################################### # 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 30850 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 30850 1 2 '3D CBCA(CO)NH' . . . 30850 1 3 '3D HNCACB' . . . 30850 1 4 '3D H(CCO)NH' . . . 30850 1 5 '3D HNCO' . . . 30850 1 6 '3D HBHA(CO)NH' . . . 30850 1 7 '3D 1H-15N NOESY' . . . 30850 1 8 '3D 1H-13C NOESY aliphatic' . . . 30850 1 9 '3D 1H-13C NOESY aromatic' . . . 30850 1 10 '2D 1H-1H NOESY' . . . 30850 1 11 '2D 1H-13C HSQC' . . . 30850 1 12 '3D HN(CA)CO' . . . 30850 1 13 '3D C(CO)NH' . . . 30850 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 CYS H H 1 8.044 0.000 . 1 . . . . A 291 CYS H . 30850 1 2 . 1 . 1 2 2 CYS HA H 1 4.811 0.000 . 1 . . . . A 291 CYS HA . 30850 1 3 . 1 . 1 2 2 CYS HB2 H 1 3.194 0.000 . 2 . . . . A 291 CYS HB2 . 30850 1 4 . 1 . 1 2 2 CYS HB3 H 1 3.009 0.000 . 2 . . . . A 291 CYS HB3 . 30850 1 5 . 1 . 1 2 2 CYS C C 13 173.791 0.000 . 1 . . . . A 291 CYS C . 30850 1 6 . 1 . 1 2 2 CYS CA C 13 55.375 0.000 . 1 . . . . A 291 CYS CA . 30850 1 7 . 1 . 1 2 2 CYS CB C 13 42.198 0.001 . 1 . . . . A 291 CYS CB . 30850 1 8 . 1 . 1 2 2 CYS N N 15 127.205 0.000 . 1 . . . . A 291 CYS N . 30850 1 9 . 1 . 1 3 3 LYS H H 1 8.613 0.000 . 1 . . . . A 292 LYS H . 30850 1 10 . 1 . 1 3 3 LYS HA H 1 4.322 0.000 . 1 . . . . A 292 LYS HA . 30850 1 11 . 1 . 1 3 3 LYS HB2 H 1 1.733 0.006 . 2 . . . . A 292 LYS HB2 . 30850 1 12 . 1 . 1 3 3 LYS HB3 H 1 1.641 0.000 . 2 . . . . A 292 LYS HB3 . 30850 1 13 . 1 . 1 3 3 LYS HG2 H 1 1.345 0.000 . 2 . . . . A 292 LYS HG2 . 30850 1 14 . 1 . 1 3 3 LYS HG3 H 1 1.369 0.000 . 2 . . . . A 292 LYS HG3 . 30850 1 15 . 1 . 1 3 3 LYS HD2 H 1 1.587 0.000 . 2 . . . . A 292 LYS HD2 . 30850 1 16 . 1 . 1 3 3 LYS HD3 H 1 1.587 0.000 . 2 . . . . A 292 LYS HD3 . 30850 1 17 . 1 . 1 3 3 LYS HE2 H 1 2.914 0.001 . 2 . . . . A 292 LYS HE2 . 30850 1 18 . 1 . 1 3 3 LYS HE3 H 1 2.914 0.001 . 2 . . . . A 292 LYS HE3 . 30850 1 19 . 1 . 1 3 3 LYS C C 13 175.673 0.000 . 1 . . . . A 292 LYS C . 30850 1 20 . 1 . 1 3 3 LYS CA C 13 56.113 0.000 . 1 . . . . A 292 LYS CA . 30850 1 21 . 1 . 1 3 3 LYS CB C 13 33.380 0.015 . 1 . . . . A 292 LYS CB . 30850 1 22 . 1 . 1 3 3 LYS CG C 13 24.610 0.000 . 1 . . . . A 292 LYS CG . 30850 1 23 . 1 . 1 3 3 LYS CD C 13 29.189 0.001 . 1 . . . . A 292 LYS CD . 30850 1 24 . 1 . 1 3 3 LYS CE C 13 42.190 0.009 . 1 . . . . A 292 LYS CE . 30850 1 25 . 1 . 1 3 3 LYS N N 15 123.491 0.000 . 1 . . . . A 292 LYS N . 30850 1 26 . 1 . 1 4 4 ALA H H 1 8.456 0.000 . 1 . . . . A 293 ALA H . 30850 1 27 . 1 . 1 4 4 ALA HA H 1 4.360 0.000 . 1 . . . . A 293 ALA HA . 30850 1 28 . 1 . 1 4 4 ALA HB1 H 1 1.369 0.000 . 1 . . . . A 293 ALA HB1 . 30850 1 29 . 1 . 1 4 4 ALA HB2 H 1 1.369 0.000 . 1 . . . . A 293 ALA HB2 . 30850 1 30 . 1 . 1 4 4 ALA HB3 H 1 1.369 0.000 . 1 . . . . A 293 ALA HB3 . 30850 1 31 . 1 . 1 4 4 ALA C C 13 177.825 0.000 . 1 . . . . A 293 ALA C . 30850 1 32 . 1 . 1 4 4 ALA CA C 13 52.501 0.000 . 1 . . . . A 293 ALA CA . 30850 1 33 . 1 . 1 4 4 ALA CB C 13 19.425 0.000 . 1 . . . . A 293 ALA CB . 30850 1 34 . 1 . 1 4 4 ALA N N 15 127.045 0.000 . 1 . . . . A 293 ALA N . 30850 1 35 . 1 . 1 5 5 THR H H 1 8.251 0.000 . 1 . . . . A 294 THR H . 30850 1 36 . 1 . 1 5 5 THR HA H 1 4.406 0.000 . 1 . . . . A 294 THR HA . 30850 1 37 . 1 . 1 5 5 THR HB H 1 4.255 0.000 . 1 . . . . A 294 THR HB . 30850 1 38 . 1 . 1 5 5 THR HG21 H 1 1.172 0.000 . 1 . . . . A 294 THR HG21 . 30850 1 39 . 1 . 1 5 5 THR HG22 H 1 1.172 0.000 . 1 . . . . A 294 THR HG22 . 30850 1 40 . 1 . 1 5 5 THR HG23 H 1 1.172 0.000 . 1 . . . . A 294 THR HG23 . 30850 1 41 . 1 . 1 5 5 THR C C 13 174.783 0.000 . 1 . . . . A 294 THR C . 30850 1 42 . 1 . 1 5 5 THR CA C 13 61.698 0.020 . 1 . . . . A 294 THR CA . 30850 1 43 . 1 . 1 5 5 THR CB C 13 69.939 0.000 . 1 . . . . A 294 THR CB . 30850 1 44 . 1 . 1 5 5 THR CG2 C 13 21.657 0.000 . 1 . . . . A 294 THR CG2 . 30850 1 45 . 1 . 1 5 5 THR N N 15 113.533 0.000 . 1 . . . . A 294 THR N . 30850 1 46 . 1 . 1 6 6 THR H H 1 8.106 0.000 . 1 . . . . A 295 THR H . 30850 1 47 . 1 . 1 6 6 THR HA H 1 4.371 0.000 . 1 . . . . A 295 THR HA . 30850 1 48 . 1 . 1 6 6 THR HB H 1 4.233 0.006 . 1 . . . . A 295 THR HB . 30850 1 49 . 1 . 1 6 6 THR HG21 H 1 1.173 0.000 . 1 . . . . A 295 THR HG21 . 30850 1 50 . 1 . 1 6 6 THR HG22 H 1 1.173 0.000 . 1 . . . . A 295 THR HG22 . 30850 1 51 . 1 . 1 6 6 THR HG23 H 1 1.173 0.000 . 1 . . . . A 295 THR HG23 . 30850 1 52 . 1 . 1 6 6 THR C C 13 175.065 0.000 . 1 . . . . A 295 THR C . 30850 1 53 . 1 . 1 6 6 THR CA C 13 61.774 0.001 . 1 . . . . A 295 THR CA . 30850 1 54 . 1 . 1 6 6 THR CB C 13 69.971 0.000 . 1 . . . . A 295 THR CB . 30850 1 55 . 1 . 1 6 6 THR CG2 C 13 21.609 0.000 . 1 . . . . A 295 THR CG2 . 30850 1 56 . 1 . 1 6 6 THR N N 15 114.833 0.000 . 1 . . . . A 295 THR N . 30850 1 57 . 1 . 1 7 7 GLY H H 1 8.398 0.000 . 1 . . . . A 296 GLY H . 30850 1 58 . 1 . 1 7 7 GLY HA2 H 1 3.984 0.000 . 2 . . . . A 296 GLY HA2 . 30850 1 59 . 1 . 1 7 7 GLY HA3 H 1 3.931 0.000 . 2 . . . . A 296 GLY HA3 . 30850 1 60 . 1 . 1 7 7 GLY C C 13 173.911 0.000 . 1 . . . . A 296 GLY C . 30850 1 61 . 1 . 1 7 7 GLY CA C 13 45.425 0.010 . 1 . . . . A 296 GLY CA . 30850 1 62 . 1 . 1 7 7 GLY N N 15 110.975 0.000 . 1 . . . . A 296 GLY N . 30850 1 63 . 1 . 1 8 8 ASP H H 1 8.221 0.000 . 1 . . . . A 297 ASP H . 30850 1 64 . 1 . 1 8 8 ASP HA H 1 4.641 0.000 . 1 . . . . A 297 ASP HA . 30850 1 65 . 1 . 1 8 8 ASP HB2 H 1 2.730 0.000 . 2 . . . . A 297 ASP HB2 . 30850 1 66 . 1 . 1 8 8 ASP HB3 H 1 2.628 0.000 . 2 . . . . A 297 ASP HB3 . 30850 1 67 . 1 . 1 8 8 ASP C C 13 176.463 0.000 . 1 . . . . A 297 ASP C . 30850 1 68 . 1 . 1 8 8 ASP CA C 13 54.426 0.000 . 1 . . . . A 297 ASP CA . 30850 1 69 . 1 . 1 8 8 ASP CB C 13 41.329 0.000 . 1 . . . . A 297 ASP CB . 30850 1 70 . 1 . 1 8 8 ASP CG C 13 177.466 0.000 . 1 . . . . A 297 ASP CG . 30850 1 71 . 1 . 1 8 8 ASP N N 15 120.432 0.000 . 1 . . . . A 297 ASP N . 30850 1 72 . 1 . 1 9 9 SER H H 1 8.229 0.000 . 1 . . . . A 298 SER H . 30850 1 73 . 1 . 1 9 9 SER HA H 1 4.361 0.000 . 1 . . . . A 298 SER HA . 30850 1 74 . 1 . 1 9 9 SER HB2 H 1 3.883 0.000 . 2 . . . . A 298 SER HB2 . 30850 1 75 . 1 . 1 9 9 SER HB3 H 1 3.807 0.000 . 2 . . . . A 298 SER HB3 . 30850 1 76 . 1 . 1 9 9 SER C C 13 174.661 0.000 . 1 . . . . A 298 SER C . 30850 1 77 . 1 . 1 9 9 SER CA C 13 58.848 0.007 . 1 . . . . A 298 SER CA . 30850 1 78 . 1 . 1 9 9 SER CB C 13 63.851 0.001 . 1 . . . . A 298 SER CB . 30850 1 79 . 1 . 1 9 9 SER N N 15 115.799 0.000 . 1 . . . . A 298 SER N . 30850 1 80 . 1 . 1 10 10 GLU H H 1 8.431 0.000 . 1 . . . . A 299 GLU H . 30850 1 81 . 1 . 1 10 10 GLU HA H 1 4.186 0.000 . 1 . . . . A 299 GLU HA . 30850 1 82 . 1 . 1 10 10 GLU HB2 H 1 1.836 0.000 . 2 . . . . A 299 GLU HB2 . 30850 1 83 . 1 . 1 10 10 GLU HB3 H 1 1.836 0.000 . 2 . . . . A 299 GLU HB3 . 30850 1 84 . 1 . 1 10 10 GLU HG2 H 1 2.111 0.004 . 2 . . . . A 299 GLU HG2 . 30850 1 85 . 1 . 1 10 10 GLU HG3 H 1 2.001 0.004 . 2 . . . . A 299 GLU HG3 . 30850 1 86 . 1 . 1 10 10 GLU C C 13 176.221 0.000 . 1 . . . . A 299 GLU C . 30850 1 87 . 1 . 1 10 10 GLU CA C 13 57.085 0.000 . 1 . . . . A 299 GLU CA . 30850 1 88 . 1 . 1 10 10 GLU CB C 13 29.996 0.000 . 1 . . . . A 299 GLU CB . 30850 1 89 . 1 . 1 10 10 GLU CG C 13 36.156 0.006 . 1 . . . . A 299 GLU CG . 30850 1 90 . 1 . 1 10 10 GLU CD C 13 181.155 0.000 . 1 . . . . A 299 GLU CD . 30850 1 91 . 1 . 1 10 10 GLU N N 15 122.407 0.006 . 1 . . . . A 299 GLU N . 30850 1 92 . 1 . 1 11 11 PHE H H 1 8.080 0.000 . 1 . . . . A 300 PHE H . 30850 1 93 . 1 . 1 11 11 PHE HA H 1 4.525 0.003 . 1 . . . . A 300 PHE HA . 30850 1 94 . 1 . 1 11 11 PHE HB2 H 1 3.023 0.000 . 2 . . . . A 300 PHE HB2 . 30850 1 95 . 1 . 1 11 11 PHE HB3 H 1 2.943 0.000 . 2 . . . . A 300 PHE HB3 . 30850 1 96 . 1 . 1 11 11 PHE HD1 H 1 7.104 0.000 . 1 . . . . A 300 PHE HD1 . 30850 1 97 . 1 . 1 11 11 PHE HD2 H 1 7.104 0.000 . 1 . . . . A 300 PHE HD2 . 30850 1 98 . 1 . 1 11 11 PHE C C 13 175.385 0.000 . 1 . . . . A 300 PHE C . 30850 1 99 . 1 . 1 11 11 PHE CA C 13 58.092 0.000 . 1 . . . . A 300 PHE CA . 30850 1 100 . 1 . 1 11 11 PHE CB C 13 39.726 0.000 . 1 . . . . A 300 PHE CB . 30850 1 101 . 1 . 1 11 11 PHE CD1 C 13 131.484 0.010 . 1 . . . . A 300 PHE CD1 . 30850 1 102 . 1 . 1 11 11 PHE CD2 C 13 131.484 0.000 . 1 . . . . A 300 PHE CD2 . 30850 1 103 . 1 . 1 11 11 PHE N N 15 119.874 0.000 . 1 . . . . A 300 PHE N . 30850 1 104 . 1 . 1 12 12 TYR H H 1 7.929 0.000 . 1 . . . . A 301 TYR H . 30850 1 105 . 1 . 1 12 12 TYR HA H 1 4.476 0.000 . 1 . . . . A 301 TYR HA . 30850 1 106 . 1 . 1 12 12 TYR HB2 H 1 3.048 0.005 . 2 . . . . A 301 TYR HB2 . 30850 1 107 . 1 . 1 12 12 TYR HB3 H 1 2.892 0.000 . 2 . . . . A 301 TYR HB3 . 30850 1 108 . 1 . 1 12 12 TYR HD1 H 1 7.104 0.000 . 1 . . . . A 301 TYR HD1 . 30850 1 109 . 1 . 1 12 12 TYR HD2 H 1 7.104 0.000 . 1 . . . . A 301 TYR HD2 . 30850 1 110 . 1 . 1 12 12 TYR HE1 H 1 6.799 0.000 . 1 . . . . A 301 TYR HE1 . 30850 1 111 . 1 . 1 12 12 TYR HE2 H 1 6.799 0.000 . 1 . . . . A 301 TYR HE2 . 30850 1 112 . 1 . 1 12 12 TYR C C 13 175.237 0.000 . 1 . . . . A 301 TYR C . 30850 1 113 . 1 . 1 12 12 TYR CA C 13 58.132 0.000 . 1 . . . . A 301 TYR CA . 30850 1 114 . 1 . 1 12 12 TYR CB C 13 38.997 0.001 . 1 . . . . A 301 TYR CB . 30850 1 115 . 1 . 1 12 12 TYR CD1 C 13 131.491 0.000 . 1 . . . . A 301 TYR CD1 . 30850 1 116 . 1 . 1 12 12 TYR CD2 C 13 131.491 0.000 . 1 . . . . A 301 TYR CD2 . 30850 1 117 . 1 . 1 12 12 TYR CE1 C 13 118.160 0.000 . 1 . . . . A 301 TYR CE1 . 30850 1 118 . 1 . 1 12 12 TYR CE2 C 13 118.160 0.000 . 1 . . . . A 301 TYR CE2 . 30850 1 119 . 1 . 1 12 12 TYR N N 15 121.074 0.000 . 1 . . . . A 301 TYR N . 30850 1 120 . 1 . 1 13 13 ASP H H 1 8.217 0.000 . 1 . . . . A 302 ASP H . 30850 1 121 . 1 . 1 13 13 ASP HA H 1 4.599 0.000 . 1 . . . . A 302 ASP HA . 30850 1 122 . 1 . 1 13 13 ASP HB2 H 1 2.740 0.002 . 2 . . . . A 302 ASP HB2 . 30850 1 123 . 1 . 1 13 13 ASP HB3 H 1 2.658 0.006 . 2 . . . . A 302 ASP HB3 . 30850 1 124 . 1 . 1 13 13 ASP C C 13 176.543 0.000 . 1 . . . . A 302 ASP C . 30850 1 125 . 1 . 1 13 13 ASP CA C 13 54.338 0.000 . 1 . . . . A 302 ASP CA . 30850 1 126 . 1 . 1 13 13 ASP CB C 13 41.326 0.007 . 1 . . . . A 302 ASP CB . 30850 1 127 . 1 . 1 13 13 ASP CG C 13 177.256 0.000 . 1 . . . . A 302 ASP CG . 30850 1 128 . 1 . 1 13 13 ASP N N 15 121.785 0.000 . 1 . . . . A 302 ASP N . 30850 1 129 . 1 . 1 14 14 THR H H 1 8.037 0.000 . 1 . . . . A 303 THR H . 30850 1 130 . 1 . 1 14 14 THR HA H 1 4.148 0.001 . 1 . . . . A 303 THR HA . 30850 1 131 . 1 . 1 14 14 THR HB H 1 4.191 0.000 . 1 . . . . A 303 THR HB . 30850 1 132 . 1 . 1 14 14 THR HG21 H 1 1.140 0.000 . 1 . . . . A 303 THR HG21 . 30850 1 133 . 1 . 1 14 14 THR HG22 H 1 1.140 0.000 . 1 . . . . A 303 THR HG22 . 30850 1 134 . 1 . 1 14 14 THR HG23 H 1 1.140 0.000 . 1 . . . . A 303 THR HG23 . 30850 1 135 . 1 . 1 14 14 THR C C 13 175.155 0.000 . 1 . . . . A 303 THR C . 30850 1 136 . 1 . 1 14 14 THR CA C 13 63.278 0.013 . 1 . . . . A 303 THR CA . 30850 1 137 . 1 . 1 14 14 THR CB C 13 69.357 0.012 . 1 . . . . A 303 THR CB . 30850 1 138 . 1 . 1 14 14 THR CG2 C 13 21.658 0.000 . 1 . . . . A 303 THR CG2 . 30850 1 139 . 1 . 1 14 14 THR N N 15 114.267 0.000 . 1 . . . . A 303 THR N . 30850 1 140 . 1 . 1 15 15 TYR H H 1 8.218 0.000 . 1 . . . . A 304 TYR H . 30850 1 141 . 1 . 1 15 15 TYR HA H 1 4.395 0.000 . 1 . . . . A 304 TYR HA . 30850 1 142 . 1 . 1 15 15 TYR HB2 H 1 3.012 0.000 . 2 . . . . A 304 TYR HB2 . 30850 1 143 . 1 . 1 15 15 TYR HB3 H 1 3.012 0.000 . 2 . . . . A 304 TYR HB3 . 30850 1 144 . 1 . 1 15 15 TYR HD1 H 1 7.088 0.001 . 1 . . . . A 304 TYR HD1 . 30850 1 145 . 1 . 1 15 15 TYR HD2 H 1 7.088 0.001 . 1 . . . . A 304 TYR HD2 . 30850 1 146 . 1 . 1 15 15 TYR HE1 H 1 6.796 0.000 . 1 . . . . A 304 TYR HE1 . 30850 1 147 . 1 . 1 15 15 TYR HE2 H 1 6.796 0.000 . 1 . . . . A 304 TYR HE2 . 30850 1 148 . 1 . 1 15 15 TYR C C 13 176.297 0.000 . 1 . . . . A 304 TYR C . 30850 1 149 . 1 . 1 15 15 TYR CA C 13 59.528 0.000 . 1 . . . . A 304 TYR CA . 30850 1 150 . 1 . 1 15 15 TYR CB C 13 38.362 0.000 . 1 . . . . A 304 TYR CB . 30850 1 151 . 1 . 1 15 15 TYR CD1 C 13 133.293 0.002 . 1 . . . . A 304 TYR CD1 . 30850 1 152 . 1 . 1 15 15 TYR CD2 C 13 133.293 0.000 . 1 . . . . A 304 TYR CD2 . 30850 1 153 . 1 . 1 15 15 TYR CE1 C 13 118.085 0.001 . 1 . . . . A 304 TYR CE1 . 30850 1 154 . 1 . 1 15 15 TYR CE2 C 13 118.085 0.000 . 1 . . . . A 304 TYR CE2 . 30850 1 155 . 1 . 1 15 15 TYR N N 15 123.407 0.000 . 1 . . . . A 304 TYR N . 30850 1 156 . 1 . 1 16 16 SER H H 1 7.981 0.000 . 1 . . . . A 305 SER H . 30850 1 157 . 1 . 1 16 16 SER HA H 1 4.319 0.000 . 1 . . . . A 305 SER HA . 30850 1 158 . 1 . 1 16 16 SER HB2 H 1 3.945 0.000 . 2 . . . . A 305 SER HB2 . 30850 1 159 . 1 . 1 16 16 SER HB3 H 1 3.848 0.000 . 2 . . . . A 305 SER HB3 . 30850 1 160 . 1 . 1 16 16 SER C C 13 175.715 0.000 . 1 . . . . A 305 SER C . 30850 1 161 . 1 . 1 16 16 SER CA C 13 59.064 0.000 . 1 . . . . A 305 SER CA . 30850 1 162 . 1 . 1 16 16 SER CB C 13 63.623 0.001 . 1 . . . . A 305 SER CB . 30850 1 163 . 1 . 1 16 16 SER N N 15 117.489 0.000 . 1 . . . . A 305 SER N . 30850 1 164 . 1 . 1 17 17 ILE H H 1 8.257 0.000 . 1 . . . . A 306 ILE H . 30850 1 165 . 1 . 1 17 17 ILE HA H 1 3.956 0.000 . 1 . . . . A 306 ILE HA . 30850 1 166 . 1 . 1 17 17 ILE HB H 1 1.918 0.000 . 1 . . . . A 306 ILE HB . 30850 1 167 . 1 . 1 17 17 ILE HG12 H 1 1.555 0.000 . 2 . . . . A 306 ILE HG12 . 30850 1 168 . 1 . 1 17 17 ILE HG13 H 1 1.248 0.000 . 2 . . . . A 306 ILE HG13 . 30850 1 169 . 1 . 1 17 17 ILE HG21 H 1 0.934 0.000 . 1 . . . . A 306 ILE HG21 . 30850 1 170 . 1 . 1 17 17 ILE HG22 H 1 0.934 0.000 . 1 . . . . A 306 ILE HG22 . 30850 1 171 . 1 . 1 17 17 ILE HG23 H 1 0.934 0.000 . 1 . . . . A 306 ILE HG23 . 30850 1 172 . 1 . 1 17 17 ILE HD11 H 1 0.856 0.000 . 1 . . . . A 306 ILE HD11 . 30850 1 173 . 1 . 1 17 17 ILE HD12 H 1 0.856 0.000 . 1 . . . . A 306 ILE HD12 . 30850 1 174 . 1 . 1 17 17 ILE HD13 H 1 0.856 0.000 . 1 . . . . A 306 ILE HD13 . 30850 1 175 . 1 . 1 17 17 ILE C C 13 177.404 0.000 . 1 . . . . A 306 ILE C . 30850 1 176 . 1 . 1 17 17 ILE CA C 13 64.007 0.000 . 1 . . . . A 306 ILE CA . 30850 1 177 . 1 . 1 17 17 ILE CB C 13 37.982 0.000 . 1 . . . . A 306 ILE CB . 30850 1 178 . 1 . 1 17 17 ILE CG1 C 13 28.690 0.001 . 1 . . . . A 306 ILE CG1 . 30850 1 179 . 1 . 1 17 17 ILE CG2 C 13 17.358 0.000 . 1 . . . . A 306 ILE CG2 . 30850 1 180 . 1 . 1 17 17 ILE CD1 C 13 13.459 0.000 . 1 . . . . A 306 ILE CD1 . 30850 1 181 . 1 . 1 17 17 ILE N N 15 124.026 0.000 . 1 . . . . A 306 ILE N . 30850 1 182 . 1 . 1 18 18 THR H H 1 7.841 0.000 . 1 . . . . A 307 THR H . 30850 1 183 . 1 . 1 18 18 THR HA H 1 3.941 0.000 . 1 . . . . A 307 THR HA . 30850 1 184 . 1 . 1 18 18 THR HB H 1 4.117 0.001 . 1 . . . . A 307 THR HB . 30850 1 185 . 1 . 1 18 18 THR HG21 H 1 1.241 0.000 . 1 . . . . A 307 THR HG21 . 30850 1 186 . 1 . 1 18 18 THR HG22 H 1 1.241 0.000 . 1 . . . . A 307 THR HG22 . 30850 1 187 . 1 . 1 18 18 THR HG23 H 1 1.241 0.000 . 1 . . . . A 307 THR HG23 . 30850 1 188 . 1 . 1 18 18 THR C C 13 175.972 0.000 . 1 . . . . A 307 THR C . 30850 1 189 . 1 . 1 18 18 THR CA C 13 65.676 0.014 . 1 . . . . A 307 THR CA . 30850 1 190 . 1 . 1 18 18 THR CB C 13 68.860 0.000 . 1 . . . . A 307 THR CB . 30850 1 191 . 1 . 1 18 18 THR CG2 C 13 21.899 0.001 . 1 . . . . A 307 THR CG2 . 30850 1 192 . 1 . 1 18 18 THR N N 15 116.619 0.000 . 1 . . . . A 307 THR N . 30850 1 193 . 1 . 1 19 19 ALA H H 1 7.992 0.000 . 1 . . . . A 308 ALA H . 30850 1 194 . 1 . 1 19 19 ALA HA H 1 4.057 0.001 . 1 . . . . A 308 ALA HA . 30850 1 195 . 1 . 1 19 19 ALA HB1 H 1 1.365 0.000 . 1 . . . . A 308 ALA HB1 . 30850 1 196 . 1 . 1 19 19 ALA HB2 H 1 1.365 0.000 . 1 . . . . A 308 ALA HB2 . 30850 1 197 . 1 . 1 19 19 ALA HB3 H 1 1.365 0.000 . 1 . . . . A 308 ALA HB3 . 30850 1 198 . 1 . 1 19 19 ALA C C 13 179.416 0.000 . 1 . . . . A 308 ALA C . 30850 1 199 . 1 . 1 19 19 ALA CA C 13 54.968 0.000 . 1 . . . . A 308 ALA CA . 30850 1 200 . 1 . 1 19 19 ALA CB C 13 18.181 0.005 . 1 . . . . A 308 ALA CB . 30850 1 201 . 1 . 1 19 19 ALA N N 15 123.979 0.000 . 1 . . . . A 308 ALA N . 30850 1 202 . 1 . 1 20 20 CYS H H 1 7.910 0.000 . 1 . . . . A 309 CYS H . 30850 1 203 . 1 . 1 20 20 CYS HA H 1 4.279 0.000 . 1 . . . . A 309 CYS HA . 30850 1 204 . 1 . 1 20 20 CYS HB2 H 1 3.327 0.000 . 2 . . . . A 309 CYS HB2 . 30850 1 205 . 1 . 1 20 20 CYS HB3 H 1 3.327 0.000 . 2 . . . . A 309 CYS HB3 . 30850 1 206 . 1 . 1 20 20 CYS C C 13 177.145 0.000 . 1 . . . . A 309 CYS C . 30850 1 207 . 1 . 1 20 20 CYS CA C 13 59.736 0.000 . 1 . . . . A 309 CYS CA . 30850 1 208 . 1 . 1 20 20 CYS CB C 13 40.242 0.000 . 1 . . . . A 309 CYS CB . 30850 1 209 . 1 . 1 20 20 CYS N N 15 118.187 0.000 . 1 . . . . A 309 CYS N . 30850 1 210 . 1 . 1 21 21 ARG H H 1 8.430 0.000 . 1 . . . . A 310 ARG H . 30850 1 211 . 1 . 1 21 21 ARG HA H 1 4.078 0.000 . 1 . . . . A 310 ARG HA . 30850 1 212 . 1 . 1 21 21 ARG HB2 H 1 1.988 0.001 . 2 . . . . A 310 ARG HB2 . 30850 1 213 . 1 . 1 21 21 ARG HB3 H 1 1.988 0.001 . 2 . . . . A 310 ARG HB3 . 30850 1 214 . 1 . 1 21 21 ARG HG2 H 1 1.694 0.000 . 1 . . . . A 310 ARG HG2 . 30850 1 215 . 1 . 1 21 21 ARG HG3 H 1 1.778 0.001 . 1 . . . . A 310 ARG HG3 . 30850 1 216 . 1 . 1 21 21 ARG HD2 H 1 3.203 0.000 . 2 . . . . A 310 ARG HD2 . 30850 1 217 . 1 . 1 21 21 ARG HD3 H 1 3.203 0.000 . 2 . . . . A 310 ARG HD3 . 30850 1 218 . 1 . 1 21 21 ARG HE H 1 7.527 0.000 . 1 . . . . A 310 ARG HE . 30850 1 219 . 1 . 1 21 21 ARG C C 13 178.366 0.002 . 1 . . . . A 310 ARG C . 30850 1 220 . 1 . 1 21 21 ARG CA C 13 59.266 0.004 . 1 . . . . A 310 ARG CA . 30850 1 221 . 1 . 1 21 21 ARG CB C 13 29.273 0.002 . 1 . . . . A 310 ARG CB . 30850 1 222 . 1 . 1 21 21 ARG CG C 13 27.215 0.000 . 1 . . . . A 310 ARG CG . 30850 1 223 . 1 . 1 21 21 ARG CD C 13 42.933 0.002 . 1 . . . . A 310 ARG CD . 30850 1 224 . 1 . 1 21 21 ARG N N 15 122.562 0.000 . 1 . . . . A 310 ARG N . 30850 1 225 . 1 . 1 21 21 ARG NE N 15 84.003 0.001 . 1 . . . . A 310 ARG NE . 30850 1 226 . 1 . 1 22 22 ILE H H 1 8.298 0.000 . 1 . . . . A 311 ILE H . 30850 1 227 . 1 . 1 22 22 ILE HA H 1 4.057 0.000 . 1 . . . . A 311 ILE HA . 30850 1 228 . 1 . 1 22 22 ILE HB H 1 1.942 0.010 . 1 . . . . A 311 ILE HB . 30850 1 229 . 1 . 1 22 22 ILE HG12 H 1 1.292 0.000 . 2 . . . . A 311 ILE HG12 . 30850 1 230 . 1 . 1 22 22 ILE HG13 H 1 1.707 0.000 . 2 . . . . A 311 ILE HG13 . 30850 1 231 . 1 . 1 22 22 ILE HG21 H 1 1.011 0.000 . 1 . . . . A 311 ILE HG21 . 30850 1 232 . 1 . 1 22 22 ILE HG22 H 1 1.011 0.000 . 1 . . . . A 311 ILE HG22 . 30850 1 233 . 1 . 1 22 22 ILE HG23 H 1 1.011 0.000 . 1 . . . . A 311 ILE HG23 . 30850 1 234 . 1 . 1 22 22 ILE HD11 H 1 0.930 0.000 . 1 . . . . A 311 ILE HD11 . 30850 1 235 . 1 . 1 22 22 ILE HD12 H 1 0.930 0.000 . 1 . . . . A 311 ILE HD12 . 30850 1 236 . 1 . 1 22 22 ILE HD13 H 1 0.930 0.000 . 1 . . . . A 311 ILE HD13 . 30850 1 237 . 1 . 1 22 22 ILE C C 13 179.633 0.000 . 1 . . . . A 311 ILE C . 30850 1 238 . 1 . 1 22 22 ILE CA C 13 64.322 0.013 . 1 . . . . A 311 ILE CA . 30850 1 239 . 1 . 1 22 22 ILE CB C 13 37.864 0.000 . 1 . . . . A 311 ILE CB . 30850 1 240 . 1 . 1 22 22 ILE CG1 C 13 29.328 0.025 . 1 . . . . A 311 ILE CG1 . 30850 1 241 . 1 . 1 22 22 ILE CG2 C 13 17.703 0.002 . 1 . . . . A 311 ILE CG2 . 30850 1 242 . 1 . 1 22 22 ILE CD1 C 13 13.476 0.000 . 1 . . . . A 311 ILE CD1 . 30850 1 243 . 1 . 1 22 22 ILE N N 15 120.054 0.000 . 1 . . . . A 311 ILE N . 30850 1 244 . 1 . 1 23 23 ASP H H 1 8.229 0.000 . 1 . . . . A 312 ASP H . 30850 1 245 . 1 . 1 23 23 ASP HA H 1 4.453 0.000 . 1 . . . . A 312 ASP HA . 30850 1 246 . 1 . 1 23 23 ASP HB2 H 1 2.855 0.001 . 2 . . . . A 312 ASP HB2 . 30850 1 247 . 1 . 1 23 23 ASP HB3 H 1 2.736 0.000 . 2 . . . . A 312 ASP HB3 . 30850 1 248 . 1 . 1 23 23 ASP C C 13 177.851 0.000 . 1 . . . . A 312 ASP C . 30850 1 249 . 1 . 1 23 23 ASP CA C 13 57.909 0.000 . 1 . . . . A 312 ASP CA . 30850 1 250 . 1 . 1 23 23 ASP CB C 13 41.182 0.001 . 1 . . . . A 312 ASP CB . 30850 1 251 . 1 . 1 23 23 ASP CG C 13 176.493 0.000 . 1 . . . . A 312 ASP CG . 30850 1 252 . 1 . 1 23 23 ASP N N 15 123.656 0.002 . 1 . . . . A 312 ASP N . 30850 1 253 . 1 . 1 24 24 CYS H H 1 8.253 0.000 . 1 . . . . A 313 CYS H . 30850 1 254 . 1 . 1 24 24 CYS HA H 1 4.237 0.000 . 1 . . . . A 313 CYS HA . 30850 1 255 . 1 . 1 24 24 CYS HB2 H 1 3.680 0.000 . 2 . . . . A 313 CYS HB2 . 30850 1 256 . 1 . 1 24 24 CYS HB3 H 1 3.439 0.000 . 2 . . . . A 313 CYS HB3 . 30850 1 257 . 1 . 1 24 24 CYS C C 13 176.514 0.000 . 1 . . . . A 313 CYS C . 30850 1 258 . 1 . 1 24 24 CYS CA C 13 59.277 0.003 . 1 . . . . A 313 CYS CA . 30850 1 259 . 1 . 1 24 24 CYS CB C 13 42.716 0.001 . 1 . . . . A 313 CYS CB . 30850 1 260 . 1 . 1 24 24 CYS N N 15 119.002 0.000 . 1 . . . . A 313 CYS N . 30850 1 261 . 1 . 1 25 25 GLU H H 1 8.843 0.000 . 1 . . . . A 314 GLU H . 30850 1 262 . 1 . 1 25 25 GLU HA H 1 3.912 0.000 . 1 . . . . A 314 GLU HA . 30850 1 263 . 1 . 1 25 25 GLU HB2 H 1 2.299 0.000 . 2 . . . . A 314 GLU HB2 . 30850 1 264 . 1 . 1 25 25 GLU HB3 H 1 1.958 0.000 . 2 . . . . A 314 GLU HB3 . 30850 1 265 . 1 . 1 25 25 GLU HG2 H 1 2.668 0.004 . 2 . . . . A 314 GLU HG2 . 30850 1 266 . 1 . 1 25 25 GLU HG3 H 1 2.205 0.006 . 2 . . . . A 314 GLU HG3 . 30850 1 267 . 1 . 1 25 25 GLU C C 13 178.187 0.000 . 1 . . . . A 314 GLU C . 30850 1 268 . 1 . 1 25 25 GLU CA C 13 59.813 0.000 . 1 . . . . A 314 GLU CA . 30850 1 269 . 1 . 1 25 25 GLU CB C 13 29.850 0.000 . 1 . . . . A 314 GLU CB . 30850 1 270 . 1 . 1 25 25 GLU CG C 13 36.663 0.010 . 1 . . . . A 314 GLU CG . 30850 1 271 . 1 . 1 25 25 GLU CD C 13 178.821 0.000 . 1 . . . . A 314 GLU CD . 30850 1 272 . 1 . 1 25 25 GLU N N 15 120.321 0.000 . 1 . . . . A 314 GLU N . 30850 1 273 . 1 . 1 26 26 THR H H 1 8.309 0.000 . 1 . . . . A 315 THR H . 30850 1 274 . 1 . 1 26 26 THR HA H 1 4.326 0.000 . 1 . . . . A 315 THR HA . 30850 1 275 . 1 . 1 26 26 THR HB H 1 4.349 0.000 . 1 . . . . A 315 THR HB . 30850 1 276 . 1 . 1 26 26 THR HG21 H 1 1.264 0.001 . 1 . . . . A 315 THR HG21 . 30850 1 277 . 1 . 1 26 26 THR HG22 H 1 1.264 0.001 . 1 . . . . A 315 THR HG22 . 30850 1 278 . 1 . 1 26 26 THR HG23 H 1 1.264 0.001 . 1 . . . . A 315 THR HG23 . 30850 1 279 . 1 . 1 26 26 THR C C 13 176.037 0.000 . 1 . . . . A 315 THR C . 30850 1 280 . 1 . 1 26 26 THR CA C 13 67.038 0.001 . 1 . . . . A 315 THR CA . 30850 1 281 . 1 . 1 26 26 THR CB C 13 69.021 0.000 . 1 . . . . A 315 THR CB . 30850 1 282 . 1 . 1 26 26 THR CG2 C 13 21.266 0.000 . 1 . . . . A 315 THR CG2 . 30850 1 283 . 1 . 1 26 26 THR N N 15 116.201 0.000 . 1 . . . . A 315 THR N . 30850 1 284 . 1 . 1 27 27 ARG H H 1 8.028 0.000 . 1 . . . . A 316 ARG H . 30850 1 285 . 1 . 1 27 27 ARG HA H 1 3.958 0.000 . 1 . . . . A 316 ARG HA . 30850 1 286 . 1 . 1 27 27 ARG HB2 H 1 1.857 0.000 . 1 . . . . A 316 ARG HB2 . 30850 1 287 . 1 . 1 27 27 ARG HB3 H 1 2.023 0.000 . 1 . . . . A 316 ARG HB3 . 30850 1 288 . 1 . 1 27 27 ARG HG2 H 1 1.837 0.000 . 2 . . . . A 316 ARG HG2 . 30850 1 289 . 1 . 1 27 27 ARG HG3 H 1 1.653 0.000 . 2 . . . . A 316 ARG HG3 . 30850 1 290 . 1 . 1 27 27 ARG HD2 H 1 3.264 0.000 . 2 . . . . A 316 ARG HD2 . 30850 1 291 . 1 . 1 27 27 ARG HD3 H 1 3.264 0.000 . 2 . . . . A 316 ARG HD3 . 30850 1 292 . 1 . 1 27 27 ARG HE H 1 7.362 0.000 . 1 . . . . A 316 ARG HE . 30850 1 293 . 1 . 1 27 27 ARG C C 13 178.633 0.000 . 1 . . . . A 316 ARG C . 30850 1 294 . 1 . 1 27 27 ARG CA C 13 59.990 0.008 . 1 . . . . A 316 ARG CA . 30850 1 295 . 1 . 1 27 27 ARG CB C 13 30.154 0.001 . 1 . . . . A 316 ARG CB . 30850 1 296 . 1 . 1 27 27 ARG CG C 13 28.324 0.000 . 1 . . . . A 316 ARG CG . 30850 1 297 . 1 . 1 27 27 ARG CD C 13 43.731 0.000 . 1 . . . . A 316 ARG CD . 30850 1 298 . 1 . 1 27 27 ARG N N 15 120.245 0.000 . 1 . . . . A 316 ARG N . 30850 1 299 . 1 . 1 27 27 ARG NE N 15 85.406 0.000 . 1 . . . . A 316 ARG NE . 30850 1 300 . 1 . 1 28 28 TYR H H 1 8.375 0.000 . 1 . . . . A 317 TYR H . 30850 1 301 . 1 . 1 28 28 TYR HA H 1 4.019 0.000 . 1 . . . . A 317 TYR HA . 30850 1 302 . 1 . 1 28 28 TYR HB2 H 1 3.147 0.001 . 2 . . . . A 317 TYR HB2 . 30850 1 303 . 1 . 1 28 28 TYR HB3 H 1 3.010 0.001 . 2 . . . . A 317 TYR HB3 . 30850 1 304 . 1 . 1 28 28 TYR HD1 H 1 6.505 0.002 . 1 . . . . A 317 TYR HD1 . 30850 1 305 . 1 . 1 28 28 TYR HD2 H 1 6.505 0.002 . 1 . . . . A 317 TYR HD2 . 30850 1 306 . 1 . 1 28 28 TYR HE1 H 1 6.590 0.001 . 1 . . . . A 317 TYR HE1 . 30850 1 307 . 1 . 1 28 28 TYR HE2 H 1 6.590 0.001 . 1 . . . . A 317 TYR HE2 . 30850 1 308 . 1 . 1 28 28 TYR C C 13 179.207 0.000 . 1 . . . . A 317 TYR C . 30850 1 309 . 1 . 1 28 28 TYR CA C 13 62.291 0.007 . 1 . . . . A 317 TYR CA . 30850 1 310 . 1 . 1 28 28 TYR CB C 13 39.227 0.000 . 1 . . . . A 317 TYR CB . 30850 1 311 . 1 . 1 28 28 TYR CD1 C 13 133.030 0.001 . 1 . . . . A 317 TYR CD1 . 30850 1 312 . 1 . 1 28 28 TYR CD2 C 13 133.030 0.000 . 1 . . . . A 317 TYR CD2 . 30850 1 313 . 1 . 1 28 28 TYR CE1 C 13 118.097 0.007 . 1 . . . . A 317 TYR CE1 . 30850 1 314 . 1 . 1 28 28 TYR CE2 C 13 118.097 0.000 . 1 . . . . A 317 TYR CE2 . 30850 1 315 . 1 . 1 28 28 TYR N N 15 119.401 0.000 . 1 . . . . A 317 TYR N . 30850 1 316 . 1 . 1 29 29 LEU H H 1 8.568 0.000 . 1 . . . . A 318 LEU H . 30850 1 317 . 1 . 1 29 29 LEU HA H 1 3.892 0.000 . 1 . . . . A 318 LEU HA . 30850 1 318 . 1 . 1 29 29 LEU HB2 H 1 2.131 0.000 . 2 . . . . A 318 LEU HB2 . 30850 1 319 . 1 . 1 29 29 LEU HB3 H 1 1.946 0.006 . 2 . . . . A 318 LEU HB3 . 30850 1 320 . 1 . 1 29 29 LEU HG H 1 2.009 0.000 . 1 . . . . A 318 LEU HG . 30850 1 321 . 1 . 1 29 29 LEU HD11 H 1 1.015 0.000 . 1 . . . . A 318 LEU HD11 . 30850 1 322 . 1 . 1 29 29 LEU HD12 H 1 1.015 0.000 . 1 . . . . A 318 LEU HD12 . 30850 1 323 . 1 . 1 29 29 LEU HD13 H 1 1.015 0.000 . 1 . . . . A 318 LEU HD13 . 30850 1 324 . 1 . 1 29 29 LEU HD21 H 1 0.982 0.001 . 1 . . . . A 318 LEU HD21 . 30850 1 325 . 1 . 1 29 29 LEU HD22 H 1 0.982 0.001 . 1 . . . . A 318 LEU HD22 . 30850 1 326 . 1 . 1 29 29 LEU HD23 H 1 0.982 0.001 . 1 . . . . A 318 LEU HD23 . 30850 1 327 . 1 . 1 29 29 LEU C C 13 179.595 0.000 . 1 . . . . A 318 LEU C . 30850 1 328 . 1 . 1 29 29 LEU CA C 13 58.505 0.000 . 1 . . . . A 318 LEU CA . 30850 1 329 . 1 . 1 29 29 LEU CB C 13 40.947 0.003 . 1 . . . . A 318 LEU CB . 30850 1 330 . 1 . 1 29 29 LEU CG C 13 28.035 0.000 . 1 . . . . A 318 LEU CG . 30850 1 331 . 1 . 1 29 29 LEU CD1 C 13 25.498 0.002 . 1 . . . . A 318 LEU CD1 . 30850 1 332 . 1 . 1 29 29 LEU CD2 C 13 25.697 0.000 . 1 . . . . A 318 LEU CD2 . 30850 1 333 . 1 . 1 29 29 LEU N N 15 121.941 0.000 . 1 . . . . A 318 LEU N . 30850 1 334 . 1 . 1 30 30 VAL H H 1 8.831 0.000 . 1 . . . . A 319 VAL H . 30850 1 335 . 1 . 1 30 30 VAL HA H 1 3.430 0.001 . 1 . . . . A 319 VAL HA . 30850 1 336 . 1 . 1 30 30 VAL HB H 1 2.081 0.000 . 1 . . . . A 319 VAL HB . 30850 1 337 . 1 . 1 30 30 VAL HG11 H 1 0.865 0.000 . 2 . . . . A 319 VAL HG11 . 30850 1 338 . 1 . 1 30 30 VAL HG12 H 1 0.865 0.000 . 2 . . . . A 319 VAL HG12 . 30850 1 339 . 1 . 1 30 30 VAL HG13 H 1 0.865 0.000 . 2 . . . . A 319 VAL HG13 . 30850 1 340 . 1 . 1 30 30 VAL HG21 H 1 0.832 0.000 . 2 . . . . A 319 VAL HG21 . 30850 1 341 . 1 . 1 30 30 VAL HG22 H 1 0.832 0.000 . 2 . . . . A 319 VAL HG22 . 30850 1 342 . 1 . 1 30 30 VAL HG23 H 1 0.832 0.000 . 2 . . . . A 319 VAL HG23 . 30850 1 343 . 1 . 1 30 30 VAL C C 13 179.595 0.000 . 1 . . . . A 319 VAL C . 30850 1 344 . 1 . 1 30 30 VAL CA C 13 67.687 0.000 . 1 . . . . A 319 VAL CA . 30850 1 345 . 1 . 1 30 30 VAL CB C 13 31.387 0.000 . 1 . . . . A 319 VAL CB . 30850 1 346 . 1 . 1 30 30 VAL CG1 C 13 23.716 0.001 . 1 . . . . A 319 VAL CG1 . 30850 1 347 . 1 . 1 30 30 VAL CG2 C 13 21.333 0.000 . 1 . . . . A 319 VAL CG2 . 30850 1 348 . 1 . 1 30 30 VAL N N 15 121.489 0.000 . 1 . . . . A 319 VAL N . 30850 1 349 . 1 . 1 31 31 GLU H H 1 8.333 0.000 . 1 . . . . A 320 GLU H . 30850 1 350 . 1 . 1 31 31 GLU HA H 1 3.961 0.000 . 1 . . . . A 320 GLU HA . 30850 1 351 . 1 . 1 31 31 GLU HB2 H 1 1.855 0.001 . 2 . . . . A 320 GLU HB2 . 30850 1 352 . 1 . 1 31 31 GLU HB3 H 1 2.060 0.007 . 2 . . . . A 320 GLU HB3 . 30850 1 353 . 1 . 1 31 31 GLU HG2 H 1 2.142 0.000 . 1 . . . . A 320 GLU HG2 . 30850 1 354 . 1 . 1 31 31 GLU HG3 H 1 2.356 0.004 . 1 . . . . A 320 GLU HG3 . 30850 1 355 . 1 . 1 31 31 GLU C C 13 177.908 0.000 . 1 . . . . A 320 GLU C . 30850 1 356 . 1 . 1 31 31 GLU CA C 13 59.350 0.001 . 1 . . . . A 320 GLU CA . 30850 1 357 . 1 . 1 31 31 GLU CB C 13 29.817 0.000 . 1 . . . . A 320 GLU CB . 30850 1 358 . 1 . 1 31 31 GLU CG C 13 36.490 0.000 . 1 . . . . A 320 GLU CG . 30850 1 359 . 1 . 1 31 31 GLU CD C 13 180.950 0.000 . 1 . . . . A 320 GLU CD . 30850 1 360 . 1 . 1 31 31 GLU N N 15 119.181 0.000 . 1 . . . . A 320 GLU N . 30850 1 361 . 1 . 1 32 32 ASN H H 1 7.730 0.000 . 1 . . . . A 321 ASN H . 30850 1 362 . 1 . 1 32 32 ASN HA H 1 4.489 0.000 . 1 . . . . A 321 ASN HA . 30850 1 363 . 1 . 1 32 32 ASN HB2 H 1 2.319 0.001 . 2 . . . . A 321 ASN HB2 . 30850 1 364 . 1 . 1 32 32 ASN HB3 H 1 2.256 0.003 . 2 . . . . A 321 ASN HB3 . 30850 1 365 . 1 . 1 32 32 ASN HD21 H 1 6.455 0.000 . 2 . . . . A 321 ASN HD21 . 30850 1 366 . 1 . 1 32 32 ASN HD22 H 1 6.249 0.000 . 2 . . . . A 321 ASN HD22 . 30850 1 367 . 1 . 1 32 32 ASN C C 13 176.220 0.000 . 1 . . . . A 321 ASN C . 30850 1 368 . 1 . 1 32 32 ASN CA C 13 56.166 0.000 . 1 . . . . A 321 ASN CA . 30850 1 369 . 1 . 1 32 32 ASN CB C 13 40.245 0.001 . 1 . . . . A 321 ASN CB . 30850 1 370 . 1 . 1 32 32 ASN N N 15 113.082 0.000 . 1 . . . . A 321 ASN N . 30850 1 371 . 1 . 1 32 32 ASN ND2 N 15 114.760 0.009 . 1 . . . . A 321 ASN ND2 . 30850 1 372 . 1 . 1 33 33 CYS H H 1 8.857 0.000 . 1 . . . . A 322 CYS H . 30850 1 373 . 1 . 1 33 33 CYS HA H 1 4.981 0.000 . 1 . . . . A 322 CYS HA . 30850 1 374 . 1 . 1 33 33 CYS HB2 H 1 3.230 0.000 . 2 . . . . A 322 CYS HB2 . 30850 1 375 . 1 . 1 33 33 CYS HB3 H 1 2.792 0.002 . 2 . . . . A 322 CYS HB3 . 30850 1 376 . 1 . 1 33 33 CYS C C 13 174.629 0.000 . 1 . . . . A 322 CYS C . 30850 1 377 . 1 . 1 33 33 CYS CA C 13 52.852 0.008 . 1 . . . . A 322 CYS CA . 30850 1 378 . 1 . 1 33 33 CYS CB C 13 41.176 0.000 . 1 . . . . A 322 CYS CB . 30850 1 379 . 1 . 1 33 33 CYS N N 15 114.622 0.000 . 1 . . . . A 322 CYS N . 30850 1 380 . 1 . 1 34 34 ASN H H 1 8.114 0.000 . 1 . . . . A 323 ASN H . 30850 1 381 . 1 . 1 34 34 ASN HA H 1 4.666 0.000 . 1 . . . . A 323 ASN HA . 30850 1 382 . 1 . 1 34 34 ASN HB2 H 1 3.051 0.000 . 2 . . . . A 323 ASN HB2 . 30850 1 383 . 1 . 1 34 34 ASN HB3 H 1 2.689 0.000 . 2 . . . . A 323 ASN HB3 . 30850 1 384 . 1 . 1 34 34 ASN HD21 H 1 7.345 0.000 . 2 . . . . A 323 ASN HD21 . 30850 1 385 . 1 . 1 34 34 ASN HD22 H 1 6.726 0.000 . 2 . . . . A 323 ASN HD22 . 30850 1 386 . 1 . 1 34 34 ASN C C 13 173.451 0.000 . 1 . . . . A 323 ASN C . 30850 1 387 . 1 . 1 34 34 ASN CA C 13 54.209 0.001 . 1 . . . . A 323 ASN CA . 30850 1 388 . 1 . 1 34 34 ASN CB C 13 37.686 0.000 . 1 . . . . A 323 ASN CB . 30850 1 389 . 1 . 1 34 34 ASN N N 15 116.263 0.000 . 1 . . . . A 323 ASN N . 30850 1 390 . 1 . 1 34 34 ASN ND2 N 15 111.403 0.008 . 1 . . . . A 323 ASN ND2 . 30850 1 391 . 1 . 1 35 35 CYS H H 1 7.429 0.000 . 1 . . . . A 324 CYS H . 30850 1 392 . 1 . 1 35 35 CYS HA H 1 5.026 0.006 . 1 . . . . A 324 CYS HA . 30850 1 393 . 1 . 1 35 35 CYS HB2 H 1 2.995 0.002 . 2 . . . . A 324 CYS HB2 . 30850 1 394 . 1 . 1 35 35 CYS HB3 H 1 3.147 0.001 . 2 . . . . A 324 CYS HB3 . 30850 1 395 . 1 . 1 35 35 CYS C C 13 168.404 0.000 . 1 . . . . A 324 CYS C . 30850 1 396 . 1 . 1 35 35 CYS CA C 13 54.538 0.013 . 1 . . . . A 324 CYS CA . 30850 1 397 . 1 . 1 35 35 CYS CB C 13 44.572 0.000 . 1 . . . . A 324 CYS CB . 30850 1 398 . 1 . 1 35 35 CYS N N 15 110.553 0.000 . 1 . . . . A 324 CYS N . 30850 1 399 . 1 . 1 36 36 ARG H H 1 8.582 0.000 . 1 . . . . A 325 ARG H . 30850 1 400 . 1 . 1 36 36 ARG HA H 1 4.925 0.000 . 1 . . . . A 325 ARG HA . 30850 1 401 . 1 . 1 36 36 ARG HB2 H 1 1.506 0.000 . 2 . . . . A 325 ARG HB2 . 30850 1 402 . 1 . 1 36 36 ARG HB3 H 1 1.506 0.000 . 2 . . . . A 325 ARG HB3 . 30850 1 403 . 1 . 1 36 36 ARG HG2 H 1 1.305 0.001 . 1 . . . . A 325 ARG HG2 . 30850 1 404 . 1 . 1 36 36 ARG HG3 H 1 0.985 0.000 . 1 . . . . A 325 ARG HG3 . 30850 1 405 . 1 . 1 36 36 ARG HD2 H 1 2.567 0.000 . 2 . . . . A 325 ARG HD2 . 30850 1 406 . 1 . 1 36 36 ARG HD3 H 1 2.835 0.003 . 2 . . . . A 325 ARG HD3 . 30850 1 407 . 1 . 1 36 36 ARG HE H 1 7.001 0.000 . 1 . . . . A 325 ARG HE . 30850 1 408 . 1 . 1 36 36 ARG C C 13 175.696 0.000 . 1 . . . . A 325 ARG C . 30850 1 409 . 1 . 1 36 36 ARG CA C 13 52.630 0.003 . 1 . . . . A 325 ARG CA . 30850 1 410 . 1 . 1 36 36 ARG CB C 13 34.024 0.015 . 1 . . . . A 325 ARG CB . 30850 1 411 . 1 . 1 36 36 ARG CG C 13 25.842 0.003 . 1 . . . . A 325 ARG CG . 30850 1 412 . 1 . 1 36 36 ARG CD C 13 42.774 0.000 . 1 . . . . A 325 ARG CD . 30850 1 413 . 1 . 1 36 36 ARG N N 15 111.841 0.000 . 1 . . . . A 325 ARG N . 30850 1 414 . 1 . 1 36 36 ARG NE N 15 86.048 0.000 . 1 . . . . A 325 ARG NE . 30850 1 415 . 1 . 1 37 37 MET H H 1 7.619 0.000 . 1 . . . . A 326 MET H . 30850 1 416 . 1 . 1 37 37 MET HA H 1 4.663 0.000 . 1 . . . . A 326 MET HA . 30850 1 417 . 1 . 1 37 37 MET HB2 H 1 1.749 0.000 . 1 . . . . A 326 MET HB2 . 30850 1 418 . 1 . 1 37 37 MET HB3 H 1 2.572 0.002 . 1 . . . . A 326 MET HB3 . 30850 1 419 . 1 . 1 37 37 MET HG2 H 1 2.574 0.000 . 2 . . . . A 326 MET HG2 . 30850 1 420 . 1 . 1 37 37 MET HG3 H 1 2.453 0.001 . 2 . . . . A 326 MET HG3 . 30850 1 421 . 1 . 1 37 37 MET HE1 H 1 2.113 0.000 . 1 . . . . A 326 MET HE1 . 30850 1 422 . 1 . 1 37 37 MET HE2 H 1 2.113 0.000 . 1 . . . . A 326 MET HE2 . 30850 1 423 . 1 . 1 37 37 MET HE3 H 1 2.113 0.000 . 1 . . . . A 326 MET HE3 . 30850 1 424 . 1 . 1 37 37 MET C C 13 178.095 0.000 . 1 . . . . A 326 MET C . 30850 1 425 . 1 . 1 37 37 MET CA C 13 55.521 0.003 . 1 . . . . A 326 MET CA . 30850 1 426 . 1 . 1 37 37 MET CB C 13 34.371 0.002 . 1 . . . . A 326 MET CB . 30850 1 427 . 1 . 1 37 37 MET CG C 13 32.983 0.000 . 1 . . . . A 326 MET CG . 30850 1 428 . 1 . 1 37 37 MET CE C 13 18.278 0.000 . 1 . . . . A 326 MET CE . 30850 1 429 . 1 . 1 37 37 MET N N 15 120.452 0.000 . 1 . . . . A 326 MET N . 30850 1 430 . 1 . 1 38 38 VAL H H 1 8.163 0.000 . 1 . . . . A 327 VAL H . 30850 1 431 . 1 . 1 38 38 VAL HA H 1 3.894 0.000 . 1 . . . . A 327 VAL HA . 30850 1 432 . 1 . 1 38 38 VAL HB H 1 1.963 0.000 . 1 . . . . A 327 VAL HB . 30850 1 433 . 1 . 1 38 38 VAL HG11 H 1 0.775 0.000 . 2 . . . . A 327 VAL HG11 . 30850 1 434 . 1 . 1 38 38 VAL HG12 H 1 0.775 0.000 . 2 . . . . A 327 VAL HG12 . 30850 1 435 . 1 . 1 38 38 VAL HG13 H 1 0.775 0.000 . 2 . . . . A 327 VAL HG13 . 30850 1 436 . 1 . 1 38 38 VAL HG21 H 1 0.775 0.000 . 2 . . . . A 327 VAL HG21 . 30850 1 437 . 1 . 1 38 38 VAL HG22 H 1 0.775 0.000 . 2 . . . . A 327 VAL HG22 . 30850 1 438 . 1 . 1 38 38 VAL HG23 H 1 0.775 0.000 . 2 . . . . A 327 VAL HG23 . 30850 1 439 . 1 . 1 38 38 VAL C C 13 175.978 0.000 . 1 . . . . A 327 VAL C . 30850 1 440 . 1 . 1 38 38 VAL CA C 13 64.658 0.002 . 1 . . . . A 327 VAL CA . 30850 1 441 . 1 . 1 38 38 VAL CB C 13 31.644 0.000 . 1 . . . . A 327 VAL CB . 30850 1 442 . 1 . 1 38 38 VAL CG1 C 13 20.317 0.000 . 1 . . . . A 327 VAL CG1 . 30850 1 443 . 1 . 1 38 38 VAL CG2 C 13 20.317 0.000 . 1 . . . . A 327 VAL CG2 . 30850 1 444 . 1 . 1 38 38 VAL N N 15 115.387 0.000 . 1 . . . . A 327 VAL N . 30850 1 445 . 1 . 1 39 39 HIS H H 1 7.970 0.000 . 1 . . . . A 328 HIS H . 30850 1 446 . 1 . 1 39 39 HIS HA H 1 4.730 0.000 . 1 . . . . A 328 HIS HA . 30850 1 447 . 1 . 1 39 39 HIS HB2 H 1 3.387 0.000 . 2 . . . . A 328 HIS HB2 . 30850 1 448 . 1 . 1 39 39 HIS HB3 H 1 2.920 0.000 . 2 . . . . A 328 HIS HB3 . 30850 1 449 . 1 . 1 39 39 HIS HD2 H 1 6.891 0.001 . 1 . . . . A 328 HIS HD2 . 30850 1 450 . 1 . 1 39 39 HIS HE1 H 1 7.943 0.000 . 1 . . . . A 328 HIS HE1 . 30850 1 451 . 1 . 1 39 39 HIS C C 13 175.435 0.000 . 1 . . . . A 328 HIS C . 30850 1 452 . 1 . 1 39 39 HIS CA C 13 56.524 0.000 . 1 . . . . A 328 HIS CA . 30850 1 453 . 1 . 1 39 39 HIS CB C 13 30.251 0.000 . 1 . . . . A 328 HIS CB . 30850 1 454 . 1 . 1 39 39 HIS CD2 C 13 118.092 0.013 . 1 . . . . A 328 HIS CD2 . 30850 1 455 . 1 . 1 39 39 HIS CE1 C 13 139.274 0.000 . 1 . . . . A 328 HIS CE1 . 30850 1 456 . 1 . 1 39 39 HIS N N 15 115.599 0.000 . 1 . . . . A 328 HIS N . 30850 1 457 . 1 . 1 40 40 MET H H 1 7.488 0.000 . 1 . . . . A 329 MET H . 30850 1 458 . 1 . 1 40 40 MET HA H 1 4.237 0.000 . 1 . . . . A 329 MET HA . 30850 1 459 . 1 . 1 40 40 MET HB2 H 1 1.957 0.000 . 2 . . . . A 329 MET HB2 . 30850 1 460 . 1 . 1 40 40 MET HB3 H 1 2.342 0.001 . 2 . . . . A 329 MET HB3 . 30850 1 461 . 1 . 1 40 40 MET HG2 H 1 2.282 0.001 . 2 . . . . A 329 MET HG2 . 30850 1 462 . 1 . 1 40 40 MET HG3 H 1 1.725 0.001 . 2 . . . . A 329 MET HG3 . 30850 1 463 . 1 . 1 40 40 MET HE1 H 1 2.175 0.000 . 1 . . . . A 329 MET HE1 . 30850 1 464 . 1 . 1 40 40 MET HE2 H 1 2.175 0.000 . 1 . . . . A 329 MET HE2 . 30850 1 465 . 1 . 1 40 40 MET HE3 H 1 2.175 0.000 . 1 . . . . A 329 MET HE3 . 30850 1 466 . 1 . 1 40 40 MET C C 13 173.777 0.000 . 1 . . . . A 329 MET C . 30850 1 467 . 1 . 1 40 40 MET CA C 13 55.248 0.001 . 1 . . . . A 329 MET CA . 30850 1 468 . 1 . 1 40 40 MET CB C 13 32.100 0.000 . 1 . . . . A 329 MET CB . 30850 1 469 . 1 . 1 40 40 MET CG C 13 34.250 0.000 . 1 . . . . A 329 MET CG . 30850 1 470 . 1 . 1 40 40 MET CE C 13 19.262 0.008 . 1 . . . . A 329 MET CE . 30850 1 471 . 1 . 1 40 40 MET N N 15 122.422 0.000 . 1 . . . . A 329 MET N . 30850 1 472 . 1 . 1 41 41 PRO HA H 1 4.652 0.001 . 1 . . . . A 330 PRO HA . 30850 1 473 . 1 . 1 41 41 PRO HB2 H 1 2.212 0.000 . 2 . . . . A 330 PRO HB2 . 30850 1 474 . 1 . 1 41 41 PRO HB3 H 1 2.091 0.004 . 2 . . . . A 330 PRO HB3 . 30850 1 475 . 1 . 1 41 41 PRO HG2 H 1 2.066 0.001 . 2 . . . . A 330 PRO HG2 . 30850 1 476 . 1 . 1 41 41 PRO HG3 H 1 1.946 0.000 . 2 . . . . A 330 PRO HG3 . 30850 1 477 . 1 . 1 41 41 PRO HD2 H 1 3.984 0.000 . 1 . . . . A 330 PRO HD2 . 30850 1 478 . 1 . 1 41 41 PRO HD3 H 1 3.594 0.004 . 1 . . . . A 330 PRO HD3 . 30850 1 479 . 1 . 1 41 41 PRO C C 13 175.086 0.000 . 1 . . . . A 330 PRO C . 30850 1 480 . 1 . 1 41 41 PRO CA C 13 62.544 0.000 . 1 . . . . A 330 PRO CA . 30850 1 481 . 1 . 1 41 41 PRO CB C 13 32.829 0.001 . 1 . . . . A 330 PRO CB . 30850 1 482 . 1 . 1 41 41 PRO CG C 13 26.360 0.009 . 1 . . . . A 330 PRO CG . 30850 1 483 . 1 . 1 41 41 PRO CD C 13 49.717 0.001 . 1 . . . . A 330 PRO CD . 30850 1 484 . 1 . 1 42 42 GLY H H 1 8.034 0.000 . 1 . . . . A 331 GLY H . 30850 1 485 . 1 . 1 42 42 GLY HA2 H 1 4.297 0.000 . 2 . . . . A 331 GLY HA2 . 30850 1 486 . 1 . 1 42 42 GLY HA3 H 1 3.603 0.000 . 2 . . . . A 331 GLY HA3 . 30850 1 487 . 1 . 1 42 42 GLY C C 13 172.840 0.000 . 1 . . . . A 331 GLY C . 30850 1 488 . 1 . 1 42 42 GLY CA C 13 44.597 0.000 . 1 . . . . A 331 GLY CA . 30850 1 489 . 1 . 1 42 42 GLY N N 15 104.219 0.000 . 1 . . . . A 331 GLY N . 30850 1 490 . 1 . 1 43 43 ASP H H 1 7.901 0.000 . 1 . . . . A 332 ASP H . 30850 1 491 . 1 . 1 43 43 ASP HA H 1 4.643 0.000 . 1 . . . . A 332 ASP HA . 30850 1 492 . 1 . 1 43 43 ASP HB2 H 1 2.567 0.001 . 2 . . . . A 332 ASP HB2 . 30850 1 493 . 1 . 1 43 43 ASP HB3 H 1 2.503 0.000 . 2 . . . . A 332 ASP HB3 . 30850 1 494 . 1 . 1 43 43 ASP C C 13 176.710 0.000 . 1 . . . . A 332 ASP C . 30850 1 495 . 1 . 1 43 43 ASP CA C 13 53.280 0.003 . 1 . . . . A 332 ASP CA . 30850 1 496 . 1 . 1 43 43 ASP CB C 13 42.087 0.002 . 1 . . . . A 332 ASP CB . 30850 1 497 . 1 . 1 43 43 ASP CG C 13 178.070 0.000 . 1 . . . . A 332 ASP CG . 30850 1 498 . 1 . 1 43 43 ASP N N 15 116.130 0.000 . 1 . . . . A 332 ASP N . 30850 1 499 . 1 . 1 44 44 ALA H H 1 7.914 0.000 . 1 . . . . A 333 ALA H . 30850 1 500 . 1 . 1 44 44 ALA HA H 1 4.339 0.000 . 1 . . . . A 333 ALA HA . 30850 1 501 . 1 . 1 44 44 ALA HB1 H 1 1.120 0.000 . 1 . . . . A 333 ALA HB1 . 30850 1 502 . 1 . 1 44 44 ALA HB2 H 1 1.120 0.000 . 1 . . . . A 333 ALA HB2 . 30850 1 503 . 1 . 1 44 44 ALA HB3 H 1 1.120 0.000 . 1 . . . . A 333 ALA HB3 . 30850 1 504 . 1 . 1 44 44 ALA C C 13 174.380 0.000 . 1 . . . . A 333 ALA C . 30850 1 505 . 1 . 1 44 44 ALA CA C 13 51.319 0.002 . 1 . . . . A 333 ALA CA . 30850 1 506 . 1 . 1 44 44 ALA CB C 13 17.291 0.000 . 1 . . . . A 333 ALA CB . 30850 1 507 . 1 . 1 44 44 ALA N N 15 124.141 0.001 . 1 . . . . A 333 ALA N . 30850 1 508 . 1 . 1 45 45 PRO HA H 1 4.241 0.000 . 1 . . . . A 334 PRO HA . 30850 1 509 . 1 . 1 45 45 PRO HB2 H 1 2.284 0.000 . 2 . . . . A 334 PRO HB2 . 30850 1 510 . 1 . 1 45 45 PRO HB3 H 1 1.834 0.000 . 2 . . . . A 334 PRO HB3 . 30850 1 511 . 1 . 1 45 45 PRO HG2 H 1 2.128 0.000 . 2 . . . . A 334 PRO HG2 . 30850 1 512 . 1 . 1 45 45 PRO HG3 H 1 1.983 0.000 . 2 . . . . A 334 PRO HG3 . 30850 1 513 . 1 . 1 45 45 PRO HD2 H 1 3.673 0.000 . 2 . . . . A 334 PRO HD2 . 30850 1 514 . 1 . 1 45 45 PRO HD3 H 1 3.484 0.000 . 2 . . . . A 334 PRO HD3 . 30850 1 515 . 1 . 1 45 45 PRO C C 13 176.803 0.000 . 1 . . . . A 334 PRO C . 30850 1 516 . 1 . 1 45 45 PRO CA C 13 62.451 0.000 . 1 . . . . A 334 PRO CA . 30850 1 517 . 1 . 1 45 45 PRO CB C 13 32.032 0.001 . 1 . . . . A 334 PRO CB . 30850 1 518 . 1 . 1 45 45 PRO CG C 13 27.928 0.004 . 1 . . . . A 334 PRO CG . 30850 1 519 . 1 . 1 45 45 PRO CD C 13 50.004 0.007 . 1 . . . . A 334 PRO CD . 30850 1 520 . 1 . 1 46 46 TYR H H 1 8.334 0.000 . 1 . . . . A 335 TYR H . 30850 1 521 . 1 . 1 46 46 TYR HA H 1 5.178 0.001 . 1 . . . . A 335 TYR HA . 30850 1 522 . 1 . 1 46 46 TYR HB2 H 1 3.163 0.000 . 2 . . . . A 335 TYR HB2 . 30850 1 523 . 1 . 1 46 46 TYR HB3 H 1 2.694 0.000 . 2 . . . . A 335 TYR HB3 . 30850 1 524 . 1 . 1 46 46 TYR HD1 H 1 7.020 0.001 . 1 . . . . A 335 TYR HD1 . 30850 1 525 . 1 . 1 46 46 TYR HD2 H 1 7.020 0.001 . 1 . . . . A 335 TYR HD2 . 30850 1 526 . 1 . 1 46 46 TYR HE1 H 1 6.798 0.000 . 1 . . . . A 335 TYR HE1 . 30850 1 527 . 1 . 1 46 46 TYR HE2 H 1 6.798 0.000 . 1 . . . . A 335 TYR HE2 . 30850 1 528 . 1 . 1 46 46 TYR C C 13 178.919 0.000 . 1 . . . . A 335 TYR C . 30850 1 529 . 1 . 1 46 46 TYR CA C 13 57.314 0.017 . 1 . . . . A 335 TYR CA . 30850 1 530 . 1 . 1 46 46 TYR CB C 13 37.779 0.001 . 1 . . . . A 335 TYR CB . 30850 1 531 . 1 . 1 46 46 TYR CD1 C 13 132.443 0.000 . 1 . . . . A 335 TYR CD1 . 30850 1 532 . 1 . 1 46 46 TYR CD2 C 13 132.443 0.003 . 1 . . . . A 335 TYR CD2 . 30850 1 533 . 1 . 1 46 46 TYR CE1 C 13 117.926 0.000 . 1 . . . . A 335 TYR CE1 . 30850 1 534 . 1 . 1 46 46 TYR CE2 C 13 117.926 0.001 . 1 . . . . A 335 TYR CE2 . 30850 1 535 . 1 . 1 46 46 TYR N N 15 120.150 0.000 . 1 . . . . A 335 TYR N . 30850 1 536 . 1 . 1 47 47 CYS H H 1 8.969 0.000 . 1 . . . . A 336 CYS H . 30850 1 537 . 1 . 1 47 47 CYS HA H 1 4.676 0.000 . 1 . . . . A 336 CYS HA . 30850 1 538 . 1 . 1 47 47 CYS HB2 H 1 2.868 0.000 . 2 . . . . A 336 CYS HB2 . 30850 1 539 . 1 . 1 47 47 CYS HB3 H 1 2.282 0.003 . 2 . . . . A 336 CYS HB3 . 30850 1 540 . 1 . 1 47 47 CYS C C 13 175.394 0.000 . 1 . . . . A 336 CYS C . 30850 1 541 . 1 . 1 47 47 CYS CA C 13 55.019 0.000 . 1 . . . . A 336 CYS CA . 30850 1 542 . 1 . 1 47 47 CYS CB C 13 40.837 0.001 . 1 . . . . A 336 CYS CB . 30850 1 543 . 1 . 1 47 47 CYS N N 15 122.378 0.001 . 1 . . . . A 336 CYS N . 30850 1 544 . 1 . 1 48 48 THR H H 1 9.306 0.000 . 1 . . . . A 337 THR H . 30850 1 545 . 1 . 1 48 48 THR HA H 1 4.696 0.000 . 1 . . . . A 337 THR HA . 30850 1 546 . 1 . 1 48 48 THR HB H 1 4.901 0.000 . 1 . . . . A 337 THR HB . 30850 1 547 . 1 . 1 48 48 THR HG1 H 1 5.789 0.000 . 1 . . . . A 337 THR HG1 . 30850 1 548 . 1 . 1 48 48 THR HG21 H 1 1.462 0.000 . 1 . . . . A 337 THR HG21 . 30850 1 549 . 1 . 1 48 48 THR HG22 H 1 1.462 0.000 . 1 . . . . A 337 THR HG22 . 30850 1 550 . 1 . 1 48 48 THR HG23 H 1 1.462 0.000 . 1 . . . . A 337 THR HG23 . 30850 1 551 . 1 . 1 48 48 THR C C 13 173.418 0.000 . 1 . . . . A 337 THR C . 30850 1 552 . 1 . 1 48 48 THR CA C 13 60.647 0.000 . 1 . . . . A 337 THR CA . 30850 1 553 . 1 . 1 48 48 THR CB C 13 68.325 0.009 . 1 . . . . A 337 THR CB . 30850 1 554 . 1 . 1 48 48 THR CG2 C 13 21.929 0.000 . 1 . . . . A 337 THR CG2 . 30850 1 555 . 1 . 1 48 48 THR N N 15 117.746 0.001 . 1 . . . . A 337 THR N . 30850 1 556 . 1 . 1 49 49 PRO HA H 1 4.372 0.000 . 1 . . . . A 338 PRO HA . 30850 1 557 . 1 . 1 49 49 PRO HB2 H 1 2.416 0.000 . 2 . . . . A 338 PRO HB2 . 30850 1 558 . 1 . 1 49 49 PRO HB3 H 1 2.416 0.000 . 2 . . . . A 338 PRO HB3 . 30850 1 559 . 1 . 1 49 49 PRO HG2 H 1 2.262 0.000 . 1 . . . . A 338 PRO HG2 . 30850 1 560 . 1 . 1 49 49 PRO HG3 H 1 2.031 0.000 . 1 . . . . A 338 PRO HG3 . 30850 1 561 . 1 . 1 49 49 PRO HD2 H 1 3.961 0.000 . 1 . . . . A 338 PRO HD2 . 30850 1 562 . 1 . 1 49 49 PRO HD3 H 1 4.003 0.000 . 1 . . . . A 338 PRO HD3 . 30850 1 563 . 1 . 1 49 49 PRO C C 13 179.719 0.000 . 1 . . . . A 338 PRO C . 30850 1 564 . 1 . 1 49 49 PRO CA C 13 66.554 0.000 . 1 . . . . A 338 PRO CA . 30850 1 565 . 1 . 1 49 49 PRO CB C 13 31.708 0.015 . 1 . . . . A 338 PRO CB . 30850 1 566 . 1 . 1 49 49 PRO CG C 13 28.489 0.000 . 1 . . . . A 338 PRO CG . 30850 1 567 . 1 . 1 49 49 PRO CD C 13 50.195 0.001 . 1 . . . . A 338 PRO CD . 30850 1 568 . 1 . 1 50 50 GLU H H 1 8.718 0.000 . 1 . . . . A 339 GLU H . 30850 1 569 . 1 . 1 50 50 GLU HA H 1 4.092 0.000 . 1 . . . . A 339 GLU HA . 30850 1 570 . 1 . 1 50 50 GLU HB2 H 1 2.050 0.000 . 1 . . . . A 339 GLU HB2 . 30850 1 571 . 1 . 1 50 50 GLU HB3 H 1 1.961 0.000 . 1 . . . . A 339 GLU HB3 . 30850 1 572 . 1 . 1 50 50 GLU HG2 H 1 2.437 0.001 . 2 . . . . A 339 GLU HG2 . 30850 1 573 . 1 . 1 50 50 GLU HG3 H 1 2.254 0.004 . 2 . . . . A 339 GLU HG3 . 30850 1 574 . 1 . 1 50 50 GLU C C 13 178.406 0.000 . 1 . . . . A 339 GLU C . 30850 1 575 . 1 . 1 50 50 GLU CA C 13 60.598 0.000 . 1 . . . . A 339 GLU CA . 30850 1 576 . 1 . 1 50 50 GLU CB C 13 28.911 0.000 . 1 . . . . A 339 GLU CB . 30850 1 577 . 1 . 1 50 50 GLU CG C 13 37.194 0.012 . 1 . . . . A 339 GLU CG . 30850 1 578 . 1 . 1 50 50 GLU CD C 13 181.779 0.000 . 1 . . . . A 339 GLU CD . 30850 1 579 . 1 . 1 50 50 GLU N N 15 117.918 0.000 . 1 . . . . A 339 GLU N . 30850 1 580 . 1 . 1 51 51 GLN H H 1 7.820 0.000 . 1 . . . . A 340 GLN H . 30850 1 581 . 1 . 1 51 51 GLN HA H 1 4.182 0.000 . 1 . . . . A 340 GLN HA . 30850 1 582 . 1 . 1 51 51 GLN HB2 H 1 2.000 0.000 . 2 . . . . A 340 GLN HB2 . 30850 1 583 . 1 . 1 51 51 GLN HB3 H 1 2.000 0.000 . 2 . . . . A 340 GLN HB3 . 30850 1 584 . 1 . 1 51 51 GLN HG2 H 1 2.500 0.002 . 2 . . . . A 340 GLN HG2 . 30850 1 585 . 1 . 1 51 51 GLN HG3 H 1 2.500 0.002 . 2 . . . . A 340 GLN HG3 . 30850 1 586 . 1 . 1 51 51 GLN HE21 H 1 7.552 0.000 . 1 . . . . A 340 GLN HE21 . 30850 1 587 . 1 . 1 51 51 GLN HE22 H 1 6.881 0.000 . 1 . . . . A 340 GLN HE22 . 30850 1 588 . 1 . 1 51 51 GLN C C 13 180.900 0.000 . 1 . . . . A 340 GLN C . 30850 1 589 . 1 . 1 51 51 GLN CA C 13 58.924 0.001 . 1 . . . . A 340 GLN CA . 30850 1 590 . 1 . 1 51 51 GLN CB C 13 30.727 0.000 . 1 . . . . A 340 GLN CB . 30850 1 591 . 1 . 1 51 51 GLN CG C 13 35.212 0.006 . 1 . . . . A 340 GLN CG . 30850 1 592 . 1 . 1 51 51 GLN N N 15 118.976 0.000 . 1 . . . . A 340 GLN N . 30850 1 593 . 1 . 1 51 51 GLN NE2 N 15 112.180 0.016 . 1 . . . . A 340 GLN NE2 . 30850 1 594 . 1 . 1 52 52 TYR H H 1 9.091 0.000 . 1 . . . . A 341 TYR H . 30850 1 595 . 1 . 1 52 52 TYR HA H 1 4.151 0.002 . 1 . . . . A 341 TYR HA . 30850 1 596 . 1 . 1 52 52 TYR HB2 H 1 3.125 0.000 . 1 . . . . A 341 TYR HB2 . 30850 1 597 . 1 . 1 52 52 TYR HB3 H 1 3.200 0.002 . 1 . . . . A 341 TYR HB3 . 30850 1 598 . 1 . 1 52 52 TYR HD1 H 1 7.122 0.000 . 1 . . . . A 341 TYR HD1 . 30850 1 599 . 1 . 1 52 52 TYR HD2 H 1 7.122 0.000 . 1 . . . . A 341 TYR HD2 . 30850 1 600 . 1 . 1 52 52 TYR HE1 H 1 6.870 0.001 . 1 . . . . A 341 TYR HE1 . 30850 1 601 . 1 . 1 52 52 TYR HE2 H 1 6.870 0.001 . 1 . . . . A 341 TYR HE2 . 30850 1 602 . 1 . 1 52 52 TYR C C 13 176.208 0.000 . 1 . . . . A 341 TYR C . 30850 1 603 . 1 . 1 52 52 TYR CA C 13 62.953 0.000 . 1 . . . . A 341 TYR CA . 30850 1 604 . 1 . 1 52 52 TYR CB C 13 37.990 0.000 . 1 . . . . A 341 TYR CB . 30850 1 605 . 1 . 1 52 52 TYR CD1 C 13 133.456 0.000 . 1 . . . . A 341 TYR CD1 . 30850 1 606 . 1 . 1 52 52 TYR CD2 C 13 133.456 0.000 . 1 . . . . A 341 TYR CD2 . 30850 1 607 . 1 . 1 52 52 TYR CE1 C 13 118.747 0.000 . 1 . . . . A 341 TYR CE1 . 30850 1 608 . 1 . 1 52 52 TYR CE2 C 13 118.747 0.012 . 1 . . . . A 341 TYR CE2 . 30850 1 609 . 1 . 1 52 52 TYR N N 15 121.938 0.000 . 1 . . . . A 341 TYR N . 30850 1 610 . 1 . 1 53 53 LYS H H 1 7.569 0.000 . 1 . . . . A 342 LYS H . 30850 1 611 . 1 . 1 53 53 LYS HA H 1 4.115 0.002 . 1 . . . . A 342 LYS HA . 30850 1 612 . 1 . 1 53 53 LYS HB2 H 1 1.983 0.000 . 1 . . . . A 342 LYS HB2 . 30850 1 613 . 1 . 1 53 53 LYS HB3 H 1 1.924 0.000 . 1 . . . . A 342 LYS HB3 . 30850 1 614 . 1 . 1 53 53 LYS HG2 H 1 1.557 0.000 . 1 . . . . A 342 LYS HG2 . 30850 1 615 . 1 . 1 53 53 LYS HG3 H 1 1.485 0.000 . 1 . . . . A 342 LYS HG3 . 30850 1 616 . 1 . 1 53 53 LYS HD2 H 1 1.729 0.000 . 2 . . . . A 342 LYS HD2 . 30850 1 617 . 1 . 1 53 53 LYS HD3 H 1 1.729 0.000 . 2 . . . . A 342 LYS HD3 . 30850 1 618 . 1 . 1 53 53 LYS HE2 H 1 3.003 0.003 . 2 . . . . A 342 LYS HE2 . 30850 1 619 . 1 . 1 53 53 LYS HE3 H 1 3.003 0.003 . 2 . . . . A 342 LYS HE3 . 30850 1 620 . 1 . 1 53 53 LYS C C 13 178.601 0.000 . 1 . . . . A 342 LYS C . 30850 1 621 . 1 . 1 53 53 LYS CA C 13 58.924 0.000 . 1 . . . . A 342 LYS CA . 30850 1 622 . 1 . 1 53 53 LYS CB C 13 33.170 0.001 . 1 . . . . A 342 LYS CB . 30850 1 623 . 1 . 1 53 53 LYS CG C 13 24.767 0.000 . 1 . . . . A 342 LYS CG . 30850 1 624 . 1 . 1 53 53 LYS CD C 13 29.213 0.030 . 1 . . . . A 342 LYS CD . 30850 1 625 . 1 . 1 53 53 LYS CE C 13 42.267 0.011 . 1 . . . . A 342 LYS CE . 30850 1 626 . 1 . 1 53 53 LYS N N 15 116.047 0.000 . 1 . . . . A 342 LYS N . 30850 1 627 . 1 . 1 54 54 GLU H H 1 8.344 0.000 . 1 . . . . A 343 GLU H . 30850 1 628 . 1 . 1 54 54 GLU HA H 1 4.175 0.000 . 1 . . . . A 343 GLU HA . 30850 1 629 . 1 . 1 54 54 GLU HB2 H 1 1.985 0.000 . 2 . . . . A 343 GLU HB2 . 30850 1 630 . 1 . 1 54 54 GLU HB3 H 1 1.985 0.000 . 2 . . . . A 343 GLU HB3 . 30850 1 631 . 1 . 1 54 54 GLU HG2 H 1 2.388 0.000 . 1 . . . . A 343 GLU HG2 . 30850 1 632 . 1 . 1 54 54 GLU HG3 H 1 2.281 0.000 . 1 . . . . A 343 GLU HG3 . 30850 1 633 . 1 . 1 54 54 GLU C C 13 176.726 0.000 . 1 . . . . A 343 GLU C . 30850 1 634 . 1 . 1 54 54 GLU CA C 13 57.549 0.000 . 1 . . . . A 343 GLU CA . 30850 1 635 . 1 . 1 54 54 GLU CB C 13 30.492 0.000 . 1 . . . . A 343 GLU CB . 30850 1 636 . 1 . 1 54 54 GLU CG C 13 36.300 0.000 . 1 . . . . A 343 GLU CG . 30850 1 637 . 1 . 1 54 54 GLU CD C 13 180.544 0.000 . 1 . . . . A 343 GLU CD . 30850 1 638 . 1 . 1 54 54 GLU N N 15 112.912 0.000 . 1 . . . . A 343 GLU N . 30850 1 639 . 1 . 1 55 55 CYS H H 1 7.895 0.000 . 1 . . . . A 344 CYS H . 30850 1 640 . 1 . 1 55 55 CYS HA H 1 4.699 0.000 . 1 . . . . A 344 CYS HA . 30850 1 641 . 1 . 1 55 55 CYS HB2 H 1 3.013 0.000 . 1 . . . . A 344 CYS HB2 . 30850 1 642 . 1 . 1 55 55 CYS HB3 H 1 3.115 0.000 . 1 . . . . A 344 CYS HB3 . 30850 1 643 . 1 . 1 55 55 CYS C C 13 174.965 0.000 . 1 . . . . A 344 CYS C . 30850 1 644 . 1 . 1 55 55 CYS CA C 13 59.296 0.000 . 1 . . . . A 344 CYS CA . 30850 1 645 . 1 . 1 55 55 CYS CB C 13 42.250 0.000 . 1 . . . . A 344 CYS CB . 30850 1 646 . 1 . 1 55 55 CYS N N 15 115.840 0.000 . 1 . . . . A 344 CYS N . 30850 1 647 . 1 . 1 56 56 ALA H H 1 8.845 0.000 . 1 . . . . A 345 ALA H . 30850 1 648 . 1 . 1 56 56 ALA HA H 1 4.096 0.000 . 1 . . . . A 345 ALA HA . 30850 1 649 . 1 . 1 56 56 ALA HB1 H 1 1.311 0.000 . 1 . . . . A 345 ALA HB1 . 30850 1 650 . 1 . 1 56 56 ALA HB2 H 1 1.311 0.000 . 1 . . . . A 345 ALA HB2 . 30850 1 651 . 1 . 1 56 56 ALA HB3 H 1 1.311 0.000 . 1 . . . . A 345 ALA HB3 . 30850 1 652 . 1 . 1 56 56 ALA C C 13 177.200 0.000 . 1 . . . . A 345 ALA C . 30850 1 653 . 1 . 1 56 56 ALA CA C 13 56.169 0.002 . 1 . . . . A 345 ALA CA . 30850 1 654 . 1 . 1 56 56 ALA CB C 13 20.076 0.000 . 1 . . . . A 345 ALA CB . 30850 1 655 . 1 . 1 56 56 ALA N N 15 124.857 0.000 . 1 . . . . A 345 ALA N . 30850 1 656 . 1 . 1 57 57 ASP H H 1 9.171 0.000 . 1 . . . . A 346 ASP H . 30850 1 657 . 1 . 1 57 57 ASP HA H 1 4.613 0.000 . 1 . . . . A 346 ASP HA . 30850 1 658 . 1 . 1 57 57 ASP HB2 H 1 2.593 0.002 . 2 . . . . A 346 ASP HB2 . 30850 1 659 . 1 . 1 57 57 ASP HB3 H 1 2.593 0.002 . 2 . . . . A 346 ASP HB3 . 30850 1 660 . 1 . 1 57 57 ASP CA C 13 58.275 0.000 . 1 . . . . A 346 ASP CA . 30850 1 661 . 1 . 1 57 57 ASP CB C 13 37.753 0.001 . 1 . . . . A 346 ASP CB . 30850 1 662 . 1 . 1 57 57 ASP CG C 13 175.966 0.000 . 1 . . . . A 346 ASP CG . 30850 1 663 . 1 . 1 57 57 ASP N N 15 117.940 0.000 . 1 . . . . A 346 ASP N . 30850 1 664 . 1 . 1 58 58 PRO HA H 1 4.348 0.001 . 1 . . . . A 347 PRO HA . 30850 1 665 . 1 . 1 58 58 PRO HB2 H 1 2.280 0.000 . 2 . . . . A 347 PRO HB2 . 30850 1 666 . 1 . 1 58 58 PRO HB3 H 1 1.814 0.003 . 2 . . . . A 347 PRO HB3 . 30850 1 667 . 1 . 1 58 58 PRO HG2 H 1 1.897 0.000 . 2 . . . . A 347 PRO HG2 . 30850 1 668 . 1 . 1 58 58 PRO HG3 H 1 1.897 0.000 . 2 . . . . A 347 PRO HG3 . 30850 1 669 . 1 . 1 58 58 PRO HD2 H 1 3.329 0.000 . 1 . . . . A 347 PRO HD2 . 30850 1 670 . 1 . 1 58 58 PRO HD3 H 1 3.562 0.000 . 1 . . . . A 347 PRO HD3 . 30850 1 671 . 1 . 1 58 58 PRO C C 13 179.570 0.000 . 1 . . . . A 347 PRO C . 30850 1 672 . 1 . 1 58 58 PRO CA C 13 65.427 0.001 . 1 . . . . A 347 PRO CA . 30850 1 673 . 1 . 1 58 58 PRO CB C 13 30.530 0.002 . 1 . . . . A 347 PRO CB . 30850 1 674 . 1 . 1 58 58 PRO CG C 13 27.739 0.004 . 1 . . . . A 347 PRO CG . 30850 1 675 . 1 . 1 58 58 PRO CD C 13 50.098 0.008 . 1 . . . . A 347 PRO CD . 30850 1 676 . 1 . 1 59 59 ALA H H 1 7.797 0.000 . 1 . . . . A 348 ALA H . 30850 1 677 . 1 . 1 59 59 ALA HA H 1 4.374 0.000 . 1 . . . . A 348 ALA HA . 30850 1 678 . 1 . 1 59 59 ALA HB1 H 1 1.556 0.000 . 1 . . . . A 348 ALA HB1 . 30850 1 679 . 1 . 1 59 59 ALA HB2 H 1 1.556 0.000 . 1 . . . . A 348 ALA HB2 . 30850 1 680 . 1 . 1 59 59 ALA HB3 H 1 1.556 0.000 . 1 . . . . A 348 ALA HB3 . 30850 1 681 . 1 . 1 59 59 ALA C C 13 179.506 0.000 . 1 . . . . A 348 ALA C . 30850 1 682 . 1 . 1 59 59 ALA CA C 13 55.223 0.000 . 1 . . . . A 348 ALA CA . 30850 1 683 . 1 . 1 59 59 ALA CB C 13 18.184 0.000 . 1 . . . . A 348 ALA CB . 30850 1 684 . 1 . 1 59 59 ALA N N 15 120.875 0.001 . 1 . . . . A 348 ALA N . 30850 1 685 . 1 . 1 60 60 LEU H H 1 8.499 0.000 . 1 . . . . A 349 LEU H . 30850 1 686 . 1 . 1 60 60 LEU HA H 1 4.131 0.000 . 1 . . . . A 349 LEU HA . 30850 1 687 . 1 . 1 60 60 LEU HB2 H 1 1.944 0.000 . 2 . . . . A 349 LEU HB2 . 30850 1 688 . 1 . 1 60 60 LEU HB3 H 1 1.716 0.001 . 2 . . . . A 349 LEU HB3 . 30850 1 689 . 1 . 1 60 60 LEU HG H 1 1.946 0.000 . 1 . . . . A 349 LEU HG . 30850 1 690 . 1 . 1 60 60 LEU HD11 H 1 0.953 0.000 . 2 . . . . A 349 LEU HD11 . 30850 1 691 . 1 . 1 60 60 LEU HD12 H 1 0.953 0.000 . 2 . . . . A 349 LEU HD12 . 30850 1 692 . 1 . 1 60 60 LEU HD13 H 1 0.953 0.000 . 2 . . . . A 349 LEU HD13 . 30850 1 693 . 1 . 1 60 60 LEU HD21 H 1 1.014 0.000 . 2 . . . . A 349 LEU HD21 . 30850 1 694 . 1 . 1 60 60 LEU HD22 H 1 1.014 0.000 . 2 . . . . A 349 LEU HD22 . 30850 1 695 . 1 . 1 60 60 LEU HD23 H 1 1.014 0.000 . 2 . . . . A 349 LEU HD23 . 30850 1 696 . 1 . 1 60 60 LEU C C 13 179.473 0.000 . 1 . . . . A 349 LEU C . 30850 1 697 . 1 . 1 60 60 LEU CA C 13 57.792 0.006 . 1 . . . . A 349 LEU CA . 30850 1 698 . 1 . 1 60 60 LEU CB C 13 40.912 0.011 . 1 . . . . A 349 LEU CB . 30850 1 699 . 1 . 1 60 60 LEU CG C 13 27.309 0.000 . 1 . . . . A 349 LEU CG . 30850 1 700 . 1 . 1 60 60 LEU CD1 C 13 23.229 0.000 . 1 . . . . A 349 LEU CD1 . 30850 1 701 . 1 . 1 60 60 LEU CD2 C 13 25.104 0.000 . 1 . . . . A 349 LEU CD2 . 30850 1 702 . 1 . 1 60 60 LEU N N 15 119.136 0.000 . 1 . . . . A 349 LEU N . 30850 1 703 . 1 . 1 61 61 ASP H H 1 7.929 0.000 . 1 . . . . A 350 ASP H . 30850 1 704 . 1 . 1 61 61 ASP HA H 1 4.397 0.000 . 1 . . . . A 350 ASP HA . 30850 1 705 . 1 . 1 61 61 ASP HB2 H 1 2.742 0.000 . 2 . . . . A 350 ASP HB2 . 30850 1 706 . 1 . 1 61 61 ASP HB3 H 1 2.631 0.001 . 2 . . . . A 350 ASP HB3 . 30850 1 707 . 1 . 1 61 61 ASP C C 13 178.279 0.000 . 1 . . . . A 350 ASP C . 30850 1 708 . 1 . 1 61 61 ASP CA C 13 57.085 0.000 . 1 . . . . A 350 ASP CA . 30850 1 709 . 1 . 1 61 61 ASP CB C 13 40.664 0.000 . 1 . . . . A 350 ASP CB . 30850 1 710 . 1 . 1 61 61 ASP N N 15 119.200 0.000 . 1 . . . . A 350 ASP N . 30850 1 711 . 1 . 1 62 62 PHE H H 1 7.909 0.000 . 1 . . . . A 351 PHE H . 30850 1 712 . 1 . 1 62 62 PHE HA H 1 4.248 0.001 . 1 . . . . A 351 PHE HA . 30850 1 713 . 1 . 1 62 62 PHE HB2 H 1 3.228 0.000 . 1 . . . . A 351 PHE HB2 . 30850 1 714 . 1 . 1 62 62 PHE HB3 H 1 3.308 0.000 . 1 . . . . A 351 PHE HB3 . 30850 1 715 . 1 . 1 62 62 PHE HD1 H 1 7.120 0.002 . 1 . . . . A 351 PHE HD1 . 30850 1 716 . 1 . 1 62 62 PHE HD2 H 1 7.120 0.002 . 1 . . . . A 351 PHE HD2 . 30850 1 717 . 1 . 1 62 62 PHE HE1 H 1 7.143 0.000 . 1 . . . . A 351 PHE HE1 . 30850 1 718 . 1 . 1 62 62 PHE HE2 H 1 7.143 0.000 . 1 . . . . A 351 PHE HE2 . 30850 1 719 . 1 . 1 62 62 PHE C C 13 177.238 0.000 . 1 . . . . A 351 PHE C . 30850 1 720 . 1 . 1 62 62 PHE CA C 13 60.735 0.003 . 1 . . . . A 351 PHE CA . 30850 1 721 . 1 . 1 62 62 PHE CB C 13 39.032 0.000 . 1 . . . . A 351 PHE CB . 30850 1 722 . 1 . 1 62 62 PHE CD1 C 13 131.850 0.000 . 1 . . . . A 351 PHE CD1 . 30850 1 723 . 1 . 1 62 62 PHE CD2 C 13 131.850 0.000 . 1 . . . . A 351 PHE CD2 . 30850 1 724 . 1 . 1 62 62 PHE CE1 C 13 133.337 0.000 . 1 . . . . A 351 PHE CE1 . 30850 1 725 . 1 . 1 62 62 PHE CE2 C 13 133.337 0.000 . 1 . . . . A 351 PHE CE2 . 30850 1 726 . 1 . 1 62 62 PHE N N 15 120.656 0.000 . 1 . . . . A 351 PHE N . 30850 1 727 . 1 . 1 63 63 LEU H H 1 7.965 0.000 . 1 . . . . A 352 LEU H . 30850 1 728 . 1 . 1 63 63 LEU HA H 1 3.603 0.002 . 1 . . . . A 352 LEU HA . 30850 1 729 . 1 . 1 63 63 LEU HB2 H 1 1.510 0.000 . 2 . . . . A 352 LEU HB2 . 30850 1 730 . 1 . 1 63 63 LEU HB3 H 1 1.510 0.000 . 2 . . . . A 352 LEU HB3 . 30850 1 731 . 1 . 1 63 63 LEU HG H 1 1.427 0.000 . 1 . . . . A 352 LEU HG . 30850 1 732 . 1 . 1 63 63 LEU HD11 H 1 0.527 0.000 . 1 . . . . A 352 LEU HD11 . 30850 1 733 . 1 . 1 63 63 LEU HD12 H 1 0.527 0.000 . 1 . . . . A 352 LEU HD12 . 30850 1 734 . 1 . 1 63 63 LEU HD13 H 1 0.527 0.000 . 1 . . . . A 352 LEU HD13 . 30850 1 735 . 1 . 1 63 63 LEU HD21 H 1 0.409 0.000 . 1 . . . . A 352 LEU HD21 . 30850 1 736 . 1 . 1 63 63 LEU HD22 H 1 0.409 0.000 . 1 . . . . A 352 LEU HD22 . 30850 1 737 . 1 . 1 63 63 LEU HD23 H 1 0.409 0.000 . 1 . . . . A 352 LEU HD23 . 30850 1 738 . 1 . 1 63 63 LEU C C 13 178.458 0.000 . 1 . . . . A 352 LEU C . 30850 1 739 . 1 . 1 63 63 LEU CA C 13 57.224 0.000 . 1 . . . . A 352 LEU CA . 30850 1 740 . 1 . 1 63 63 LEU CB C 13 42.102 0.003 . 1 . . . . A 352 LEU CB . 30850 1 741 . 1 . 1 63 63 LEU CG C 13 26.658 0.000 . 1 . . . . A 352 LEU CG . 30850 1 742 . 1 . 1 63 63 LEU CD1 C 13 24.756 0.000 . 1 . . . . A 352 LEU CD1 . 30850 1 743 . 1 . 1 63 63 LEU CD2 C 13 23.778 0.000 . 1 . . . . A 352 LEU CD2 . 30850 1 744 . 1 . 1 63 63 LEU N N 15 119.048 0.000 . 1 . . . . A 352 LEU N . 30850 1 745 . 1 . 1 64 64 VAL H H 1 7.597 0.000 . 1 . . . . A 353 VAL H . 30850 1 746 . 1 . 1 64 64 VAL HA H 1 3.865 0.000 . 1 . . . . A 353 VAL HA . 30850 1 747 . 1 . 1 64 64 VAL HB H 1 2.176 0.000 . 1 . . . . A 353 VAL HB . 30850 1 748 . 1 . 1 64 64 VAL HG11 H 1 1.027 0.000 . 1 . . . . A 353 VAL HG11 . 30850 1 749 . 1 . 1 64 64 VAL HG12 H 1 1.027 0.000 . 1 . . . . A 353 VAL HG12 . 30850 1 750 . 1 . 1 64 64 VAL HG13 H 1 1.027 0.000 . 1 . . . . A 353 VAL HG13 . 30850 1 751 . 1 . 1 64 64 VAL HG21 H 1 0.913 0.000 . 1 . . . . A 353 VAL HG21 . 30850 1 752 . 1 . 1 64 64 VAL HG22 H 1 0.913 0.000 . 1 . . . . A 353 VAL HG22 . 30850 1 753 . 1 . 1 64 64 VAL HG23 H 1 0.913 0.000 . 1 . . . . A 353 VAL HG23 . 30850 1 754 . 1 . 1 64 64 VAL C C 13 177.566 0.000 . 1 . . . . A 353 VAL C . 30850 1 755 . 1 . 1 64 64 VAL CA C 13 64.190 0.000 . 1 . . . . A 353 VAL CA . 30850 1 756 . 1 . 1 64 64 VAL CB C 13 32.073 0.001 . 1 . . . . A 353 VAL CB . 30850 1 757 . 1 . 1 64 64 VAL CG1 C 13 21.581 0.000 . 1 . . . . A 353 VAL CG1 . 30850 1 758 . 1 . 1 64 64 VAL CG2 C 13 21.218 0.000 . 1 . . . . A 353 VAL CG2 . 30850 1 759 . 1 . 1 64 64 VAL N N 15 114.909 0.000 . 1 . . . . A 353 VAL N . 30850 1 760 . 1 . 1 65 65 GLU H H 1 7.755 0.000 . 1 . . . . A 354 GLU H . 30850 1 761 . 1 . 1 65 65 GLU HA H 1 4.118 0.000 . 1 . . . . A 354 GLU HA . 30850 1 762 . 1 . 1 65 65 GLU HB2 H 1 1.990 0.000 . 2 . . . . A 354 GLU HB2 . 30850 1 763 . 1 . 1 65 65 GLU HB3 H 1 1.990 0.000 . 2 . . . . A 354 GLU HB3 . 30850 1 764 . 1 . 1 65 65 GLU HG2 H 1 2.212 0.000 . 2 . . . . A 354 GLU HG2 . 30850 1 765 . 1 . 1 65 65 GLU HG3 H 1 2.379 0.000 . 2 . . . . A 354 GLU HG3 . 30850 1 766 . 1 . 1 65 65 GLU C C 13 177.663 0.000 . 1 . . . . A 354 GLU C . 30850 1 767 . 1 . 1 65 65 GLU CA C 13 57.797 0.000 . 1 . . . . A 354 GLU CA . 30850 1 768 . 1 . 1 65 65 GLU CB C 13 30.190 0.000 . 1 . . . . A 354 GLU CB . 30850 1 769 . 1 . 1 65 65 GLU CG C 13 36.223 0.002 . 1 . . . . A 354 GLU CG . 30850 1 770 . 1 . 1 65 65 GLU N N 15 119.952 0.000 . 1 . . . . A 354 GLU N . 30850 1 771 . 1 . 1 66 66 LYS H H 1 8.036 0.000 . 1 . . . . A 355 LYS H . 30850 1 772 . 1 . 1 66 66 LYS HA H 1 4.270 0.000 . 1 . . . . A 355 LYS HA . 30850 1 773 . 1 . 1 66 66 LYS HB2 H 1 1.592 0.000 . 2 . . . . A 355 LYS HB2 . 30850 1 774 . 1 . 1 66 66 LYS HB3 H 1 1.350 0.000 . 2 . . . . A 355 LYS HB3 . 30850 1 775 . 1 . 1 66 66 LYS HG2 H 1 1.168 0.000 . 2 . . . . A 355 LYS HG2 . 30850 1 776 . 1 . 1 66 66 LYS HG3 H 1 1.168 0.000 . 2 . . . . A 355 LYS HG3 . 30850 1 777 . 1 . 1 66 66 LYS HD2 H 1 1.523 0.000 . 2 . . . . A 355 LYS HD2 . 30850 1 778 . 1 . 1 66 66 LYS HD3 H 1 1.490 0.000 . 2 . . . . A 355 LYS HD3 . 30850 1 779 . 1 . 1 66 66 LYS HE2 H 1 2.845 0.000 . 2 . . . . A 355 LYS HE2 . 30850 1 780 . 1 . 1 66 66 LYS HE3 H 1 2.900 0.000 . 2 . . . . A 355 LYS HE3 . 30850 1 781 . 1 . 1 66 66 LYS C C 13 176.782 0.000 . 1 . . . . A 355 LYS C . 30850 1 782 . 1 . 1 66 66 LYS CA C 13 56.142 0.008 . 1 . . . . A 355 LYS CA . 30850 1 783 . 1 . 1 66 66 LYS CB C 13 33.235 0.000 . 1 . . . . A 355 LYS CB . 30850 1 784 . 1 . 1 66 66 LYS CG C 13 24.439 0.002 . 1 . . . . A 355 LYS CG . 30850 1 785 . 1 . 1 66 66 LYS CD C 13 28.777 0.001 . 1 . . . . A 355 LYS CD . 30850 1 786 . 1 . 1 66 66 LYS CE C 13 42.268 0.000 . 1 . . . . A 355 LYS CE . 30850 1 787 . 1 . 1 66 66 LYS N N 15 118.988 0.000 . 1 . . . . A 355 LYS N . 30850 1 788 . 1 . 1 67 67 ASP H H 1 8.010 0.000 . 1 . . . . A 356 ASP H . 30850 1 789 . 1 . 1 67 67 ASP HA H 1 4.543 0.000 . 1 . . . . A 356 ASP HA . 30850 1 790 . 1 . 1 67 67 ASP HB2 H 1 2.813 0.000 . 2 . . . . A 356 ASP HB2 . 30850 1 791 . 1 . 1 67 67 ASP HB3 H 1 2.542 0.000 . 2 . . . . A 356 ASP HB3 . 30850 1 792 . 1 . 1 67 67 ASP C C 13 176.033 0.000 . 1 . . . . A 356 ASP C . 30850 1 793 . 1 . 1 67 67 ASP CA C 13 54.906 0.015 . 1 . . . . A 356 ASP CA . 30850 1 794 . 1 . 1 67 67 ASP CB C 13 40.869 0.000 . 1 . . . . A 356 ASP CB . 30850 1 795 . 1 . 1 67 67 ASP CG C 13 177.292 0.000 . 1 . . . . A 356 ASP CG . 30850 1 796 . 1 . 1 67 67 ASP N N 15 120.707 0.000 . 1 . . . . A 356 ASP N . 30850 1 797 . 1 . 1 68 68 ASN H H 1 8.116 0.000 . 1 . . . . A 357 ASN H . 30850 1 798 . 1 . 1 68 68 ASN HA H 1 4.561 0.000 . 1 . . . . A 357 ASN HA . 30850 1 799 . 1 . 1 68 68 ASN HB2 H 1 2.719 0.000 . 2 . . . . A 357 ASN HB2 . 30850 1 800 . 1 . 1 68 68 ASN HB3 H 1 2.719 0.000 . 2 . . . . A 357 ASN HB3 . 30850 1 801 . 1 . 1 68 68 ASN HD21 H 1 7.388 0.000 . 2 . . . . A 357 ASN HD21 . 30850 1 802 . 1 . 1 68 68 ASN HD22 H 1 6.480 0.000 . 2 . . . . A 357 ASN HD22 . 30850 1 803 . 1 . 1 68 68 ASN C C 13 175.759 0.000 . 1 . . . . A 357 ASN C . 30850 1 804 . 1 . 1 68 68 ASN CA C 13 54.473 0.000 . 1 . . . . A 357 ASN CA . 30850 1 805 . 1 . 1 68 68 ASN CB C 13 38.963 0.000 . 1 . . . . A 357 ASN CB . 30850 1 806 . 1 . 1 68 68 ASN N N 15 117.704 0.000 . 1 . . . . A 357 ASN N . 30850 1 807 . 1 . 1 68 68 ASN ND2 N 15 113.196 0.007 . 1 . . . . A 357 ASN ND2 . 30850 1 808 . 1 . 1 69 69 GLU H H 1 8.414 0.000 . 1 . . . . A 358 GLU H . 30850 1 809 . 1 . 1 69 69 GLU HA H 1 4.250 0.000 . 1 . . . . A 358 GLU HA . 30850 1 810 . 1 . 1 69 69 GLU HB2 H 1 2.047 0.000 . 2 . . . . A 358 GLU HB2 . 30850 1 811 . 1 . 1 69 69 GLU HB3 H 1 1.902 0.000 . 2 . . . . A 358 GLU HB3 . 30850 1 812 . 1 . 1 69 69 GLU HG2 H 1 2.201 0.000 . 2 . . . . A 358 GLU HG2 . 30850 1 813 . 1 . 1 69 69 GLU HG3 H 1 2.132 0.000 . 2 . . . . A 358 GLU HG3 . 30850 1 814 . 1 . 1 69 69 GLU C C 13 176.227 0.000 . 1 . . . . A 358 GLU C . 30850 1 815 . 1 . 1 69 69 GLU CA C 13 57.149 0.016 . 1 . . . . A 358 GLU CA . 30850 1 816 . 1 . 1 69 69 GLU CB C 13 30.258 0.000 . 1 . . . . A 358 GLU CB . 30850 1 817 . 1 . 1 69 69 GLU CG C 13 36.436 0.000 . 1 . . . . A 358 GLU CG . 30850 1 818 . 1 . 1 69 69 GLU CD C 13 181.247 0.000 . 1 . . . . A 358 GLU CD . 30850 1 819 . 1 . 1 69 69 GLU N N 15 119.570 0.000 . 1 . . . . A 358 GLU N . 30850 1 820 . 1 . 1 70 70 TYR H H 1 8.264 0.000 . 1 . . . . A 359 TYR H . 30850 1 821 . 1 . 1 70 70 TYR HA H 1 4.186 0.000 . 1 . . . . A 359 TYR HA . 30850 1 822 . 1 . 1 70 70 TYR HB2 H 1 2.983 0.001 . 2 . . . . A 359 TYR HB2 . 30850 1 823 . 1 . 1 70 70 TYR HB3 H 1 2.847 0.000 . 2 . . . . A 359 TYR HB3 . 30850 1 824 . 1 . 1 70 70 TYR HD1 H 1 7.141 0.005 . 1 . . . . A 359 TYR HD1 . 30850 1 825 . 1 . 1 70 70 TYR HD2 H 1 7.141 0.005 . 1 . . . . A 359 TYR HD2 . 30850 1 826 . 1 . 1 70 70 TYR HE1 H 1 6.956 0.000 . 1 . . . . A 359 TYR HE1 . 30850 1 827 . 1 . 1 70 70 TYR HE2 H 1 6.956 0.000 . 1 . . . . A 359 TYR HE2 . 30850 1 828 . 1 . 1 70 70 TYR C C 13 176.520 0.000 . 1 . . . . A 359 TYR C . 30850 1 829 . 1 . 1 70 70 TYR CA C 13 61.050 0.000 . 1 . . . . A 359 TYR CA . 30850 1 830 . 1 . 1 70 70 TYR CB C 13 39.395 0.001 . 1 . . . . A 359 TYR CB . 30850 1 831 . 1 . 1 70 70 TYR CD1 C 13 133.013 0.000 . 1 . . . . A 359 TYR CD1 . 30850 1 832 . 1 . 1 70 70 TYR CD2 C 13 133.013 0.000 . 1 . . . . A 359 TYR CD2 . 30850 1 833 . 1 . 1 70 70 TYR CE1 C 13 118.510 0.000 . 1 . . . . A 359 TYR CE1 . 30850 1 834 . 1 . 1 70 70 TYR CE2 C 13 118.510 0.000 . 1 . . . . A 359 TYR CE2 . 30850 1 835 . 1 . 1 70 70 TYR N N 15 120.714 0.000 . 1 . . . . A 359 TYR N . 30850 1 836 . 1 . 1 71 71 CYS H H 1 8.314 0.000 . 1 . . . . A 360 CYS H . 30850 1 837 . 1 . 1 71 71 CYS HA H 1 4.783 0.000 . 1 . . . . A 360 CYS HA . 30850 1 838 . 1 . 1 71 71 CYS HB2 H 1 3.123 0.000 . 2 . . . . A 360 CYS HB2 . 30850 1 839 . 1 . 1 71 71 CYS HB3 H 1 2.958 0.000 . 2 . . . . A 360 CYS HB3 . 30850 1 840 . 1 . 1 71 71 CYS C C 13 173.829 0.000 . 1 . . . . A 360 CYS C . 30850 1 841 . 1 . 1 71 71 CYS CA C 13 54.148 0.000 . 1 . . . . A 360 CYS CA . 30850 1 842 . 1 . 1 71 71 CYS CB C 13 40.122 0.000 . 1 . . . . A 360 CYS CB . 30850 1 843 . 1 . 1 71 71 CYS N N 15 115.970 0.000 . 1 . . . . A 360 CYS N . 30850 1 844 . 1 . 1 72 72 VAL H H 1 8.365 0.000 . 1 . . . . A 361 VAL H . 30850 1 845 . 1 . 1 72 72 VAL HA H 1 4.014 0.000 . 1 . . . . A 361 VAL HA . 30850 1 846 . 1 . 1 72 72 VAL HB H 1 2.058 0.000 . 1 . . . . A 361 VAL HB . 30850 1 847 . 1 . 1 72 72 VAL HG11 H 1 0.875 0.000 . 2 . . . . A 361 VAL HG11 . 30850 1 848 . 1 . 1 72 72 VAL HG12 H 1 0.875 0.000 . 2 . . . . A 361 VAL HG12 . 30850 1 849 . 1 . 1 72 72 VAL HG13 H 1 0.875 0.000 . 2 . . . . A 361 VAL HG13 . 30850 1 850 . 1 . 1 72 72 VAL HG21 H 1 0.823 0.000 . 2 . . . . A 361 VAL HG21 . 30850 1 851 . 1 . 1 72 72 VAL HG22 H 1 0.823 0.000 . 2 . . . . A 361 VAL HG22 . 30850 1 852 . 1 . 1 72 72 VAL HG23 H 1 0.823 0.000 . 2 . . . . A 361 VAL HG23 . 30850 1 853 . 1 . 1 72 72 VAL C C 13 175.843 0.000 . 1 . . . . A 361 VAL C . 30850 1 854 . 1 . 1 72 72 VAL CA C 13 62.469 0.000 . 1 . . . . A 361 VAL CA . 30850 1 855 . 1 . 1 72 72 VAL CB C 13 31.385 0.000 . 1 . . . . A 361 VAL CB . 30850 1 856 . 1 . 1 72 72 VAL CG1 C 13 21.576 0.000 . 1 . . . . A 361 VAL CG1 . 30850 1 857 . 1 . 1 72 72 VAL CG2 C 13 20.563 0.000 . 1 . . . . A 361 VAL CG2 . 30850 1 858 . 1 . 1 72 72 VAL N N 15 124.687 0.000 . 1 . . . . A 361 VAL N . 30850 1 859 . 1 . 1 73 73 CYS H H 1 8.414 0.000 . 1 . . . . A 362 CYS H . 30850 1 860 . 1 . 1 73 73 CYS HA H 1 4.931 0.000 . 1 . . . . A 362 CYS HA . 30850 1 861 . 1 . 1 73 73 CYS HB2 H 1 2.813 0.000 . 2 . . . . A 362 CYS HB2 . 30850 1 862 . 1 . 1 73 73 CYS HB3 H 1 3.190 0.000 . 2 . . . . A 362 CYS HB3 . 30850 1 863 . 1 . 1 73 73 CYS C C 13 174.016 0.000 . 1 . . . . A 362 CYS C . 30850 1 864 . 1 . 1 73 73 CYS CA C 13 53.753 0.000 . 1 . . . . A 362 CYS CA . 30850 1 865 . 1 . 1 73 73 CYS CB C 13 41.707 0.000 . 1 . . . . A 362 CYS CB . 30850 1 866 . 1 . 1 73 73 CYS N N 15 123.643 0.000 . 1 . . . . A 362 CYS N . 30850 1 867 . 1 . 1 74 74 GLU H H 1 8.442 0.000 . 1 . . . . A 363 GLU H . 30850 1 868 . 1 . 1 74 74 GLU HA H 1 4.333 0.000 . 1 . . . . A 363 GLU HA . 30850 1 869 . 1 . 1 74 74 GLU HB2 H 1 1.971 0.000 . 2 . . . . A 363 GLU HB2 . 30850 1 870 . 1 . 1 74 74 GLU HB3 H 1 1.818 0.000 . 2 . . . . A 363 GLU HB3 . 30850 1 871 . 1 . 1 74 74 GLU HG2 H 1 2.186 0.001 . 2 . . . . A 363 GLU HG2 . 30850 1 872 . 1 . 1 74 74 GLU HG3 H 1 2.186 0.001 . 2 . . . . A 363 GLU HG3 . 30850 1 873 . 1 . 1 74 74 GLU C C 13 175.672 0.000 . 1 . . . . A 363 GLU C . 30850 1 874 . 1 . 1 74 74 GLU CA C 13 56.137 0.000 . 1 . . . . A 363 GLU CA . 30850 1 875 . 1 . 1 74 74 GLU CB C 13 30.971 0.000 . 1 . . . . A 363 GLU CB . 30850 1 876 . 1 . 1 74 74 GLU CG C 13 36.209 0.001 . 1 . . . . A 363 GLU CG . 30850 1 877 . 1 . 1 74 74 GLU CD C 13 180.875 0.000 . 1 . . . . A 363 GLU CD . 30850 1 878 . 1 . 1 74 74 GLU N N 15 122.025 0.000 . 1 . . . . A 363 GLU N . 30850 1 879 . 1 . 1 75 75 MET H H 1 8.477 0.000 . 1 . . . . A 364 MET H . 30850 1 880 . 1 . 1 75 75 MET HA H 1 4.676 0.004 . 1 . . . . A 364 MET HA . 30850 1 881 . 1 . 1 75 75 MET HB2 H 1 2.024 0.001 . 2 . . . . A 364 MET HB2 . 30850 1 882 . 1 . 1 75 75 MET HB3 H 1 1.912 0.001 . 2 . . . . A 364 MET HB3 . 30850 1 883 . 1 . 1 75 75 MET HG2 H 1 2.586 0.000 . 2 . . . . A 364 MET HG2 . 30850 1 884 . 1 . 1 75 75 MET HG3 H 1 2.512 0.000 . 2 . . . . A 364 MET HG3 . 30850 1 885 . 1 . 1 75 75 MET HE1 H 1 2.068 0.000 . 1 . . . . A 364 MET HE1 . 30850 1 886 . 1 . 1 75 75 MET HE2 H 1 2.068 0.000 . 1 . . . . A 364 MET HE2 . 30850 1 887 . 1 . 1 75 75 MET HE3 H 1 2.068 0.000 . 1 . . . . A 364 MET HE3 . 30850 1 888 . 1 . 1 75 75 MET C C 13 174.110 0.000 . 1 . . . . A 364 MET C . 30850 1 889 . 1 . 1 75 75 MET CA C 13 53.264 0.015 . 1 . . . . A 364 MET CA . 30850 1 890 . 1 . 1 75 75 MET CB C 13 32.641 0.000 . 1 . . . . A 364 MET CB . 30850 1 891 . 1 . 1 75 75 MET CG C 13 32.266 0.000 . 1 . . . . A 364 MET CG . 30850 1 892 . 1 . 1 75 75 MET CE C 13 17.235 0.000 . 1 . . . . A 364 MET CE . 30850 1 893 . 1 . 1 75 75 MET N N 15 122.467 0.000 . 1 . . . . A 364 MET N . 30850 1 894 . 1 . 1 76 76 PRO HA H 1 4.540 0.000 . 1 . . . . A 365 PRO HA . 30850 1 895 . 1 . 1 76 76 PRO HB2 H 1 2.229 0.000 . 2 . . . . A 365 PRO HB2 . 30850 1 896 . 1 . 1 76 76 PRO HB3 H 1 1.923 0.000 . 2 . . . . A 365 PRO HB3 . 30850 1 897 . 1 . 1 76 76 PRO HG2 H 1 2.006 0.000 . 1 . . . . A 365 PRO HG2 . 30850 1 898 . 1 . 1 76 76 PRO HG3 H 1 1.928 0.000 . 1 . . . . A 365 PRO HG3 . 30850 1 899 . 1 . 1 76 76 PRO HD2 H 1 3.713 0.000 . 2 . . . . A 365 PRO HD2 . 30850 1 900 . 1 . 1 76 76 PRO HD3 H 1 3.622 0.000 . 2 . . . . A 365 PRO HD3 . 30850 1 901 . 1 . 1 76 76 PRO C C 13 176.811 0.000 . 1 . . . . A 365 PRO C . 30850 1 902 . 1 . 1 76 76 PRO CA C 13 62.964 0.000 . 1 . . . . A 365 PRO CA . 30850 1 903 . 1 . 1 76 76 PRO CB C 13 32.119 0.002 . 1 . . . . A 365 PRO CB . 30850 1 904 . 1 . 1 76 76 PRO CG C 13 27.305 0.003 . 1 . . . . A 365 PRO CG . 30850 1 905 . 1 . 1 76 76 PRO CD C 13 50.628 0.000 . 1 . . . . A 365 PRO CD . 30850 1 906 . 1 . 1 77 77 CYS H H 1 8.473 0.000 . 1 . . . . A 366 CYS H . 30850 1 907 . 1 . 1 77 77 CYS HA H 1 4.629 0.000 . 1 . . . . A 366 CYS HA . 30850 1 908 . 1 . 1 77 77 CYS HB2 H 1 3.233 0.000 . 2 . . . . A 366 CYS HB2 . 30850 1 909 . 1 . 1 77 77 CYS HB3 H 1 2.937 0.000 . 2 . . . . A 366 CYS HB3 . 30850 1 910 . 1 . 1 77 77 CYS C C 13 173.596 0.000 . 1 . . . . A 366 CYS C . 30850 1 911 . 1 . 1 77 77 CYS CA C 13 55.293 0.000 . 1 . . . . A 366 CYS CA . 30850 1 912 . 1 . 1 77 77 CYS CB C 13 41.678 0.000 . 1 . . . . A 366 CYS CB . 30850 1 913 . 1 . 1 77 77 CYS N N 15 119.615 0.000 . 1 . . . . A 366 CYS N . 30850 1 914 . 1 . 1 78 78 ASN H H 1 8.092 0.000 . 1 . . . . A 367 ASN H . 30850 1 915 . 1 . 1 78 78 ASN HA H 1 4.453 0.000 . 1 . . . . A 367 ASN HA . 30850 1 916 . 1 . 1 78 78 ASN HB2 H 1 2.735 0.000 . 2 . . . . A 367 ASN HB2 . 30850 1 917 . 1 . 1 78 78 ASN HB3 H 1 2.645 0.000 . 2 . . . . A 367 ASN HB3 . 30850 1 918 . 1 . 1 78 78 ASN HD21 H 1 7.473 0.000 . 2 . . . . A 367 ASN HD21 . 30850 1 919 . 1 . 1 78 78 ASN HD22 H 1 6.782 0.000 . 2 . . . . A 367 ASN HD22 . 30850 1 920 . 1 . 1 78 78 ASN C C 13 179.244 0.000 . 1 . . . . A 367 ASN C . 30850 1 921 . 1 . 1 78 78 ASN CA C 13 54.840 0.000 . 1 . . . . A 367 ASN CA . 30850 1 922 . 1 . 1 78 78 ASN CB C 13 40.868 0.001 . 1 . . . . A 367 ASN CB . 30850 1 923 . 1 . 1 78 78 ASN N N 15 125.577 0.000 . 1 . . . . A 367 ASN N . 30850 1 924 . 1 . 1 78 78 ASN ND2 N 15 112.702 0.001 . 1 . . . . A 367 ASN ND2 . 30850 1 stop_ save_