################################### # 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 50789 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name Ugt2b7 _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 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.15 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCO' . . . 50789 1 2 '3D HNCACO' . . . 50789 1 3 '3D HNCA' . . . 50789 1 4 '3D HN(CO)CA' . . . 50789 1 5 '3D HNCACB' . . . 50789 1 6 '3D CBCA(CO)NH' . . . 50789 1 7 '3D H(CCO)NH' . . . 50789 1 8 '3D HCCH-TOCSY' . . . 50789 1 9 '3D (H)CCH-TOCSY' . . . 50789 1 10 '3D C(CO)NH' . . . 50789 1 11 '3D HBHA(CO)NH' . . . 50789 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 . . 50789 1 2 $software_2 . . 50789 1 3 $software_3 . . 50789 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 SER HA H 1 4.450 0.02 . 1 . . . . . 284 S HA . 50789 1 2 . 1 . 1 2 2 SER HB2 H 1 3.990 0.02 . 2 . . . . . 284 S HB2 . 50789 1 3 . 1 . 1 2 2 SER HB3 H 1 3.907 0.02 . 2 . . . . . 284 S HB3 . 50789 1 4 . 1 . 1 2 2 SER C C 13 174.255 0.2 . 1 . . . . . 284 S C . 50789 1 5 . 1 . 1 2 2 SER CA C 13 59.318 0.2 . 1 . . . . . 284 S CA . 50789 1 6 . 1 . 1 2 2 SER CB C 13 63.771 0.2 . 1 . . . . . 284 S CB . 50789 1 7 . 1 . 1 3 3 ALA H H 1 8.835 0.02 . 1 . . . . . 285 A H . 50789 1 8 . 1 . 1 3 3 ALA HA H 1 4.466 0.02 . 1 . . . . . 285 A HA . 50789 1 9 . 1 . 1 3 3 ALA HB1 H 1 1.469 0.02 . 1 . . . . . 285 A HB1 . 50789 1 10 . 1 . 1 3 3 ALA HB2 H 1 1.469 0.02 . 1 . . . . . 285 A HB2 . 50789 1 11 . 1 . 1 3 3 ALA HB3 H 1 1.469 0.02 . 1 . . . . . 285 A HB3 . 50789 1 12 . 1 . 1 3 3 ALA C C 13 177.070 0.2 . 1 . . . . . 285 A C . 50789 1 13 . 1 . 1 3 3 ALA CA C 13 52.222 0.2 . 1 . . . . . 285 A CA . 50789 1 14 . 1 . 1 3 3 ALA CB C 13 20.694 0.2 . 1 . . . . . 285 A CB . 50789 1 15 . 1 . 1 3 3 ALA N N 15 126.203 0.15 . 1 . . . . . 285 A N . 50789 1 16 . 1 . 1 4 4 LYS H H 1 8.677 0.02 . 1 . . . . . 286 K H . 50789 1 17 . 1 . 1 4 4 LYS C C 13 173.686 0.2 . 1 . . . . . 286 K C . 50789 1 18 . 1 . 1 4 4 LYS CA C 13 53.755 0.2 . 1 . . . . . 286 K CA . 50789 1 19 . 1 . 1 4 4 LYS CB C 13 32.142 0.2 . 1 . . . . . 286 K CB . 50789 1 20 . 1 . 1 4 4 LYS N N 15 125.083 0.15 . 1 . . . . . 286 K N . 50789 1 21 . 1 . 1 5 5 PRO HA H 1 4.343 0.02 . 1 . . . . . 287 P HA . 50789 1 22 . 1 . 1 5 5 PRO HB2 H 1 2.400 0.02 . 2 . . . . . 287 P HB2 . 50789 1 23 . 1 . 1 5 5 PRO HB3 H 1 1.783 0.02 . 2 . . . . . 287 P HB3 . 50789 1 24 . 1 . 1 5 5 PRO HG2 H 1 1.965 0.02 . 2 . . . . . 287 P HG2 . 50789 1 25 . 1 . 1 5 5 PRO HG3 H 1 2.098 0.02 . 2 . . . . . 287 P HG3 . 50789 1 26 . 1 . 1 5 5 PRO HD2 H 1 3.788 0.02 . 2 . . . . . 287 P HD2 . 50789 1 27 . 1 . 1 5 5 PRO C C 13 177.600 0.2 . 1 . . . . . 287 P C . 50789 1 28 . 1 . 1 5 5 PRO CA C 13 62.900 0.2 . 1 . . . . . 287 P CA . 50789 1 29 . 1 . 1 5 5 PRO CB C 13 32.300 0.2 . 1 . . . . . 287 P CB . 50789 1 30 . 1 . 1 5 5 PRO CG C 13 27.664 0.2 . 1 . . . . . 287 P CG . 50789 1 31 . 1 . 1 5 5 PRO CD C 13 50.710 0.2 . 1 . . . . . 287 P CD . 50789 1 32 . 1 . 1 6 6 LEU H H 1 8.890 0.02 . 1 . . . . . 288 L H . 50789 1 33 . 1 . 1 6 6 LEU HA H 1 4.690 0.02 . 1 . . . . . 288 L HA . 50789 1 34 . 1 . 1 6 6 LEU HB2 H 1 1.880 0.02 . 2 . . . . . 288 L HB2 . 50789 1 35 . 1 . 1 6 6 LEU HB3 H 1 1.240 0.02 . 2 . . . . . 288 L HB3 . 50789 1 36 . 1 . 1 6 6 LEU HD11 H 1 0.793 0.02 . 2 . . . . . 288 L HD11 . 50789 1 37 . 1 . 1 6 6 LEU HD12 H 1 0.793 0.02 . 2 . . . . . 288 L HD12 . 50789 1 38 . 1 . 1 6 6 LEU HD13 H 1 0.793 0.02 . 2 . . . . . 288 L HD13 . 50789 1 39 . 1 . 1 6 6 LEU HD21 H 1 0.817 0.02 . 2 . . . . . 288 L HD21 . 50789 1 40 . 1 . 1 6 6 LEU HD22 H 1 0.817 0.02 . 2 . . . . . 288 L HD22 . 50789 1 41 . 1 . 1 6 6 LEU HD23 H 1 0.817 0.02 . 2 . . . . . 288 L HD23 . 50789 1 42 . 1 . 1 6 6 LEU C C 13 175.500 0.2 . 1 . . . . . 288 L C . 50789 1 43 . 1 . 1 6 6 LEU CA C 13 52.800 0.2 . 1 . . . . . 288 L CA . 50789 1 44 . 1 . 1 6 6 LEU CB C 13 41.300 0.2 . 1 . . . . . 288 L CB . 50789 1 45 . 1 . 1 6 6 LEU CD1 C 13 27.200 0.2 . 2 . . . . . 288 L CD1 . 50789 1 46 . 1 . 1 6 6 LEU CD2 C 13 23.550 0.2 . 2 . . . . . 288 L CD2 . 50789 1 47 . 1 . 1 6 6 LEU N N 15 122.792 0.15 . 1 . . . . . 288 L N . 50789 1 48 . 1 . 1 7 7 PRO HA H 1 4.598 0.02 . 1 . . . . . 289 P HA . 50789 1 49 . 1 . 1 7 7 PRO C C 13 178.071 0.2 . 1 . . . . . 289 P C . 50789 1 50 . 1 . 1 7 7 PRO CA C 13 63.227 0.2 . 1 . . . . . 289 P CA . 50789 1 51 . 1 . 1 7 7 PRO CB C 13 32.540 0.2 . 1 . . . . . 289 P CB . 50789 1 52 . 1 . 1 8 8 LYS H H 1 8.879 0.02 . 1 . . . . . 290 K H . 50789 1 53 . 1 . 1 8 8 LYS HA H 1 4.042 0.02 . 1 . . . . . 290 K HA . 50789 1 54 . 1 . 1 8 8 LYS HB2 H 1 1.881 0.02 . 2 . . . . . 290 K HB2 . 50789 1 55 . 1 . 1 8 8 LYS HB3 H 1 2.072 0.02 . 2 . . . . . 290 K HB3 . 50789 1 56 . 1 . 1 8 8 LYS HG2 H 1 1.517 0.02 . 2 . . . . . 290 K HG2 . 50789 1 57 . 1 . 1 8 8 LYS HD3 H 1 1.756 0.02 . 2 . . . . . 290 K HD3 . 50789 1 58 . 1 . 1 8 8 LYS HE2 H 1 3.099 0.02 . 2 . . . . . 290 K HE2 . 50789 1 59 . 1 . 1 8 8 LYS C C 13 177.534 0.2 . 1 . . . . . 290 K C . 50789 1 60 . 1 . 1 8 8 LYS CA C 13 60.647 0.2 . 1 . . . . . 290 K CA . 50789 1 61 . 1 . 1 8 8 LYS CB C 13 32.701 0.2 . 1 . . . . . 290 K CB . 50789 1 62 . 1 . 1 8 8 LYS CG C 13 24.556 0.2 . 1 . . . . . 290 K CG . 50789 1 63 . 1 . 1 8 8 LYS CD C 13 28.889 0.2 . 1 . . . . . 290 K CD . 50789 1 64 . 1 . 1 8 8 LYS CE C 13 42.445 0.2 . 1 . . . . . 290 K CE . 50789 1 65 . 1 . 1 8 8 LYS N N 15 126.786 0.15 . 1 . . . . . 290 K N . 50789 1 66 . 1 . 1 9 9 GLU H H 1 9.310 0.02 . 1 . . . . . 291 E H . 50789 1 67 . 1 . 1 9 9 GLU HA H 1 4.273 0.02 . 1 . . . . . 291 E HA . 50789 1 68 . 1 . 1 9 9 GLU HB3 H 1 2.191 0.02 . 2 . . . . . 291 E HB3 . 50789 1 69 . 1 . 1 9 9 GLU HG2 H 1 2.470 0.02 . 2 . . . . . 291 E HG2 . 50789 1 70 . 1 . 1 9 9 GLU C C 13 179.849 0.2 . 1 . . . . . 291 E C . 50789 1 71 . 1 . 1 9 9 GLU CA C 13 59.798 0.2 . 1 . . . . . 291 E CA . 50789 1 72 . 1 . 1 9 9 GLU CB C 13 28.823 0.2 . 1 . . . . . 291 E CB . 50789 1 73 . 1 . 1 9 9 GLU CG C 13 36.555 0.2 . 1 . . . . . 291 E CG . 50789 1 74 . 1 . 1 9 9 GLU N N 15 115.977 0.15 . 1 . . . . . 291 E N . 50789 1 75 . 1 . 1 10 10 MET H H 1 7.435 0.02 . 1 . . . . . 292 M H . 50789 1 76 . 1 . 1 10 10 MET HA H 1 4.269 0.02 . 1 . . . . . 292 M HA . 50789 1 77 . 1 . 1 10 10 MET HB2 H 1 1.953 0.02 . 2 . . . . . 292 M HB2 . 50789 1 78 . 1 . 1 10 10 MET HB3 H 1 2.262 0.02 . 2 . . . . . 292 M HB3 . 50789 1 79 . 1 . 1 10 10 MET HG2 H 1 2.490 0.02 . 2 . . . . . 292 M HG2 . 50789 1 80 . 1 . 1 10 10 MET HG3 H 1 2.306 0.02 . 2 . . . . . 292 M HG3 . 50789 1 81 . 1 . 1 10 10 MET C C 13 176.994 0.2 . 1 . . . . . 292 M C . 50789 1 82 . 1 . 1 10 10 MET CA C 13 59.260 0.2 . 1 . . . . . 292 M CA . 50789 1 83 . 1 . 1 10 10 MET CB C 13 34.084 0.2 . 1 . . . . . 292 M CB . 50789 1 84 . 1 . 1 10 10 MET CG C 13 33.100 0.2 . 1 . . . . . 292 M CG . 50789 1 85 . 1 . 1 10 10 MET N N 15 120.676 0.15 . 1 . . . . . 292 M N . 50789 1 86 . 1 . 1 11 11 GLU H H 1 8.666 0.02 . 1 . . . . . 293 E H . 50789 1 87 . 1 . 1 11 11 GLU HA H 1 4.050 0.02 . 1 . . . . . 293 E HA . 50789 1 88 . 1 . 1 11 11 GLU HB3 H 1 2.116 0.02 . 2 . . . . . 293 E HB3 . 50789 1 89 . 1 . 1 11 11 GLU HG2 H 1 2.533 0.02 . 2 . . . . . 293 E HG2 . 50789 1 90 . 1 . 1 11 11 GLU HG3 H 1 2.264 0.02 . 2 . . . . . 293 E HG3 . 50789 1 91 . 1 . 1 11 11 GLU C C 13 178.533 0.2 . 1 . . . . . 293 E C . 50789 1 92 . 1 . 1 11 11 GLU CA C 13 59.249 0.2 . 1 . . . . . 293 E CA . 50789 1 93 . 1 . 1 11 11 GLU CB C 13 29.020 0.2 . 1 . . . . . 293 E CB . 50789 1 94 . 1 . 1 11 11 GLU CG C 13 34.626 0.2 . 1 . . . . . 293 E CG . 50789 1 95 . 1 . 1 11 11 GLU N N 15 122.694 0.15 . 1 . . . . . 293 E N . 50789 1 96 . 1 . 1 12 12 ASP H H 1 8.748 0.02 . 1 . . . . . 294 D H . 50789 1 97 . 1 . 1 12 12 ASP HA H 1 4.382 0.02 . 1 . . . . . 294 D HA . 50789 1 98 . 1 . 1 12 12 ASP HB3 H 1 2.769 0.02 . 2 . . . . . 294 D HB3 . 50789 1 99 . 1 . 1 12 12 ASP C C 13 179.236 0.2 . 1 . . . . . 294 D C . 50789 1 100 . 1 . 1 12 12 ASP CA C 13 57.547 0.2 . 1 . . . . . 294 D CA . 50789 1 101 . 1 . 1 12 12 ASP CB C 13 40.047 0.2 . 1 . . . . . 294 D CB . 50789 1 102 . 1 . 1 12 12 ASP N N 15 118.445 0.15 . 1 . . . . . 294 D N . 50789 1 103 . 1 . 1 13 13 PHE H H 1 7.471 0.02 . 1 . . . . . 295 F H . 50789 1 104 . 1 . 1 13 13 PHE HA H 1 4.498 0.02 . 1 . . . . . 295 F HA . 50789 1 105 . 1 . 1 13 13 PHE HB2 H 1 3.145 0.02 . 2 . . . . . 295 F HB2 . 50789 1 106 . 1 . 1 13 13 PHE HB3 H 1 3.416 0.02 . 2 . . . . . 295 F HB3 . 50789 1 107 . 1 . 1 13 13 PHE C C 13 179.144 0.2 . 1 . . . . . 295 F C . 50789 1 108 . 1 . 1 13 13 PHE CA C 13 61.026 0.2 . 1 . . . . . 295 F CA . 50789 1 109 . 1 . 1 13 13 PHE CB C 13 39.645 0.2 . 1 . . . . . 295 F CB . 50789 1 110 . 1 . 1 13 13 PHE N N 15 121.174 0.15 . 1 . . . . . 295 F N . 50789 1 111 . 1 . 1 14 14 VAL H H 1 8.835 0.02 . 1 . . . . . 296 V H . 50789 1 112 . 1 . 1 14 14 VAL HA H 1 3.223 0.02 . 1 . . . . . 296 V HA . 50789 1 113 . 1 . 1 14 14 VAL HB H 1 1.905 0.02 . 1 . . . . . 296 V HB . 50789 1 114 . 1 . 1 14 14 VAL HG11 H 1 0.134 0.02 . 2 . . . . . 296 V HG11 . 50789 1 115 . 1 . 1 14 14 VAL HG12 H 1 0.134 0.02 . 2 . . . . . 296 V HG12 . 50789 1 116 . 1 . 1 14 14 VAL HG13 H 1 0.134 0.02 . 2 . . . . . 296 V HG13 . 50789 1 117 . 1 . 1 14 14 VAL HG21 H 1 0.727 0.02 . 2 . . . . . 296 V HG21 . 50789 1 118 . 1 . 1 14 14 VAL HG22 H 1 0.727 0.02 . 2 . . . . . 296 V HG22 . 50789 1 119 . 1 . 1 14 14 VAL HG23 H 1 0.727 0.02 . 2 . . . . . 296 V HG23 . 50789 1 120 . 1 . 1 14 14 VAL C C 13 179.924 0.2 . 1 . . . . . 296 V C . 50789 1 121 . 1 . 1 14 14 VAL CA C 13 66.254 0.2 . 1 . . . . . 296 V CA . 50789 1 122 . 1 . 1 14 14 VAL CB C 13 31.306 0.2 . 1 . . . . . 296 V CB . 50789 1 123 . 1 . 1 14 14 VAL CG1 C 13 20.649 0.2 . 2 . . . . . 296 V CG1 . 50789 1 124 . 1 . 1 14 14 VAL CG2 C 13 22.816 0.2 . 2 . . . . . 296 V CG2 . 50789 1 125 . 1 . 1 14 14 VAL N N 15 120.998 0.15 . 1 . . . . . 296 V N . 50789 1 126 . 1 . 1 15 15 GLN H H 1 9.243 0.02 . 1 . . . . . 297 Q H . 50789 1 127 . 1 . 1 15 15 GLN HA H 1 4.031 0.02 . 1 . . . . . 297 Q HA . 50789 1 128 . 1 . 1 15 15 GLN HB2 H 1 2.316 0.02 . 2 . . . . . 297 Q HB2 . 50789 1 129 . 1 . 1 15 15 GLN HB3 H 1 2.160 0.02 . 2 . . . . . 297 Q HB3 . 50789 1 130 . 1 . 1 15 15 GLN HG2 H 1 2.705 0.02 . 2 . . . . . 297 Q HG2 . 50789 1 131 . 1 . 1 15 15 GLN HE21 H 1 8.270 0.02 . 2 . . . . . 297 Q HE21 . 50789 1 132 . 1 . 1 15 15 GLN HE22 H 1 7.115 0.02 . 2 . . . . . 297 Q HE22 . 50789 1 133 . 1 . 1 15 15 GLN C C 13 179.063 0.2 . 1 . . . . . 297 Q C . 50789 1 134 . 1 . 1 15 15 GLN CA C 13 58.558 0.2 . 1 . . . . . 297 Q CA . 50789 1 135 . 1 . 1 15 15 GLN CB C 13 27.253 0.2 . 1 . . . . . 297 Q CB . 50789 1 136 . 1 . 1 15 15 GLN CG C 13 32.994 0.2 . 1 . . . . . 297 Q CG . 50789 1 137 . 1 . 1 15 15 GLN N N 15 120.582 0.15 . 1 . . . . . 297 Q N . 50789 1 138 . 1 . 1 15 15 GLN NE2 N 15 112.136 0.15 . 1 . . . . . 297 Q NE2 . 50789 1 139 . 1 . 1 16 16 SER H H 1 7.830 0.02 . 1 . . . . . 298 S H . 50789 1 140 . 1 . 1 16 16 SER HA H 1 4.448 0.02 . 1 . . . . . 298 S HA . 50789 1 141 . 1 . 1 16 16 SER HB3 H 1 4.120 0.02 . 2 . . . . . 298 S HB3 . 50789 1 142 . 1 . 1 16 16 SER CA C 13 60.700 0.2 . 1 . . . . . 298 S CA . 50789 1 143 . 1 . 1 16 16 SER CB C 13 62.956 0.2 . 1 . . . . . 298 S CB . 50789 1 144 . 1 . 1 16 16 SER N N 15 116.884 0.15 . 1 . . . . . 298 S N . 50789 1 145 . 1 . 1 17 17 SER H H 1 7.495 0.02 . 1 . . . . . 299 S H . 50789 1 146 . 1 . 1 17 17 SER HA H 1 4.331 0.02 . 1 . . . . . 299 S HA . 50789 1 147 . 1 . 1 17 17 SER HB2 H 1 3.280 0.02 . 2 . . . . . 299 S HB2 . 50789 1 148 . 1 . 1 17 17 SER HB3 H 1 4.331 0.02 . 2 . . . . . 299 S HB3 . 50789 1 149 . 1 . 1 17 17 SER C C 13 175.698 0.2 . 1 . . . . . 299 S C . 50789 1 150 . 1 . 1 17 17 SER CA C 13 59.777 0.2 . 1 . . . . . 299 S CA . 50789 1 151 . 1 . 1 17 17 SER CB C 13 64.708 0.2 . 1 . . . . . 299 S CB . 50789 1 152 . 1 . 1 17 17 SER N N 15 118.320 0.15 . 1 . . . . . 299 S N . 50789 1 153 . 1 . 1 18 18 GLY H H 1 7.777 0.02 . 1 . . . . . 300 G H . 50789 1 154 . 1 . 1 18 18 GLY HA2 H 1 3.990 0.02 . 2 . . . . . 300 G HA2 . 50789 1 155 . 1 . 1 18 18 GLY C C 13 175.508 0.2 . 1 . . . . . 300 G C . 50789 1 156 . 1 . 1 18 18 GLY CA C 13 47.306 0.2 . 1 . . . . . 300 G CA . 50789 1 157 . 1 . 1 18 18 GLY N N 15 111.098 0.15 . 1 . . . . . 300 G N . 50789 1 158 . 1 . 1 19 19 GLU HA H 1 4.261 0.02 . 1 . . . . . 301 E HA . 50789 1 159 . 1 . 1 19 19 GLU HB2 H 1 1.973 0.02 . 2 . . . . . 301 E HB2 . 50789 1 160 . 1 . 1 19 19 GLU HB3 H 1 2.203 0.02 . 2 . . . . . 301 E HB3 . 50789 1 161 . 1 . 1 19 19 GLU HG3 H 1 2.324 0.02 . 2 . . . . . 301 E HG3 . 50789 1 162 . 1 . 1 19 19 GLU C C 13 177.476 0.2 . 1 . . . . . 301 E C . 50789 1 163 . 1 . 1 19 19 GLU CA C 13 57.047 0.2 . 1 . . . . . 301 E CA . 50789 1 164 . 1 . 1 19 19 GLU CB C 13 29.479 0.2 . 1 . . . . . 301 E CB . 50789 1 165 . 1 . 1 19 19 GLU CG C 13 36.026 0.2 . 1 . . . . . 301 E CG . 50789 1 166 . 1 . 1 20 20 ASN H H 1 8.389 0.02 . 1 . . . . . 302 N H . 50789 1 167 . 1 . 1 20 20 ASN HA H 1 4.570 0.02 . 1 . . . . . 302 N HA . 50789 1 168 . 1 . 1 20 20 ASN HB2 H 1 3.111 0.02 . 2 . . . . . 302 N HB2 . 50789 1 169 . 1 . 1 20 20 ASN HB3 H 1 2.372 0.02 . 2 . . . . . 302 N HB3 . 50789 1 170 . 1 . 1 20 20 ASN C C 13 176.828 0.2 . 1 . . . . . 302 N C . 50789 1 171 . 1 . 1 20 20 ASN CA C 13 55.829 0.2 . 1 . . . . . 302 N CA . 50789 1 172 . 1 . 1 20 20 ASN CB C 13 39.683 0.2 . 1 . . . . . 302 N CB . 50789 1 173 . 1 . 1 20 20 ASN N N 15 115.918 0.15 . 1 . . . . . 302 N N . 50789 1 174 . 1 . 1 21 21 GLY H H 1 6.653 0.02 . 1 . . . . . 303 G H . 50789 1 175 . 1 . 1 21 21 GLY HA2 H 1 4.448 0.02 . 2 . . . . . 303 G HA2 . 50789 1 176 . 1 . 1 21 21 GLY HA3 H 1 4.005 0.02 . 2 . . . . . 303 G HA3 . 50789 1 177 . 1 . 1 21 21 GLY C C 13 172.893 0.2 . 1 . . . . . 303 G C . 50789 1 178 . 1 . 1 21 21 GLY CA C 13 45.943 0.2 . 1 . . . . . 303 G CA . 50789 1 179 . 1 . 1 21 21 GLY N N 15 104.343 0.15 . 1 . . . . . 303 G N . 50789 1 180 . 1 . 1 22 22 VAL H H 1 8.170 0.02 . 1 . . . . . 304 V H . 50789 1 181 . 1 . 1 22 22 VAL HA H 1 5.780 0.02 . 1 . . . . . 304 V HA . 50789 1 182 . 1 . 1 22 22 VAL HB H 1 1.919 0.02 . 1 . . . . . 304 V HB . 50789 1 183 . 1 . 1 22 22 VAL HG11 H 1 0.591 0.02 . 2 . . . . . 304 V HG11 . 50789 1 184 . 1 . 1 22 22 VAL HG12 H 1 0.591 0.02 . 2 . . . . . 304 V HG12 . 50789 1 185 . 1 . 1 22 22 VAL HG13 H 1 0.591 0.02 . 2 . . . . . 304 V HG13 . 50789 1 186 . 1 . 1 22 22 VAL HG21 H 1 0.738 0.02 . 2 . . . . . 304 V HG21 . 50789 1 187 . 1 . 1 22 22 VAL HG22 H 1 0.738 0.02 . 2 . . . . . 304 V HG22 . 50789 1 188 . 1 . 1 22 22 VAL HG23 H 1 0.738 0.02 . 2 . . . . . 304 V HG23 . 50789 1 189 . 1 . 1 22 22 VAL C C 13 175.503 0.2 . 1 . . . . . 304 V C . 50789 1 190 . 1 . 1 22 22 VAL CA C 13 58.481 0.2 . 1 . . . . . 304 V CA . 50789 1 191 . 1 . 1 22 22 VAL CB C 13 36.187 0.2 . 1 . . . . . 304 V CB . 50789 1 192 . 1 . 1 22 22 VAL CG1 C 13 19.656 0.2 . 2 . . . . . 304 V CG1 . 50789 1 193 . 1 . 1 22 22 VAL CG2 C 13 22.678 0.2 . 2 . . . . . 304 V CG2 . 50789 1 194 . 1 . 1 22 22 VAL N N 15 107.217 0.15 . 1 . . . . . 304 V N . 50789 1 195 . 1 . 1 23 23 VAL H H 1 8.896 0.02 . 1 . . . . . 305 V H . 50789 1 196 . 1 . 1 23 23 VAL HA H 1 4.762 0.02 . 1 . . . . . 305 V HA . 50789 1 197 . 1 . 1 23 23 VAL HB H 1 1.881 0.02 . 1 . . . . . 305 V HB . 50789 1 198 . 1 . 1 23 23 VAL HG11 H 1 0.766 0.02 . 2 . . . . . 305 V HG11 . 50789 1 199 . 1 . 1 23 23 VAL HG12 H 1 0.766 0.02 . 2 . . . . . 305 V HG12 . 50789 1 200 . 1 . 1 23 23 VAL HG13 H 1 0.766 0.02 . 2 . . . . . 305 V HG13 . 50789 1 201 . 1 . 1 23 23 VAL HG21 H 1 0.766 0.02 . 2 . . . . . 305 V HG21 . 50789 1 202 . 1 . 1 23 23 VAL HG22 H 1 0.766 0.02 . 2 . . . . . 305 V HG22 . 50789 1 203 . 1 . 1 23 23 VAL HG23 H 1 0.766 0.02 . 2 . . . . . 305 V HG23 . 50789 1 204 . 1 . 1 23 23 VAL C C 13 173.578 0.2 . 1 . . . . . 305 V C . 50789 1 205 . 1 . 1 23 23 VAL CA C 13 60.128 0.2 . 1 . . . . . 305 V CA . 50789 1 206 . 1 . 1 23 23 VAL CB C 13 35.244 0.2 . 1 . . . . . 305 V CB . 50789 1 207 . 1 . 1 23 23 VAL CG1 C 13 21.825 0.2 . 2 . . . . . 305 V CG1 . 50789 1 208 . 1 . 1 23 23 VAL CG2 C 13 21.825 0.2 . 2 . . . . . 305 V CG2 . 50789 1 209 . 1 . 1 23 23 VAL N N 15 119.902 0.15 . 1 . . . . . 305 V N . 50789 1 210 . 1 . 1 24 24 VAL H H 1 7.988 0.02 . 1 . . . . . 306 V H . 50789 1 211 . 1 . 1 24 24 VAL HA H 1 4.745 0.02 . 1 . . . . . 306 V HA . 50789 1 212 . 1 . 1 24 24 VAL HB H 1 2.071 0.02 . 1 . . . . . 306 V HB . 50789 1 213 . 1 . 1 24 24 VAL HG11 H 1 0.951 0.02 . 2 . . . . . 306 V HG11 . 50789 1 214 . 1 . 1 24 24 VAL HG12 H 1 0.951 0.02 . 2 . . . . . 306 V HG12 . 50789 1 215 . 1 . 1 24 24 VAL HG13 H 1 0.951 0.02 . 2 . . . . . 306 V HG13 . 50789 1 216 . 1 . 1 24 24 VAL HG21 H 1 0.958 0.02 . 2 . . . . . 306 V HG21 . 50789 1 217 . 1 . 1 24 24 VAL HG22 H 1 0.958 0.02 . 2 . . . . . 306 V HG22 . 50789 1 218 . 1 . 1 24 24 VAL HG23 H 1 0.958 0.02 . 2 . . . . . 306 V HG23 . 50789 1 219 . 1 . 1 24 24 VAL C C 13 173.499 0.2 . 1 . . . . . 306 V C . 50789 1 220 . 1 . 1 24 24 VAL CA C 13 61.317 0.2 . 1 . . . . . 306 V CA . 50789 1 221 . 1 . 1 24 24 VAL CB C 13 34.170 0.2 . 1 . . . . . 306 V CB . 50789 1 222 . 1 . 1 24 24 VAL CG1 C 13 21.394 0.2 . 2 . . . . . 306 V CG1 . 50789 1 223 . 1 . 1 24 24 VAL CG2 C 13 23.111 0.2 . 2 . . . . . 306 V CG2 . 50789 1 224 . 1 . 1 24 24 VAL N N 15 125.193 0.15 . 1 . . . . . 306 V N . 50789 1 225 . 1 . 1 25 25 PHE H H 1 9.404 0.02 . 1 . . . . . 307 F H . 50789 1 226 . 1 . 1 25 25 PHE HA H 1 5.709 0.02 . 1 . . . . . 307 F HA . 50789 1 227 . 1 . 1 25 25 PHE HB2 H 1 2.332 0.02 . 2 . . . . . 307 F HB2 . 50789 1 228 . 1 . 1 25 25 PHE HB3 H 1 3.451 0.02 . 2 . . . . . 307 F HB3 . 50789 1 229 . 1 . 1 25 25 PHE C C 13 174.341 0.2 . 1 . . . . . 307 F C . 50789 1 230 . 1 . 1 25 25 PHE CA C 13 54.214 0.2 . 1 . . . . . 307 F CA . 50789 1 231 . 1 . 1 25 25 PHE CB C 13 41.675 0.2 . 1 . . . . . 307 F CB . 50789 1 232 . 1 . 1 25 25 PHE N N 15 130.801 0.15 . 1 . . . . . 307 F N . 50789 1 233 . 1 . 1 26 26 SER H H 1 8.999 0.02 . 1 . . . . . 308 S H . 50789 1 234 . 1 . 1 26 26 SER CA C 13 58.068 0.2 . 1 . . . . . 308 S CA . 50789 1 235 . 1 . 1 26 26 SER CB C 13 64.136 0.2 . 1 . . . . . 308 S CB . 50789 1 236 . 1 . 1 26 26 SER N N 15 121.088 0.15 . 1 . . . . . 308 S N . 50789 1 237 . 1 . 1 33 33 ASN HA H 1 4.790 0.02 . 1 . . . . . 315 N HA . 50789 1 238 . 1 . 1 33 33 ASN HB2 H 1 2.806 0.02 . 2 . . . . . 315 N HB2 . 50789 1 239 . 1 . 1 33 33 ASN HB3 H 1 2.955 0.02 . 2 . . . . . 315 N HB3 . 50789 1 240 . 1 . 1 33 33 ASN C C 13 174.829 0.2 . 1 . . . . . 315 N C . 50789 1 241 . 1 . 1 33 33 ASN CA C 13 53.147 0.2 . 1 . . . . . 315 N CA . 50789 1 242 . 1 . 1 33 33 ASN CB C 13 38.339 0.2 . 1 . . . . . 315 N CB . 50789 1 243 . 1 . 1 34 34 MET H H 1 8.028 0.02 . 1 . . . . . 316 M H . 50789 1 244 . 1 . 1 34 34 MET HA H 1 4.800 0.02 . 1 . . . . . 316 M HA . 50789 1 245 . 1 . 1 34 34 MET HB2 H 1 3.070 0.02 . 2 . . . . . 316 M HB2 . 50789 1 246 . 1 . 1 34 34 MET HB3 H 1 2.800 0.02 . 2 . . . . . 316 M HB3 . 50789 1 247 . 1 . 1 34 34 MET C C 13 175.556 0.2 . 1 . . . . . 316 M C . 50789 1 248 . 1 . 1 34 34 MET CA C 13 55.362 0.2 . 1 . . . . . 316 M CA . 50789 1 249 . 1 . 1 34 34 MET CB C 13 32.206 0.2 . 1 . . . . . 316 M CB . 50789 1 250 . 1 . 1 34 34 MET N N 15 120.507 0.15 . 1 . . . . . 316 M N . 50789 1 251 . 1 . 1 35 35 THR H H 1 8.023 0.02 . 1 . . . . . 317 T H . 50789 1 252 . 1 . 1 35 35 THR HA H 1 4.536 0.02 . 1 . . . . . 317 T HA . 50789 1 253 . 1 . 1 35 35 THR HB H 1 4.890 0.02 . 1 . . . . . 317 T HB . 50789 1 254 . 1 . 1 35 35 THR HG21 H 1 1.490 0.02 . 1 . . . . . 317 T HG21 . 50789 1 255 . 1 . 1 35 35 THR HG22 H 1 1.490 0.02 . 1 . . . . . 317 T HG22 . 50789 1 256 . 1 . 1 35 35 THR HG23 H 1 1.490 0.02 . 1 . . . . . 317 T HG23 . 50789 1 257 . 1 . 1 35 35 THR C C 13 174.867 0.2 . 1 . . . . . 317 T C . 50789 1 258 . 1 . 1 35 35 THR CA C 13 60.788 0.2 . 1 . . . . . 317 T CA . 50789 1 259 . 1 . 1 35 35 THR CB C 13 71.440 0.2 . 1 . . . . . 317 T CB . 50789 1 260 . 1 . 1 35 35 THR CG2 C 13 22.450 0.2 . 1 . . . . . 317 T CG2 . 50789 1 261 . 1 . 1 35 35 THR N N 15 116.884 0.15 . 1 . . . . . 317 T N . 50789 1 262 . 1 . 1 36 36 GLU H H 1 9.023 0.02 . 1 . . . . . 318 E H . 50789 1 263 . 1 . 1 36 36 GLU HA H 1 4.114 0.02 . 1 . . . . . 318 E HA . 50789 1 264 . 1 . 1 36 36 GLU HB2 H 1 2.132 0.02 . 2 . . . . . 318 E HB2 . 50789 1 265 . 1 . 1 36 36 GLU HG2 H 1 2.446 0.02 . 2 . . . . . 318 E HG2 . 50789 1 266 . 1 . 1 36 36 GLU C C 13 178.591 0.2 . 1 . . . . . 318 E C . 50789 1 267 . 1 . 1 36 36 GLU CA C 13 59.936 0.2 . 1 . . . . . 318 E CA . 50789 1 268 . 1 . 1 36 36 GLU CB C 13 29.520 0.2 . 1 . . . . . 318 E CB . 50789 1 269 . 1 . 1 36 36 GLU CG C 13 36.990 0.2 . 1 . . . . . 318 E CG . 50789 1 270 . 1 . 1 36 36 GLU N N 15 121.654 0.15 . 1 . . . . . 318 E N . 50789 1 271 . 1 . 1 37 37 GLU H H 1 8.281 0.02 . 1 . . . . . 319 E H . 50789 1 272 . 1 . 1 37 37 GLU HA H 1 4.146 0.02 . 1 . . . . . 319 E HA . 50789 1 273 . 1 . 1 37 37 GLU HB2 H 1 2.197 0.02 . 2 . . . . . 319 E HB2 . 50789 1 274 . 1 . 1 37 37 GLU HG2 H 1 2.551 0.02 . 2 . . . . . 319 E HG2 . 50789 1 275 . 1 . 1 37 37 GLU HG3 H 1 2.365 0.02 . 2 . . . . . 319 E HG3 . 50789 1 276 . 1 . 1 37 37 GLU C C 13 178.624 0.2 . 1 . . . . . 319 E C . 50789 1 277 . 1 . 1 37 37 GLU CA C 13 60.163 0.2 . 1 . . . . . 319 E CA . 50789 1 278 . 1 . 1 37 37 GLU CB C 13 28.837 0.2 . 1 . . . . . 319 E CB . 50789 1 279 . 1 . 1 37 37 GLU CG C 13 34.905 0.2 . 1 . . . . . 319 E CG . 50789 1 280 . 1 . 1 37 37 GLU N N 15 119.210 0.15 . 1 . . . . . 319 E N . 50789 1 281 . 1 . 1 38 38 ARG H H 1 7.731 0.02 . 1 . . . . . 320 R H . 50789 1 282 . 1 . 1 38 38 ARG HA H 1 3.940 0.02 . 1 . . . . . 320 R HA . 50789 1 283 . 1 . 1 38 38 ARG C C 13 178.612 0.2 . 1 . . . . . 320 R C . 50789 1 284 . 1 . 1 38 38 ARG CA C 13 58.739 0.2 . 1 . . . . . 320 R CA . 50789 1 285 . 1 . 1 38 38 ARG CB C 13 34.289 0.2 . 1 . . . . . 320 R CB . 50789 1 286 . 1 . 1 38 38 ARG N N 15 119.392 0.15 . 1 . . . . . 320 R N . 50789 1 287 . 1 . 1 39 39 ALA H H 1 8.510 0.02 . 1 . . . . . 321 A H . 50789 1 288 . 1 . 1 39 39 ALA HA H 1 4.206 0.02 . 1 . . . . . 321 A HA . 50789 1 289 . 1 . 1 39 39 ALA HB1 H 1 1.624 0.02 . 1 . . . . . 321 A HB1 . 50789 1 290 . 1 . 1 39 39 ALA HB2 H 1 1.624 0.02 . 1 . . . . . 321 A HB2 . 50789 1 291 . 1 . 1 39 39 ALA HB3 H 1 1.624 0.02 . 1 . . . . . 321 A HB3 . 50789 1 292 . 1 . 1 39 39 ALA C C 13 179.732 0.2 . 1 . . . . . 321 A C . 50789 1 293 . 1 . 1 39 39 ALA CA C 13 55.997 0.2 . 1 . . . . . 321 A CA . 50789 1 294 . 1 . 1 39 39 ALA CB C 13 18.488 0.2 . 1 . . . . . 321 A CB . 50789 1 295 . 1 . 1 39 39 ALA N N 15 120.922 0.15 . 1 . . . . . 321 A N . 50789 1 296 . 1 . 1 40 40 ASN H H 1 8.354 0.02 . 1 . . . . . 322 N H . 50789 1 297 . 1 . 1 40 40 ASN HA H 1 4.702 0.02 . 1 . . . . . 322 N HA . 50789 1 298 . 1 . 1 40 40 ASN HB2 H 1 2.807 0.02 . 2 . . . . . 322 N HB2 . 50789 1 299 . 1 . 1 40 40 ASN HB3 H 1 3.034 0.02 . 2 . . . . . 322 N HB3 . 50789 1 300 . 1 . 1 40 40 ASN C C 13 179.543 0.2 . 1 . . . . . 322 N C . 50789 1 301 . 1 . 1 40 40 ASN CA C 13 55.224 0.2 . 1 . . . . . 322 N CA . 50789 1 302 . 1 . 1 40 40 ASN CB C 13 37.984 0.2 . 1 . . . . . 322 N CB . 50789 1 303 . 1 . 1 40 40 ASN N N 15 116.245 0.15 . 1 . . . . . 322 N N . 50789 1 304 . 1 . 1 41 41 VAL H H 1 7.940 0.02 . 1 . . . . . 323 V H . 50789 1 305 . 1 . 1 41 41 VAL HA H 1 3.618 0.02 . 1 . . . . . 323 V HA . 50789 1 306 . 1 . 1 41 41 VAL HB H 1 2.216 0.02 . 1 . . . . . 323 V HB . 50789 1 307 . 1 . 1 41 41 VAL HG11 H 1 0.783 0.02 . 2 . . . . . 323 V HG11 . 50789 1 308 . 1 . 1 41 41 VAL HG12 H 1 0.783 0.02 . 2 . . . . . 323 V HG12 . 50789 1 309 . 1 . 1 41 41 VAL HG13 H 1 0.783 0.02 . 2 . . . . . 323 V HG13 . 50789 1 310 . 1 . 1 41 41 VAL HG21 H 1 1.158 0.02 . 2 . . . . . 323 V HG21 . 50789 1 311 . 1 . 1 41 41 VAL HG22 H 1 1.158 0.02 . 2 . . . . . 323 V HG22 . 50789 1 312 . 1 . 1 41 41 VAL HG23 H 1 1.158 0.02 . 2 . . . . . 323 V HG23 . 50789 1 313 . 1 . 1 41 41 VAL C C 13 178.856 0.2 . 1 . . . . . 323 V C . 50789 1 314 . 1 . 1 41 41 VAL CA C 13 67.063 0.2 . 1 . . . . . 323 V CA . 50789 1 315 . 1 . 1 41 41 VAL CB C 13 31.588 0.2 . 1 . . . . . 323 V CB . 50789 1 316 . 1 . 1 41 41 VAL CG1 C 13 19.817 0.2 . 2 . . . . . 323 V CG1 . 50789 1 317 . 1 . 1 41 41 VAL CG2 C 13 23.974 0.2 . 2 . . . . . 323 V CG2 . 50789 1 318 . 1 . 1 41 41 VAL N N 15 125.073 0.15 . 1 . . . . . 323 V N . 50789 1 319 . 1 . 1 42 42 ILE H H 1 8.120 0.02 . 1 . . . . . 324 I H . 50789 1 320 . 1 . 1 42 42 ILE HA H 1 3.257 0.02 . 1 . . . . . 324 I HA . 50789 1 321 . 1 . 1 42 42 ILE HB H 1 1.735 0.02 . 1 . . . . . 324 I HB . 50789 1 322 . 1 . 1 42 42 ILE HG12 H 1 1.760 0.02 . 2 . . . . . 324 I HG12 . 50789 1 323 . 1 . 1 42 42 ILE HG21 H 1 -0.145 0.02 . 1 . . . . . 324 I HG21 . 50789 1 324 . 1 . 1 42 42 ILE HG22 H 1 -0.145 0.02 . 1 . . . . . 324 I HG22 . 50789 1 325 . 1 . 1 42 42 ILE HG23 H 1 -0.145 0.02 . 1 . . . . . 324 I HG23 . 50789 1 326 . 1 . 1 42 42 ILE HD11 H 1 0.990 0.02 . 1 . . . . . 324 I HD11 . 50789 1 327 . 1 . 1 42 42 ILE HD12 H 1 0.990 0.02 . 1 . . . . . 324 I HD12 . 50789 1 328 . 1 . 1 42 42 ILE HD13 H 1 0.990 0.02 . 1 . . . . . 324 I HD13 . 50789 1 329 . 1 . 1 42 42 ILE C C 13 177.609 0.2 . 1 . . . . . 324 I C . 50789 1 330 . 1 . 1 42 42 ILE CA C 13 65.043 0.2 . 1 . . . . . 324 I CA . 50789 1 331 . 1 . 1 42 42 ILE CB C 13 38.078 0.2 . 1 . . . . . 324 I CB . 50789 1 332 . 1 . 1 42 42 ILE CG1 C 13 30.380 0.2 . 1 . . . . . 324 I CG1 . 50789 1 333 . 1 . 1 42 42 ILE CG2 C 13 18.998 0.2 . 1 . . . . . 324 I CG2 . 50789 1 334 . 1 . 1 42 42 ILE CD1 C 13 14.114 0.2 . 1 . . . . . 324 I CD1 . 50789 1 335 . 1 . 1 42 42 ILE N N 15 120.471 0.15 . 1 . . . . . 324 I N . 50789 1 336 . 1 . 1 43 43 ALA H H 1 8.842 0.02 . 1 . . . . . 325 A H . 50789 1 337 . 1 . 1 43 43 ALA HA H 1 3.893 0.02 . 1 . . . . . 325 A HA . 50789 1 338 . 1 . 1 43 43 ALA HB1 H 1 1.612 0.02 . 1 . . . . . 325 A HB1 . 50789 1 339 . 1 . 1 43 43 ALA HB2 H 1 1.612 0.02 . 1 . . . . . 325 A HB2 . 50789 1 340 . 1 . 1 43 43 ALA HB3 H 1 1.612 0.02 . 1 . . . . . 325 A HB3 . 50789 1 341 . 1 . 1 43 43 ALA C C 13 180.218 0.2 . 1 . . . . . 325 A C . 50789 1 342 . 1 . 1 43 43 ALA CA C 13 55.568 0.2 . 1 . . . . . 325 A CA . 50789 1 343 . 1 . 1 43 43 ALA CB C 13 17.999 0.2 . 1 . . . . . 325 A CB . 50789 1 344 . 1 . 1 43 43 ALA N N 15 120.947 0.15 . 1 . . . . . 325 A N . 50789 1 345 . 1 . 1 44 44 SER H H 1 8.091 0.02 . 1 . . . . . 326 S H . 50789 1 346 . 1 . 1 44 44 SER HA H 1 4.187 0.02 . 1 . . . . . 326 S HA . 50789 1 347 . 1 . 1 44 44 SER HB2 H 1 4.073 0.02 . 2 . . . . . 326 S HB2 . 50789 1 348 . 1 . 1 44 44 SER HB3 H 1 3.945 0.02 . 2 . . . . . 326 S HB3 . 50789 1 349 . 1 . 1 44 44 SER CA C 13 61.790 0.2 . 1 . . . . . 326 S CA . 50789 1 350 . 1 . 1 44 44 SER CB C 13 63.037 0.2 . 1 . . . . . 326 S CB . 50789 1 351 . 1 . 1 44 44 SER N N 15 112.592 0.15 . 1 . . . . . 326 S N . 50789 1 352 . 1 . 1 45 45 ALA H H 1 7.364 0.02 . 1 . . . . . 327 A H . 50789 1 353 . 1 . 1 45 45 ALA HA H 1 4.028 0.02 . 1 . . . . . 327 A HA . 50789 1 354 . 1 . 1 45 45 ALA HB1 H 1 1.568 0.02 . 1 . . . . . 327 A HB1 . 50789 1 355 . 1 . 1 45 45 ALA HB2 H 1 1.568 0.02 . 1 . . . . . 327 A HB2 . 50789 1 356 . 1 . 1 45 45 ALA HB3 H 1 1.568 0.02 . 1 . . . . . 327 A HB3 . 50789 1 357 . 1 . 1 45 45 ALA C C 13 178.699 0.2 . 1 . . . . . 327 A C . 50789 1 358 . 1 . 1 45 45 ALA CA C 13 55.399 0.2 . 1 . . . . . 327 A CA . 50789 1 359 . 1 . 1 45 45 ALA CB C 13 19.715 0.2 . 1 . . . . . 327 A CB . 50789 1 360 . 1 . 1 45 45 ALA N N 15 123.276 0.15 . 1 . . . . . 327 A N . 50789 1 361 . 1 . 1 46 46 LEU H H 1 7.886 0.02 . 1 . . . . . 328 L H . 50789 1 362 . 1 . 1 46 46 LEU HA H 1 3.623 0.02 . 1 . . . . . 328 L HA . 50789 1 363 . 1 . 1 46 46 LEU HB2 H 1 1.610 0.02 . 2 . . . . . 328 L HB2 . 50789 1 364 . 1 . 1 46 46 LEU HB3 H 1 1.456 0.02 . 2 . . . . . 328 L HB3 . 50789 1 365 . 1 . 1 46 46 LEU HG H 1 1.630 0.02 . 1 . . . . . 328 L HG . 50789 1 366 . 1 . 1 46 46 LEU HD11 H 1 0.484 0.02 . 2 . . . . . 328 L HD11 . 50789 1 367 . 1 . 1 46 46 LEU HD12 H 1 0.484 0.02 . 2 . . . . . 328 L HD12 . 50789 1 368 . 1 . 1 46 46 LEU HD13 H 1 0.484 0.02 . 2 . . . . . 328 L HD13 . 50789 1 369 . 1 . 1 46 46 LEU HD21 H 1 0.080 0.02 . 2 . . . . . 328 L HD21 . 50789 1 370 . 1 . 1 46 46 LEU HD22 H 1 0.080 0.02 . 2 . . . . . 328 L HD22 . 50789 1 371 . 1 . 1 46 46 LEU HD23 H 1 0.080 0.02 . 2 . . . . . 328 L HD23 . 50789 1 372 . 1 . 1 46 46 LEU C C 13 177.471 0.2 . 1 . . . . . 328 L C . 50789 1 373 . 1 . 1 46 46 LEU CA C 13 56.951 0.2 . 1 . . . . . 328 L CA . 50789 1 374 . 1 . 1 46 46 LEU CB C 13 41.620 0.2 . 1 . . . . . 328 L CB . 50789 1 375 . 1 . 1 46 46 LEU CG C 13 25.540 0.2 . 1 . . . . . 328 L CG . 50789 1 376 . 1 . 1 46 46 LEU CD1 C 13 20.800 0.2 . 2 . . . . . 328 L CD1 . 50789 1 377 . 1 . 1 46 46 LEU CD2 C 13 26.110 0.2 . 2 . . . . . 328 L CD2 . 50789 1 378 . 1 . 1 46 46 LEU N N 15 113.700 0.15 . 1 . . . . . 328 L N . 50789 1 379 . 1 . 1 47 47 ALA H H 1 7.725 0.02 . 1 . . . . . 329 A H . 50789 1 380 . 1 . 1 47 47 ALA HA H 1 4.794 0.02 . 1 . . . . . 329 A HA . 50789 1 381 . 1 . 1 47 47 ALA HB1 H 1 1.604 0.02 . 1 . . . . . 329 A HB1 . 50789 1 382 . 1 . 1 47 47 ALA HB2 H 1 1.604 0.02 . 1 . . . . . 329 A HB2 . 50789 1 383 . 1 . 1 47 47 ALA HB3 H 1 1.604 0.02 . 1 . . . . . 329 A HB3 . 50789 1 384 . 1 . 1 47 47 ALA C C 13 178.857 0.2 . 1 . . . . . 329 A C . 50789 1 385 . 1 . 1 47 47 ALA CA C 13 52.917 0.2 . 1 . . . . . 329 A CA . 50789 1 386 . 1 . 1 47 47 ALA CB C 13 19.156 0.2 . 1 . . . . . 329 A CB . 50789 1 387 . 1 . 1 47 47 ALA N N 15 115.726 0.15 . 1 . . . . . 329 A N . 50789 1 388 . 1 . 1 48 48 GLN H H 1 7.368 0.02 . 1 . . . . . 330 Q H . 50789 1 389 . 1 . 1 48 48 GLN HA H 1 4.348 0.02 . 1 . . . . . 330 Q HA . 50789 1 390 . 1 . 1 48 48 GLN HB2 H 1 2.476 0.02 . 2 . . . . . 330 Q HB2 . 50789 1 391 . 1 . 1 48 48 GLN HB3 H 1 2.083 0.02 . 2 . . . . . 330 Q HB3 . 50789 1 392 . 1 . 1 48 48 GLN HG2 H 1 2.608 0.02 . 2 . . . . . 330 Q HG2 . 50789 1 393 . 1 . 1 48 48 GLN HG3 H 1 2.302 0.02 . 2 . . . . . 330 Q HG3 . 50789 1 394 . 1 . 1 48 48 GLN C C 13 175.775 0.2 . 1 . . . . . 330 Q C . 50789 1 395 . 1 . 1 48 48 GLN CA C 13 56.227 0.2 . 1 . . . . . 330 Q CA . 50789 1 396 . 1 . 1 48 48 GLN CB C 13 31.078 0.2 . 1 . . . . . 330 Q CB . 50789 1 397 . 1 . 1 48 48 GLN CG C 13 34.866 0.2 . 1 . . . . . 330 Q CG . 50789 1 398 . 1 . 1 48 48 GLN N N 15 113.286 0.15 . 1 . . . . . 330 Q N . 50789 1 399 . 1 . 1 49 49 ILE H H 1 6.992 0.02 . 1 . . . . . 331 I H . 50789 1 400 . 1 . 1 49 49 ILE HA H 1 4.780 0.02 . 1 . . . . . 331 I HA . 50789 1 401 . 1 . 1 49 49 ILE HB H 1 2.290 0.02 . 1 . . . . . 331 I HB . 50789 1 402 . 1 . 1 49 49 ILE HG12 H 1 1.450 0.02 . 2 . . . . . 331 I HG12 . 50789 1 403 . 1 . 1 49 49 ILE HG21 H 1 0.815 0.02 . 1 . . . . . 331 I HG21 . 50789 1 404 . 1 . 1 49 49 ILE HG22 H 1 0.815 0.02 . 1 . . . . . 331 I HG22 . 50789 1 405 . 1 . 1 49 49 ILE HG23 H 1 0.815 0.02 . 1 . . . . . 331 I HG23 . 50789 1 406 . 1 . 1 49 49 ILE HD11 H 1 0.759 0.02 . 1 . . . . . 331 I HD11 . 50789 1 407 . 1 . 1 49 49 ILE HD12 H 1 0.759 0.02 . 1 . . . . . 331 I HD12 . 50789 1 408 . 1 . 1 49 49 ILE HD13 H 1 0.759 0.02 . 1 . . . . . 331 I HD13 . 50789 1 409 . 1 . 1 49 49 ILE C C 13 174.338 0.2 . 1 . . . . . 331 I C . 50789 1 410 . 1 . 1 49 49 ILE CA C 13 58.860 0.2 . 1 . . . . . 331 I CA . 50789 1 411 . 1 . 1 49 49 ILE CB C 13 37.504 0.2 . 1 . . . . . 331 I CB . 50789 1 412 . 1 . 1 49 49 ILE CG1 C 13 23.800 0.2 . 1 . . . . . 331 I CG1 . 50789 1 413 . 1 . 1 49 49 ILE CG2 C 13 18.367 0.2 . 1 . . . . . 331 I CG2 . 50789 1 414 . 1 . 1 49 49 ILE CD1 C 13 14.637 0.2 . 1 . . . . . 331 I CD1 . 50789 1 415 . 1 . 1 49 49 ILE N N 15 113.038 0.15 . 1 . . . . . 331 I N . 50789 1 416 . 1 . 1 50 50 PRO HA H 1 4.382 0.02 . 1 . . . . . 332 P HA . 50789 1 417 . 1 . 1 50 50 PRO HB3 H 1 1.824 0.02 . 2 . . . . . 332 P HB3 . 50789 1 418 . 1 . 1 50 50 PRO HG3 H 1 2.160 0.02 . 2 . . . . . 332 P HG3 . 50789 1 419 . 1 . 1 50 50 PRO HD3 H 1 3.703 0.02 . 2 . . . . . 332 P HD3 . 50789 1 420 . 1 . 1 50 50 PRO C C 13 177.508 0.2 . 1 . . . . . 332 P C . 50789 1 421 . 1 . 1 50 50 PRO CA C 13 63.413 0.2 . 1 . . . . . 332 P CA . 50789 1 422 . 1 . 1 50 50 PRO CB C 13 31.794 0.2 . 1 . . . . . 332 P CB . 50789 1 423 . 1 . 1 50 50 PRO CG C 13 27.055 0.2 . 1 . . . . . 332 P CG . 50789 1 424 . 1 . 1 50 50 PRO CD C 13 50.503 0.2 . 1 . . . . . 332 P CD . 50789 1 425 . 1 . 1 51 51 GLN H H 1 6.660 0.02 . 1 . . . . . 333 Q H . 50789 1 426 . 1 . 1 51 51 GLN HA H 1 4.007 0.02 . 1 . . . . . 333 Q HA . 50789 1 427 . 1 . 1 51 51 GLN HB2 H 1 1.940 0.02 . 2 . . . . . 333 Q HB2 . 50789 1 428 . 1 . 1 51 51 GLN HG2 H 1 2.470 0.02 . 2 . . . . . 333 Q HG2 . 50789 1 429 . 1 . 1 51 51 GLN HG3 H 1 1.790 0.02 . 2 . . . . . 333 Q HG3 . 50789 1 430 . 1 . 1 51 51 GLN C C 13 175.145 0.2 . 1 . . . . . 333 Q C . 50789 1 431 . 1 . 1 51 51 GLN CA C 13 58.036 0.2 . 1 . . . . . 333 Q CA . 50789 1 432 . 1 . 1 51 51 GLN CB C 13 29.179 0.2 . 1 . . . . . 333 Q CB . 50789 1 433 . 1 . 1 51 51 GLN CG C 13 34.888 0.2 . 1 . . . . . 333 Q CG . 50789 1 434 . 1 . 1 51 51 GLN N N 15 117.839 0.15 . 1 . . . . . 333 Q N . 50789 1 435 . 1 . 1 52 52 LYS H H 1 7.226 0.02 . 1 . . . . . 334 K H . 50789 1 436 . 1 . 1 52 52 LYS HA H 1 5.042 0.02 . 1 . . . . . 334 K HA . 50789 1 437 . 1 . 1 52 52 LYS HB2 H 1 1.616 0.02 . 2 . . . . . 334 K HB2 . 50789 1 438 . 1 . 1 52 52 LYS HE2 H 1 2.764 0.02 . 2 . . . . . 334 K HE2 . 50789 1 439 . 1 . 1 52 52 LYS C C 13 176.586 0.2 . 1 . . . . . 334 K C . 50789 1 440 . 1 . 1 52 52 LYS CA C 13 54.365 0.2 . 1 . . . . . 334 K CA . 50789 1 441 . 1 . 1 52 52 LYS CB C 13 32.546 0.2 . 1 . . . . . 334 K CB . 50789 1 442 . 1 . 1 52 52 LYS CG C 13 26.128 0.2 . 1 . . . . . 334 K CG . 50789 1 443 . 1 . 1 52 52 LYS CD C 13 27.890 0.2 . 1 . . . . . 334 K CD . 50789 1 444 . 1 . 1 52 52 LYS CE C 13 42.800 0.2 . 1 . . . . . 334 K CE . 50789 1 445 . 1 . 1 52 52 LYS N N 15 113.848 0.15 . 1 . . . . . 334 K N . 50789 1 446 . 1 . 1 53 53 VAL H H 1 9.064 0.02 . 1 . . . . . 335 V H . 50789 1 447 . 1 . 1 53 53 VAL HA H 1 5.025 0.02 . 1 . . . . . 335 V HA . 50789 1 448 . 1 . 1 53 53 VAL HB H 1 2.293 0.02 . 1 . . . . . 335 V HB . 50789 1 449 . 1 . 1 53 53 VAL HG11 H 1 0.942 0.02 . 2 . . . . . 335 V HG11 . 50789 1 450 . 1 . 1 53 53 VAL HG12 H 1 0.942 0.02 . 2 . . . . . 335 V HG12 . 50789 1 451 . 1 . 1 53 53 VAL HG13 H 1 0.942 0.02 . 2 . . . . . 335 V HG13 . 50789 1 452 . 1 . 1 53 53 VAL HG21 H 1 0.782 0.02 . 2 . . . . . 335 V HG21 . 50789 1 453 . 1 . 1 53 53 VAL HG22 H 1 0.782 0.02 . 2 . . . . . 335 V HG22 . 50789 1 454 . 1 . 1 53 53 VAL HG23 H 1 0.782 0.02 . 2 . . . . . 335 V HG23 . 50789 1 455 . 1 . 1 53 53 VAL C C 13 174.678 0.2 . 1 . . . . . 335 V C . 50789 1 456 . 1 . 1 53 53 VAL CA C 13 61.246 0.2 . 1 . . . . . 335 V CA . 50789 1 457 . 1 . 1 53 53 VAL CB C 13 34.504 0.2 . 1 . . . . . 335 V CB . 50789 1 458 . 1 . 1 53 53 VAL CG1 C 13 21.800 0.2 . 2 . . . . . 335 V CG1 . 50789 1 459 . 1 . 1 53 53 VAL CG2 C 13 21.040 0.2 . 2 . . . . . 335 V CG2 . 50789 1 460 . 1 . 1 53 53 VAL N N 15 120.223 0.15 . 1 . . . . . 335 V N . 50789 1 461 . 1 . 1 54 54 LEU H H 1 8.626 0.02 . 1 . . . . . 336 L H . 50789 1 462 . 1 . 1 54 54 LEU HA H 1 5.351 0.02 . 1 . . . . . 336 L HA . 50789 1 463 . 1 . 1 54 54 LEU HB2 H 1 1.781 0.02 . 2 . . . . . 336 L HB2 . 50789 1 464 . 1 . 1 54 54 LEU HB3 H 1 1.598 0.02 . 2 . . . . . 336 L HB3 . 50789 1 465 . 1 . 1 54 54 LEU HD11 H 1 1.050 0.02 . 2 . . . . . 336 L HD11 . 50789 1 466 . 1 . 1 54 54 LEU HD12 H 1 1.050 0.02 . 2 . . . . . 336 L HD12 . 50789 1 467 . 1 . 1 54 54 LEU HD13 H 1 1.050 0.02 . 2 . . . . . 336 L HD13 . 50789 1 468 . 1 . 1 54 54 LEU HD21 H 1 0.887 0.02 . 2 . . . . . 336 L HD21 . 50789 1 469 . 1 . 1 54 54 LEU HD22 H 1 0.887 0.02 . 2 . . . . . 336 L HD22 . 50789 1 470 . 1 . 1 54 54 LEU HD23 H 1 0.887 0.02 . 2 . . . . . 336 L HD23 . 50789 1 471 . 1 . 1 54 54 LEU C C 13 173.353 0.2 . 1 . . . . . 336 L C . 50789 1 472 . 1 . 1 54 54 LEU CA C 13 56.813 0.2 . 1 . . . . . 336 L CA . 50789 1 473 . 1 . 1 54 54 LEU CB C 13 42.137 0.2 . 1 . . . . . 336 L CB . 50789 1 474 . 1 . 1 54 54 LEU CD1 C 13 26.600 0.2 . 2 . . . . . 336 L CD1 . 50789 1 475 . 1 . 1 54 54 LEU CD2 C 13 27.400 0.2 . 2 . . . . . 336 L CD2 . 50789 1 476 . 1 . 1 54 54 LEU N N 15 127.350 0.15 . 1 . . . . . 336 L N . 50789 1 477 . 1 . 1 55 55 TRP H H 1 9.189 0.02 . 1 . . . . . 337 W H . 50789 1 478 . 1 . 1 55 55 TRP HA H 1 6.085 0.02 . 1 . . . . . 337 W HA . 50789 1 479 . 1 . 1 55 55 TRP HB2 H 1 2.640 0.02 . 2 . . . . . 337 W HB2 . 50789 1 480 . 1 . 1 55 55 TRP HB3 H 1 3.486 0.02 . 2 . . . . . 337 W HB3 . 50789 1 481 . 1 . 1 55 55 TRP HD1 H 1 6.916 0.02 . 1 . . . . . 337 W HD1 . 50789 1 482 . 1 . 1 55 55 TRP HE3 H 1 6.838 0.02 . 1 . . . . . 337 W HE3 . 50789 1 483 . 1 . 1 55 55 TRP HZ2 H 1 6.670 0.02 . 1 . . . . . 337 W HZ2 . 50789 1 484 . 1 . 1 55 55 TRP HZ3 H 1 6.367 0.02 . 1 . . . . . 337 W HZ3 . 50789 1 485 . 1 . 1 55 55 TRP HH2 H 1 6.887 0.02 . 1 . . . . . 337 W HH2 . 50789 1 486 . 1 . 1 55 55 TRP C C 13 174.658 0.2 . 1 . . . . . 337 W C . 50789 1 487 . 1 . 1 55 55 TRP CA C 13 53.062 0.2 . 1 . . . . . 337 W CA . 50789 1 488 . 1 . 1 55 55 TRP CB C 13 32.313 0.2 . 1 . . . . . 337 W CB . 50789 1 489 . 1 . 1 55 55 TRP CD1 C 13 124.500 0.2 . 1 . . . . . 337 W CD1 . 50789 1 490 . 1 . 1 55 55 TRP CE3 C 13 121.060 0.2 . 1 . . . . . 337 W CE3 . 50789 1 491 . 1 . 1 55 55 TRP CZ2 C 13 113.180 0.2 . 1 . . . . . 337 W CZ2 . 50789 1 492 . 1 . 1 55 55 TRP CZ3 C 13 118.630 0.2 . 1 . . . . . 337 W CZ3 . 50789 1 493 . 1 . 1 55 55 TRP CH2 C 13 123.311 0.2 . 1 . . . . . 337 W CH2 . 50789 1 494 . 1 . 1 55 55 TRP N N 15 127.005 0.15 . 1 . . . . . 337 W N . 50789 1 495 . 1 . 1 56 56 ARG H H 1 9.120 0.02 . 1 . . . . . 338 R H . 50789 1 496 . 1 . 1 56 56 ARG HA H 1 5.286 0.02 . 1 . . . . . 338 R HA . 50789 1 497 . 1 . 1 56 56 ARG HB2 H 1 1.660 0.02 . 2 . . . . . 338 R HB2 . 50789 1 498 . 1 . 1 56 56 ARG HG2 H 1 2.390 0.02 . 2 . . . . . 338 R HG2 . 50789 1 499 . 1 . 1 56 56 ARG HD2 H 1 3.235 0.02 . 2 . . . . . 338 R HD2 . 50789 1 500 . 1 . 1 56 56 ARG HD3 H 1 3.235 0.02 . 2 . . . . . 338 R HD3 . 50789 1 501 . 1 . 1 56 56 ARG C C 13 172.965 0.2 . 1 . . . . . 338 R C . 50789 1 502 . 1 . 1 56 56 ARG CA C 13 55.530 0.2 . 1 . . . . . 338 R CA . 50789 1 503 . 1 . 1 56 56 ARG CB C 13 29.411 0.2 . 1 . . . . . 338 R CB . 50789 1 504 . 1 . 1 56 56 ARG CG C 13 27.950 0.2 . 1 . . . . . 338 R CG . 50789 1 505 . 1 . 1 56 56 ARG CD C 13 43.660 0.2 . 1 . . . . . 338 R CD . 50789 1 506 . 1 . 1 56 56 ARG N N 15 127.832 0.15 . 1 . . . . . 338 R N . 50789 1 507 . 1 . 1 57 57 PHE H H 1 8.669 0.02 . 1 . . . . . 339 F H . 50789 1 508 . 1 . 1 57 57 PHE HA H 1 4.584 0.02 . 1 . . . . . 339 F HA . 50789 1 509 . 1 . 1 57 57 PHE HB2 H 1 1.747 0.02 . 2 . . . . . 339 F HB2 . 50789 1 510 . 1 . 1 57 57 PHE HB3 H 1 1.598 0.02 . 2 . . . . . 339 F HB3 . 50789 1 511 . 1 . 1 57 57 PHE C C 13 173.239 0.2 . 1 . . . . . 339 F C . 50789 1 512 . 1 . 1 57 57 PHE CA C 13 57.838 0.2 . 1 . . . . . 339 F CA . 50789 1 513 . 1 . 1 57 57 PHE CB C 13 43.134 0.2 . 1 . . . . . 339 F CB . 50789 1 514 . 1 . 1 57 57 PHE N N 15 132.727 0.15 . 1 . . . . . 339 F N . 50789 1 515 . 1 . 1 58 58 ASP H H 1 7.703 0.02 . 1 . . . . . 340 D H . 50789 1 516 . 1 . 1 58 58 ASP HA H 1 4.563 0.02 . 1 . . . . . 340 D HA . 50789 1 517 . 1 . 1 58 58 ASP HB3 H 1 2.523 0.02 . 2 . . . . . 340 D HB3 . 50789 1 518 . 1 . 1 58 58 ASP C C 13 174.662 0.2 . 1 . . . . . 340 D C . 50789 1 519 . 1 . 1 58 58 ASP CA C 13 52.854 0.2 . 1 . . . . . 340 D CA . 50789 1 520 . 1 . 1 58 58 ASP CB C 13 42.501 0.2 . 1 . . . . . 340 D CB . 50789 1 521 . 1 . 1 58 58 ASP N N 15 124.995 0.15 . 1 . . . . . 340 D N . 50789 1 522 . 1 . 1 59 59 GLY H H 1 5.912 0.02 . 1 . . . . . 341 G H . 50789 1 523 . 1 . 1 59 59 GLY HA2 H 1 3.886 0.02 . 2 . . . . . 341 G HA2 . 50789 1 524 . 1 . 1 59 59 GLY HA3 H 1 3.362 0.02 . 2 . . . . . 341 G HA3 . 50789 1 525 . 1 . 1 59 59 GLY CA C 13 44.339 0.2 . 1 . . . . . 341 G CA . 50789 1 526 . 1 . 1 59 59 GLY N N 15 106.685 0.15 . 1 . . . . . 341 G N . 50789 1 527 . 1 . 1 60 60 ASN H H 1 8.500 0.02 . 1 . . . . . 342 N H . 50789 1 528 . 1 . 1 60 60 ASN HA H 1 4.524 0.02 . 1 . . . . . 342 N HA . 50789 1 529 . 1 . 1 60 60 ASN HB2 H 1 2.660 0.02 . 2 . . . . . 342 N HB2 . 50789 1 530 . 1 . 1 60 60 ASN HB3 H 1 2.740 0.02 . 2 . . . . . 342 N HB3 . 50789 1 531 . 1 . 1 60 60 ASN C C 13 175.477 0.2 . 1 . . . . . 342 N C . 50789 1 532 . 1 . 1 60 60 ASN CA C 13 52.879 0.2 . 1 . . . . . 342 N CA . 50789 1 533 . 1 . 1 60 60 ASN CB C 13 38.565 0.2 . 1 . . . . . 342 N CB . 50789 1 534 . 1 . 1 60 60 ASN N N 15 118.366 0.15 . 1 . . . . . 342 N N . 50789 1 535 . 1 . 1 61 61 LYS H H 1 8.491 0.02 . 1 . . . . . 343 K H . 50789 1 536 . 1 . 1 61 61 LYS C C 13 175.012 0.2 . 1 . . . . . 343 K C . 50789 1 537 . 1 . 1 61 61 LYS CA C 13 55.420 0.2 . 1 . . . . . 343 K CA . 50789 1 538 . 1 . 1 61 61 LYS CB C 13 32.626 0.2 . 1 . . . . . 343 K CB . 50789 1 539 . 1 . 1 61 61 LYS N N 15 123.851 0.15 . 1 . . . . . 343 K N . 50789 1 540 . 1 . 1 62 62 PRO HA H 1 4.650 0.02 . 1 . . . . . 344 P HA . 50789 1 541 . 1 . 1 62 62 PRO HB2 H 1 2.448 0.02 . 2 . . . . . 344 P HB2 . 50789 1 542 . 1 . 1 62 62 PRO HB3 H 1 1.590 0.02 . 2 . . . . . 344 P HB3 . 50789 1 543 . 1 . 1 62 62 PRO HG3 H 1 1.703 0.02 . 2 . . . . . 344 P HG3 . 50789 1 544 . 1 . 1 62 62 PRO HD2 H 1 3.815 0.02 . 2 . . . . . 344 P HD2 . 50789 1 545 . 1 . 1 62 62 PRO HD3 H 1 3.205 0.02 . 2 . . . . . 344 P HD3 . 50789 1 546 . 1 . 1 62 62 PRO C C 13 177.470 0.2 . 1 . . . . . 344 P C . 50789 1 547 . 1 . 1 62 62 PRO CA C 13 62.889 0.2 . 1 . . . . . 344 P CA . 50789 1 548 . 1 . 1 62 62 PRO CB C 13 32.467 0.2 . 1 . . . . . 344 P CB . 50789 1 549 . 1 . 1 62 62 PRO CG C 13 27.895 0.2 . 1 . . . . . 344 P CG . 50789 1 550 . 1 . 1 62 62 PRO CD C 13 51.672 0.2 . 1 . . . . . 344 P CD . 50789 1 551 . 1 . 1 63 63 ASP H H 1 8.891 0.02 . 1 . . . . . 345 D H . 50789 1 552 . 1 . 1 63 63 ASP HA H 1 4.439 0.02 . 1 . . . . . 345 D HA . 50789 1 553 . 1 . 1 63 63 ASP HB2 H 1 2.748 0.02 . 2 . . . . . 345 D HB2 . 50789 1 554 . 1 . 1 63 63 ASP HB3 H 1 2.614 0.02 . 2 . . . . . 345 D HB3 . 50789 1 555 . 1 . 1 63 63 ASP C C 13 177.562 0.2 . 1 . . . . . 345 D C . 50789 1 556 . 1 . 1 63 63 ASP CA C 13 57.069 0.2 . 1 . . . . . 345 D CA . 50789 1 557 . 1 . 1 63 63 ASP CB C 13 41.456 0.2 . 1 . . . . . 345 D CB . 50789 1 558 . 1 . 1 63 63 ASP N N 15 124.921 0.15 . 1 . . . . . 345 D N . 50789 1 559 . 1 . 1 64 64 THR H H 1 7.240 0.02 . 1 . . . . . 346 T H . 50789 1 560 . 1 . 1 64 64 THR HA H 1 4.224 0.02 . 1 . . . . . 346 T HA . 50789 1 561 . 1 . 1 64 64 THR HB H 1 4.496 0.02 . 1 . . . . . 346 T HB . 50789 1 562 . 1 . 1 64 64 THR HG21 H 1 1.073 0.02 . 1 . . . . . 346 T HG21 . 50789 1 563 . 1 . 1 64 64 THR HG22 H 1 1.073 0.02 . 1 . . . . . 346 T HG22 . 50789 1 564 . 1 . 1 64 64 THR HG23 H 1 1.073 0.02 . 1 . . . . . 346 T HG23 . 50789 1 565 . 1 . 1 64 64 THR C C 13 173.934 0.2 . 1 . . . . . 346 T C . 50789 1 566 . 1 . 1 64 64 THR CA C 13 60.022 0.2 . 1 . . . . . 346 T CA . 50789 1 567 . 1 . 1 64 64 THR CB C 13 68.110 0.2 . 1 . . . . . 346 T CB . 50789 1 568 . 1 . 1 64 64 THR CG2 C 13 22.362 0.2 . 1 . . . . . 346 T CG2 . 50789 1 569 . 1 . 1 64 64 THR N N 15 104.073 0.15 . 1 . . . . . 346 T N . 50789 1 570 . 1 . 1 65 65 LEU H H 1 6.684 0.02 . 1 . . . . . 347 L H . 50789 1 571 . 1 . 1 65 65 LEU HA H 1 4.051 0.02 . 1 . . . . . 347 L HA . 50789 1 572 . 1 . 1 65 65 LEU HB2 H 1 1.800 0.02 . 2 . . . . . 347 L HB2 . 50789 1 573 . 1 . 1 65 65 LEU HB3 H 1 1.351 0.02 . 2 . . . . . 347 L HB3 . 50789 1 574 . 1 . 1 65 65 LEU HG H 1 1.047 0.02 . 1 . . . . . 347 L HG . 50789 1 575 . 1 . 1 65 65 LEU HD11 H 1 0.900 0.02 . 2 . . . . . 347 L HD11 . 50789 1 576 . 1 . 1 65 65 LEU HD12 H 1 0.900 0.02 . 2 . . . . . 347 L HD12 . 50789 1 577 . 1 . 1 65 65 LEU HD13 H 1 0.900 0.02 . 2 . . . . . 347 L HD13 . 50789 1 578 . 1 . 1 65 65 LEU HD21 H 1 1.047 0.02 . 2 . . . . . 347 L HD21 . 50789 1 579 . 1 . 1 65 65 LEU HD22 H 1 1.047 0.02 . 2 . . . . . 347 L HD22 . 50789 1 580 . 1 . 1 65 65 LEU HD23 H 1 1.047 0.02 . 2 . . . . . 347 L HD23 . 50789 1 581 . 1 . 1 65 65 LEU C C 13 177.726 0.2 . 1 . . . . . 347 L C . 50789 1 582 . 1 . 1 65 65 LEU CA C 13 56.313 0.2 . 1 . . . . . 347 L CA . 50789 1 583 . 1 . 1 65 65 LEU CB C 13 43.502 0.2 . 1 . . . . . 347 L CB . 50789 1 584 . 1 . 1 65 65 LEU CD1 C 13 26.900 0.2 . 2 . . . . . 347 L CD1 . 50789 1 585 . 1 . 1 65 65 LEU CD2 C 13 25.560 0.2 . 2 . . . . . 347 L CD2 . 50789 1 586 . 1 . 1 65 65 LEU N N 15 120.109 0.15 . 1 . . . . . 347 L N . 50789 1 587 . 1 . 1 66 66 GLY H H 1 10.029 0.02 . 1 . . . . . 348 G H . 50789 1 588 . 1 . 1 66 66 GLY HA2 H 1 4.499 0.02 . 2 . . . . . 348 G HA2 . 50789 1 589 . 1 . 1 66 66 GLY HA3 H 1 3.764 0.02 . 2 . . . . . 348 G HA3 . 50789 1 590 . 1 . 1 66 66 GLY C C 13 175.030 0.2 . 1 . . . . . 348 G C . 50789 1 591 . 1 . 1 66 66 GLY CA C 13 44.544 0.2 . 1 . . . . . 348 G CA . 50789 1 592 . 1 . 1 66 66 GLY N N 15 117.352 0.15 . 1 . . . . . 348 G N . 50789 1 593 . 1 . 1 67 67 LEU H H 1 8.581 0.02 . 1 . . . . . 349 L H . 50789 1 594 . 1 . 1 67 67 LEU HA H 1 4.329 0.02 . 1 . . . . . 349 L HA . 50789 1 595 . 1 . 1 67 67 LEU HB3 H 1 1.738 0.02 . 2 . . . . . 349 L HB3 . 50789 1 596 . 1 . 1 67 67 LEU HG H 1 1.880 0.02 . 1 . . . . . 349 L HG . 50789 1 597 . 1 . 1 67 67 LEU HD11 H 1 0.993 0.02 . 2 . . . . . 349 L HD11 . 50789 1 598 . 1 . 1 67 67 LEU HD12 H 1 0.993 0.02 . 2 . . . . . 349 L HD12 . 50789 1 599 . 1 . 1 67 67 LEU HD13 H 1 0.993 0.02 . 2 . . . . . 349 L HD13 . 50789 1 600 . 1 . 1 67 67 LEU HD21 H 1 1.009 0.02 . 2 . . . . . 349 L HD21 . 50789 1 601 . 1 . 1 67 67 LEU HD22 H 1 1.009 0.02 . 2 . . . . . 349 L HD22 . 50789 1 602 . 1 . 1 67 67 LEU HD23 H 1 1.009 0.02 . 2 . . . . . 349 L HD23 . 50789 1 603 . 1 . 1 67 67 LEU C C 13 177.600 0.2 . 1 . . . . . 349 L C . 50789 1 604 . 1 . 1 67 67 LEU CA C 13 56.664 0.2 . 1 . . . . . 349 L CA . 50789 1 605 . 1 . 1 67 67 LEU CB C 13 41.900 0.2 . 1 . . . . . 349 L CB . 50789 1 606 . 1 . 1 67 67 LEU CG C 13 27.068 0.2 . 1 . . . . . 349 L CG . 50789 1 607 . 1 . 1 67 67 LEU CD1 C 13 23.456 0.2 . 2 . . . . . 349 L CD1 . 50789 1 608 . 1 . 1 67 67 LEU CD2 C 13 24.923 0.2 . 2 . . . . . 349 L CD2 . 50789 1 609 . 1 . 1 67 67 LEU N N 15 121.008 0.15 . 1 . . . . . 349 L N . 50789 1 610 . 1 . 1 68 68 ASN H H 1 8.573 0.02 . 1 . . . . . 350 N H . 50789 1 611 . 1 . 1 68 68 ASN HA H 1 4.485 0.02 . 1 . . . . . 350 N HA . 50789 1 612 . 1 . 1 68 68 ASN HB2 H 1 3.315 0.02 . 2 . . . . . 350 N HB2 . 50789 1 613 . 1 . 1 68 68 ASN HB3 H 1 2.887 0.02 . 2 . . . . . 350 N HB3 . 50789 1 614 . 1 . 1 68 68 ASN C C 13 173.891 0.2 . 1 . . . . . 350 N C . 50789 1 615 . 1 . 1 68 68 ASN CA C 13 53.834 0.2 . 1 . . . . . 350 N CA . 50789 1 616 . 1 . 1 68 68 ASN CB C 13 38.541 0.2 . 1 . . . . . 350 N CB . 50789 1 617 . 1 . 1 68 68 ASN N N 15 116.881 0.15 . 1 . . . . . 350 N N . 50789 1 618 . 1 . 1 69 69 THR H H 1 7.796 0.02 . 1 . . . . . 351 T H . 50789 1 619 . 1 . 1 69 69 THR HA H 1 5.319 0.02 . 1 . . . . . 351 T HA . 50789 1 620 . 1 . 1 69 69 THR HB H 1 4.154 0.02 . 1 . . . . . 351 T HB . 50789 1 621 . 1 . 1 69 69 THR HG21 H 1 1.290 0.02 . 1 . . . . . 351 T HG21 . 50789 1 622 . 1 . 1 69 69 THR HG22 H 1 1.290 0.02 . 1 . . . . . 351 T HG22 . 50789 1 623 . 1 . 1 69 69 THR HG23 H 1 1.290 0.02 . 1 . . . . . 351 T HG23 . 50789 1 624 . 1 . 1 69 69 THR C C 13 172.319 0.2 . 1 . . . . . 351 T C . 50789 1 625 . 1 . 1 69 69 THR CA C 13 62.323 0.2 . 1 . . . . . 351 T CA . 50789 1 626 . 1 . 1 69 69 THR CB C 13 70.781 0.2 . 1 . . . . . 351 T CB . 50789 1 627 . 1 . 1 69 69 THR CG2 C 13 22.045 0.2 . 1 . . . . . 351 T CG2 . 50789 1 628 . 1 . 1 69 69 THR N N 15 118.140 0.15 . 1 . . . . . 351 T N . 50789 1 629 . 1 . 1 70 70 ARG H H 1 9.011 0.02 . 1 . . . . . 352 R H . 50789 1 630 . 1 . 1 70 70 ARG HA H 1 4.522 0.02 . 1 . . . . . 352 R HA . 50789 1 631 . 1 . 1 70 70 ARG HB2 H 1 1.250 0.02 . 2 . . . . . 352 R HB2 . 50789 1 632 . 1 . 1 70 70 ARG HB3 H 1 1.150 0.02 . 2 . . . . . 352 R HB3 . 50789 1 633 . 1 . 1 70 70 ARG HG3 H 1 0.883 0.02 . 2 . . . . . 352 R HG3 . 50789 1 634 . 1 . 1 70 70 ARG HD2 H 1 1.906 0.02 . 2 . . . . . 352 R HD2 . 50789 1 635 . 1 . 1 70 70 ARG HD3 H 1 2.627 0.02 . 2 . . . . . 352 R HD3 . 50789 1 636 . 1 . 1 70 70 ARG C C 13 173.414 0.2 . 1 . . . . . 352 R C . 50789 1 637 . 1 . 1 70 70 ARG CA C 13 54.488 0.2 . 1 . . . . . 352 R CA . 50789 1 638 . 1 . 1 70 70 ARG CB C 13 34.386 0.2 . 1 . . . . . 352 R CB . 50789 1 639 . 1 . 1 70 70 ARG CG C 13 27.406 0.2 . 1 . . . . . 352 R CG . 50789 1 640 . 1 . 1 70 70 ARG CD C 13 42.962 0.2 . 1 . . . . . 352 R CD . 50789 1 641 . 1 . 1 70 70 ARG N N 15 125.526 0.15 . 1 . . . . . 352 R N . 50789 1 642 . 1 . 1 71 71 LEU H H 1 8.052 0.02 . 1 . . . . . 353 L H . 50789 1 643 . 1 . 1 71 71 LEU HA H 1 5.258 0.02 . 1 . . . . . 353 L HA . 50789 1 644 . 1 . 1 71 71 LEU HB2 H 1 1.606 0.02 . 2 . . . . . 353 L HB2 . 50789 1 645 . 1 . 1 71 71 LEU HB3 H 1 1.212 0.02 . 2 . . . . . 353 L HB3 . 50789 1 646 . 1 . 1 71 71 LEU HG H 1 1.520 0.02 . 1 . . . . . 353 L HG . 50789 1 647 . 1 . 1 71 71 LEU HD11 H 1 0.691 0.02 . 2 . . . . . 353 L HD11 . 50789 1 648 . 1 . 1 71 71 LEU HD12 H 1 0.691 0.02 . 2 . . . . . 353 L HD12 . 50789 1 649 . 1 . 1 71 71 LEU HD13 H 1 0.691 0.02 . 2 . . . . . 353 L HD13 . 50789 1 650 . 1 . 1 71 71 LEU HD21 H 1 0.171 0.02 . 2 . . . . . 353 L HD21 . 50789 1 651 . 1 . 1 71 71 LEU HD22 H 1 0.171 0.02 . 2 . . . . . 353 L HD22 . 50789 1 652 . 1 . 1 71 71 LEU HD23 H 1 0.171 0.02 . 2 . . . . . 353 L HD23 . 50789 1 653 . 1 . 1 71 71 LEU C C 13 177.033 0.2 . 1 . . . . . 353 L C . 50789 1 654 . 1 . 1 71 71 LEU CA C 13 52.948 0.2 . 1 . . . . . 353 L CA . 50789 1 655 . 1 . 1 71 71 LEU CB C 13 42.348 0.2 . 1 . . . . . 353 L CB . 50789 1 656 . 1 . 1 71 71 LEU CG C 13 26.360 0.2 . 1 . . . . . 353 L CG . 50789 1 657 . 1 . 1 71 71 LEU CD1 C 13 25.820 0.2 . 2 . . . . . 353 L CD1 . 50789 1 658 . 1 . 1 71 71 LEU CD2 C 13 23.419 0.2 . 2 . . . . . 353 L CD2 . 50789 1 659 . 1 . 1 71 71 LEU N N 15 121.336 0.15 . 1 . . . . . 353 L N . 50789 1 660 . 1 . 1 72 72 TYR H H 1 8.787 0.02 . 1 . . . . . 354 Y H . 50789 1 661 . 1 . 1 72 72 TYR HA H 1 4.755 0.02 . 1 . . . . . 354 Y HA . 50789 1 662 . 1 . 1 72 72 TYR HB2 H 1 2.140 0.02 . 2 . . . . . 354 Y HB2 . 50789 1 663 . 1 . 1 72 72 TYR HB3 H 1 3.150 0.02 . 2 . . . . . 354 Y HB3 . 50789 1 664 . 1 . 1 72 72 TYR HD1 H 1 7.001 0.02 . 3 . . . . . 354 Y HD1 . 50789 1 665 . 1 . 1 72 72 TYR HE1 H 1 6.630 0.02 . 3 . . . . . 354 Y HE1 . 50789 1 666 . 1 . 1 72 72 TYR C C 13 175.730 0.2 . 1 . . . . . 354 Y C . 50789 1 667 . 1 . 1 72 72 TYR CA C 13 56.952 0.2 . 1 . . . . . 354 Y CA . 50789 1 668 . 1 . 1 72 72 TYR CB C 13 44.016 0.2 . 1 . . . . . 354 Y CB . 50789 1 669 . 1 . 1 72 72 TYR CD1 C 13 133.080 0.2 . 3 . . . . . 354 Y CD1 . 50789 1 670 . 1 . 1 72 72 TYR CE1 C 13 118.200 0.2 . 3 . . . . . 354 Y CE1 . 50789 1 671 . 1 . 1 72 72 TYR N N 15 120.318 0.15 . 1 . . . . . 354 Y N . 50789 1 672 . 1 . 1 73 73 LYS H H 1 9.107 0.02 . 1 . . . . . 355 K H . 50789 1 673 . 1 . 1 73 73 LYS HA H 1 4.171 0.02 . 1 . . . . . 355 K HA . 50789 1 674 . 1 . 1 73 73 LYS HB2 H 1 1.530 0.02 . 2 . . . . . 355 K HB2 . 50789 1 675 . 1 . 1 73 73 LYS HB3 H 1 1.943 0.02 . 2 . . . . . 355 K HB3 . 50789 1 676 . 1 . 1 73 73 LYS HE2 H 1 3.039 0.02 . 2 . . . . . 355 K HE2 . 50789 1 677 . 1 . 1 73 73 LYS C C 13 176.222 0.2 . 1 . . . . . 355 K C . 50789 1 678 . 1 . 1 73 73 LYS CA C 13 58.217 0.2 . 1 . . . . . 355 K CA . 50789 1 679 . 1 . 1 73 73 LYS CB C 13 32.590 0.2 . 1 . . . . . 355 K CB . 50789 1 680 . 1 . 1 73 73 LYS CD C 13 29.311 0.2 . 1 . . . . . 355 K CD . 50789 1 681 . 1 . 1 73 73 LYS CE C 13 42.246 0.2 . 1 . . . . . 355 K CE . 50789 1 682 . 1 . 1 73 73 LYS N N 15 122.156 0.15 . 1 . . . . . 355 K N . 50789 1 683 . 1 . 1 74 74 TRP H H 1 7.709 0.02 . 1 . . . . . 356 W H . 50789 1 684 . 1 . 1 74 74 TRP HA H 1 4.490 0.02 . 1 . . . . . 356 W HA . 50789 1 685 . 1 . 1 74 74 TRP HB3 H 1 3.078 0.02 . 2 . . . . . 356 W HB3 . 50789 1 686 . 1 . 1 74 74 TRP HD1 H 1 7.362 0.02 . 1 . . . . . 356 W HD1 . 50789 1 687 . 1 . 1 74 74 TRP HE1 H 1 10.240 0.02 . 1 . . . . . 356 W HE1 . 50789 1 688 . 1 . 1 74 74 TRP HZ2 H 1 7.550 0.02 . 1 . . . . . 356 W HZ2 . 50789 1 689 . 1 . 1 74 74 TRP HZ3 H 1 7.033 0.02 . 1 . . . . . 356 W HZ3 . 50789 1 690 . 1 . 1 74 74 TRP HH2 H 1 7.285 0.02 . 1 . . . . . 356 W HH2 . 50789 1 691 . 1 . 1 74 74 TRP C C 13 174.517 0.2 . 1 . . . . . 356 W C . 50789 1 692 . 1 . 1 74 74 TRP CA C 13 57.585 0.2 . 1 . . . . . 356 W CA . 50789 1 693 . 1 . 1 74 74 TRP CB C 13 31.696 0.2 . 1 . . . . . 356 W CB . 50789 1 694 . 1 . 1 74 74 TRP CD1 C 13 127.470 0.2 . 1 . . . . . 356 W CD1 . 50789 1 695 . 1 . 1 74 74 TRP CZ2 C 13 114.790 0.2 . 1 . . . . . 356 W CZ2 . 50789 1 696 . 1 . 1 74 74 TRP CZ3 C 13 121.300 0.2 . 1 . . . . . 356 W CZ3 . 50789 1 697 . 1 . 1 74 74 TRP CH2 C 13 124.550 0.2 . 1 . . . . . 356 W CH2 . 50789 1 698 . 1 . 1 74 74 TRP N N 15 117.240 0.15 . 1 . . . . . 356 W N . 50789 1 699 . 1 . 1 74 74 TRP NE1 N 15 130.470 0.15 . 1 . . . . . 356 W NE1 . 50789 1 700 . 1 . 1 75 75 ILE H H 1 7.236 0.02 . 1 . . . . . 357 I H . 50789 1 701 . 1 . 1 75 75 ILE HA H 1 4.220 0.02 . 1 . . . . . 357 I HA . 50789 1 702 . 1 . 1 75 75 ILE HB H 1 1.226 0.02 . 1 . . . . . 357 I HB . 50789 1 703 . 1 . 1 75 75 ILE HG12 H 1 1.260 0.02 . 2 . . . . . 357 I HG12 . 50789 1 704 . 1 . 1 75 75 ILE HG21 H 1 0.521 0.02 . 1 . . . . . 357 I HG21 . 50789 1 705 . 1 . 1 75 75 ILE HG22 H 1 0.521 0.02 . 1 . . . . . 357 I HG22 . 50789 1 706 . 1 . 1 75 75 ILE HG23 H 1 0.521 0.02 . 1 . . . . . 357 I HG23 . 50789 1 707 . 1 . 1 75 75 ILE HD11 H 1 0.770 0.02 . 1 . . . . . 357 I HD11 . 50789 1 708 . 1 . 1 75 75 ILE HD12 H 1 0.770 0.02 . 1 . . . . . 357 I HD12 . 50789 1 709 . 1 . 1 75 75 ILE HD13 H 1 0.770 0.02 . 1 . . . . . 357 I HD13 . 50789 1 710 . 1 . 1 75 75 ILE C C 13 171.806 0.2 . 1 . . . . . 357 I C . 50789 1 711 . 1 . 1 75 75 ILE CA C 13 57.274 0.2 . 1 . . . . . 357 I CA . 50789 1 712 . 1 . 1 75 75 ILE CB C 13 40.456 0.2 . 1 . . . . . 357 I CB . 50789 1 713 . 1 . 1 75 75 ILE CG1 C 13 24.830 0.2 . 1 . . . . . 357 I CG1 . 50789 1 714 . 1 . 1 75 75 ILE CG2 C 13 17.978 0.2 . 1 . . . . . 357 I CG2 . 50789 1 715 . 1 . 1 75 75 ILE CD1 C 13 13.647 0.2 . 1 . . . . . 357 I CD1 . 50789 1 716 . 1 . 1 75 75 ILE N N 15 115.819 0.15 . 1 . . . . . 357 I N . 50789 1 717 . 1 . 1 76 76 PRO HA H 1 4.535 0.02 . 1 . . . . . 358 P HA . 50789 1 718 . 1 . 1 76 76 PRO HB2 H 1 2.120 0.02 . 2 . . . . . 358 P HB2 . 50789 1 719 . 1 . 1 76 76 PRO C C 13 174.889 0.2 . 1 . . . . . 358 P C . 50789 1 720 . 1 . 1 76 76 PRO CA C 13 60.710 0.2 . 1 . . . . . 358 P CA . 50789 1 721 . 1 . 1 76 76 PRO CB C 13 28.282 0.2 . 1 . . . . . 358 P CB . 50789 1 722 . 1 . 1 77 77 GLN H H 1 7.501 0.02 . 1 . . . . . 359 Q H . 50789 1 723 . 1 . 1 77 77 GLN HA H 1 3.344 0.02 . 1 . . . . . 359 Q HA . 50789 1 724 . 1 . 1 77 77 GLN C C 13 176.073 0.2 . 1 . . . . . 359 Q C . 50789 1 725 . 1 . 1 77 77 GLN CA C 13 62.049 0.2 . 1 . . . . . 359 Q CA . 50789 1 726 . 1 . 1 77 77 GLN CB C 13 31.360 0.2 . 1 . . . . . 359 Q CB . 50789 1 727 . 1 . 1 77 77 GLN N N 15 125.222 0.15 . 1 . . . . . 359 Q N . 50789 1 728 . 1 . 1 78 78 ASN H H 1 8.603 0.02 . 1 . . . . . 360 N H . 50789 1 729 . 1 . 1 78 78 ASN HA H 1 4.105 0.02 . 1 . . . . . 360 N HA . 50789 1 730 . 1 . 1 78 78 ASN HB2 H 1 2.644 0.02 . 2 . . . . . 360 N HB2 . 50789 1 731 . 1 . 1 78 78 ASN HB3 H 1 2.936 0.02 . 2 . . . . . 360 N HB3 . 50789 1 732 . 1 . 1 78 78 ASN C C 13 176.260 0.2 . 1 . . . . . 360 N C . 50789 1 733 . 1 . 1 78 78 ASN CA C 13 58.271 0.2 . 1 . . . . . 360 N CA . 50789 1 734 . 1 . 1 78 78 ASN CB C 13 39.524 0.2 . 1 . . . . . 360 N CB . 50789 1 735 . 1 . 1 78 78 ASN N N 15 117.350 0.15 . 1 . . . . . 360 N N . 50789 1 736 . 1 . 1 79 79 ASP H H 1 7.472 0.02 . 1 . . . . . 361 D H . 50789 1 737 . 1 . 1 79 79 ASP HA H 1 4.351 0.02 . 1 . . . . . 361 D HA . 50789 1 738 . 1 . 1 79 79 ASP HB2 H 1 2.967 0.02 . 2 . . . . . 361 D HB2 . 50789 1 739 . 1 . 1 79 79 ASP HB3 H 1 2.456 0.02 . 2 . . . . . 361 D HB3 . 50789 1 740 . 1 . 1 79 79 ASP C C 13 178.800 0.2 . 1 . . . . . 361 D C . 50789 1 741 . 1 . 1 79 79 ASP CA C 13 56.879 0.2 . 1 . . . . . 361 D CA . 50789 1 742 . 1 . 1 79 79 ASP CB C 13 40.704 0.2 . 1 . . . . . 361 D CB . 50789 1 743 . 1 . 1 79 79 ASP N N 15 116.584 0.15 . 1 . . . . . 361 D N . 50789 1 744 . 1 . 1 80 80 LEU H H 1 7.992 0.02 . 1 . . . . . 362 L H . 50789 1 745 . 1 . 1 80 80 LEU HA H 1 4.018 0.02 . 1 . . . . . 362 L HA . 50789 1 746 . 1 . 1 80 80 LEU HB2 H 1 1.742 0.02 . 2 . . . . . 362 L HB2 . 50789 1 747 . 1 . 1 80 80 LEU HB3 H 1 1.210 0.02 . 2 . . . . . 362 L HB3 . 50789 1 748 . 1 . 1 80 80 LEU HD11 H 1 0.750 0.02 . 2 . . . . . 362 L HD11 . 50789 1 749 . 1 . 1 80 80 LEU HD12 H 1 0.750 0.02 . 2 . . . . . 362 L HD12 . 50789 1 750 . 1 . 1 80 80 LEU HD13 H 1 0.750 0.02 . 2 . . . . . 362 L HD13 . 50789 1 751 . 1 . 1 80 80 LEU HD21 H 1 0.739 0.02 . 2 . . . . . 362 L HD21 . 50789 1 752 . 1 . 1 80 80 LEU HD22 H 1 0.739 0.02 . 2 . . . . . 362 L HD22 . 50789 1 753 . 1 . 1 80 80 LEU HD23 H 1 0.739 0.02 . 2 . . . . . 362 L HD23 . 50789 1 754 . 1 . 1 80 80 LEU C C 13 179.877 0.2 . 1 . . . . . 362 L C . 50789 1 755 . 1 . 1 80 80 LEU CA C 13 57.087 0.2 . 1 . . . . . 362 L CA . 50789 1 756 . 1 . 1 80 80 LEU CB C 13 42.870 0.2 . 1 . . . . . 362 L CB . 50789 1 757 . 1 . 1 80 80 LEU CG C 13 27.350 0.2 . 1 . . . . . 362 L CG . 50789 1 758 . 1 . 1 80 80 LEU CD1 C 13 26.740 0.2 . 2 . . . . . 362 L CD1 . 50789 1 759 . 1 . 1 80 80 LEU CD2 C 13 25.300 0.2 . 2 . . . . . 362 L CD2 . 50789 1 760 . 1 . 1 80 80 LEU N N 15 119.118 0.15 . 1 . . . . . 362 L N . 50789 1 761 . 1 . 1 81 81 LEU H H 1 8.460 0.02 . 1 . . . . . 363 L H . 50789 1 762 . 1 . 1 81 81 LEU HA H 1 3.831 0.02 . 1 . . . . . 363 L HA . 50789 1 763 . 1 . 1 81 81 LEU HB2 H 1 1.411 0.02 . 2 . . . . . 363 L HB2 . 50789 1 764 . 1 . 1 81 81 LEU HB3 H 1 1.700 0.02 . 2 . . . . . 363 L HB3 . 50789 1 765 . 1 . 1 81 81 LEU HG H 1 1.430 0.02 . 1 . . . . . 363 L HG . 50789 1 766 . 1 . 1 81 81 LEU HD11 H 1 0.262 0.02 . 2 . . . . . 363 L HD11 . 50789 1 767 . 1 . 1 81 81 LEU HD12 H 1 0.262 0.02 . 2 . . . . . 363 L HD12 . 50789 1 768 . 1 . 1 81 81 LEU HD13 H 1 0.262 0.02 . 2 . . . . . 363 L HD13 . 50789 1 769 . 1 . 1 81 81 LEU HD21 H 1 0.159 0.02 . 2 . . . . . 363 L HD21 . 50789 1 770 . 1 . 1 81 81 LEU HD22 H 1 0.159 0.02 . 2 . . . . . 363 L HD22 . 50789 1 771 . 1 . 1 81 81 LEU HD23 H 1 0.159 0.02 . 2 . . . . . 363 L HD23 . 50789 1 772 . 1 . 1 81 81 LEU C C 13 175.978 0.2 . 1 . . . . . 363 L C . 50789 1 773 . 1 . 1 81 81 LEU CA C 13 58.016 0.2 . 1 . . . . . 363 L CA . 50789 1 774 . 1 . 1 81 81 LEU CB C 13 41.053 0.2 . 1 . . . . . 363 L CB . 50789 1 775 . 1 . 1 81 81 LEU CG C 13 26.560 0.2 . 1 . . . . . 363 L CG . 50789 1 776 . 1 . 1 81 81 LEU CD1 C 13 26.330 0.2 . 2 . . . . . 363 L CD1 . 50789 1 777 . 1 . 1 81 81 LEU CD2 C 13 21.939 0.2 . 2 . . . . . 363 L CD2 . 50789 1 778 . 1 . 1 81 81 LEU N N 15 121.909 0.15 . 1 . . . . . 363 L N . 50789 1 779 . 1 . 1 82 82 GLY H H 1 7.024 0.02 . 1 . . . . . 364 G H . 50789 1 780 . 1 . 1 82 82 GLY HA2 H 1 2.692 0.02 . 2 . . . . . 364 G HA2 . 50789 1 781 . 1 . 1 82 82 GLY HA3 H 1 3.689 0.02 . 2 . . . . . 364 G HA3 . 50789 1 782 . 1 . 1 82 82 GLY C C 13 172.975 0.2 . 1 . . . . . 364 G C . 50789 1 783 . 1 . 1 82 82 GLY CA C 13 45.155 0.2 . 1 . . . . . 364 G CA . 50789 1 784 . 1 . 1 82 82 GLY N N 15 100.519 0.15 . 1 . . . . . 364 G N . 50789 1 785 . 1 . 1 83 83 HIS H H 1 7.493 0.02 . 1 . . . . . 365 H H . 50789 1 786 . 1 . 1 83 83 HIS HA H 1 4.390 0.02 . 1 . . . . . 365 H HA . 50789 1 787 . 1 . 1 83 83 HIS HB2 H 1 3.390 0.02 . 2 . . . . . 365 H HB2 . 50789 1 788 . 1 . 1 83 83 HIS HB3 H 1 3.050 0.02 . 2 . . . . . 365 H HB3 . 50789 1 789 . 1 . 1 83 83 HIS HD2 H 1 7.060 0.02 . 1 . . . . . 365 H HD2 . 50789 1 790 . 1 . 1 83 83 HIS HE1 H 1 7.447 0.02 . 1 . . . . . 365 H HE1 . 50789 1 791 . 1 . 1 83 83 HIS C C 13 176.094 0.2 . 1 . . . . . 365 H C . 50789 1 792 . 1 . 1 83 83 HIS CA C 13 56.494 0.2 . 1 . . . . . 365 H CA . 50789 1 793 . 1 . 1 83 83 HIS CB C 13 31.909 0.2 . 1 . . . . . 365 H CB . 50789 1 794 . 1 . 1 83 83 HIS CD2 C 13 118.000 0.2 . 1 . . . . . 365 H CD2 . 50789 1 795 . 1 . 1 83 83 HIS CE1 C 13 137.730 0.2 . 1 . . . . . 365 H CE1 . 50789 1 796 . 1 . 1 83 83 HIS N N 15 125.996 0.15 . 1 . . . . . 365 H N . 50789 1 797 . 1 . 1 84 84 PRO HA H 1 4.433 0.02 . 1 . . . . . 366 P HA . 50789 1 798 . 1 . 1 84 84 PRO HB2 H 1 1.952 0.02 . 2 . . . . . 366 P HB2 . 50789 1 799 . 1 . 1 84 84 PRO HB3 H 1 2.387 0.02 . 2 . . . . . 366 P HB3 . 50789 1 800 . 1 . 1 84 84 PRO HD2 H 1 3.500 0.02 . 2 . . . . . 366 P HD2 . 50789 1 801 . 1 . 1 84 84 PRO C C 13 178.734 0.2 . 1 . . . . . 366 P C . 50789 1 802 . 1 . 1 84 84 PRO CA C 13 64.876 0.2 . 1 . . . . . 366 P CA . 50789 1 803 . 1 . 1 84 84 PRO CB C 13 32.444 0.2 . 1 . . . . . 366 P CB . 50789 1 804 . 1 . 1 84 84 PRO CG C 13 27.253 0.2 . 1 . . . . . 366 P CG . 50789 1 805 . 1 . 1 84 84 PRO CD C 13 50.883 0.2 . 1 . . . . . 366 P CD . 50789 1 806 . 1 . 1 85 85 LYS H H 1 10.954 0.02 . 1 . . . . . 367 K H . 50789 1 807 . 1 . 1 85 85 LYS HA H 1 4.401 0.02 . 1 . . . . . 367 K HA . 50789 1 808 . 1 . 1 85 85 LYS HB3 H 1 1.863 0.02 . 2 . . . . . 367 K HB3 . 50789 1 809 . 1 . 1 85 85 LYS C C 13 177.012 0.2 . 1 . . . . . 367 K C . 50789 1 810 . 1 . 1 85 85 LYS CA C 13 56.602 0.2 . 1 . . . . . 367 K CA . 50789 1 811 . 1 . 1 85 85 LYS CB C 13 32.721 0.2 . 1 . . . . . 367 K CB . 50789 1 812 . 1 . 1 85 85 LYS CG C 13 25.974 0.2 . 1 . . . . . 367 K CG . 50789 1 813 . 1 . 1 85 85 LYS CD C 13 29.085 0.2 . 1 . . . . . 367 K CD . 50789 1 814 . 1 . 1 85 85 LYS CE C 13 42.662 0.2 . 1 . . . . . 367 K CE . 50789 1 815 . 1 . 1 85 85 LYS N N 15 118.870 0.15 . 1 . . . . . 367 K N . 50789 1 816 . 1 . 1 86 86 THR H H 1 8.122 0.02 . 1 . . . . . 368 T H . 50789 1 817 . 1 . 1 86 86 THR HA H 1 4.077 0.02 . 1 . . . . . 368 T HA . 50789 1 818 . 1 . 1 86 86 THR HB H 1 4.224 0.02 . 1 . . . . . 368 T HB . 50789 1 819 . 1 . 1 86 86 THR HG21 H 1 1.116 0.02 . 1 . . . . . 368 T HG21 . 50789 1 820 . 1 . 1 86 86 THR HG22 H 1 1.116 0.02 . 1 . . . . . 368 T HG22 . 50789 1 821 . 1 . 1 86 86 THR HG23 H 1 1.116 0.02 . 1 . . . . . 368 T HG23 . 50789 1 822 . 1 . 1 86 86 THR C C 13 175.486 0.2 . 1 . . . . . 368 T C . 50789 1 823 . 1 . 1 86 86 THR CA C 13 65.353 0.2 . 1 . . . . . 368 T CA . 50789 1 824 . 1 . 1 86 86 THR CB C 13 67.134 0.2 . 1 . . . . . 368 T CB . 50789 1 825 . 1 . 1 86 86 THR CG2 C 13 25.035 0.2 . 1 . . . . . 368 T CG2 . 50789 1 826 . 1 . 1 86 86 THR N N 15 120.893 0.15 . 1 . . . . . 368 T N . 50789 1 827 . 1 . 1 87 87 ARG H H 1 9.898 0.02 . 1 . . . . . 369 R H . 50789 1 828 . 1 . 1 87 87 ARG HA H 1 4.563 0.02 . 1 . . . . . 369 R HA . 50789 1 829 . 1 . 1 87 87 ARG HB2 H 1 1.613 0.02 . 2 . . . . . 369 R HB2 . 50789 1 830 . 1 . 1 87 87 ARG HB3 H 1 1.986 0.02 . 2 . . . . . 369 R HB3 . 50789 1 831 . 1 . 1 87 87 ARG HD2 H 1 3.335 0.02 . 2 . . . . . 369 R HD2 . 50789 1 832 . 1 . 1 87 87 ARG HD3 H 1 3.209 0.02 . 2 . . . . . 369 R HD3 . 50789 1 833 . 1 . 1 87 87 ARG C C 13 175.890 0.2 . 1 . . . . . 369 R C . 50789 1 834 . 1 . 1 87 87 ARG CA C 13 54.547 0.2 . 1 . . . . . 369 R CA . 50789 1 835 . 1 . 1 87 87 ARG CB C 13 32.512 0.2 . 1 . . . . . 369 R CB . 50789 1 836 . 1 . 1 87 87 ARG CG C 13 26.600 0.2 . 1 . . . . . 369 R CG . 50789 1 837 . 1 . 1 87 87 ARG CD C 13 41.822 0.2 . 1 . . . . . 369 R CD . 50789 1 838 . 1 . 1 87 87 ARG N N 15 124.498 0.15 . 1 . . . . . 369 R N . 50789 1 839 . 1 . 1 88 88 ALA H H 1 7.290 0.02 . 1 . . . . . 370 A H . 50789 1 840 . 1 . 1 88 88 ALA HA H 1 4.737 0.02 . 1 . . . . . 370 A HA . 50789 1 841 . 1 . 1 88 88 ALA HB1 H 1 1.130 0.02 . 1 . . . . . 370 A HB1 . 50789 1 842 . 1 . 1 88 88 ALA HB2 H 1 1.130 0.02 . 1 . . . . . 370 A HB2 . 50789 1 843 . 1 . 1 88 88 ALA HB3 H 1 1.130 0.02 . 1 . . . . . 370 A HB3 . 50789 1 844 . 1 . 1 88 88 ALA C C 13 173.845 0.2 . 1 . . . . . 370 A C . 50789 1 845 . 1 . 1 88 88 ALA CA C 13 51.769 0.2 . 1 . . . . . 370 A CA . 50789 1 846 . 1 . 1 88 88 ALA CB C 13 22.054 0.2 . 1 . . . . . 370 A CB . 50789 1 847 . 1 . 1 88 88 ALA N N 15 113.361 0.15 . 1 . . . . . 370 A N . 50789 1 848 . 1 . 1 89 89 PHE H H 1 8.175 0.02 . 1 . . . . . 371 F H . 50789 1 849 . 1 . 1 89 89 PHE HA H 1 5.855 0.02 . 1 . . . . . 371 F HA . 50789 1 850 . 1 . 1 89 89 PHE HB3 H 1 2.803 0.02 . 2 . . . . . 371 F HB3 . 50789 1 851 . 1 . 1 89 89 PHE C C 13 173.260 0.2 . 1 . . . . . 371 F C . 50789 1 852 . 1 . 1 89 89 PHE CA C 13 52.113 0.2 . 1 . . . . . 371 F CA . 50789 1 853 . 1 . 1 89 89 PHE CB C 13 42.271 0.2 . 1 . . . . . 371 F CB . 50789 1 854 . 1 . 1 89 89 PHE N N 15 121.448 0.15 . 1 . . . . . 371 F N . 50789 1 855 . 1 . 1 90 90 ILE H H 1 9.342 0.02 . 1 . . . . . 372 I H . 50789 1 856 . 1 . 1 90 90 ILE HA H 1 4.790 0.02 . 1 . . . . . 372 I HA . 50789 1 857 . 1 . 1 90 90 ILE HB H 1 1.299 0.02 . 1 . . . . . 372 I HB . 50789 1 858 . 1 . 1 90 90 ILE HG12 H 1 1.182 0.02 . 2 . . . . . 372 I HG12 . 50789 1 859 . 1 . 1 90 90 ILE HG13 H 1 0.619 0.02 . 2 . . . . . 372 I HG13 . 50789 1 860 . 1 . 1 90 90 ILE HG21 H 1 0.117 0.02 . 1 . . . . . 372 I HG21 . 50789 1 861 . 1 . 1 90 90 ILE HG22 H 1 0.117 0.02 . 1 . . . . . 372 I HG22 . 50789 1 862 . 1 . 1 90 90 ILE HG23 H 1 0.117 0.02 . 1 . . . . . 372 I HG23 . 50789 1 863 . 1 . 1 90 90 ILE HD11 H 1 0.411 0.02 . 1 . . . . . 372 I HD11 . 50789 1 864 . 1 . 1 90 90 ILE HD12 H 1 0.411 0.02 . 1 . . . . . 372 I HD12 . 50789 1 865 . 1 . 1 90 90 ILE HD13 H 1 0.411 0.02 . 1 . . . . . 372 I HD13 . 50789 1 866 . 1 . 1 90 90 ILE C C 13 172.581 0.2 . 1 . . . . . 372 I C . 50789 1 867 . 1 . 1 90 90 ILE CA C 13 60.161 0.2 . 1 . . . . . 372 I CA . 50789 1 868 . 1 . 1 90 90 ILE CB C 13 36.787 0.2 . 1 . . . . . 372 I CB . 50789 1 869 . 1 . 1 90 90 ILE CG1 C 13 27.370 0.2 . 1 . . . . . 372 I CG1 . 50789 1 870 . 1 . 1 90 90 ILE CG2 C 13 19.328 0.2 . 1 . . . . . 372 I CG2 . 50789 1 871 . 1 . 1 90 90 ILE CD1 C 13 15.279 0.2 . 1 . . . . . 372 I CD1 . 50789 1 872 . 1 . 1 90 90 ILE N N 15 129.188 0.15 . 1 . . . . . 372 I N . 50789 1 873 . 1 . 1 91 91 THR H H 1 8.054 0.02 . 1 . . . . . 373 T H . 50789 1 874 . 1 . 1 91 91 THR HA H 1 5.137 0.02 . 1 . . . . . 373 T HA . 50789 1 875 . 1 . 1 91 91 THR HB H 1 2.044 0.02 . 1 . . . . . 373 T HB . 50789 1 876 . 1 . 1 91 91 THR HG21 H 1 0.471 0.02 . 1 . . . . . 373 T HG21 . 50789 1 877 . 1 . 1 91 91 THR HG22 H 1 0.471 0.02 . 1 . . . . . 373 T HG22 . 50789 1 878 . 1 . 1 91 91 THR HG23 H 1 0.471 0.02 . 1 . . . . . 373 T HG23 . 50789 1 879 . 1 . 1 91 91 THR C C 13 172.246 0.2 . 1 . . . . . 373 T C . 50789 1 880 . 1 . 1 91 91 THR CA C 13 57.076 0.2 . 1 . . . . . 373 T CA . 50789 1 881 . 1 . 1 91 91 THR CB C 13 69.127 0.2 . 1 . . . . . 373 T CB . 50789 1 882 . 1 . 1 91 91 THR CG2 C 13 17.167 0.2 . 1 . . . . . 373 T CG2 . 50789 1 883 . 1 . 1 91 91 THR N N 15 118.441 0.15 . 1 . . . . . 373 T N . 50789 1 884 . 1 . 1 93 93 GLY H H 1 8.500 0.02 . 1 . . . . . 375 G H . 50789 1 885 . 1 . 1 93 93 GLY HA2 H 1 3.990 0.02 . 2 . . . . . 375 G HA2 . 50789 1 886 . 1 . 1 93 93 GLY HA3 H 1 3.134 0.02 . 2 . . . . . 375 G HA3 . 50789 1 887 . 1 . 1 93 93 GLY CA C 13 45.500 0.2 . 1 . . . . . 375 G CA . 50789 1 888 . 1 . 1 93 93 GLY N N 15 104.260 0.15 . 1 . . . . . 375 G N . 50789 1 889 . 1 . 1 96 96 ASN C C 13 177.169 0.2 . 1 . . . . . 378 N C . 50789 1 890 . 1 . 1 96 96 ASN CA C 13 56.562 0.2 . 1 . . . . . 378 N CA . 50789 1 891 . 1 . 1 96 96 ASN CB C 13 38.080 0.2 . 1 . . . . . 378 N CB . 50789 1 892 . 1 . 1 96 96 ASN HA H 1 4.589 0.02 . 1 . . . . . 378 H HA . 50789 1 893 . 1 . 1 96 96 ASN HB2 H 1 2.930 0.02 . 1 . . . . . 378 H HB2 . 50789 1 894 . 1 . 1 96 96 ASN HB3 H 1 2.930 0.02 . 1 . . . . . 378 H HB3 . 50789 1 895 . 1 . 1 97 97 GLY H H 1 8.006 0.02 . 1 . . . . . 379 G H . 50789 1 896 . 1 . 1 97 97 GLY HA2 H 1 4.110 0.02 . 2 . . . . . 379 G HA2 . 50789 1 897 . 1 . 1 97 97 GLY HA3 H 1 4.013 0.02 . 2 . . . . . 379 G HA3 . 50789 1 898 . 1 . 1 97 97 GLY C C 13 175.459 0.2 . 1 . . . . . 379 G C . 50789 1 899 . 1 . 1 97 97 GLY CA C 13 47.366 0.2 . 1 . . . . . 379 G CA . 50789 1 900 . 1 . 1 97 97 GLY N N 15 108.419 0.15 . 1 . . . . . 379 G N . 50789 1 901 . 1 . 1 98 98 ILE H H 1 7.825 0.02 . 1 . . . . . 380 I H . 50789 1 902 . 1 . 1 98 98 ILE HA H 1 3.961 0.02 . 1 . . . . . 380 I HA . 50789 1 903 . 1 . 1 98 98 ILE HB H 1 1.866 0.02 . 1 . . . . . 380 I HB . 50789 1 904 . 1 . 1 98 98 ILE HG12 H 1 1.447 0.02 . 2 . . . . . 380 I HG12 . 50789 1 905 . 1 . 1 98 98 ILE HG13 H 1 1.234 0.02 . 2 . . . . . 380 I HG13 . 50789 1 906 . 1 . 1 98 98 ILE HG21 H 1 0.919 0.02 . 1 . . . . . 380 I HG21 . 50789 1 907 . 1 . 1 98 98 ILE HG22 H 1 0.919 0.02 . 1 . . . . . 380 I HG22 . 50789 1 908 . 1 . 1 98 98 ILE HG23 H 1 0.919 0.02 . 1 . . . . . 380 I HG23 . 50789 1 909 . 1 . 1 98 98 ILE HD11 H 1 0.692 0.02 . 1 . . . . . 380 I HD11 . 50789 1 910 . 1 . 1 98 98 ILE HD12 H 1 0.692 0.02 . 1 . . . . . 380 I HD12 . 50789 1 911 . 1 . 1 98 98 ILE HD13 H 1 0.692 0.02 . 1 . . . . . 380 I HD13 . 50789 1 912 . 1 . 1 98 98 ILE CA C 13 64.675 0.2 . 1 . . . . . 380 I CA . 50789 1 913 . 1 . 1 98 98 ILE CB C 13 37.101 0.2 . 1 . . . . . 380 I CB . 50789 1 914 . 1 . 1 98 98 ILE CG1 C 13 28.490 0.2 . 1 . . . . . 380 I CG1 . 50789 1 915 . 1 . 1 98 98 ILE CG2 C 13 17.900 0.2 . 1 . . . . . 380 I CG2 . 50789 1 916 . 1 . 1 98 98 ILE CD1 C 13 13.541 0.2 . 1 . . . . . 380 I CD1 . 50789 1 917 . 1 . 1 98 98 ILE N N 15 117.750 0.15 . 1 . . . . . 380 I N . 50789 1 918 . 1 . 1 99 99 TYR H H 1 8.001 0.02 . 1 . . . . . 381 Y H . 50789 1 919 . 1 . 1 99 99 TYR C C 13 178.835 0.2 . 1 . . . . . 381 Y C . 50789 1 920 . 1 . 1 99 99 TYR CA C 13 62.005 0.2 . 1 . . . . . 381 Y CA . 50789 1 921 . 1 . 1 99 99 TYR CB C 13 37.581 0.2 . 1 . . . . . 381 Y CB . 50789 1 922 . 1 . 1 99 99 TYR N N 15 118.560 0.15 . 1 . . . . . 381 Y N . 50789 1 923 . 1 . 1 100 100 GLU H H 1 8.051 0.02 . 1 . . . . . 382 E H . 50789 1 924 . 1 . 1 100 100 GLU HA H 1 3.910 0.02 . 1 . . . . . 382 E HA . 50789 1 925 . 1 . 1 100 100 GLU C C 13 178.065 0.2 . 1 . . . . . 382 E C . 50789 1 926 . 1 . 1 100 100 GLU CA C 13 59.721 0.2 . 1 . . . . . 382 E CA . 50789 1 927 . 1 . 1 100 100 GLU CB C 13 30.252 0.2 . 1 . . . . . 382 E CB . 50789 1 928 . 1 . 1 100 100 GLU CG C 13 37.130 0.2 . 1 . . . . . 382 E CG . 50789 1 929 . 1 . 1 100 100 GLU N N 15 119.539 0.15 . 1 . . . . . 382 E N . 50789 1 930 . 1 . 1 101 101 ALA H H 1 8.499 0.02 . 1 . . . . . 383 A H . 50789 1 931 . 1 . 1 101 101 ALA HA H 1 3.960 0.02 . 1 . . . . . 383 A HA . 50789 1 932 . 1 . 1 101 101 ALA HB1 H 1 1.932 0.02 . 1 . . . . . 383 A HB1 . 50789 1 933 . 1 . 1 101 101 ALA HB2 H 1 1.932 0.02 . 1 . . . . . 383 A HB2 . 50789 1 934 . 1 . 1 101 101 ALA HB3 H 1 1.932 0.02 . 1 . . . . . 383 A HB3 . 50789 1 935 . 1 . 1 101 101 ALA C C 13 180.518 0.2 . 1 . . . . . 383 A C . 50789 1 936 . 1 . 1 101 101 ALA CA C 13 56.480 0.2 . 1 . . . . . 383 A CA . 50789 1 937 . 1 . 1 101 101 ALA CB C 13 18.383 0.2 . 1 . . . . . 383 A CB . 50789 1 938 . 1 . 1 101 101 ALA N N 15 122.453 0.15 . 1 . . . . . 383 A N . 50789 1 939 . 1 . 1 102 102 ILE H H 1 8.660 0.02 . 1 . . . . . 384 I H . 50789 1 940 . 1 . 1 102 102 ILE HA H 1 3.526 0.02 . 1 . . . . . 384 I HA . 50789 1 941 . 1 . 1 102 102 ILE HB H 1 1.830 0.02 . 1 . . . . . 384 I HB . 50789 1 942 . 1 . 1 102 102 ILE HG12 H 1 1.889 0.02 . 2 . . . . . 384 I HG12 . 50789 1 943 . 1 . 1 102 102 ILE HG13 H 1 0.870 0.02 . 2 . . . . . 384 I HG13 . 50789 1 944 . 1 . 1 102 102 ILE HG21 H 1 0.730 0.02 . 1 . . . . . 384 I HG21 . 50789 1 945 . 1 . 1 102 102 ILE HG22 H 1 0.730 0.02 . 1 . . . . . 384 I HG22 . 50789 1 946 . 1 . 1 102 102 ILE HG23 H 1 0.730 0.02 . 1 . . . . . 384 I HG23 . 50789 1 947 . 1 . 1 102 102 ILE HD11 H 1 0.851 0.02 . 1 . . . . . 384 I HD11 . 50789 1 948 . 1 . 1 102 102 ILE HD12 H 1 0.851 0.02 . 1 . . . . . 384 I HD12 . 50789 1 949 . 1 . 1 102 102 ILE HD13 H 1 0.851 0.02 . 1 . . . . . 384 I HD13 . 50789 1 950 . 1 . 1 102 102 ILE CA C 13 65.465 0.2 . 1 . . . . . 384 I CA . 50789 1 951 . 1 . 1 102 102 ILE CB C 13 37.880 0.2 . 1 . . . . . 384 I CB . 50789 1 952 . 1 . 1 102 102 ILE CG1 C 13 29.370 0.2 . 1 . . . . . 384 I CG1 . 50789 1 953 . 1 . 1 102 102 ILE CG2 C 13 17.738 0.2 . 1 . . . . . 384 I CG2 . 50789 1 954 . 1 . 1 102 102 ILE CD1 C 13 14.372 0.2 . 1 . . . . . 384 I CD1 . 50789 1 955 . 1 . 1 102 102 ILE N N 15 117.903 0.15 . 1 . . . . . 384 I N . 50789 1 956 . 1 . 1 103 103 TYR H H 1 8.401 0.02 . 1 . . . . . 385 Y H . 50789 1 957 . 1 . 1 103 103 TYR C C 13 178.316 0.2 . 1 . . . . . 385 Y C . 50789 1 958 . 1 . 1 103 103 TYR CA C 13 61.997 0.2 . 1 . . . . . 385 Y CA . 50789 1 959 . 1 . 1 103 103 TYR CB C 13 38.121 0.2 . 1 . . . . . 385 Y CB . 50789 1 960 . 1 . 1 103 103 TYR N N 15 121.733 0.15 . 1 . . . . . 385 Y N . 50789 1 961 . 1 . 1 104 104 HIS H H 1 7.797 0.02 . 1 . . . . . 386 H H . 50789 1 962 . 1 . 1 104 104 HIS HA H 1 4.551 0.02 . 1 . . . . . 386 H HA . 50789 1 963 . 1 . 1 104 104 HIS HB2 H 1 2.673 0.02 . 2 . . . . . 386 H HB2 . 50789 1 964 . 1 . 1 104 104 HIS HB3 H 1 3.248 0.02 . 2 . . . . . 386 H HB3 . 50789 1 965 . 1 . 1 104 104 HIS C C 13 175.198 0.2 . 1 . . . . . 386 H C . 50789 1 966 . 1 . 1 104 104 HIS CA C 13 57.089 0.2 . 1 . . . . . 386 H CA . 50789 1 967 . 1 . 1 104 104 HIS CB C 13 32.648 0.2 . 1 . . . . . 386 H CB . 50789 1 968 . 1 . 1 104 104 HIS N N 15 114.139 0.15 . 1 . . . . . 386 H N . 50789 1 969 . 1 . 1 105 105 GLY H H 1 8.106 0.02 . 1 . . . . . 387 G H . 50789 1 970 . 1 . 1 105 105 GLY HA2 H 1 3.492 0.02 . 2 . . . . . 387 G HA2 . 50789 1 971 . 1 . 1 105 105 GLY HA3 H 1 4.221 0.02 . 2 . . . . . 387 G HA3 . 50789 1 972 . 1 . 1 105 105 GLY C C 13 173.069 0.2 . 1 . . . . . 387 G C . 50789 1 973 . 1 . 1 105 105 GLY CA C 13 47.905 0.2 . 1 . . . . . 387 G CA . 50789 1 974 . 1 . 1 105 105 GLY N N 15 112.168 0.15 . 1 . . . . . 387 G N . 50789 1 975 . 1 . 1 106 106 ILE H H 1 8.800 0.02 . 1 . . . . . 388 I H . 50789 1 976 . 1 . 1 106 106 ILE HA H 1 4.690 0.02 . 1 . . . . . 388 I HA . 50789 1 977 . 1 . 1 106 106 ILE HB H 1 2.100 0.02 . 1 . . . . . 388 I HB . 50789 1 978 . 1 . 1 106 106 ILE HG12 H 1 1.370 0.02 . 2 . . . . . 388 I HG12 . 50789 1 979 . 1 . 1 106 106 ILE HG13 H 1 1.550 0.02 . 2 . . . . . 388 I HG13 . 50789 1 980 . 1 . 1 106 106 ILE HG21 H 1 0.875 0.02 . 1 . . . . . 388 I HG21 . 50789 1 981 . 1 . 1 106 106 ILE HG22 H 1 0.875 0.02 . 1 . . . . . 388 I HG22 . 50789 1 982 . 1 . 1 106 106 ILE HG23 H 1 0.875 0.02 . 1 . . . . . 388 I HG23 . 50789 1 983 . 1 . 1 106 106 ILE HD11 H 1 0.699 0.02 . 1 . . . . . 388 I HD11 . 50789 1 984 . 1 . 1 106 106 ILE HD12 H 1 0.699 0.02 . 1 . . . . . 388 I HD12 . 50789 1 985 . 1 . 1 106 106 ILE HD13 H 1 0.699 0.02 . 1 . . . . . 388 I HD13 . 50789 1 986 . 1 . 1 106 106 ILE C C 13 172.737 0.2 . 1 . . . . . 388 I C . 50789 1 987 . 1 . 1 106 106 ILE CA C 13 54.701 0.2 . 1 . . . . . 388 I CA . 50789 1 988 . 1 . 1 106 106 ILE CB C 13 38.035 0.2 . 1 . . . . . 388 I CB . 50789 1 989 . 1 . 1 106 106 ILE CG1 C 13 27.140 0.2 . 1 . . . . . 388 I CG1 . 50789 1 990 . 1 . 1 106 106 ILE CG2 C 13 17.390 0.2 . 1 . . . . . 388 I CG2 . 50789 1 991 . 1 . 1 106 106 ILE CD1 C 13 8.825 0.2 . 1 . . . . . 388 I CD1 . 50789 1 992 . 1 . 1 106 106 ILE N N 15 123.249 0.15 . 1 . . . . . 388 I N . 50789 1 993 . 1 . 1 107 107 PRO C C 13 175.754 0.2 . 1 . . . . . 389 P C . 50789 1 994 . 1 . 1 107 107 PRO CA C 13 62.886 0.2 . 1 . . . . . 389 P CA . 50789 1 995 . 1 . 1 107 107 PRO CB C 13 33.618 0.2 . 1 . . . . . 389 P CB . 50789 1 996 . 1 . 1 108 108 MET H H 1 7.520 0.02 . 1 . . . . . 390 M H . 50789 1 997 . 1 . 1 108 108 MET HA H 1 5.676 0.02 . 1 . . . . . 390 M HA . 50789 1 998 . 1 . 1 108 108 MET HB3 H 1 1.686 0.02 . 2 . . . . . 390 M HB3 . 50789 1 999 . 1 . 1 108 108 MET C C 13 175.658 0.2 . 1 . . . . . 390 M C . 50789 1 1000 . 1 . 1 108 108 MET CA C 13 54.595 0.2 . 1 . . . . . 390 M CA . 50789 1 1001 . 1 . 1 108 108 MET N N 15 114.836 0.15 . 1 . . . . . 390 M N . 50789 1 1002 . 1 . 1 109 109 VAL H H 1 8.411 0.02 . 1 . . . . . 391 V H . 50789 1 1003 . 1 . 1 109 109 VAL HA H 1 4.252 0.02 . 1 . . . . . 391 V HA . 50789 1 1004 . 1 . 1 109 109 VAL HB H 1 1.783 0.02 . 1 . . . . . 391 V HB . 50789 1 1005 . 1 . 1 109 109 VAL HG11 H 1 0.582 0.02 . 2 . . . . . 391 V HG11 . 50789 1 1006 . 1 . 1 109 109 VAL HG12 H 1 0.582 0.02 . 2 . . . . . 391 V HG12 . 50789 1 1007 . 1 . 1 109 109 VAL HG13 H 1 0.582 0.02 . 2 . . . . . 391 V HG13 . 50789 1 1008 . 1 . 1 109 109 VAL HG21 H 1 0.527 0.02 . 2 . . . . . 391 V HG21 . 50789 1 1009 . 1 . 1 109 109 VAL HG22 H 1 0.527 0.02 . 2 . . . . . 391 V HG22 . 50789 1 1010 . 1 . 1 109 109 VAL HG23 H 1 0.527 0.02 . 2 . . . . . 391 V HG23 . 50789 1 1011 . 1 . 1 109 109 VAL C C 13 174.867 0.2 . 1 . . . . . 391 V C . 50789 1 1012 . 1 . 1 109 109 VAL CA C 13 61.382 0.2 . 1 . . . . . 391 V CA . 50789 1 1013 . 1 . 1 109 109 VAL CB C 13 32.692 0.2 . 1 . . . . . 391 V CB . 50789 1 1014 . 1 . 1 109 109 VAL CG1 C 13 21.357 0.2 . 2 . . . . . 391 V CG1 . 50789 1 1015 . 1 . 1 109 109 VAL CG2 C 13 20.897 0.2 . 2 . . . . . 391 V CG2 . 50789 1 1016 . 1 . 1 109 109 VAL N N 15 119.824 0.15 . 1 . . . . . 391 V N . 50789 1 1017 . 1 . 1 110 110 GLY H H 1 9.328 0.02 . 1 . . . . . 392 G H . 50789 1 1018 . 1 . 1 110 110 GLY C C 13 171.632 0.2 . 1 . . . . . 392 G C . 50789 1 1019 . 1 . 1 110 110 GLY CA C 13 44.756 0.2 . 1 . . . . . 392 G CA . 50789 1 1020 . 1 . 1 110 110 GLY N N 15 112.530 0.15 . 1 . . . . . 392 G N . 50789 1 1021 . 1 . 1 111 111 ILE H H 1 8.852 0.02 . 1 . . . . . 393 I H . 50789 1 1022 . 1 . 1 111 111 ILE HA H 1 4.930 0.02 . 1 . . . . . 393 I HA . 50789 1 1023 . 1 . 1 111 111 ILE HB H 1 1.925 0.02 . 1 . . . . . 393 I HB . 50789 1 1024 . 1 . 1 111 111 ILE HG12 H 1 1.227 0.02 . 2 . . . . . 393 I HG12 . 50789 1 1025 . 1 . 1 111 111 ILE HG13 H 1 0.838 0.02 . 2 . . . . . 393 I HG13 . 50789 1 1026 . 1 . 1 111 111 ILE HG21 H 1 0.996 0.02 . 1 . . . . . 393 I HG21 . 50789 1 1027 . 1 . 1 111 111 ILE HG22 H 1 0.996 0.02 . 1 . . . . . 393 I HG22 . 50789 1 1028 . 1 . 1 111 111 ILE HG23 H 1 0.996 0.02 . 1 . . . . . 393 I HG23 . 50789 1 1029 . 1 . 1 111 111 ILE HD11 H 1 0.567 0.02 . 1 . . . . . 393 I HD11 . 50789 1 1030 . 1 . 1 111 111 ILE HD12 H 1 0.567 0.02 . 1 . . . . . 393 I HD12 . 50789 1 1031 . 1 . 1 111 111 ILE HD13 H 1 0.567 0.02 . 1 . . . . . 393 I HD13 . 50789 1 1032 . 1 . 1 111 111 ILE CA C 13 58.210 0.2 . 1 . . . . . 393 I CA . 50789 1 1033 . 1 . 1 111 111 ILE CB C 13 36.820 0.2 . 1 . . . . . 393 I CB . 50789 1 1034 . 1 . 1 111 111 ILE CG1 C 13 25.250 0.2 . 1 . . . . . 393 I CG1 . 50789 1 1035 . 1 . 1 111 111 ILE CG2 C 13 19.230 0.2 . 1 . . . . . 393 I CG2 . 50789 1 1036 . 1 . 1 111 111 ILE CD1 C 13 13.522 0.2 . 1 . . . . . 393 I CD1 . 50789 1 1037 . 1 . 1 111 111 ILE N N 15 124.152 0.15 . 1 . . . . . 393 I N . 50789 1 1038 . 1 . 1 112 112 PRO HA H 1 4.490 0.02 . 1 . . . . . 394 P HA . 50789 1 1039 . 1 . 1 112 112 PRO CA C 13 62.600 0.2 . 1 . . . . . 394 P CA . 50789 1 1040 . 1 . 1 112 112 PRO CB C 13 32.740 0.2 . 1 . . . . . 394 P CB . 50789 1 1041 . 1 . 1 113 113 LEU H H 1 8.577 0.02 . 1 . . . . . 395 L H . 50789 1 1042 . 1 . 1 113 113 LEU HA H 1 4.570 0.02 . 1 . . . . . 395 L HA . 50789 1 1043 . 1 . 1 113 113 LEU HB2 H 1 1.067 0.02 . 2 . . . . . 395 L HB2 . 50789 1 1044 . 1 . 1 113 113 LEU CA C 13 56.670 0.2 . 1 . . . . . 395 L CA . 50789 1 1045 . 1 . 1 113 113 LEU CB C 13 44.920 0.2 . 1 . . . . . 395 L CB . 50789 1 1046 . 1 . 1 113 113 LEU CD1 C 13 27.200 0.2 . 2 . . . . . 395 L CD1 . 50789 1 1047 . 1 . 1 113 113 LEU N N 15 121.217 0.15 . 1 . . . . . 395 L N . 50789 1 1048 . 1 . 1 114 114 PHE H H 1 7.951 0.02 . 1 . . . . . 396 F H . 50789 1 1049 . 1 . 1 114 114 PHE HA H 1 4.980 0.02 . 1 . . . . . 396 F HA . 50789 1 1050 . 1 . 1 114 114 PHE HB2 H 1 3.340 0.02 . 2 . . . . . 396 F HB2 . 50789 1 1051 . 1 . 1 114 114 PHE HB3 H 1 3.060 0.02 . 2 . . . . . 396 F HB3 . 50789 1 1052 . 1 . 1 114 114 PHE C C 13 174.200 0.2 . 1 . . . . . 396 F C . 50789 1 1053 . 1 . 1 114 114 PHE CA C 13 56.500 0.2 . 1 . . . . . 396 F CA . 50789 1 1054 . 1 . 1 114 114 PHE CB C 13 41.400 0.2 . 1 . . . . . 396 F CB . 50789 1 1055 . 1 . 1 114 114 PHE N N 15 116.509 0.15 . 1 . . . . . 396 F N . 50789 1 1056 . 1 . 1 115 115 ALA H H 1 8.820 0.02 . 1 . . . . . 397 A H . 50789 1 1057 . 1 . 1 115 115 ALA HA H 1 4.110 0.02 . 1 . . . . . 397 A HA . 50789 1 1058 . 1 . 1 115 115 ALA HB1 H 1 1.640 0.02 . 1 . . . . . 397 A HB1 . 50789 1 1059 . 1 . 1 115 115 ALA HB2 H 1 1.640 0.02 . 1 . . . . . 397 A HB2 . 50789 1 1060 . 1 . 1 115 115 ALA HB3 H 1 1.640 0.02 . 1 . . . . . 397 A HB3 . 50789 1 1061 . 1 . 1 115 115 ALA C C 13 176.700 0.2 . 1 . . . . . 397 A C . 50789 1 1062 . 1 . 1 115 115 ALA CA C 13 53.750 0.2 . 1 . . . . . 397 A CA . 50789 1 1063 . 1 . 1 115 115 ALA CB C 13 17.700 0.2 . 1 . . . . . 397 A CB . 50789 1 1064 . 1 . 1 115 115 ALA N N 15 121.451 0.15 . 1 . . . . . 397 A N . 50789 1 1065 . 1 . 1 116 116 ASP H H 1 9.299 0.02 . 1 . . . . . 398 D H . 50789 1 1066 . 1 . 1 116 116 ASP HA H 1 4.650 0.02 . 1 . . . . . 398 D HA . 50789 1 1067 . 1 . 1 116 116 ASP HB2 H 1 2.990 0.02 . 2 . . . . . 398 D HB2 . 50789 1 1068 . 1 . 1 116 116 ASP HB3 H 1 2.820 0.02 . 2 . . . . . 398 D HB3 . 50789 1 1069 . 1 . 1 116 116 ASP CA C 13 53.900 0.2 . 1 . . . . . 398 D CA . 50789 1 1070 . 1 . 1 116 116 ASP CB C 13 39.200 0.2 . 1 . . . . . 398 D CB . 50789 1 1071 . 1 . 1 116 116 ASP N N 15 119.274 0.15 . 1 . . . . . 398 D N . 50789 1 1072 . 1 . 1 117 117 GLN H H 1 8.133 0.02 . 1 . . . . . 399 Q H . 50789 1 1073 . 1 . 1 117 117 GLN CA C 13 59.020 0.2 . 1 . . . . . 399 Q CA . 50789 1 1074 . 1 . 1 117 117 GLN N N 15 119.229 0.15 . 1 . . . . . 399 Q N . 50789 1 1075 . 1 . 1 120 120 ASN C C 13 178.891 0.2 . 1 . . . . . 402 N C . 50789 1 1076 . 1 . 1 120 120 ASN CA C 13 55.538 0.2 . 1 . . . . . 402 N CA . 50789 1 1077 . 1 . 1 120 120 ASN CB C 13 37.615 0.2 . 1 . . . . . 402 N CB . 50789 1 1078 . 1 . 1 121 121 ILE H H 1 8.509 0.02 . 1 . . . . . 403 I H . 50789 1 1079 . 1 . 1 121 121 ILE HA H 1 3.760 0.02 . 1 . . . . . 403 I HA . 50789 1 1080 . 1 . 1 121 121 ILE HB H 1 2.129 0.02 . 1 . . . . . 403 I HB . 50789 1 1081 . 1 . 1 121 121 ILE HG12 H 1 1.866 0.02 . 2 . . . . . 403 I HG12 . 50789 1 1082 . 1 . 1 121 121 ILE HG13 H 1 1.050 0.02 . 2 . . . . . 403 I HG13 . 50789 1 1083 . 1 . 1 121 121 ILE HG21 H 1 0.766 0.02 . 1 . . . . . 403 I HG21 . 50789 1 1084 . 1 . 1 121 121 ILE HG22 H 1 0.766 0.02 . 1 . . . . . 403 I HG22 . 50789 1 1085 . 1 . 1 121 121 ILE HG23 H 1 0.766 0.02 . 1 . . . . . 403 I HG23 . 50789 1 1086 . 1 . 1 121 121 ILE HD11 H 1 0.493 0.02 . 1 . . . . . 403 I HD11 . 50789 1 1087 . 1 . 1 121 121 ILE HD12 H 1 0.493 0.02 . 1 . . . . . 403 I HD12 . 50789 1 1088 . 1 . 1 121 121 ILE HD13 H 1 0.493 0.02 . 1 . . . . . 403 I HD13 . 50789 1 1089 . 1 . 1 121 121 ILE C C 13 177.216 0.2 . 1 . . . . . 403 I C . 50789 1 1090 . 1 . 1 121 121 ILE CA C 13 60.831 0.2 . 1 . . . . . 403 I CA . 50789 1 1091 . 1 . 1 121 121 ILE CB C 13 34.850 0.2 . 1 . . . . . 403 I CB . 50789 1 1092 . 1 . 1 121 121 ILE CG1 C 13 27.367 0.2 . 1 . . . . . 403 I CG1 . 50789 1 1093 . 1 . 1 121 121 ILE CG2 C 13 17.451 0.2 . 1 . . . . . 403 I CG2 . 50789 1 1094 . 1 . 1 121 121 ILE CD1 C 13 8.933 0.2 . 1 . . . . . 403 I CD1 . 50789 1 1095 . 1 . 1 121 121 ILE N N 15 118.626 0.15 . 1 . . . . . 403 I N . 50789 1 1096 . 1 . 1 122 122 ALA H H 1 8.629 0.02 . 1 . . . . . 404 A H . 50789 1 1097 . 1 . 1 122 122 ALA HA H 1 4.119 0.02 . 1 . . . . . 404 A HA . 50789 1 1098 . 1 . 1 122 122 ALA HB1 H 1 1.599 0.02 . 1 . . . . . 404 A HB1 . 50789 1 1099 . 1 . 1 122 122 ALA HB2 H 1 1.599 0.02 . 1 . . . . . 404 A HB2 . 50789 1 1100 . 1 . 1 122 122 ALA HB3 H 1 1.599 0.02 . 1 . . . . . 404 A HB3 . 50789 1 1101 . 1 . 1 122 122 ALA CA C 13 55.860 0.2 . 1 . . . . . 404 A CA . 50789 1 1102 . 1 . 1 122 122 ALA CB C 13 18.007 0.2 . 1 . . . . . 404 A CB . 50789 1 1103 . 1 . 1 122 122 ALA N N 15 125.188 0.15 . 1 . . . . . 404 A N . 50789 1 1104 . 1 . 1 123 123 HIS H H 1 8.059 0.02 . 1 . . . . . 405 H H . 50789 1 1105 . 1 . 1 123 123 HIS HA H 1 4.556 0.02 . 1 . . . . . 405 H HA . 50789 1 1106 . 1 . 1 123 123 HIS HB3 H 1 3.298 0.02 . 2 . . . . . 405 H HB3 . 50789 1 1107 . 1 . 1 123 123 HIS C C 13 177.579 0.2 . 1 . . . . . 405 H C . 50789 1 1108 . 1 . 1 123 123 HIS CA C 13 59.123 0.2 . 1 . . . . . 405 H CA . 50789 1 1109 . 1 . 1 123 123 HIS CB C 13 30.357 0.2 . 1 . . . . . 405 H CB . 50789 1 1110 . 1 . 1 123 123 HIS N N 15 118.507 0.15 . 1 . . . . . 405 H N . 50789 1 1111 . 1 . 1 124 124 MET H H 1 7.626 0.02 . 1 . . . . . 406 M H . 50789 1 1112 . 1 . 1 124 124 MET C C 13 179.095 0.2 . 1 . . . . . 406 M C . 50789 1 1113 . 1 . 1 124 124 MET CA C 13 56.688 0.2 . 1 . . . . . 406 M CA . 50789 1 1114 . 1 . 1 124 124 MET CB C 13 35.378 0.2 . 1 . . . . . 406 M CB . 50789 1 1115 . 1 . 1 124 124 MET N N 15 116.207 0.15 . 1 . . . . . 406 M N . 50789 1 1116 . 1 . 1 125 125 LYS H H 1 9.166 0.02 . 1 . . . . . 407 K H . 50789 1 1117 . 1 . 1 125 125 LYS C C 13 180.667 0.2 . 1 . . . . . 407 K C . 50789 1 1118 . 1 . 1 125 125 LYS CA C 13 59.564 0.2 . 1 . . . . . 407 K CA . 50789 1 1119 . 1 . 1 125 125 LYS N N 15 122.862 0.15 . 1 . . . . . 407 K N . 50789 1 1120 . 1 . 1 126 126 ALA H H 1 8.376 0.02 . 1 . . . . . 408 A H . 50789 1 1121 . 1 . 1 126 126 ALA HA H 1 4.264 0.02 . 1 . . . . . 408 A HA . 50789 1 1122 . 1 . 1 126 126 ALA HB1 H 1 1.657 0.02 . 1 . . . . . 408 A HB1 . 50789 1 1123 . 1 . 1 126 126 ALA HB2 H 1 1.657 0.02 . 1 . . . . . 408 A HB2 . 50789 1 1124 . 1 . 1 126 126 ALA HB3 H 1 1.657 0.02 . 1 . . . . . 408 A HB3 . 50789 1 1125 . 1 . 1 126 126 ALA C C 13 179.546 0.2 . 1 . . . . . 408 A C . 50789 1 1126 . 1 . 1 126 126 ALA CA C 13 55.076 0.2 . 1 . . . . . 408 A CA . 50789 1 1127 . 1 . 1 126 126 ALA CB C 13 17.619 0.2 . 1 . . . . . 408 A CB . 50789 1 1128 . 1 . 1 126 126 ALA N N 15 124.589 0.15 . 1 . . . . . 408 A N . 50789 1 1129 . 1 . 1 127 127 ARG H H 1 7.458 0.02 . 1 . . . . . 409 R H . 50789 1 1130 . 1 . 1 127 127 ARG HA H 1 4.390 0.02 . 1 . . . . . 409 R HA . 50789 1 1131 . 1 . 1 127 127 ARG HB2 H 1 2.230 0.02 . 2 . . . . . 409 R HB2 . 50789 1 1132 . 1 . 1 127 127 ARG C C 13 176.038 0.2 . 1 . . . . . 409 R C . 50789 1 1133 . 1 . 1 127 127 ARG CA C 13 54.633 0.2 . 1 . . . . . 409 R CA . 50789 1 1134 . 1 . 1 127 127 ARG CB C 13 30.359 0.2 . 1 . . . . . 409 R CB . 50789 1 1135 . 1 . 1 127 127 ARG CG C 13 26.400 0.2 . 1 . . . . . 409 R CG . 50789 1 1136 . 1 . 1 127 127 ARG CD C 13 42.400 0.2 . 1 . . . . . 409 R CD . 50789 1 1137 . 1 . 1 127 127 ARG N N 15 114.075 0.15 . 1 . . . . . 409 R N . 50789 1 1138 . 1 . 1 128 128 GLY H H 1 8.021 0.02 . 1 . . . . . 410 G H . 50789 1 1139 . 1 . 1 128 128 GLY HA2 H 1 3.860 0.02 . 2 . . . . . 410 G HA2 . 50789 1 1140 . 1 . 1 128 128 GLY HA3 H 1 4.040 0.02 . 2 . . . . . 410 G HA3 . 50789 1 1141 . 1 . 1 128 128 GLY C C 13 173.090 0.2 . 1 . . . . . 410 G C . 50789 1 1142 . 1 . 1 128 128 GLY CA C 13 45.930 0.2 . 1 . . . . . 410 G CA . 50789 1 1143 . 1 . 1 128 128 GLY N N 15 107.551 0.15 . 1 . . . . . 410 G N . 50789 1 1144 . 1 . 1 129 129 ALA H H 1 8.011 0.02 . 1 . . . . . 411 A H . 50789 1 1145 . 1 . 1 129 129 ALA HA H 1 4.818 0.02 . 1 . . . . . 411 A HA . 50789 1 1146 . 1 . 1 129 129 ALA HB1 H 1 1.309 0.02 . 1 . . . . . 411 A HB1 . 50789 1 1147 . 1 . 1 129 129 ALA HB2 H 1 1.309 0.02 . 1 . . . . . 411 A HB2 . 50789 1 1148 . 1 . 1 129 129 ALA HB3 H 1 1.309 0.02 . 1 . . . . . 411 A HB3 . 50789 1 1149 . 1 . 1 129 129 ALA C C 13 174.294 0.2 . 1 . . . . . 411 A C . 50789 1 1150 . 1 . 1 129 129 ALA CA C 13 51.806 0.2 . 1 . . . . . 411 A CA . 50789 1 1151 . 1 . 1 129 129 ALA CB C 13 21.752 0.2 . 1 . . . . . 411 A CB . 50789 1 1152 . 1 . 1 129 129 ALA N N 15 118.405 0.15 . 1 . . . . . 411 A N . 50789 1 1153 . 1 . 1 130 130 ALA H H 1 7.137 0.02 . 1 . . . . . 412 A H . 50789 1 1154 . 1 . 1 130 130 ALA HA H 1 5.904 0.02 . 1 . . . . . 412 A HA . 50789 1 1155 . 1 . 1 130 130 ALA HB1 H 1 1.029 0.02 . 1 . . . . . 412 A HB1 . 50789 1 1156 . 1 . 1 130 130 ALA HB2 H 1 1.029 0.02 . 1 . . . . . 412 A HB2 . 50789 1 1157 . 1 . 1 130 130 ALA HB3 H 1 1.029 0.02 . 1 . . . . . 412 A HB3 . 50789 1 1158 . 1 . 1 130 130 ALA C C 13 176.613 0.2 . 1 . . . . . 412 A C . 50789 1 1159 . 1 . 1 130 130 ALA CA C 13 49.588 0.2 . 1 . . . . . 412 A CA . 50789 1 1160 . 1 . 1 130 130 ALA CB C 13 25.086 0.2 . 1 . . . . . 412 A CB . 50789 1 1161 . 1 . 1 130 130 ALA N N 15 114.736 0.15 . 1 . . . . . 412 A N . 50789 1 1162 . 1 . 1 131 131 VAL H H 1 7.615 0.02 . 1 . . . . . 413 V H . 50789 1 1163 . 1 . 1 131 131 VAL HA H 1 4.360 0.02 . 1 . . . . . 413 V HA . 50789 1 1164 . 1 . 1 131 131 VAL HB H 1 1.921 0.02 . 1 . . . . . 413 V HB . 50789 1 1165 . 1 . 1 131 131 VAL HG11 H 1 0.742 0.02 . 2 . . . . . 413 V HG11 . 50789 1 1166 . 1 . 1 131 131 VAL HG12 H 1 0.742 0.02 . 2 . . . . . 413 V HG12 . 50789 1 1167 . 1 . 1 131 131 VAL HG13 H 1 0.742 0.02 . 2 . . . . . 413 V HG13 . 50789 1 1168 . 1 . 1 131 131 VAL HG21 H 1 0.877 0.02 . 2 . . . . . 413 V HG21 . 50789 1 1169 . 1 . 1 131 131 VAL HG22 H 1 0.877 0.02 . 2 . . . . . 413 V HG22 . 50789 1 1170 . 1 . 1 131 131 VAL HG23 H 1 0.877 0.02 . 2 . . . . . 413 V HG23 . 50789 1 1171 . 1 . 1 131 131 VAL C C 13 173.671 0.2 . 1 . . . . . 413 V C . 50789 1 1172 . 1 . 1 131 131 VAL CA C 13 60.348 0.2 . 1 . . . . . 413 V CA . 50789 1 1173 . 1 . 1 131 131 VAL CB C 13 34.302 0.2 . 1 . . . . . 413 V CB . 50789 1 1174 . 1 . 1 131 131 VAL CG1 C 13 21.250 0.2 . 2 . . . . . 413 V CG1 . 50789 1 1175 . 1 . 1 131 131 VAL CG2 C 13 22.142 0.2 . 2 . . . . . 413 V CG2 . 50789 1 1176 . 1 . 1 131 131 VAL N N 15 115.008 0.15 . 1 . . . . . 413 V N . 50789 1 1177 . 1 . 1 132 132 ARG H H 1 8.804 0.02 . 1 . . . . . 414 R H . 50789 1 1178 . 1 . 1 132 132 ARG HA H 1 5.346 0.02 . 1 . . . . . 414 R HA . 50789 1 1179 . 1 . 1 132 132 ARG C C 13 174.876 0.2 . 1 . . . . . 414 R C . 50789 1 1180 . 1 . 1 132 132 ARG CA C 13 54.459 0.2 . 1 . . . . . 414 R CA . 50789 1 1181 . 1 . 1 132 132 ARG CB C 13 33.723 0.2 . 1 . . . . . 414 R CB . 50789 1 1182 . 1 . 1 132 132 ARG CD C 13 43.960 0.2 . 1 . . . . . 414 R CD . 50789 1 1183 . 1 . 1 132 132 ARG N N 15 125.295 0.15 . 1 . . . . . 414 R N . 50789 1 1184 . 1 . 1 133 133 VAL H H 1 8.646 0.02 . 1 . . . . . 415 V H . 50789 1 1185 . 1 . 1 133 133 VAL HA H 1 4.348 0.02 . 1 . . . . . 415 V HA . 50789 1 1186 . 1 . 1 133 133 VAL HB H 1 1.857 0.02 . 1 . . . . . 415 V HB . 50789 1 1187 . 1 . 1 133 133 VAL HG11 H 1 0.756 0.02 . 2 . . . . . 415 V HG11 . 50789 1 1188 . 1 . 1 133 133 VAL HG12 H 1 0.756 0.02 . 2 . . . . . 415 V HG12 . 50789 1 1189 . 1 . 1 133 133 VAL HG13 H 1 0.756 0.02 . 2 . . . . . 415 V HG13 . 50789 1 1190 . 1 . 1 133 133 VAL HG21 H 1 0.644 0.02 . 2 . . . . . 415 V HG21 . 50789 1 1191 . 1 . 1 133 133 VAL HG22 H 1 0.644 0.02 . 2 . . . . . 415 V HG22 . 50789 1 1192 . 1 . 1 133 133 VAL HG23 H 1 0.644 0.02 . 2 . . . . . 415 V HG23 . 50789 1 1193 . 1 . 1 133 133 VAL C C 13 173.565 0.2 . 1 . . . . . 415 V C . 50789 1 1194 . 1 . 1 133 133 VAL CA C 13 60.196 0.2 . 1 . . . . . 415 V CA . 50789 1 1195 . 1 . 1 133 133 VAL CB C 13 34.797 0.2 . 1 . . . . . 415 V CB . 50789 1 1196 . 1 . 1 133 133 VAL CG1 C 13 23.172 0.2 . 2 . . . . . 415 V CG1 . 50789 1 1197 . 1 . 1 133 133 VAL CG2 C 13 21.827 0.2 . 2 . . . . . 415 V CG2 . 50789 1 1198 . 1 . 1 133 133 VAL N N 15 123.210 0.15 . 1 . . . . . 415 V N . 50789 1 1199 . 1 . 1 134 134 ASP H H 1 8.604 0.02 . 1 . . . . . 416 D H . 50789 1 1200 . 1 . 1 134 134 ASP HB2 H 1 2.495 0.02 . 2 . . . . . 416 D HB2 . 50789 1 1201 . 1 . 1 134 134 ASP HB3 H 1 2.833 0.02 . 2 . . . . . 416 D HB3 . 50789 1 1202 . 1 . 1 134 134 ASP C C 13 174.962 0.2 . 1 . . . . . 416 D C . 50789 1 1203 . 1 . 1 134 134 ASP CA C 13 53.229 0.2 . 1 . . . . . 416 D CA . 50789 1 1204 . 1 . 1 134 134 ASP CB C 13 42.407 0.2 . 1 . . . . . 416 D CB . 50789 1 1205 . 1 . 1 134 134 ASP N N 15 123.620 0.15 . 1 . . . . . 416 D N . 50789 1 1206 . 1 . 1 135 135 PHE H H 1 9.188 0.02 . 1 . . . . . 417 F H . 50789 1 1207 . 1 . 1 135 135 PHE HA H 1 3.985 0.02 . 1 . . . . . 417 F HA . 50789 1 1208 . 1 . 1 135 135 PHE HB2 H 1 3.140 0.02 . 2 . . . . . 417 F HB2 . 50789 1 1209 . 1 . 1 135 135 PHE HB3 H 1 2.867 0.02 . 2 . . . . . 417 F HB3 . 50789 1 1210 . 1 . 1 135 135 PHE HD1 H 1 7.146 0.02 . 3 . . . . . 417 F HD1 . 50789 1 1211 . 1 . 1 135 135 PHE C C 13 175.839 0.2 . 1 . . . . . 417 F C . 50789 1 1212 . 1 . 1 135 135 PHE CA C 13 62.332 0.2 . 1 . . . . . 417 F CA . 50789 1 1213 . 1 . 1 135 135 PHE CB C 13 40.324 0.2 . 1 . . . . . 417 F CB . 50789 1 1214 . 1 . 1 135 135 PHE CD1 C 13 131.910 0.2 . 3 . . . . . 417 F CD1 . 50789 1 1215 . 1 . 1 135 135 PHE N N 15 127.540 0.15 . 1 . . . . . 417 F N . 50789 1 1216 . 1 . 1 136 136 ASN H H 1 8.581 0.02 . 1 . . . . . 418 N H . 50789 1 1217 . 1 . 1 136 136 ASN HA H 1 4.372 0.02 . 1 . . . . . 418 N HA . 50789 1 1218 . 1 . 1 136 136 ASN HB2 H 1 2.851 0.02 . 2 . . . . . 418 N HB2 . 50789 1 1219 . 1 . 1 136 136 ASN HB3 H 1 2.988 0.02 . 2 . . . . . 418 N HB3 . 50789 1 1220 . 1 . 1 136 136 ASN C C 13 177.044 0.2 . 1 . . . . . 418 N C . 50789 1 1221 . 1 . 1 136 136 ASN CA C 13 55.912 0.2 . 1 . . . . . 418 N CA . 50789 1 1222 . 1 . 1 136 136 ASN CB C 13 39.216 0.2 . 1 . . . . . 418 N CB . 50789 1 1223 . 1 . 1 136 136 ASN N N 15 110.416 0.15 . 1 . . . . . 418 N N . 50789 1 1224 . 1 . 1 137 137 THR H H 1 7.436 0.02 . 1 . . . . . 419 T H . 50789 1 1225 . 1 . 1 137 137 THR HA H 1 4.485 0.02 . 1 . . . . . 419 T HA . 50789 1 1226 . 1 . 1 137 137 THR HB H 1 4.397 0.02 . 1 . . . . . 419 T HB . 50789 1 1227 . 1 . 1 137 137 THR HG21 H 1 1.165 0.02 . 1 . . . . . 419 T HG21 . 50789 1 1228 . 1 . 1 137 137 THR HG22 H 1 1.165 0.02 . 1 . . . . . 419 T HG22 . 50789 1 1229 . 1 . 1 137 137 THR HG23 H 1 1.165 0.02 . 1 . . . . . 419 T HG23 . 50789 1 1230 . 1 . 1 137 137 THR C C 13 176.100 0.2 . 1 . . . . . 419 T C . 50789 1 1231 . 1 . 1 137 137 THR CA C 13 61.422 0.2 . 1 . . . . . 419 T CA . 50789 1 1232 . 1 . 1 137 137 THR CB C 13 70.620 0.2 . 1 . . . . . 419 T CB . 50789 1 1233 . 1 . 1 137 137 THR CG2 C 13 21.355 0.2 . 1 . . . . . 419 T CG2 . 50789 1 1234 . 1 . 1 137 137 THR N N 15 105.171 0.15 . 1 . . . . . 419 T N . 50789 1 1235 . 1 . 1 138 138 MET H H 1 8.107 0.02 . 1 . . . . . 420 M H . 50789 1 1236 . 1 . 1 138 138 MET C C 13 175.243 0.2 . 1 . . . . . 420 M C . 50789 1 1237 . 1 . 1 138 138 MET CA C 13 57.024 0.2 . 1 . . . . . 420 M CA . 50789 1 1238 . 1 . 1 138 138 MET CB C 13 31.387 0.2 . 1 . . . . . 420 M CB . 50789 1 1239 . 1 . 1 138 138 MET N N 15 121.949 0.15 . 1 . . . . . 420 M N . 50789 1 1240 . 1 . 1 139 139 SER H H 1 9.258 0.02 . 1 . . . . . 421 S H . 50789 1 1241 . 1 . 1 139 139 SER HA H 1 4.900 0.02 . 1 . . . . . 421 S HA . 50789 1 1242 . 1 . 1 139 139 SER HB2 H 1 4.029 0.02 . 2 . . . . . 421 S HB2 . 50789 1 1243 . 1 . 1 139 139 SER HB3 H 1 4.460 0.02 . 2 . . . . . 421 S HB3 . 50789 1 1244 . 1 . 1 139 139 SER C C 13 175.877 0.2 . 1 . . . . . 421 S C . 50789 1 1245 . 1 . 1 139 139 SER CA C 13 55.600 0.2 . 1 . . . . . 421 S CA . 50789 1 1246 . 1 . 1 139 139 SER CB C 13 66.569 0.2 . 1 . . . . . 421 S CB . 50789 1 1247 . 1 . 1 139 139 SER N N 15 118.303 0.15 . 1 . . . . . 421 S N . 50789 1 1248 . 1 . 1 140 140 SER H H 1 9.451 0.02 . 1 . . . . . 422 S H . 50789 1 1249 . 1 . 1 140 140 SER HA H 1 3.950 0.02 . 1 . . . . . 422 S HA . 50789 1 1250 . 1 . 1 140 140 SER C C 13 176.258 0.2 . 1 . . . . . 422 S C . 50789 1 1251 . 1 . 1 140 140 SER CA C 13 62.682 0.2 . 1 . . . . . 422 S CA . 50789 1 1252 . 1 . 1 140 140 SER CB C 13 62.680 0.2 . 1 . . . . . 422 S CB . 50789 1 1253 . 1 . 1 140 140 SER N N 15 117.213 0.15 . 1 . . . . . 422 S N . 50789 1 1254 . 1 . 1 141 141 THR H H 1 7.853 0.02 . 1 . . . . . 423 T H . 50789 1 1255 . 1 . 1 141 141 THR HA H 1 3.835 0.02 . 1 . . . . . 423 T HA . 50789 1 1256 . 1 . 1 141 141 THR HB H 1 4.023 0.02 . 1 . . . . . 423 T HB . 50789 1 1257 . 1 . 1 141 141 THR HG21 H 1 1.230 0.02 . 1 . . . . . 423 T HG21 . 50789 1 1258 . 1 . 1 141 141 THR HG22 H 1 1.230 0.02 . 1 . . . . . 423 T HG22 . 50789 1 1259 . 1 . 1 141 141 THR HG23 H 1 1.230 0.02 . 1 . . . . . 423 T HG23 . 50789 1 1260 . 1 . 1 141 141 THR CA C 13 66.528 0.2 . 1 . . . . . 423 T CA . 50789 1 1261 . 1 . 1 141 141 THR CB C 13 68.664 0.2 . 1 . . . . . 423 T CB . 50789 1 1262 . 1 . 1 141 141 THR CG2 C 13 22.221 0.2 . 1 . . . . . 423 T CG2 . 50789 1 1263 . 1 . 1 141 141 THR N N 15 116.863 0.15 . 1 . . . . . 423 T N . 50789 1 1264 . 1 . 1 142 142 ASP H H 1 7.781 0.02 . 1 . . . . . 424 D H . 50789 1 1265 . 1 . 1 142 142 ASP HA H 1 4.369 0.02 . 1 . . . . . 424 D HA . 50789 1 1266 . 1 . 1 142 142 ASP HB2 H 1 2.922 0.02 . 2 . . . . . 424 D HB2 . 50789 1 1267 . 1 . 1 142 142 ASP HB3 H 1 2.647 0.02 . 2 . . . . . 424 D HB3 . 50789 1 1268 . 1 . 1 142 142 ASP C C 13 179.405 0.2 . 1 . . . . . 424 D C . 50789 1 1269 . 1 . 1 142 142 ASP CA C 13 57.663 0.2 . 1 . . . . . 424 D CA . 50789 1 1270 . 1 . 1 142 142 ASP CB C 13 41.206 0.2 . 1 . . . . . 424 D CB . 50789 1 1271 . 1 . 1 142 142 ASP N N 15 121.911 0.15 . 1 . . . . . 424 D N . 50789 1 1272 . 1 . 1 143 143 LEU H H 1 7.466 0.02 . 1 . . . . . 425 L H . 50789 1 1273 . 1 . 1 143 143 LEU HA H 1 4.056 0.02 . 1 . . . . . 425 L HA . 50789 1 1274 . 1 . 1 143 143 LEU HB3 H 1 1.616 0.02 . 2 . . . . . 425 L HB3 . 50789 1 1275 . 1 . 1 143 143 LEU HD11 H 1 0.819 0.02 . 2 . . . . . 425 L HD11 . 50789 1 1276 . 1 . 1 143 143 LEU HD12 H 1 0.819 0.02 . 2 . . . . . 425 L HD12 . 50789 1 1277 . 1 . 1 143 143 LEU HD13 H 1 0.819 0.02 . 2 . . . . . 425 L HD13 . 50789 1 1278 . 1 . 1 143 143 LEU HD21 H 1 0.819 0.02 . 2 . . . . . 425 L HD21 . 50789 1 1279 . 1 . 1 143 143 LEU HD22 H 1 0.819 0.02 . 2 . . . . . 425 L HD22 . 50789 1 1280 . 1 . 1 143 143 LEU HD23 H 1 0.819 0.02 . 2 . . . . . 425 L HD23 . 50789 1 1281 . 1 . 1 143 143 LEU C C 13 176.973 0.2 . 1 . . . . . 425 L C . 50789 1 1282 . 1 . 1 143 143 LEU CA C 13 57.641 0.2 . 1 . . . . . 425 L CA . 50789 1 1283 . 1 . 1 143 143 LEU CB C 13 40.408 0.2 . 1 . . . . . 425 L CB . 50789 1 1284 . 1 . 1 143 143 LEU CD1 C 13 22.880 0.2 . 2 . . . . . 425 L CD1 . 50789 1 1285 . 1 . 1 143 143 LEU CD2 C 13 27.090 0.2 . 2 . . . . . 425 L CD2 . 50789 1 1286 . 1 . 1 143 143 LEU N N 15 119.948 0.15 . 1 . . . . . 425 L N . 50789 1 1287 . 1 . 1 144 144 LEU H H 1 8.508 0.02 . 1 . . . . . 426 L H . 50789 1 1288 . 1 . 1 144 144 LEU HA H 1 3.885 0.02 . 1 . . . . . 426 L HA . 50789 1 1289 . 1 . 1 144 144 LEU HB2 H 1 1.967 0.02 . 2 . . . . . 426 L HB2 . 50789 1 1290 . 1 . 1 144 144 LEU HB3 H 1 1.433 0.02 . 2 . . . . . 426 L HB3 . 50789 1 1291 . 1 . 1 144 144 LEU HD21 H 1 0.919 0.02 . 2 . . . . . 426 L HD21 . 50789 1 1292 . 1 . 1 144 144 LEU HD22 H 1 0.919 0.02 . 2 . . . . . 426 L HD22 . 50789 1 1293 . 1 . 1 144 144 LEU HD23 H 1 0.919 0.02 . 2 . . . . . 426 L HD23 . 50789 1 1294 . 1 . 1 144 144 LEU C C 13 177.877 0.2 . 1 . . . . . 426 L C . 50789 1 1295 . 1 . 1 144 144 LEU CA C 13 58.228 0.2 . 1 . . . . . 426 L CA . 50789 1 1296 . 1 . 1 144 144 LEU CB C 13 42.718 0.2 . 1 . . . . . 426 L CB . 50789 1 1297 . 1 . 1 144 144 LEU CD2 C 13 23.657 0.2 . 2 . . . . . 426 L CD2 . 50789 1 1298 . 1 . 1 144 144 LEU N N 15 120.473 0.15 . 1 . . . . . 426 L N . 50789 1 1299 . 1 . 1 145 145 ASN H H 1 8.699 0.02 . 1 . . . . . 427 N H . 50789 1 1300 . 1 . 1 145 145 ASN HA H 1 4.379 0.02 . 1 . . . . . 427 N HA . 50789 1 1301 . 1 . 1 145 145 ASN HB2 H 1 2.895 0.02 . 2 . . . . . 427 N HB2 . 50789 1 1302 . 1 . 1 145 145 ASN HB3 H 1 2.763 0.02 . 2 . . . . . 427 N HB3 . 50789 1 1303 . 1 . 1 145 145 ASN C C 13 178.162 0.2 . 1 . . . . . 427 N C . 50789 1 1304 . 1 . 1 145 145 ASN CA C 13 55.777 0.2 . 1 . . . . . 427 N CA . 50789 1 1305 . 1 . 1 145 145 ASN CB C 13 37.626 0.2 . 1 . . . . . 427 N CB . 50789 1 1306 . 1 . 1 145 145 ASN N N 15 115.964 0.15 . 1 . . . . . 427 N N . 50789 1 1307 . 1 . 1 146 146 ALA H H 1 7.467 0.02 . 1 . . . . . 428 A H . 50789 1 1308 . 1 . 1 146 146 ALA HA H 1 4.028 0.02 . 1 . . . . . 428 A HA . 50789 1 1309 . 1 . 1 146 146 ALA HB1 H 1 1.357 0.02 . 1 . . . . . 428 A HB1 . 50789 1 1310 . 1 . 1 146 146 ALA HB2 H 1 1.357 0.02 . 1 . . . . . 428 A HB2 . 50789 1 1311 . 1 . 1 146 146 ALA HB3 H 1 1.357 0.02 . 1 . . . . . 428 A HB3 . 50789 1 1312 . 1 . 1 146 146 ALA C C 13 177.999 0.2 . 1 . . . . . 428 A C . 50789 1 1313 . 1 . 1 146 146 ALA CA C 13 55.399 0.2 . 1 . . . . . 428 A CA . 50789 1 1314 . 1 . 1 146 146 ALA CB C 13 19.019 0.2 . 1 . . . . . 428 A CB . 50789 1 1315 . 1 . 1 146 146 ALA N N 15 123.095 0.15 . 1 . . . . . 428 A N . 50789 1 1316 . 1 . 1 147 147 LEU H H 1 8.032 0.02 . 1 . . . . . 429 L H . 50789 1 1317 . 1 . 1 147 147 LEU HA H 1 3.657 0.02 . 1 . . . . . 429 L HA . 50789 1 1318 . 1 . 1 147 147 LEU HB2 H 1 1.368 0.02 . 2 . . . . . 429 L HB2 . 50789 1 1319 . 1 . 1 147 147 LEU HB3 H 1 1.807 0.02 . 2 . . . . . 429 L HB3 . 50789 1 1320 . 1 . 1 147 147 LEU HG H 1 1.570 0.02 . 1 . . . . . 429 L HG . 50789 1 1321 . 1 . 1 147 147 LEU HD11 H 1 0.667 0.02 . 2 . . . . . 429 L HD11 . 50789 1 1322 . 1 . 1 147 147 LEU HD12 H 1 0.667 0.02 . 2 . . . . . 429 L HD12 . 50789 1 1323 . 1 . 1 147 147 LEU HD13 H 1 0.667 0.02 . 2 . . . . . 429 L HD13 . 50789 1 1324 . 1 . 1 147 147 LEU HD21 H 1 0.645 0.02 . 2 . . . . . 429 L HD21 . 50789 1 1325 . 1 . 1 147 147 LEU HD22 H 1 0.645 0.02 . 2 . . . . . 429 L HD22 . 50789 1 1326 . 1 . 1 147 147 LEU HD23 H 1 0.645 0.02 . 2 . . . . . 429 L HD23 . 50789 1 1327 . 1 . 1 147 147 LEU C C 13 177.902 0.2 . 1 . . . . . 429 L C . 50789 1 1328 . 1 . 1 147 147 LEU CA C 13 57.548 0.2 . 1 . . . . . 429 L CA . 50789 1 1329 . 1 . 1 147 147 LEU CB C 13 42.400 0.2 . 1 . . . . . 429 L CB . 50789 1 1330 . 1 . 1 147 147 LEU CG C 13 27.000 0.2 . 1 . . . . . 429 L CG . 50789 1 1331 . 1 . 1 147 147 LEU CD1 C 13 24.900 0.2 . 2 . . . . . 429 L CD1 . 50789 1 1332 . 1 . 1 147 147 LEU CD2 C 13 24.576 0.2 . 2 . . . . . 429 L CD2 . 50789 1 1333 . 1 . 1 147 147 LEU N N 15 116.936 0.15 . 1 . . . . . 429 L N . 50789 1 1334 . 1 . 1 148 148 LYS H H 1 8.545 0.02 . 1 . . . . . 430 K H . 50789 1 1335 . 1 . 1 148 148 LYS HD3 H 1 1.687 0.02 . 2 . . . . . 430 K HD3 . 50789 1 1336 . 1 . 1 148 148 LYS HE2 H 1 2.933 0.02 . 2 . . . . . 430 K HE2 . 50789 1 1337 . 1 . 1 148 148 LYS C C 13 179.439 0.2 . 1 . . . . . 430 K C . 50789 1 1338 . 1 . 1 148 148 LYS CA C 13 60.339 0.2 . 1 . . . . . 430 K CA . 50789 1 1339 . 1 . 1 148 148 LYS CB C 13 32.588 0.2 . 1 . . . . . 430 K CB . 50789 1 1340 . 1 . 1 148 148 LYS CG C 13 26.089 0.2 . 1 . . . . . 430 K CG . 50789 1 1341 . 1 . 1 148 148 LYS CD C 13 29.870 0.2 . 1 . . . . . 430 K CD . 50789 1 1342 . 1 . 1 148 148 LYS CE C 13 41.933 0.2 . 1 . . . . . 430 K CE . 50789 1 1343 . 1 . 1 148 148 LYS N N 15 115.669 0.15 . 1 . . . . . 430 K N . 50789 1 1344 . 1 . 1 149 149 ARG H H 1 7.618 0.02 . 1 . . . . . 431 R H . 50789 1 1345 . 1 . 1 149 149 ARG HA H 1 4.140 0.02 . 1 . . . . . 431 R HA . 50789 1 1346 . 1 . 1 149 149 ARG HB3 H 1 1.906 0.02 . 2 . . . . . 431 R HB3 . 50789 1 1347 . 1 . 1 149 149 ARG HG3 H 1 1.756 0.02 . 2 . . . . . 431 R HG3 . 50789 1 1348 . 1 . 1 149 149 ARG HD3 H 1 3.271 0.02 . 2 . . . . . 431 R HD3 . 50789 1 1349 . 1 . 1 149 149 ARG C C 13 176.896 0.2 . 1 . . . . . 431 R C . 50789 1 1350 . 1 . 1 149 149 ARG CA C 13 59.809 0.2 . 1 . . . . . 431 R CA . 50789 1 1351 . 1 . 1 149 149 ARG CB C 13 30.192 0.2 . 1 . . . . . 431 R CB . 50789 1 1352 . 1 . 1 149 149 ARG CG C 13 27.096 0.2 . 1 . . . . . 431 R CG . 50789 1 1353 . 1 . 1 149 149 ARG CD C 13 43.969 0.2 . 1 . . . . . 431 R CD . 50789 1 1354 . 1 . 1 149 149 ARG N N 15 118.363 0.15 . 1 . . . . . 431 R N . 50789 1 1355 . 1 . 1 150 150 VAL H H 1 7.266 0.02 . 1 . . . . . 432 V H . 50789 1 1356 . 1 . 1 150 150 VAL HA H 1 3.595 0.02 . 1 . . . . . 432 V HA . 50789 1 1357 . 1 . 1 150 150 VAL HB H 1 1.730 0.02 . 1 . . . . . 432 V HB . 50789 1 1358 . 1 . 1 150 150 VAL HG11 H 1 0.470 0.02 . 2 . . . . . 432 V HG11 . 50789 1 1359 . 1 . 1 150 150 VAL HG12 H 1 0.470 0.02 . 2 . . . . . 432 V HG12 . 50789 1 1360 . 1 . 1 150 150 VAL HG13 H 1 0.470 0.02 . 2 . . . . . 432 V HG13 . 50789 1 1361 . 1 . 1 150 150 VAL HG21 H 1 0.606 0.02 . 2 . . . . . 432 V HG21 . 50789 1 1362 . 1 . 1 150 150 VAL HG22 H 1 0.606 0.02 . 2 . . . . . 432 V HG22 . 50789 1 1363 . 1 . 1 150 150 VAL HG23 H 1 0.606 0.02 . 2 . . . . . 432 V HG23 . 50789 1 1364 . 1 . 1 150 150 VAL C C 13 176.599 0.2 . 1 . . . . . 432 V C . 50789 1 1365 . 1 . 1 150 150 VAL CA C 13 64.849 0.2 . 1 . . . . . 432 V CA . 50789 1 1366 . 1 . 1 150 150 VAL CB C 13 31.248 0.2 . 1 . . . . . 432 V CB . 50789 1 1367 . 1 . 1 150 150 VAL CG1 C 13 21.384 0.2 . 2 . . . . . 432 V CG1 . 50789 1 1368 . 1 . 1 150 150 VAL CG2 C 13 21.827 0.2 . 2 . . . . . 432 V CG2 . 50789 1 1369 . 1 . 1 150 150 VAL N N 15 111.490 0.15 . 1 . . . . . 432 V N . 50789 1 1370 . 1 . 1 151 151 ILE H H 1 7.708 0.02 . 1 . . . . . 433 I H . 50789 1 1371 . 1 . 1 151 151 ILE HA H 1 3.786 0.02 . 1 . . . . . 433 I HA . 50789 1 1372 . 1 . 1 151 151 ILE HB H 1 1.554 0.02 . 1 . . . . . 433 I HB . 50789 1 1373 . 1 . 1 151 151 ILE HG12 H 1 1.709 0.02 . 2 . . . . . 433 I HG12 . 50789 1 1374 . 1 . 1 151 151 ILE HG13 H 1 0.500 0.02 . 2 . . . . . 433 I HG13 . 50789 1 1375 . 1 . 1 151 151 ILE HG21 H 1 0.765 0.02 . 1 . . . . . 433 I HG21 . 50789 1 1376 . 1 . 1 151 151 ILE HG22 H 1 0.765 0.02 . 1 . . . . . 433 I HG22 . 50789 1 1377 . 1 . 1 151 151 ILE HG23 H 1 0.765 0.02 . 1 . . . . . 433 I HG23 . 50789 1 1378 . 1 . 1 151 151 ILE HD11 H 1 0.534 0.02 . 1 . . . . . 433 I HD11 . 50789 1 1379 . 1 . 1 151 151 ILE HD12 H 1 0.534 0.02 . 1 . . . . . 433 I HD12 . 50789 1 1380 . 1 . 1 151 151 ILE HD13 H 1 0.534 0.02 . 1 . . . . . 433 I HD13 . 50789 1 1381 . 1 . 1 151 151 ILE C C 13 177.463 0.2 . 1 . . . . . 433 I C . 50789 1 1382 . 1 . 1 151 151 ILE CA C 13 64.326 0.2 . 1 . . . . . 433 I CA . 50789 1 1383 . 1 . 1 151 151 ILE CB C 13 39.093 0.2 . 1 . . . . . 433 I CB . 50789 1 1384 . 1 . 1 151 151 ILE CG1 C 13 30.230 0.2 . 1 . . . . . 433 I CG1 . 50789 1 1385 . 1 . 1 151 151 ILE CG2 C 13 17.285 0.2 . 1 . . . . . 433 I CG2 . 50789 1 1386 . 1 . 1 151 151 ILE CD1 C 13 14.016 0.2 . 1 . . . . . 433 I CD1 . 50789 1 1387 . 1 . 1 151 151 ILE N N 15 116.655 0.15 . 1 . . . . . 433 I N . 50789 1 1388 . 1 . 1 152 152 ASN H H 1 7.989 0.02 . 1 . . . . . 434 N H . 50789 1 1389 . 1 . 1 152 152 ASN HA H 1 4.757 0.02 . 1 . . . . . 434 N HA . 50789 1 1390 . 1 . 1 152 152 ASN HB2 H 1 2.993 0.02 . 2 . . . . . 434 N HB2 . 50789 1 1391 . 1 . 1 152 152 ASN HB3 H 1 2.825 0.02 . 2 . . . . . 434 N HB3 . 50789 1 1392 . 1 . 1 152 152 ASN C C 13 175.474 0.2 . 1 . . . . . 434 N C . 50789 1 1393 . 1 . 1 152 152 ASN CA C 13 54.943 0.2 . 1 . . . . . 434 N CA . 50789 1 1394 . 1 . 1 152 152 ASN CB C 13 39.894 0.2 . 1 . . . . . 434 N CB . 50789 1 1395 . 1 . 1 152 152 ASN N N 15 113.890 0.15 . 1 . . . . . 434 N N . 50789 1 1396 . 1 . 1 153 153 ASP H H 1 8.408 0.02 . 1 . . . . . 435 D H . 50789 1 1397 . 1 . 1 153 153 ASP HA H 1 5.298 0.02 . 1 . . . . . 435 D HA . 50789 1 1398 . 1 . 1 153 153 ASP HB2 H 1 3.890 0.02 . 2 . . . . . 435 D HB2 . 50789 1 1399 . 1 . 1 153 153 ASP HB3 H 1 2.830 0.02 . 2 . . . . . 435 D HB3 . 50789 1 1400 . 1 . 1 153 153 ASP C C 13 176.262 0.2 . 1 . . . . . 435 D C . 50789 1 1401 . 1 . 1 153 153 ASP CA C 13 51.201 0.2 . 1 . . . . . 435 D CA . 50789 1 1402 . 1 . 1 153 153 ASP CB C 13 41.258 0.2 . 1 . . . . . 435 D CB . 50789 1 1403 . 1 . 1 153 153 ASP N N 15 122.995 0.15 . 1 . . . . . 435 D N . 50789 1 1404 . 1 . 1 154 154 PRO HA H 1 4.496 0.02 . 1 . . . . . 436 P HA . 50789 1 1405 . 1 . 1 154 154 PRO HB2 H 1 2.465 0.02 . 2 . . . . . 436 P HB2 . 50789 1 1406 . 1 . 1 154 154 PRO HB3 H 1 2.173 0.02 . 2 . . . . . 436 P HB3 . 50789 1 1407 . 1 . 1 154 154 PRO HG3 H 1 2.004 0.02 . 2 . . . . . 436 P HG3 . 50789 1 1408 . 1 . 1 154 154 PRO HD2 H 1 4.202 0.02 . 2 . . . . . 436 P HD2 . 50789 1 1409 . 1 . 1 154 154 PRO HD3 H 1 4.077 0.02 . 2 . . . . . 436 P HD3 . 50789 1 1410 . 1 . 1 154 154 PRO C C 13 177.128 0.2 . 1 . . . . . 436 P C . 50789 1 1411 . 1 . 1 154 154 PRO CA C 13 64.095 0.2 . 1 . . . . . 436 P CA . 50789 1 1412 . 1 . 1 154 154 PRO CB C 13 32.606 0.2 . 1 . . . . . 436 P CB . 50789 1 1413 . 1 . 1 154 154 PRO CG C 13 26.446 0.2 . 1 . . . . . 436 P CG . 50789 1 1414 . 1 . 1 154 154 PRO CD C 13 51.830 0.2 . 1 . . . . . 436 P CD . 50789 1 1415 . 1 . 1 155 155 SER H H 1 8.685 0.02 . 1 . . . . . 437 S H . 50789 1 1416 . 1 . 1 155 155 SER HA H 1 4.108 0.02 . 1 . . . . . 437 S HA . 50789 1 1417 . 1 . 1 155 155 SER HB3 H 1 3.625 0.02 . 2 . . . . . 437 S HB3 . 50789 1 1418 . 1 . 1 155 155 SER C C 13 176.290 0.2 . 1 . . . . . 437 S C . 50789 1 1419 . 1 . 1 155 155 SER CA C 13 61.731 0.2 . 1 . . . . . 437 S CA . 50789 1 1420 . 1 . 1 155 155 SER CB C 13 62.326 0.2 . 1 . . . . . 437 S CB . 50789 1 1421 . 1 . 1 155 155 SER N N 15 115.797 0.15 . 1 . . . . . 437 S N . 50789 1 1422 . 1 . 1 156 156 TYR H H 1 7.126 0.02 . 1 . . . . . 438 Y H . 50789 1 1423 . 1 . 1 156 156 TYR HA H 1 4.710 0.02 . 1 . . . . . 438 Y HA . 50789 1 1424 . 1 . 1 156 156 TYR HB2 H 1 2.924 0.02 . 2 . . . . . 438 Y HB2 . 50789 1 1425 . 1 . 1 156 156 TYR HB3 H 1 3.239 0.02 . 2 . . . . . 438 Y HB3 . 50789 1 1426 . 1 . 1 156 156 TYR HD1 H 1 7.180 0.02 . 3 . . . . . 438 Y HD1 . 50789 1 1427 . 1 . 1 156 156 TYR HE1 H 1 6.600 0.02 . 3 . . . . . 438 Y HE1 . 50789 1 1428 . 1 . 1 156 156 TYR C C 13 177.933 0.2 . 1 . . . . . 438 Y C . 50789 1 1429 . 1 . 1 156 156 TYR CA C 13 62.333 0.2 . 1 . . . . . 438 Y CA . 50789 1 1430 . 1 . 1 156 156 TYR CB C 13 37.826 0.2 . 1 . . . . . 438 Y CB . 50789 1 1431 . 1 . 1 156 156 TYR CD1 C 13 133.220 0.2 . 3 . . . . . 438 Y CD1 . 50789 1 1432 . 1 . 1 156 156 TYR CE1 C 13 118.200 0.2 . 3 . . . . . 438 Y CE1 . 50789 1 1433 . 1 . 1 156 156 TYR N N 15 121.181 0.15 . 1 . . . . . 438 Y N . 50789 1 1434 . 1 . 1 157 157 LYS H H 1 8.199 0.02 . 1 . . . . . 439 K H . 50789 1 1435 . 1 . 1 157 157 LYS HA H 1 4.102 0.02 . 1 . . . . . 439 K HA . 50789 1 1436 . 1 . 1 157 157 LYS HB2 H 1 2.198 0.02 . 2 . . . . . 439 K HB2 . 50789 1 1437 . 1 . 1 157 157 LYS HB3 H 1 2.049 0.02 . 2 . . . . . 439 K HB3 . 50789 1 1438 . 1 . 1 157 157 LYS HG3 H 1 1.704 0.02 . 2 . . . . . 439 K HG3 . 50789 1 1439 . 1 . 1 157 157 LYS HD3 H 1 1.704 0.02 . 2 . . . . . 439 K HD3 . 50789 1 1440 . 1 . 1 157 157 LYS C C 13 177.785 0.2 . 1 . . . . . 439 K C . 50789 1 1441 . 1 . 1 157 157 LYS CA C 13 58.477 0.2 . 1 . . . . . 439 K CA . 50789 1 1442 . 1 . 1 157 157 LYS CB C 13 32.659 0.2 . 1 . . . . . 439 K CB . 50789 1 1443 . 1 . 1 157 157 LYS CG C 13 24.652 0.2 . 1 . . . . . 439 K CG . 50789 1 1444 . 1 . 1 157 157 LYS CD C 13 29.228 0.2 . 1 . . . . . 439 K CD . 50789 1 1445 . 1 . 1 157 157 LYS N N 15 121.342 0.15 . 1 . . . . . 439 K N . 50789 1 1446 . 1 . 1 158 158 GLU H H 1 8.118 0.02 . 1 . . . . . 440 E H . 50789 1 1447 . 1 . 1 158 158 GLU HA H 1 3.983 0.02 . 1 . . . . . 440 E HA . 50789 1 1448 . 1 . 1 158 158 GLU HB3 H 1 2.095 0.02 . 2 . . . . . 440 E HB3 . 50789 1 1449 . 1 . 1 158 158 GLU HG2 H 1 2.188 0.02 . 2 . . . . . 440 E HG2 . 50789 1 1450 . 1 . 1 158 158 GLU HG3 H 1 2.364 0.02 . 2 . . . . . 440 E HG3 . 50789 1 1451 . 1 . 1 158 158 GLU C C 13 179.770 0.2 . 1 . . . . . 440 E C . 50789 1 1452 . 1 . 1 158 158 GLU CA C 13 59.615 0.2 . 1 . . . . . 440 E CA . 50789 1 1453 . 1 . 1 158 158 GLU CB C 13 29.502 0.2 . 1 . . . . . 440 E CB . 50789 1 1454 . 1 . 1 158 158 GLU CG C 13 36.165 0.2 . 1 . . . . . 440 E CG . 50789 1 1455 . 1 . 1 158 158 GLU N N 15 117.761 0.15 . 1 . . . . . 440 E N . 50789 1 1456 . 1 . 1 159 159 ASN H H 1 8.626 0.02 . 1 . . . . . 441 N H . 50789 1 1457 . 1 . 1 159 159 ASN HA H 1 4.616 0.02 . 1 . . . . . 441 N HA . 50789 1 1458 . 1 . 1 159 159 ASN HB2 H 1 2.723 0.02 . 2 . . . . . 441 N HB2 . 50789 1 1459 . 1 . 1 159 159 ASN HB3 H 1 3.028 0.02 . 2 . . . . . 441 N HB3 . 50789 1 1460 . 1 . 1 159 159 ASN C C 13 179.354 0.2 . 1 . . . . . 441 N C . 50789 1 1461 . 1 . 1 159 159 ASN CA C 13 56.185 0.2 . 1 . . . . . 441 N CA . 50789 1 1462 . 1 . 1 159 159 ASN CB C 13 37.706 0.2 . 1 . . . . . 441 N CB . 50789 1 1463 . 1 . 1 159 159 ASN N N 15 117.675 0.15 . 1 . . . . . 441 N N . 50789 1 1464 . 1 . 1 160 160 VAL H H 1 8.725 0.02 . 1 . . . . . 442 V H . 50789 1 1465 . 1 . 1 160 160 VAL HA H 1 4.063 0.02 . 1 . . . . . 442 V HA . 50789 1 1466 . 1 . 1 160 160 VAL HB H 1 2.117 0.02 . 1 . . . . . 442 V HB . 50789 1 1467 . 1 . 1 160 160 VAL HG11 H 1 1.078 0.02 . 2 . . . . . 442 V HG11 . 50789 1 1468 . 1 . 1 160 160 VAL HG12 H 1 1.078 0.02 . 2 . . . . . 442 V HG12 . 50789 1 1469 . 1 . 1 160 160 VAL HG13 H 1 1.078 0.02 . 2 . . . . . 442 V HG13 . 50789 1 1470 . 1 . 1 160 160 VAL HG21 H 1 1.056 0.02 . 2 . . . . . 442 V HG21 . 50789 1 1471 . 1 . 1 160 160 VAL HG22 H 1 1.056 0.02 . 2 . . . . . 442 V HG22 . 50789 1 1472 . 1 . 1 160 160 VAL HG23 H 1 1.056 0.02 . 2 . . . . . 442 V HG23 . 50789 1 1473 . 1 . 1 160 160 VAL C C 13 177.575 0.2 . 1 . . . . . 442 V C . 50789 1 1474 . 1 . 1 160 160 VAL CA C 13 65.836 0.2 . 1 . . . . . 442 V CA . 50789 1 1475 . 1 . 1 160 160 VAL CB C 13 31.600 0.2 . 1 . . . . . 442 V CB . 50789 1 1476 . 1 . 1 160 160 VAL CG1 C 13 22.958 0.2 . 2 . . . . . 442 V CG1 . 50789 1 1477 . 1 . 1 160 160 VAL CG2 C 13 21.512 0.2 . 2 . . . . . 442 V CG2 . 50789 1 1478 . 1 . 1 160 160 VAL N N 15 122.288 0.15 . 1 . . . . . 442 V N . 50789 1 1479 . 1 . 1 161 161 MET H H 1 8.180 0.02 . 1 . . . . . 443 M H . 50789 1 1480 . 1 . 1 161 161 MET HA H 1 4.468 0.02 . 1 . . . . . 443 M HA . 50789 1 1481 . 1 . 1 161 161 MET HG2 H 1 2.888 0.02 . 2 . . . . . 443 M HG2 . 50789 1 1482 . 1 . 1 161 161 MET HG3 H 1 2.750 0.02 . 2 . . . . . 443 M HG3 . 50789 1 1483 . 1 . 1 161 161 MET C C 13 179.430 0.2 . 1 . . . . . 443 M C . 50789 1 1484 . 1 . 1 161 161 MET CA C 13 57.462 0.2 . 1 . . . . . 443 M CA . 50789 1 1485 . 1 . 1 161 161 MET CB C 13 30.749 0.2 . 1 . . . . . 443 M CB . 50789 1 1486 . 1 . 1 161 161 MET CG C 13 32.384 0.2 . 1 . . . . . 443 M CG . 50789 1 1487 . 1 . 1 161 161 MET N N 15 121.917 0.15 . 1 . . . . . 443 M N . 50789 1 1488 . 1 . 1 162 162 LYS H H 1 7.711 0.02 . 1 . . . . . 444 K H . 50789 1 1489 . 1 . 1 162 162 LYS HA H 1 4.103 0.02 . 1 . . . . . 444 K HA . 50789 1 1490 . 1 . 1 162 162 LYS HB3 H 1 2.022 0.02 . 2 . . . . . 444 K HB3 . 50789 1 1491 . 1 . 1 162 162 LYS HG3 H 1 1.433 0.02 . 2 . . . . . 444 K HG3 . 50789 1 1492 . 1 . 1 162 162 LYS HD2 H 1 1.825 0.02 . 2 . . . . . 444 K HD2 . 50789 1 1493 . 1 . 1 162 162 LYS HE2 H 1 3.005 0.02 . 2 . . . . . 444 K HE2 . 50789 1 1494 . 1 . 1 162 162 LYS C C 13 179.146 0.2 . 1 . . . . . 444 K C . 50789 1 1495 . 1 . 1 162 162 LYS CA C 13 59.641 0.2 . 1 . . . . . 444 K CA . 50789 1 1496 . 1 . 1 162 162 LYS CB C 13 32.655 0.2 . 1 . . . . . 444 K CB . 50789 1 1497 . 1 . 1 162 162 LYS CG C 13 25.525 0.2 . 1 . . . . . 444 K CG . 50789 1 1498 . 1 . 1 162 162 LYS CD C 13 29.782 0.2 . 1 . . . . . 444 K CD . 50789 1 1499 . 1 . 1 162 162 LYS CE C 13 42.577 0.2 . 1 . . . . . 444 K CE . 50789 1 1500 . 1 . 1 162 162 LYS N N 15 119.402 0.15 . 1 . . . . . 444 K N . 50789 1 1501 . 1 . 1 163 163 LEU H H 1 7.306 0.02 . 1 . . . . . 445 L H . 50789 1 1502 . 1 . 1 163 163 LEU HA H 1 4.164 0.02 . 1 . . . . . 445 L HA . 50789 1 1503 . 1 . 1 163 163 LEU HB2 H 1 2.106 0.02 . 2 . . . . . 445 L HB2 . 50789 1 1504 . 1 . 1 163 163 LEU HB3 H 1 1.577 0.02 . 2 . . . . . 445 L HB3 . 50789 1 1505 . 1 . 1 163 163 LEU HD11 H 1 0.871 0.02 . 2 . . . . . 445 L HD11 . 50789 1 1506 . 1 . 1 163 163 LEU HD12 H 1 0.871 0.02 . 2 . . . . . 445 L HD12 . 50789 1 1507 . 1 . 1 163 163 LEU HD13 H 1 0.871 0.02 . 2 . . . . . 445 L HD13 . 50789 1 1508 . 1 . 1 163 163 LEU HD21 H 1 0.871 0.02 . 2 . . . . . 445 L HD21 . 50789 1 1509 . 1 . 1 163 163 LEU HD22 H 1 0.871 0.02 . 2 . . . . . 445 L HD22 . 50789 1 1510 . 1 . 1 163 163 LEU HD23 H 1 0.871 0.02 . 2 . . . . . 445 L HD23 . 50789 1 1511 . 1 . 1 163 163 LEU C C 13 178.651 0.2 . 1 . . . . . 445 L C . 50789 1 1512 . 1 . 1 163 163 LEU CA C 13 56.772 0.2 . 1 . . . . . 445 L CA . 50789 1 1513 . 1 . 1 163 163 LEU CB C 13 41.477 0.2 . 1 . . . . . 445 L CB . 50789 1 1514 . 1 . 1 163 163 LEU CD1 C 13 26.146 0.2 . 2 . . . . . 445 L CD1 . 50789 1 1515 . 1 . 1 163 163 LEU CD2 C 13 22.600 0.2 . 2 . . . . . 445 L CD2 . 50789 1 1516 . 1 . 1 163 163 LEU N N 15 117.622 0.15 . 1 . . . . . 445 L N . 50789 1 1517 . 1 . 1 164 164 SER H H 1 8.187 0.02 . 1 . . . . . 446 S H . 50789 1 1518 . 1 . 1 164 164 SER HA H 1 4.485 0.02 . 1 . . . . . 446 S HA . 50789 1 1519 . 1 . 1 164 164 SER HB2 H 1 4.007 0.02 . 2 . . . . . 446 S HB2 . 50789 1 1520 . 1 . 1 164 164 SER CA C 13 60.687 0.2 . 1 . . . . . 446 S CA . 50789 1 1521 . 1 . 1 164 164 SER CB C 13 64.432 0.2 . 1 . . . . . 446 S CB . 50789 1 1522 . 1 . 1 164 164 SER N N 15 115.116 0.15 . 1 . . . . . 446 S N . 50789 1 1523 . 1 . 1 165 165 ARG H H 1 7.806 0.02 . 1 . . . . . 447 R H . 50789 1 1524 . 1 . 1 165 165 ARG HA H 1 4.253 0.02 . 1 . . . . . 447 R HA . 50789 1 1525 . 1 . 1 165 165 ARG HB3 H 1 1.875 0.02 . 2 . . . . . 447 R HB3 . 50789 1 1526 . 1 . 1 165 165 ARG HG2 H 1 1.712 0.02 . 2 . . . . . 447 R HG2 . 50789 1 1527 . 1 . 1 165 165 ARG HD2 H 1 3.207 0.02 . 2 . . . . . 447 R HD2 . 50789 1 1528 . 1 . 1 165 165 ARG HD3 H 1 3.207 0.02 . 2 . . . . . 447 R HD3 . 50789 1 1529 . 1 . 1 165 165 ARG C C 13 177.383 0.2 . 1 . . . . . 447 R C . 50789 1 1530 . 1 . 1 165 165 ARG CA C 13 57.175 0.2 . 1 . . . . . 447 R CA . 50789 1 1531 . 1 . 1 165 165 ARG CB C 13 30.491 0.2 . 1 . . . . . 447 R CB . 50789 1 1532 . 1 . 1 165 165 ARG CG C 13 27.101 0.2 . 1 . . . . . 447 R CG . 50789 1 1533 . 1 . 1 165 165 ARG CD C 13 43.574 0.2 . 1 . . . . . 447 R CD . 50789 1 1534 . 1 . 1 165 165 ARG N N 15 118.319 0.15 . 1 . . . . . 447 R N . 50789 1 1535 . 1 . 1 166 166 ILE H H 1 7.480 0.02 . 1 . . . . . 448 I H . 50789 1 1536 . 1 . 1 166 166 ILE HA H 1 4.104 0.02 . 1 . . . . . 448 I HA . 50789 1 1537 . 1 . 1 166 166 ILE HB H 1 1.952 0.02 . 1 . . . . . 448 I HB . 50789 1 1538 . 1 . 1 166 166 ILE HG12 H 1 1.250 0.02 . 2 . . . . . 448 I HG12 . 50789 1 1539 . 1 . 1 166 166 ILE HG13 H 1 1.570 0.02 . 2 . . . . . 448 I HG13 . 50789 1 1540 . 1 . 1 166 166 ILE HG21 H 1 0.901 0.02 . 1 . . . . . 448 I HG21 . 50789 1 1541 . 1 . 1 166 166 ILE HG22 H 1 0.901 0.02 . 1 . . . . . 448 I HG22 . 50789 1 1542 . 1 . 1 166 166 ILE HG23 H 1 0.901 0.02 . 1 . . . . . 448 I HG23 . 50789 1 1543 . 1 . 1 166 166 ILE HD11 H 1 0.904 0.02 . 1 . . . . . 448 I HD11 . 50789 1 1544 . 1 . 1 166 166 ILE HD12 H 1 0.904 0.02 . 1 . . . . . 448 I HD12 . 50789 1 1545 . 1 . 1 166 166 ILE HD13 H 1 0.904 0.02 . 1 . . . . . 448 I HD13 . 50789 1 1546 . 1 . 1 166 166 ILE C C 13 176.646 0.2 . 1 . . . . . 448 I C . 50789 1 1547 . 1 . 1 166 166 ILE CA C 13 62.122 0.2 . 1 . . . . . 448 I CA . 50789 1 1548 . 1 . 1 166 166 ILE CB C 13 38.514 0.2 . 1 . . . . . 448 I CB . 50789 1 1549 . 1 . 1 166 166 ILE CG1 C 13 27.820 0.2 . 1 . . . . . 448 I CG1 . 50789 1 1550 . 1 . 1 166 166 ILE CG2 C 13 17.521 0.2 . 1 . . . . . 448 I CG2 . 50789 1 1551 . 1 . 1 166 166 ILE CD1 C 13 13.361 0.2 . 1 . . . . . 448 I CD1 . 50789 1 1552 . 1 . 1 166 166 ILE N N 15 117.822 0.15 . 1 . . . . . 448 I N . 50789 1 1553 . 1 . 1 167 167 GLN H H 1 7.926 0.02 . 1 . . . . . 449 Q H . 50789 1 1554 . 1 . 1 167 167 GLN HA H 1 4.215 0.02 . 1 . . . . . 449 Q HA . 50789 1 1555 . 1 . 1 167 167 GLN HB2 H 1 1.970 0.02 . 2 . . . . . 449 Q HB2 . 50789 1 1556 . 1 . 1 167 167 GLN HG2 H 1 2.250 0.02 . 2 . . . . . 449 Q HG2 . 50789 1 1557 . 1 . 1 167 167 GLN C C 13 175.830 0.2 . 1 . . . . . 449 Q C . 50789 1 1558 . 1 . 1 167 167 GLN CA C 13 56.628 0.2 . 1 . . . . . 449 Q CA . 50789 1 1559 . 1 . 1 167 167 GLN CB C 13 29.742 0.2 . 1 . . . . . 449 Q CB . 50789 1 1560 . 1 . 1 167 167 GLN CG C 13 33.750 0.2 . 1 . . . . . 449 Q CG . 50789 1 1561 . 1 . 1 167 167 GLN N N 15 122.181 0.15 . 1 . . . . . 449 Q N . 50789 1 1562 . 1 . 1 168 168 HIS H H 1 8.141 0.02 . 1 . . . . . 450 H H . 50789 1 1563 . 1 . 1 168 168 HIS HA H 1 4.688 0.02 . 1 . . . . . 450 H HA . 50789 1 1564 . 1 . 1 168 168 HIS HB2 H 1 3.216 0.02 . 2 . . . . . 450 H HB2 . 50789 1 1565 . 1 . 1 168 168 HIS HB3 H 1 3.092 0.02 . 2 . . . . . 450 H HB3 . 50789 1 1566 . 1 . 1 168 168 HIS C C 13 173.985 0.2 . 1 . . . . . 450 H C . 50789 1 1567 . 1 . 1 168 168 HIS CA C 13 55.938 0.2 . 1 . . . . . 450 H CA . 50789 1 1568 . 1 . 1 168 168 HIS CB C 13 31.096 0.2 . 1 . . . . . 450 H CB . 50789 1 1569 . 1 . 1 168 168 HIS N N 15 119.237 0.15 . 1 . . . . . 450 H N . 50789 1 1570 . 1 . 1 169 169 ASP H H 1 8.090 0.02 . 1 . . . . . 451 D H . 50789 1 1571 . 1 . 1 169 169 ASP HA H 1 4.496 0.02 . 1 . . . . . 451 D HA . 50789 1 1572 . 1 . 1 169 169 ASP HB2 H 1 2.650 0.02 . 2 . . . . . 451 D HB2 . 50789 1 1573 . 1 . 1 169 169 ASP C C 13 181.207 0.2 . 1 . . . . . 451 D C . 50789 1 1574 . 1 . 1 169 169 ASP CA C 13 56.078 0.2 . 1 . . . . . 451 D CA . 50789 1 1575 . 1 . 1 169 169 ASP CB C 13 42.219 0.2 . 1 . . . . . 451 D CB . 50789 1 1576 . 1 . 1 169 169 ASP N N 15 126.858 0.15 . 1 . . . . . 451 D N . 50789 1 stop_ save_