 50940 1 238 . 1 . 1 82 82 GLN CB C 13 29.680 0.3 . 1 . . . . . 81 GLN CB . 50940 1 239 . 1 . 1 82 82 GLN N N 15 122.237 0.3 . 1 . . . . . 81 GLN N . 50940 1 240 . 1 . 1 83 83 THR H H 1 8.235 0.020 . 1 . . . . . 82 THR H . 50940 1 241 . 1 . 1 83 83 THR CA C 13 61.858 0.3 . 1 . . . . . 82 THR CA . 50940 1 242 . 1 . 1 83 83 THR CB C 13 69.809 0.3 . 1 . . . . . 82 THR CB . 50940 1 243 . 1 . 1 83 83 THR N N 15 115.949 0.3 . 1 . . . . . 82 THR N . 50940 1 244 . 1 . 1 84 84 GLU H H 1 8.433 0.020 . 1 . . . . . 83 GLU H . 50940 1 245 . 1 . 1 84 84 GLU CA C 13 56.499 0.3 . 1 . . . . . 83 GLU CA . 50940 1 246 . 1 . 1 84 84 GLU CB C 13 30.342 0.3 . 1 . . . . . 83 GLU CB . 50940 1 247 . 1 . 1 84 84 GLU N N 15 123.156 0.3 . 1 . . . . . 83 GLU N . 50940 1 248 . 1 . 1 85 85 GLU H H 1 8.425 0.020 . 1 . . . . . 84 GLU H . 50940 1 249 . 1 . 1 85 85 GLU CA C 13 56.576 0.3 . 1 . . . . . 84 GLU CA . 50940 1 250 . 1 . 1 85 85 GLU CB C 13 30.264 0.3 . 1 . . . . . 84 GLU CB . 50940 1 251 . 1 . 1 85 85 GLU N N 15 122.567 0.3 . 1 . . . . . 84 GLU N . 50940 1 252 . 1 . 1 86 86 VAL H H 1 8.209 0.020 . 1 . . . . . 85 VAL H . 50940 1 253 . 1 . 1 86 86 VAL CA C 13 62.148 0.3 . 1 . . . . . 85 VAL CA . 50940 1 254 . 1 . 1 86 86 VAL CB C 13 32.895 0.3 . 1 . . . . . 85 VAL CB . 50940 1 255 . 1 . 1 86 86 VAL N N 15 122.473 0.3 . 1 . . . . . 85 VAL N . 50940 1 256 . 1 . 1 87 87 LEU H H 1 8.358 0.020 . 1 . . . . . 86 LEU H . 50940 1 257 . 1 . 1 87 87 LEU CA C 13 52.707 0.3 . 1 . . . . . 86 LEU CA . 50940 1 258 . 1 . 1 87 87 LEU CB C 13 41.718 0.3 . 1 . . . . . 86 LEU CB . 50940 1 259 . 1 . 1 87 87 LEU N N 15 128.104 0.3 . 1 . . . . . 86 LEU N . 50940 1 260 . 1 . 1 90 90 SER H H 1 8.310 0.020 . 1 . . . . . 89 SER H . 50940 1 261 . 1 . 1 90 90 SER CA C 13 58.433 0.3 . 1 . . . . . 89 SER CA . 50940 1 262 . 1 . 1 90 90 SER CB C 13 63.773 0.3 . 1 . . . . . 89 SER CB . 50940 1 263 . 1 . 1 90 90 SER N N 15 115.494 0.3 . 1 . . . . . 89 SER N . 50940 1 264 . 1 . 1 91 91 ARG H H 1 8.397 0.020 . 1 . . . . . 90 ARG H . 50940 1 265 . 1 . 1 91 91 ARG CA C 13 56.576 0.3 . 1 . . . . . 90 ARG CA . 50940 1 266 . 1 . 1 91 91 ARG CB C 13 30.264 0.3 . 1 . . . . . 90 ARG CB . 50940 1 267 . 1 . 1 91 91 ARG N N 15 122.614 0.3 . 1 . . . . . 90 ARG N . 50940 1 268 . 1 . 1 92 92 SER H H 1 8.281 0.020 . 1 . . . . . 91 SER H . 50940 1 269 . 1 . 1 92 92 SER CA C 13 58.743 0.3 . 1 . . . . . 91 SER CA . 50940 1 270 . 1 . 1 92 92 SER CB C 13 63.696 0.3 . 1 . . . . . 91 SER CB . 50940 1 271 . 1 . 1 92 92 SER N N 15 116.323 0.3 . 1 . . . . . 91 SER N . 50940 1 272 . 1 . 1 93 93 THR H H 1 8.156 0.020 . 1 . . . . . 92 THR H . 50940 1 273 . 1 . 1 93 93 THR CB C 13 69.654 0.3 . 1 . . . . . 92 THR CB . 50940 1 274 . 1 . 1 93 93 THR N N 15 116.019 0.3 . 1 . . . . . 92 THR N . 50940 1 275 . 1 . 1 94 94 LEU H H 1 8.113 0.020 . 1 . . . . . 93 LEU H . 50940 1 276 . 1 . 1 94 94 LEU CA C 13 55.260 0.3 . 1 . . . . . 93 LEU CA . 50940 1 277 . 1 . 1 94 94 LEU CB C 13 42.337 0.3 . 1 . . . . . 93 LEU CB . 50940 1 278 . 1 . 1 94 94 LEU N N 15 124.079 0.3 . 1 . . . . . 93 LEU N . 50940 1 279 . 1 . 1 95 95 SER H H 1 8.209 0.020 . 1 . . . . . 94 SER H . 50940 1 280 . 1 . 1 95 95 SER CA C 13 57.969 0.3 . 1 . . . . . 94 SER CA . 50940 1 281 . 1 . 1 95 95 SER CB C 13 63.618 0.3 . 1 . . . . . 94 SER CB . 50940 1 282 . 1 . 1 95 95 SER N N 15 116.951 0.3 . 1 . . . . . 94 SER N . 50940 1 283 . 1 . 1 96 96 LEU H H 1 8.142 0.020 . 1 . . . . . 95 LEU H . 50940 1 284 . 1 . 1 96 96 LEU CA C 13 52.973 0.3 . 1 . . . . . 95 LEU CA . 50940 1 285 . 1 . 1 96 96 LEU CB C 13 41.718 0.3 . 1 . . . . . 95 LEU CB . 50940 1 286 . 1 . 1 96 96 LEU N N 15 125.383 0.3 . 1 . . . . . 95 LEU N . 50940 1 287 . 1 . 1 99 99 SER H H 1 8.145 0.020 . 1 . . . . . 98 SER H . 50940 1 288 . 1 . 1 99 99 SER CA C 13 58.747 0.3 . 1 . . . . . 98 SER CA . 50940 1 289 . 1 . 1 99 99 SER CB C 13 63.618 0.3 . 1 . . . . . 98 SER CB . 50940 1 290 . 1 . 1 99 99 SER N N 15 115.855 0.3 . 1 . . . . . 98 SER N . 50940 1 291 . 1 . 1 100 100 GLU H H 1 8.349 0.020 . 1 . . . . . 99 GLU H . 50940 1 292 . 1 . 1 100 100 GLU CA C 13 56.421 0.3 . 1 . . . . . 99 GLU CA . 50940 1 293 . 1 . 1 100 100 GLU CB C 13 33.050 0.3 . 1 . . . . . 99 GLU CB . 50940 1 294 . 1 . 1 100 100 GLU N N 15 123.493 0.3 . 1 . . . . . 99 GLU N . 50940 1 295 . 1 . 1 102 102 VAL H H 1 8.116 0.020 . 1 . . . . . 101 VAL H . 50940 1 296 . 1 . 1 102 102 VAL CA C 13 62.535 0.3 . 1 . . . . . 101 VAL CA . 50940 1 297 . 1 . 1 102 102 VAL CB C 13 32.508 0.3 . 1 . . . . . 101 VAL CB . 50940 1 298 . 1 . 1 102 102 VAL N N 15 121.729 0.3 . 1 . . . . . 101 VAL N . 50940 1 299 . 1 . 1 103 103 THR H H 1 8.176 0.020 . 1 . . . . . 102 THR H . 50940 1 300 . 1 . 1 103 103 THR CA C 13 62.223 0.3 . 1 . . . . . 102 THR CA . 50940 1 301 . 1 . 1 103 103 THR CB C 13 69.654 0.3 . 1 . . . . . 102 THR CB . 50940 1 302 . 1 . 1 103 103 THR N N 15 117.038 0.3 . 1 . . . . . 102 THR N . 50940 1 303 . 1 . 1 104 104 ASN H H 1 8.373 0.020 . 1 . . . . . 103 ASN H . 50940 1 304 . 1 . 1 104 104 ASN CA C 13 53.326 0.3 . 1 . . . . . 103 ASN CA . 50940 1 305 . 1 . 1 104 104 ASN CB C 13 38.777 0.3 . 1 . . . . . 103 ASN CB . 50940 1 306 . 1 . 1 104 104 ASN N N 15 121.048 0.3 . 1 . . . . . 103 ASN N . 50940 1 307 . 1 . 1 105 105 SER H H 1 8.278 0.020 . 1 . . . . . 104 SER H . 50940 1 308 . 1 . 1 105 105 SER CA C 13 58.691 0.3 . 1 . . . . . 104 SER CA . 50940 1 309 . 1 . 1 105 105 SER CB C 13 63.618 0.3 . 1 . . . . . 104 SER CB . 50940 1 310 . 1 . 1 105 105 SER N N 15 116.340 0.3 . 1 . . . . . 104 SER N . 50940 1 311 . 1 . 1 106 106 LEU H H 1 8.245 0.020 . 1 . . . . . 105 LEU H . 50940 1 312 . 1 . 1 106 106 LEU CA C 13 55.493 0.3 . 1 . . . . . 105 LEU CA . 50940 1 313 . 1 . 1 106 106 LEU CB C 13 42.104 0.3 . 1 . . . . . 105 LEU CB . 50940 1 314 . 1 . 1 106 106 LEU N N 15 123.680 0.3 . 1 . . . . . 105 LEU N . 50940 1 315 . 1 . 1 107 107 GLY H H 1 8.307 0.020 . 1 . . . . . 106 GLY H . 50940 1 316 . 1 . 1 107 107 GLY CA C 13 45.355 0.3 . 1 . . . . . 106 GLY CA . 50940 1 317 . 1 . 1 107 107 GLY N N 15 109.304 0.3 . 1 . . . . . 106 GLY N . 50940 1 318 . 1 . 1 108 108 SER H H 1 8.175 0.020 . 1 . . . . . 107 SER H . 50940 1 319 . 1 . 1 108 108 SER N N 15 115.438 0.3 . 1 . . . . . 107 SER N . 50940 1 320 . 1 . 1 109 109 ASN H H 1 8.457 0.020 . 1 . . . . . 108 ASN H . 50940 1 321 . 1 . 1 109 109 ASN CA C 13 53.248 0.3 . 1 . . . . . 108 ASN CA . 50940 1 322 . 1 . 1 109 109 ASN CB C 13 38.932 0.3 . 1 . . . . . 108 ASN CB . 50940 1 323 . 1 . 1 109 109 ASN N N 15 120.608 0.3 . 1 . . . . . 108 ASN N . 50940 1 324 . 1 . 1 110 110 SER H H 1 8.183 0.020 . 1 . . . . . 109 SER H . 50940 1 325 . 1 . 1 110 110 SER CA C 13 56.576 0.3 . 1 . . . . . 109 SER CA . 50940 1 326 . 1 . 1 110 110 SER CB C 13 63.386 0.3 . 1 . . . . . 109 SER CB . 50940 1 327 . 1 . 1 110 110 SER N N 15 117.249 0.3 . 1 . . . . . 109 SER N . 50940 1 328 . 1 . 1 112 112 THR H H 1 8.289 0.020 . 1 . . . . . 111 THR H . 50940 1 329 . 1 . 1 112 112 THR CA C 13 59.904 0.3 . 1 . . . . . 111 THR CA . 50940 1 330 . 1 . 1 112 112 THR CB C 13 69.732 0.3 . 1 . . . . . 111 THR CB . 50940 1 331 . 1 . 1 112 112 THR N N 15 117.367 0.3 . 1 . . . . . 111 THR N . 50940 1 332 . 1 . 1 114 114 THR H H 1 8.243 0.020 . 1 . . . . . 113 THR H . 50940 1 333 . 1 . 1 114 114 THR CA C 13 61.838 0.3 . 1 . . . . . 113 THR CA . 50940 1 334 . 1 . 1 114 114 THR CB C 13 69.809 0.3 . 1 . . . . . 113 THR CB . 50940 1 335 . 1 . 1 114 114 THR N N 15 114.394 0.3 . 1 . . . . . 113 THR N . 50940 1 336 . 1 . 1 115 115 ASP H H 1 8.323 0.020 . 1 . . . . . 114 ASP H . 50940 1 337 . 1 . 1 115 115 ASP CA C 13 54.315 0.3 . 1 . . . . . 114 ASP CA . 50940 1 338 . 1 . 1 115 115 ASP CB C 13 41.157 0.3 . 1 . . . . . 114 ASP CB . 50940 1 339 . 1 . 1 115 115 ASP N N 15 122.509 0.3 . 1 . . . . . 114 ASP N . 50940 1 340 . 1 . 1 116 116 GLU H H 1 8.443 0.020 . 1 . . . . . 115 GLU H . 50940 1 341 . 1 . 1 116 116 GLU CA C 13 56.015 0.3 . 1 . . . . . 115 GLU CA . 50940 1 342 . 1 . 1 116 116 GLU CB C 13 29.625 0.3 . 1 . . . . . 115 GLU CB . 50940 1 343 . 1 . 1 116 116 GLU N N 15 121.983 0.3 . 1 . . . . . 115 GLU N . 50940 1 344 . 1 . 1 117 117 SER H H 1 8.360 0.020 . 1 . . . . . 116 SER H . 50940 1 345 . 1 . 1 117 117 SER CA C 13 58.820 0.3 . 1 . . . . . 116 SER CA . 50940 1 346 . 1 . 1 117 117 SER CB C 13 63.696 0.3 . 1 . . . . . 116 SER CB . 50940 1 347 . 1 . 1 117 117 SER N N 15 116.528 0.3 . 1 . . . . . 116 SER N . 50940 1 348 . 1 . 1 118 118 SER H H 1 8.233 0.020 . 1 . . . . . 117 SER H . 50940 1 349 . 1 . 1 118 118 SER CA C 13 58.600 0.3 . 1 . . . . . 117 SER CA . 50940 1 350 . 1 . 1 118 118 SER CB C 13 63.768 0.3 . 1 . . . . . 117 SER CB . 50940 1 351 . 1 . 1 118 118 SER N N 15 117.805 0.3 . 1 . . . . . 117 SER N . 50940 1 352 . 1 . 1 119 119 VAL H H 1 8.042 0.020 . 1 . . . . . 118 VAL H . 50940 1 353 . 1 . 1 119 119 VAL CA C 13 62.457 0.3 . 1 . . . . . 118 VAL CA . 50940 1 354 . 1 . 1 119 119 VAL CB C 13 32.663 0.3 . 1 . . . . . 118 VAL CB . 50940 1 355 . 1 . 1 119 119 VAL N N 15 121.613 0.3 . 1 . . . . . 118 VAL N . 50940 1 356 . 1 . 1 120 120 GLN H H 1 8.388 0.020 . 1 . . . . . 119 GLN H . 50940 1 357 . 1 . 1 120 120 GLN CA C 13 55.647 0.3 . 1 . . . . . 119 GLN CA . 50940 1 358 . 1 . 1 120 120 GLN CB C 13 29.722 0.3 . 1 . . . . . 119 GLN CB . 50940 1 359 . 1 . 1 120 120 GLN N N 15 123.989 0.3 . 1 . . . . . 119 GLN N . 50940 1 360 . 1 . 1 121 121 ASP H H 1 8.329 0.020 . 1 . . . . . 120 ASP H . 50940 1 361 . 1 . 1 121 121 ASP CA C 13 54.328 0.3 . 1 . . . . . 120 ASP CA . 50940 1 362 . 1 . 1 121 121 ASP CB C 13 41.157 0.3 . 1 . . . . . 120 ASP CB . 50940 1 363 . 1 . 1 121 121 ASP N N 15 122.126 0.3 . 1 . . . . . 120 ASP N . 50940 1 364 . 1 . 1 122 122 GLU H H 1 8.526 0.020 . 1 . . . . . 121 GLU H . 50940 1 365 . 1 . 1 122 122 GLU CA C 13 57.040 0.3 . 1 . . . . . 121 GLU CA . 50940 1 366 . 1 . 1 122 122 GLU CB C 13 29.645 0.3 . 1 . . . . . 121 GLU CB . 50940 1 367 . 1 . 1 122 122 GLU N N 15 122.392 0.3 . 1 . . . . . 121 GLU N . 50940 1 368 . 1 . 1 123 123 GLY H H 1 8.472 0.020 . 1 . . . . . 122 GLY H . 50940 1 369 . 1 . 1 123 123 GLY CA C 13 45.510 0.3 . 1 . . . . . 122 GLY CA . 50940 1 370 . 1 . 1 123 123 GLY N N 15 109.535 0.3 . 1 . . . . . 122 GLY N . 50940 1 371 . 1 . 1 124 124 ALA H H 1 7.994 0.020 . 1 . . . . . 123 ALA H . 50940 1 372 . 1 . 1 124 124 ALA CA C 13 52.474 0.3 . 1 . . . . . 123 ALA CA . 50940 1 373 . 1 . 1 124 124 ALA CB C 13 19.198 0.3 . 1 . . . . . 123 ALA CB . 50940 1 374 . 1 . 1 124 124 ALA N N 15 123.443 0.3 . 1 . . . . . 123 ALA N . 50940 1 375 . 1 . 1 125 125 SER H H 1 8.203 0.020 . 1 . . . . . 124 SER H . 50940 1 376 . 1 . 1 125 125 SER CA C 13 58.356 0.3 . 1 . . . . . 124 SER CA . 50940 1 377 . 1 . 1 125 125 SER CB C 13 63.696 0.3 . 1 . . . . . 124 SER CB . 50940 1 378 . 1 . 1 125 125 SER N N 15 114.610 0.3 . 1 . . . . . 124 SER N . 50940 1 379 . 1 . 1 126 126 ASN H H 1 8.327 0.020 . 1 . . . . . 125 ASN H . 50940 1 380 . 1 . 1 126 126 ASN CA C 13 51.236 0.3 . 1 . . . . . 125 ASN CA . 50940 1 381 . 1 . 1 126 126 ASN CB C 13 38.854 0.3 . 1 . . . . . 125 ASN CB . 50940 1 382 . 1 . 1 126 126 ASN N N 15 121.048 0.3 . 1 . . . . . 125 ASN N . 50940 1 383 . 1 . 1 128 128 ALA H H 1 8.174 0.020 . 1 . . . . . 127 ALA H . 50940 1 384 . 1 . 1 128 128 ALA CA C 13 52.629 0.3 . 1 . . . . . 127 ALA CA . 50940 1 385 . 1 . 1 128 128 ALA CB C 13 18.733 0.3 . 1 . . . . . 127 ALA CB . 50940 1 386 . 1 . 1 128 128 ALA N N 15 122.675 0.3 . 1 . . . . . 127 ALA N . 50940 1 387 . 1 . 1 129 129 ALA H H 1 7.954 0.020 . 1 . . . . . 128 ALA H . 50940 1 388 . 1 . 1 129 129 ALA CA C 13 52.397 0.3 . 1 . . . . . 128 ALA CA . 50940 1 389 . 1 . 1 129 129 ALA CB C 13 18.733 0.3 . 1 . . . . . 128 ALA CB . 50940 1 390 . 1 . 1 129 129 ALA N N 15 122.489 0.3 . 1 . . . . . 128 ALA N . 50940 1 391 . 1 . 1 130 130 ALA H H 1 8.007 0.020 . 1 . . . . . 129 ALA H . 50940 1 392 . 1 . 1 130 130 ALA CA C 13 52.474 0.3 . 1 . . . . . 129 ALA CA . 50940 1 393 . 1 . 1 130 130 ALA CB C 13 18.966 0.3 . 1 . . . . . 129 ALA CB . 50940 1 394 . 1 . 1 130 130 ALA N N 15 122.349 0.3 . 1 . . . . . 129 ALA N . 50940 1 395 . 1 . 1 131 131 LEU H H 1 8.012 0.020 . 1 . . . . . 130 LEU H . 50940 1 396 . 1 . 1 131 131 LEU CA C 13 55.183 0.3 . 1 . . . . . 130 LEU CA . 50940 1 397 . 1 . 1 131 131 LEU CB C 13 42.104 0.3 . 1 . . . . . 130 LEU CB . 50940 1 398 . 1 . 1 131 131 LEU N N 15 121.062 0.3 . 1 . . . . . 130 LEU N . 50940 1 399 . 1 . 1 132 132 ILE H H 1 7.977 0.020 . 1 . . . . . 131 ILE H . 50940 1 400 . 1 . 1 132 132 ILE CA C 13 60.755 0.3 . 1 . . . . . 131 ILE CA . 50940 1 401 . 1 . 1 132 132 ILE CB C 13 38.545 0.3 . 1 . . . . . 131 ILE CB . 50940 1 402 . 1 . 1 132 132 ILE N N 15 121.682 0.3 . 1 . . . . . 131 ILE N . 50940 1 403 . 1 . 1 133 133 ALA H H 1 8.294 0.020 . 1 . . . . . 132 ALA H . 50940 1 404 . 1 . 1 133 133 ALA CA C 13 52.242 0.3 . 1 . . . . . 132 ALA CA . 50940 1 405 . 1 . 1 133 133 ALA CB C 13 19.120 0.3 . 1 . . . . . 132 ALA CB . 50940 1 406 . 1 . 1 133 133 ALA N N 15 128.404 0.3 . 1 . . . . . 132 ALA N . 50940 1 407 . 1 . 1 134 134 GLU H H 1 8.392 0.020 . 1 . . . . . 133 GLU H . 50940 1 408 . 1 . 1 134 134 GLU CA C 13 56.885 0.3 . 1 . . . . . 133 GLU CA . 50940 1 409 . 1 . 1 134 134 GLU CB C 13 30.187 0.3 . 1 . . . . . 133 GLU CB . 50940 1 410 . 1 . 1 134 134 GLU N N 15 120.572 0.3 . 1 . . . . . 133 GLU N . 50940 1 411 . 1 . 1 135 135 ASP H H 1 8.288 0.020 . 1 . . . . . 134 ASP H . 50940 1 412 . 1 . 1 135 135 ASP CA C 13 54.177 0.3 . 1 . . . . . 134 ASP CA . 50940 1 413 . 1 . 1 135 135 ASP CB C 13 40.944 0.3 . 1 . . . . . 134 ASP CB . 50940 1 414 . 1 . 1 135 135 ASP N N 15 120.798 0.3 . 1 . . . . . 134 ASP N . 50940 1 415 . 1 . 1 136 136 ALA H H 1 8.017 0.020 . 1 . . . . . 135 ALA H . 50940 1 416 . 1 . 1 136 136 ALA CA C 13 52.165 0.3 . 1 . . . . . 135 ALA CA . 50940 1 417 . 1 . 1 136 136 ALA CB C 13 19.275 0.3 . 1 . . . . . 135 ALA CB . 50940 1 418 . 1 . 1 136 136 ALA N N 15 123.916 0.3 . 1 . . . . . 135 ALA N . 50940 1 419 . 1 . 1 137 137 ALA H H 1 8.155 0.020 . 1 . . . . . 136 ALA H . 50940 1 420 . 1 . 1 137 137 ALA CA C 13 50.230 0.3 . 1 . . . . . 136 ALA CA . 50940 1 421 . 1 . 1 137 137 ALA CB C 13 18.114 0.3 . 1 . . . . . 136 ALA CB . 50940 1 422 . 1 . 1 137 137 ALA N N 15 124.676 0.3 . 1 . . . . . 136 ALA N . 50940 1 423 . 1 . 1 140 140 ALA H H 1 8.438 0.020 . 1 . . . . . 139 ALA H . 50940 1 424 . 1 . 1 140 140 ALA CA C 13 52.784 0.3 . 1 . . . . . 139 ALA CA . 50940 1 425 . 1 . 1 140 140 ALA CB C 13 18.966 0.3 . 1 . . . . . 139 ALA CB . 50940 1 426 . 1 . 1 140 140 ALA N N 15 124.494 0.3 . 1 . . . . . 139 ALA N . 50940 1 427 . 1 . 1 141 141 GLY H H 1 8.414 0.020 . 1 . . . . . 140 GLY H . 50940 1 428 . 1 . 1 141 141 GLY CA C 13 45.277 0.3 . 1 . . . . . 140 GLY CA . 50940 1 429 . 1 . 1 141 141 GLY N N 15 108.259 0.3 . 1 . . . . . 140 GLY N . 50940 1 430 . 1 . 1 142 142 THR H H 1 8.028 0.020 . 1 . . . . . 141 THR H . 50940 1 431 . 1 . 1 142 142 THR CA C 13 61.993 0.3 . 1 . . . . . 141 THR CA . 50940 1 432 . 1 . 1 142 142 THR CB C 13 69.964 0.3 . 1 . . . . . 141 THR CB . 50940 1 433 . 1 . 1 142 142 THR N N 15 113.346 0.3 . 1 . . . . . 141 THR N . 50940 1 434 . 1 . 1 143 143 THR H H 1 8.274 0.020 . 1 . . . . . 142 THR H . 50940 1 435 . 1 . 1 143 143 THR CA C 13 62.003 0.3 . 1 . . . . . 142 THR CA . 50940 1 436 . 1 . 1 143 143 THR CB C 13 69.765 0.3 . 1 . . . . . 142 THR CB . 50940 1 437 . 1 . 1 143 143 THR N N 15 116.309 0.3 . 1 . . . . . 142 THR N . 50940 1 438 . 1 . 1 144 144 THR H H 1 8.186 0.020 . 1 . . . . . 143 THR H . 50940 1 439 . 1 . 1 144 144 THR CA C 13 61.914 0.3 . 1 . . . . . 143 THR CA . 50940 1 440 . 1 . 1 144 144 THR CB C 13 69.796 0.3 . 1 . . . . . 143 THR CB . 50940 1 441 . 1 . 1 144 144 THR N N 15 116.176 0.3 . 1 . . . . . 143 THR N . 50940 1 442 . 1 . 1 145 145 SER H H 1 8.338 0.020 . 1 . . . . . 144 SER H . 50940 1 443 . 1 . 1 145 145 SER CA C 13 58.588 0.3 . 1 . . . . . 144 SER CA . 50940 1 444 . 1 . 1 145 145 SER CB C 13 63.773 0.3 . 1 . . . . . 144 SER CB . 50940 1 445 . 1 . 1 145 145 SER N N 15 118.268 0.3 . 1 . . . . . 144 SER N . 50940 1 446 . 1 . 1 146 146 LYS H H 1 8.371 0.020 . 1 . . . . . 145 LYS H . 50940 1 447 . 1 . 1 146 146 LYS CA C 13 56.477 0.3 . 1 . . . . . 145 LYS CA . 50940 1 448 . 1 . 1 146 146 LYS CB C 13 32.973 0.3 . 1 . . . . . 145 LYS CB . 50940 1 449 . 1 . 1 146 146 LYS N N 15 123.353 0.3 . 1 . . . . . 145 LYS N . 50940 1 450 . 1 . 1 147 147 SER H H 1 8.192 0.020 . 1 . . . . . 146 SER H . 50940 1 451 . 1 . 1 147 147 SER CA C 13 58.495 0.3 . 1 . . . . . 146 SER CA . 50940 1 452 . 1 . 1 147 147 SER CB C 13 63.773 0.3 . 1 . . . . . 146 SER CB . 50940 1 453 . 1 . 1 147 147 SER N N 15 116.293 0.3 . 1 . . . . . 146 SER N . 50940 1 454 . 1 . 1 148 148 LYS H H 1 8.312 0.020 . 1 . . . . . 147 LYS H . 50940 1 455 . 1 . 1 148 148 LYS CA C 13 56.337 0.3 . 1 . . . . . 147 LYS CA . 50940 1 456 . 1 . 1 148 148 LYS CB C 13 32.973 0.3 . 1 . . . . . 147 LYS CB . 50940 1 457 . 1 . 1 148 148 LYS N N 15 123.559 0.3 . 1 . . . . . 147 LYS N . 50940 1 458 . 1 . 1 149 149 LYS H H 1 8.196 0.020 . 1 . . . . . 148 LYS H . 50940 1 459 . 1 . 1 149 149 LYS CA C 13 56.463 0.3 . 1 . . . . . 148 LYS CA . 50940 1 460 . 1 . 1 149 149 LYS CB C 13 32.942 0.3 . 1 . . . . . 148 LYS CB . 50940 1 461 . 1 . 1 149 149 LYS N N 15 122.295 0.3 . 1 . . . . . 148 LYS N . 50940 1 462 . 1 . 1 150 150 LYS H H 1 8.325 0.020 . 1 . . . . . 149 LYS H . 50940 1 463 . 1 . 1 150 150 LYS CA C 13 56.421 0.3 . 1 . . . . . 149 LYS CA . 50940 1 464 . 1 . 1 150 150 LYS CB C 13 32.973 0.3 . 1 . . . . . 149 LYS CB . 50940 1 465 . 1 . 1 150 150 LYS N N 15 123.334 0.3 . 1 . . . . . 149 LYS N . 50940 1 466 . 1 . 1 151 151 LYS H H 1 8.349 0.020 . 1 . . . . . 150 LYS H . 50940 1 467 . 1 . 1 151 151 LYS CA C 13 56.499 0.3 . 1 . . . . . 150 LYS CA . 50940 1 468 . 1 . 1 151 151 LYS CB C 13 33.050 0.3 . 1 . . . . . 150 LYS CB . 50940 1 469 . 1 . 1 151 151 LYS N N 15 123.353 0.3 . 1 . . . . . 150 LYS N . 50940 1 470 . 1 . 1 152 152 ARG H H 1 8.309 0.020 . 1 . . . . . 151 ARG H . 50940 1 471 . 1 . 1 152 152 ARG CA C 13 56.237 0.3 . 1 . . . . . 151 ARG CA . 50940 1 472 . 1 . 1 152 152 ARG CB C 13 30.733 0.3 . 1 . . . . . 151 ARG CB . 50940 1 473 . 1 . 1 152 152 ARG N N 15 121.983 0.3 . 1 . . . . . 151 ARG N . 50940 1 474 . 1 . 1 153 153 GLU H H 1 8.518 0.020 . 1 . . . . . 152 GLU H . 50940 1 475 . 1 . 1 153 153 GLU CA C 13 56.499 0.3 . 1 . . . . . 152 GLU CA . 50940 1 476 . 1 . 1 153 153 GLU CB C 13 30.342 0.3 . 1 . . . . . 152 GLU CB . 50940 1 477 . 1 . 1 153 153 GLU N N 15 123.091 0.3 . 1 . . . . . 152 GLU N . 50940 1 478 . 1 . 1 154 154 LYS H H 1 8.465 0.020 . 1 . . . . . 153 LYS H . 50940 1 479 . 1 . 1 154 154 LYS CA C 13 56.576 0.3 . 1 . . . . . 153 LYS CA . 50940 1 480 . 1 . 1 154 154 LYS CB C 13 32.895 0.3 . 1 . . . . . 153 LYS CB . 50940 1 481 . 1 . 1 154 154 LYS N N 15 122.257 0.3 . 1 . . . . . 153 LYS N . 50940 1 482 . 1 . 1 155 155 GLY H H 1 8.436 0.020 . 1 . . . . . 154 GLY H . 50940 1 483 . 1 . 1 155 155 GLY CA C 13 45.200 0.3 . 1 . . . . . 154 GLY CA . 50940 1 484 . 1 . 1 155 155 GLY N N 15 110.043 0.3 . 1 . . . . . 154 GLY N . 50940 1 485 . 1 . 1 156 156 GLU H H 1 8.226 0.020 . 1 . . . . . 155 GLU H . 50940 1 486 . 1 . 1 156 156 GLU CA C 13 56.576 0.3 . 1 . . . . . 155 GLU CA . 50940 1 487 . 1 . 1 156 156 GLU CB C 13 30.419 0.3 . 1 . . . . . 155 GLU CB . 50940 1 488 . 1 . 1 156 156 GLU N N 15 120.596 0.3 . 1 . . . . . 155 GLU N . 50940 1 489 . 1 . 1 160 160 LYS H H 1 8.431 0.020 . 1 . . . . . 159 LYS H . 50940 1 490 . 1 . 1 160 160 LYS CA C 13 56.533 0.3 . 1 . . . . . 159 LYS CA . 50940 1 491 . 1 . 1 160 160 LYS CB C 13 32.729 0.3 . 1 . . . . . 159 LYS CB . 50940 1 492 . 1 . 1 160 160 LYS N N 15 122.701 0.3 . 1 . . . . . 159 LYS N . 50940 1 493 . 1 . 1 161 161 SER H H 1 8.260 0.020 . 1 . . . . . 160 SER H . 50940 1 494 . 1 . 1 161 161 SER CA C 13 58.743 0.3 . 1 . . . . . 160 SER CA . 50940 1 495 . 1 . 1 161 161 SER CB C 13 63.696 0.3 . 1 . . . . . 160 SER CB . 50940 1 496 . 1 . 1 161 161 SER N N 15 116.427 0.3 . 1 . . . . . 160 SER N . 50940 1 497 . 1 . 1 162 162 ASP H H 1 8.376 0.020 . 1 . . . . . 161 ASP H . 50940 1 498 . 1 . 1 162 162 ASP CA C 13 54.332 0.3 . 1 . . . . . 161 ASP CA . 50940 1 499 . 1 . 1 162 162 ASP CB C 13 41.021 0.3 . 1 . . . . . 161 ASP CB . 50940 1 500 . 1 . 1 162 162 ASP N N 15 122.595 0.3 . 1 . . . . . 161 ASP N . 50940 1 501 . 1 . 1 163 163 LYS H H 1 8.265 0.020 . 1 . . . . . 162 LYS H . 50940 1 502 . 1 . 1 163 163 LYS CA C 13 56.533 0.3 . 1 . . . . . 162 LYS CA . 50940 1 503 . 1 . 1 163 163 LYS CB C 13 32.582 0.3 . 1 . . . . . 162 LYS CB . 50940 1 504 . 1 . 1 163 163 LYS N N 15 121.567 0.3 . 1 . . . . . 162 LYS N . 50940 1 505 . 1 . 1 164 164 SER H H 1 8.303 0.020 . 1 . . . . . 163 SER H . 50940 1 506 . 1 . 1 164 164 SER CA C 13 58.743 0.3 . 1 . . . . . 163 SER CA . 50940 1 507 . 1 . 1 164 164 SER CB C 13 63.696 0.3 . 1 . . . . . 163 SER CB . 50940 1 508 . 1 . 1 164 164 SER N N 15 116.779 0.3 . 1 . . . . . 163 SER N . 50940 1 509 . 1 . 1 165 165 GLU H H 1 8.399 0.020 . 1 . . . . . 164 GLU H . 50940 1 510 . 1 . 1 165 165 GLU CA C 13 56.576 0.3 . 1 . . . . . 164 GLU CA . 50940 1 511 . 1 . 1 165 165 GLU CB C 13 32.973 0.3 . 1 . . . . . 164 GLU CB . 50940 1 512 . 1 . 1 165 165 GLU N N 15 122.764 0.3 . 1 . . . . . 164 GLU N . 50940 1 513 . 1 . 1 167 167 SER H H 1 8.140 0.020 . 1 . . . . . 166 SER H . 50940 1 514 . 1 . 1 167 167 SER CA C 13 58.907 0.3 . 1 . . . . . 166 SER CA . 50940 1 515 . 1 . 1 167 167 SER CB C 13 63.618 0.3 . 1 . . . . . 166 SER CB . 50940 1 516 . 1 . 1 167 167 SER N N 15 115.862 0.3 . 1 . . . . . 166 SER N . 50940 1 517 . 1 . 1 168 168 ASP H H 1 8.165 0.020 . 1 . . . . . 167 ASP H . 50940 1 518 . 1 . 1 168 168 ASP CA C 13 53.150 0.3 . 1 . . . . . 167 ASP CA . 50940 1 519 . 1 . 1 168 168 ASP N N 15 125.513 0.3 . 1 . . . . . 167 ASP N . 50940 1 520 . 1 . 1 173 173 SER H H 1 8.369 0.020 . 1 . . . . . 172 SER H . 50940 1 521 . 1 . 1 173 173 SER CA C 13 58.307 0.3 . 1 . . . . . 172 SER CA . 50940 1 522 . 1 . 1 173 173 SER CB C 13 63.773 0.3 . 1 . . . . . 172 SER CB . 50940 1 523 . 1 . 1 173 173 SER N N 15 117.234 0.3 . 1 . . . . . 172 SER N . 50940 1 524 . 1 . 1 174 174 SER H H 1 8.427 0.020 . 1 . . . . . 173 SER H . 50940 1 525 . 1 . 1 174 174 SER CA C 13 58.588 0.3 . 1 . . . . . 173 SER CA . 50940 1 526 . 1 . 1 174 174 SER CB C 13 63.841 0.3 . 1 . . . . . 173 SER CB . 50940 1 527 . 1 . 1 174 174 SER N N 15 118.072 0.3 . 1 . . . . . 173 SER N . 50940 1 528 . 1 . 1 175 175 GLY H H 1 8.417 0.020 . 1 . . . . . 174 GLY H . 50940 1 529 . 1 . 1 175 175 GLY CA C 13 45.355 0.3 . 1 . . . . . 174 GLY CA . 50940 1 530 . 1 . 1 175 175 GLY N N 15 110.696 0.3 . 1 . . . . . 174 GLY N . 50940 1 531 . 1 . 1 176 176 LYS H H 1 8.161 0.020 . 1 . . . . . 175 LYS H . 50940 1 532 . 1 . 1 176 176 LYS CA C 13 56.976 0.3 . 1 . . . . . 175 LYS CA . 50940 1 533 . 1 . 1 176 176 LYS CB C 13 33.099 0.3 . 1 . . . . . 175 LYS CB . 50940 1 534 . 1 . 1 176 176 LYS N N 15 121.009 0.3 . 1 . . . . . 175 LYS N . 50940 1 535 . 1 . 1 180 180 SER H H 1 8.379 0.020 . 1 . . . . . 179 SER H . 50940 1 536 . 1 . 1 180 180 SER CA C 13 58.356 0.3 . 1 . . . . . 179 SER CA . 50940 1 537 . 1 . 1 180 180 SER CB C 13 63.850 0.3 . 1 . . . . . 179 SER CB . 50940 1 538 . 1 . 1 180 180 SER N N 15 117.265 0.3 . 1 . . . . . 179 SER N . 50940 1 539 . 1 . 1 181 181 LYS H H 1 8.520 0.020 . 1 . . . . . 180 LYS H . 50940 1 540 . 1 . 1 181 181 LYS CA C 13 56.499 0.3 . 1 . . . . . 180 LYS CA . 50940 1 541 . 1 . 1 181 181 LYS CB C 13 30.342 0.3 . 1 . . . . . 180 LYS CB . 50940 1 542 . 1 . 1 181 181 LYS N N 15 123.156 0.3 . 1 . . . . . 180 LYS N . 50940 1 543 . 1 . 1 182 182 ARG H H 1 8.419 0.020 . 1 . . . . . 181 ARG H . 50940 1 544 . 1 . 1 182 182 ARG CA C 13 56.499 0.3 . 1 . . . . . 181 ARG CA . 50940 1 545 . 1 . 1 182 182 ARG CB C 13 30.187 0.3 . 1 . . . . . 181 ARG CB . 50940 1 546 . 1 . 1 182 182 ARG N N 15 122.418 0.3 . 1 . . . . . 181 ARG N . 50940 1 547 . 1 . 1 183 183 SER H H 1 8.390 0.020 . 1 . . . . . 182 SER H . 50940 1 548 . 1 . 1 183 183 SER CA C 13 58.820 0.3 . 1 . . . . . 182 SER CA . 50940 1 549 . 1 . 1 183 183 SER CB C 13 63.618 0.3 . 1 . . . . . 182 SER CB . 50940 1 550 . 1 . 1 183 183 SER N N 15 116.568 0.3 . 1 . . . . . 182 SER N . 50940 1 551 . 1 . 1 186 186 MET H H 1 8.260 0.020 . 1 . . . . . 185 MET H . 50940 1 552 . 1 . 1 186 186 MET CA C 13 55.570 0.3 . 1 . . . . . 185 MET CA . 50940 1 553 . 1 . 1 186 186 MET CB C 13 32.044 0.3 . 1 . . . . . 185 MET CB . 50940 1 554 . 1 . 1 186 186 MET N N 15 118.221 0.3 . 1 . . . . . 185 MET N . 50940 1 555 . 1 . 1 187 187 GLU H H 1 8.076 0.020 . 1 . . . . . 186 GLU H . 50940 1 556 . 1 . 1 187 187 GLU CA C 13 56.589 0.3 . 1 . . . . . 186 GLU CA . 50940 1 557 . 1 . 1 187 187 GLU CB C 13 30.264 0.3 . 1 . . . . . 186 GLU CB . 50940 1 558 . 1 . 1 187 187 GLU N N 15 121.084 0.3 . 1 . . . . . 186 GLU N . 50940 1 559 . 1 . 1 188 188 GLN H H 1 8.312 0.020 . 1 . . . . . 187 GLN H . 50940 1 560 . 1 . 1 188 188 GLN CA C 13 55.802 0.3 . 1 . . . . . 187 GLN CA . 50940 1 561 . 1 . 1 188 188 GLN CB C 13 29.645 0.3 . 1 . . . . . 187 GLN CB . 50940 1 562 . 1 . 1 188 188 GLN N N 15 121.167 0.3 . 1 . . . . . 187 GLN N . 50940 1 563 . 1 . 1 189 189 SER H H 1 8.398 0.020 . 1 . . . . . 188 SER H . 50940 1 564 . 1 . 1 189 189 SER CA C 13 58.356 0.3 . 1 . . . . . 188 SER CA . 50940 1 565 . 1 . 1 189 189 SER CB C 13 63.850 0.3 . 1 . . . . . 188 SER CB . 50940 1 566 . 1 . 1 189 189 SER N N 15 117.218 0.3 . 1 . . . . . 188 SER N . 50940 1 567 . 1 . 1 190 190 SER H H 1 8.445 0.020 . 1 . . . . . 189 SER H . 50940 1 568 . 1 . 1 190 190 SER CA C 13 58.665 0.3 . 1 . . . . . 189 SER CA . 50940 1 569 . 1 . 1 190 190 SER CB C 13 63.779 0.3 . 1 . . . . . 189 SER CB . 50940 1 570 . 1 . 1 190 190 SER N N 15 117.931 0.3 . 1 . . . . . 189 SER N . 50940 1 571 . 1 . 1 191 191 ASP H H 1 8.342 0.020 . 1 . . . . . 190 ASP H . 50940 1 572 . 1 . 1 191 191 ASP CA C 13 55.276 0.3 . 1 . . . . . 190 ASP CA . 50940 1 573 . 1 . 1 191 191 ASP CB C 13 42.266 0.3 . 1 . . . . . 190 ASP CB . 50940 1 574 . 1 . 1 191 191 ASP N N 15 122.503 0.3 . 1 . . . . . 190 ASP N . 50940 1 575 . 1 . 1 192 192 SER H H 1 8.247 0.020 . 1 . . . . . 191 SER H . 50940 1 576 . 1 . 1 192 192 SER CA C 13 58.523 0.3 . 1 . . . . . 191 SER CA . 50940 1 577 . 1 . 1 192 192 SER CB C 13 63.696 0.3 . 1 . . . . . 191 SER CB . 50940 1 578 . 1 . 1 192 192 SER N N 15 116.066 0.3 . 1 . . . . . 191 SER N . 50940 1 579 . 1 . 1 193 193 LEU H H 1 8.157 0.020 . 1 . . . . . 192 LEU H . 50940 1 580 . 1 . 1 193 193 LEU CA C 13 55.106 0.3 . 1 . . . . . 192 LEU CA . 50940 1 581 . 1 . 1 193 193 LEU CB C 13 42.182 0.3 . 1 . . . . . 192 LEU CB . 50940 1 582 . 1 . 1 193 193 LEU N N 15 123.562 0.3 . 1 . . . . . 192 LEU N . 50940 1 583 . 1 . 1 194 194 ALA H H 1 8.164 0.020 . 1 . . . . . 193 ALA H . 50940 1 584 . 1 . 1 194 194 ALA CA C 13 52.629 0.3 . 1 . . . . . 193 ALA CA . 50940 1 585 . 1 . 1 194 194 ALA CB C 13 18.888 0.3 . 1 . . . . . 193 ALA CB . 50940 1 586 . 1 . 1 194 194 ALA N N 15 124.412 0.3 . 1 . . . . . 193 ALA N . 50940 1 587 . 1 . 1 195 195 THR H H 1 8.002 0.020 . 1 . . . . . 194 THR H . 50940 1 588 . 1 . 1 195 195 THR CA C 13 62.055 0.3 . 1 . . . . . 194 THR CA . 50940 1 589 . 1 . 1 195 195 THR CB C 13 69.732 0.3 . 1 . . . . . 194 THR CB . 50940 1 590 . 1 . 1 195 195 THR N N 15 112.808 0.3 . 1 . . . . . 194 THR N . 50940 1 591 . 1 . 1 196 196 ASP H H 1 8.279 0.020 . 1 . . . . . 195 ASP H . 50940 1 592 . 1 . 1 196 196 ASP CA C 13 54.241 0.3 . 1 . . . . . 195 ASP CA . 50940 1 593 . 1 . 1 196 196 ASP CB C 13 40.861 0.3 . 1 . . . . . 195 ASP CB . 50940 1 594 . 1 . 1 196 196 ASP N N 15 122.575 0.3 . 1 . . . . . 195 ASP N . 50940 1 595 . 1 . 1 197 197 LEU H H 1 8.257 0.020 . 1 . . . . . 196 LEU H . 50940 1 596 . 1 . 1 197 197 LEU CA C 13 55.415 0.3 . 1 . . . . . 196 LEU CA . 50940 1 597 . 1 . 1 197 197 LEU CB C 13 41.950 0.3 . 1 . . . . . 196 LEU CB . 50940 1 598 . 1 . 1 197 197 LEU N N 15 123.297 0.3 . 1 . . . . . 196 LEU N . 50940 1 599 . 1 . 1 198 198 SER H H 1 8.290 0.020 . 1 . . . . . 197 SER H . 50940 1 600 . 1 . 1 198 198 SER CA C 13 58.831 0.3 . 1 . . . . . 197 SER CA . 50940 1 601 . 1 . 1 198 198 SER CB C 13 63.618 0.3 . 1 . . . . . 197 SER CB . 50940 1 602 . 1 . 1 198 198 SER N N 15 116.262 0.3 . 1 . . . . . 197 SER N . 50940 1 603 . 1 . 1 199 199 ALA H H 1 8.141 0.020 . 1 . . . . . 198 ALA H . 50940 1 604 . 1 . 1 199 199 ALA CA C 13 53.016 0.3 . 1 . . . . . 198 ALA CA . 50940 1 605 . 1 . 1 199 199 ALA CB C 13 18.888 0.3 . 1 . . . . . 198 ALA CB . 50940 1 606 . 1 . 1 199 199 ALA N N 15 125.457 0.3 . 1 . . . . . 198 ALA N . 50940 1 607 . 1 . 1 200 200 GLY H H 1 8.220 0.020 . 1 . . . . . 199 GLY H . 50940 1 608 . 1 . 1 200 200 GLY CA C 13 45.123 0.3 . 1 . . . . . 199 GLY CA . 50940 1 609 . 1 . 1 200 200 GLY N N 15 107.716 0.3 . 1 . . . . . 199 GLY N . 50940 1 610 . 1 . 1 201 201 ALA H H 1 8.013 0.020 . 1 . . . . . 200 ALA H . 50940 1 611 . 1 . 1 201 201 ALA CA C 13 52.165 0.3 . 1 . . . . . 200 ALA CA . 50940 1 612 . 1 . 1 201 201 ALA CB C 13 19.275 0.3 . 1 . . . . . 200 ALA CB . 50940 1 613 . 1 . 1 201 201 ALA N N 15 123.660 0.3 . 1 . . . . . 200 ALA N . 50940 1 614 . 1 . 1 202 202 ILE H H 1 8.092 0.020 . 1 . . . . . 201 ILE H . 50940 1 615 . 1 . 1 202 202 ILE CA C 13 60.987 0.3 . 1 . . . . . 201 ILE CA . 50940 1 616 . 1 . 1 202 202 ILE CB C 13 38.854 0.3 . 1 . . . . . 201 ILE CB . 50940 1 617 . 1 . 1 202 202 ILE N N 15 119.803 0.3 . 1 . . . . . 201 ILE N . 50940 1 618 . 1 . 1 203 203 ASP H H 1 8.320 0.020 . 1 . . . . . 202 ASP H . 50940 1 619 . 1 . 1 203 203 ASP CA C 13 54.100 0.3 . 1 . . . . . 202 ASP CA . 50940 1 620 . 1 . 1 203 203 ASP CB C 13 41.098 0.3 . 1 . . . . . 202 ASP CB . 50940 1 621 . 1 . 1 203 203 ASP N N 15 124.036 0.3 . 1 . . . . . 202 ASP N . 50940 1 622 . 1 . 1 204 204 GLU H H 1 8.401 0.020 . 1 . . . . . 203 GLU H . 50940 1 623 . 1 . 1 204 204 GLU CA C 13 56.755 0.3 . 1 . . . . . 203 GLU CA . 50940 1 624 . 1 . 1 204 204 GLU CB C 13 30.216 0.3 . 1 . . . . . 203 GLU CB . 50940 1 625 . 1 . 1 204 204 GLU N N 15 122.191 0.3 . 1 . . . . . 203 GLU N . 50940 1 626 . 1 . 1 205 205 GLY H H 1 8.465 0.020 . 1 . . . . . 204 GLY H . 50940 1 627 . 1 . 1 205 205 GLY CA C 13 45.510 0.3 . 1 . . . . . 204 GLY CA . 50940 1 628 . 1 . 1 205 205 GLY N N 15 109.206 0.3 . 1 . . . . . 204 GLY N . 50940 1 629 . 1 . 1 206 206 ILE H H 1 7.781 0.020 . 1 . . . . . 205 ILE H . 50940 1 630 . 1 . 1 206 206 ILE CA C 13 60.910 0.3 . 1 . . . . . 205 ILE CA . 50940 1 631 . 1 . 1 206 206 ILE CB C 13 38.777 0.3 . 1 . . . . . 205 ILE CB . 50940 1 632 . 1 . 1 206 206 ILE N N 15 119.780 0.3 . 1 . . . . . 205 ILE N . 50940 1 633 . 1 . 1 207 207 ALA H H 1 8.289 0.020 . 1 . . . . . 206 ALA H . 50940 1 634 . 1 . 1 207 207 ALA CA C 13 52.165 0.3 . 1 . . . . . 206 ALA CA . 50940 1 635 . 1 . 1 207 207 ALA CB C 13 19.120 0.3 . 1 . . . . . 206 ALA CB . 50940 1 636 . 1 . 1 207 207 ALA N N 15 128.039 0.3 . 1 . . . . . 206 ALA N . 50940 1 637 . 1 . 1 208 208 LEU H H 1 8.184 0.020 . 1 . . . . . 207 LEU H . 50940 1 638 . 1 . 1 208 208 LEU CA C 13 54.873 0.3 . 1 . . . . . 207 LEU CA . 50940 1 639 . 1 . 1 208 208 LEU CB C 13 42.337 0.3 . 1 . . . . . 207 LEU CB . 50940 1 640 . 1 . 1 208 208 LEU N N 15 122.179 0.3 . 1 . . . . . 207 LEU N . 50940 1 641 . 1 . 1 209 209 ALA H H 1 8.258 0.020 . 1 . . . . . 208 ALA H . 50940 1 642 . 1 . 1 209 209 ALA CA C 13 52.165 0.3 . 1 . . . . . 208 ALA CA . 50940 1 643 . 1 . 1 209 209 ALA CB C 13 19.430 0.3 . 1 . . . . . 208 ALA CB . 50940 1 644 . 1 . 1 209 209 ALA N N 15 124.952 0.3 . 1 . . . . . 208 ALA N . 50940 1 645 . 1 . 1 210 210 ASP H H 1 8.280 0.020 . 1 . . . . . 209 ASP H . 50940 1 646 . 1 . 1 210 210 ASP CA C 13 54.100 0.3 . 1 . . . . . 209 ASP CA . 50940 1 647 . 1 . 1 210 210 ASP CB C 13 41.176 0.3 . 1 . . . . . 209 ASP CB . 50940 1 648 . 1 . 1 210 210 ASP N N 15 119.930 0.3 . 1 . . . . . 209 ASP N . 50940 1 649 . 1 . 1 211 211 ASP H H 1 8.246 0.020 . 1 . . . . . 210 ASP H . 50940 1 650 . 1 . 1 211 211 ASP CA C 13 54.332 0.3 . 1 . . . . . 210 ASP CA . 50940 1 651 . 1 . 1 211 211 ASP CB C 13 41.176 0.3 . 1 . . . . . 210 ASP CB . 50940 1 652 . 1 . 1 211 211 ASP N N 15 120.584 0.3 . 1 . . . . . 210 ASP N . 50940 1 653 . 1 . 1 212 212 ASP H H 1 8.257 0.020 . 1 . . . . . 211 ASP H . 50940 1 654 . 1 . 1 212 212 ASP CA C 13 54.254 0.3 . 1 . . . . . 211 ASP CA . 50940 1 655 . 1 . 1 212 212 ASP CB C 13 41.176 0.3 . 1 . . . . . 211 ASP CB . 50940 1 656 . 1 . 1 212 212 ASP N N 15 120.929 0.3 . 1 . . . . . 211 ASP N . 50940 1 stop_ save_