################################### # 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 53613 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name bound _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' . . . 53613 1 2 '3D HNCACB' . . . 53613 1 3 '3D HN(CO)CACB' . . . 53613 1 4 '3D HNCO' . . . 53613 1 5 '3D HN(CA)CO' . . . 53613 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 . . 53613 1 2 $software_2 . . 53613 1 3 $software_3 . . 53613 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 SER C C 13 175.26269 0.4 . 1 . . . . . 1 SER C . 53613 1 2 . 1 . 1 1 1 SER CA C 13 58.20608 0.4 . 1 . . . . . 1 SER CA . 53613 1 3 . 1 . 1 1 1 SER CB C 13 64.65775 0.4 . 1 . . . . . 1 SER CB . 53613 1 4 . 1 . 1 2 2 LEU H H 1 8.60529 0.04 . 1 . . . . . 2 LEU H . 53613 1 5 . 1 . 1 2 2 LEU C C 13 178.11469 0.4 . 1 . . . . . 2 LEU C . 53613 1 6 . 1 . 1 2 2 LEU CA C 13 58.70085 0.4 . 1 . . . . . 2 LEU CA . 53613 1 7 . 1 . 1 2 2 LEU CB C 13 41.86256 0.4 . 1 . . . . . 2 LEU CB . 53613 1 8 . 1 . 1 2 2 LEU N N 15 123.69863 0.2 . 1 . . . . . 2 LEU N . 53613 1 9 . 1 . 1 3 3 LYS H H 1 8.13869 0.04 . 1 . . . . . 3 LYS H . 53613 1 10 . 1 . 1 3 3 LYS C C 13 178.73295 0.4 . 1 . . . . . 3 LYS C . 53613 1 11 . 1 . 1 3 3 LYS CA C 13 60.1608 0.4 . 1 . . . . . 3 LYS CA . 53613 1 12 . 1 . 1 3 3 LYS CB C 13 32.49053 0.4 . 1 . . . . . 3 LYS CB . 53613 1 13 . 1 . 1 3 3 LYS N N 15 117.87081 0.2 . 1 . . . . . 3 LYS N . 53613 1 14 . 1 . 1 4 4 GLU H H 1 7.88736 0.04 . 1 . . . . . 4 GLU H . 53613 1 15 . 1 . 1 4 4 GLU C C 13 180.32201 0.4 . 1 . . . . . 4 GLU C . 53613 1 16 . 1 . 1 4 4 GLU CA C 13 59.53252 0.4 . 1 . . . . . 4 GLU CA . 53613 1 17 . 1 . 1 4 4 GLU CB C 13 29.74223 0.4 . 1 . . . . . 4 GLU CB . 53613 1 18 . 1 . 1 4 4 GLU N N 15 119.14292 0.2 . 1 . . . . . 4 GLU N . 53613 1 19 . 1 . 1 5 5 LYS H H 1 8.23122 0.04 . 1 . . . . . 5 LYS H . 53613 1 20 . 1 . 1 5 5 LYS C C 13 178.12357 0.4 . 1 . . . . . 5 LYS C . 53613 1 21 . 1 . 1 5 5 LYS CA C 13 60.08358 0.4 . 1 . . . . . 5 LYS CA . 53613 1 22 . 1 . 1 5 5 LYS CB C 13 33.16711 0.4 . 1 . . . . . 5 LYS CB . 53613 1 23 . 1 . 1 5 5 LYS N N 15 120.88256 0.2 . 1 . . . . . 5 LYS N . 53613 1 24 . 1 . 1 6 6 PHE H H 1 8.74145 0.04 . 1 . . . . . 6 PHE H . 53613 1 25 . 1 . 1 6 6 PHE C C 13 176.65072 0.4 . 1 . . . . . 6 PHE C . 53613 1 26 . 1 . 1 6 6 PHE CA C 13 62.51648 0.4 . 1 . . . . . 6 PHE CA . 53613 1 27 . 1 . 1 6 6 PHE CB C 13 38.95405 0.4 . 1 . . . . . 6 PHE CB . 53613 1 28 . 1 . 1 6 6 PHE N N 15 120.39922 0.2 . 1 . . . . . 6 PHE N . 53613 1 29 . 1 . 1 7 7 GLU H H 1 8.12835 0.04 . 1 . . . . . 7 GLU H . 53613 1 30 . 1 . 1 7 7 GLU C C 13 179.50822 0.4 . 1 . . . . . 7 GLU C . 53613 1 31 . 1 . 1 7 7 GLU CA C 13 59.70026 0.4 . 1 . . . . . 7 GLU CA . 53613 1 32 . 1 . 1 7 7 GLU CB C 13 29.31341 0.4 . 1 . . . . . 7 GLU CB . 53613 1 33 . 1 . 1 7 7 GLU N N 15 118.55277 0.2 . 1 . . . . . 7 GLU N . 53613 1 34 . 1 . 1 8 8 GLU H H 1 7.35589 0.04 . 1 . . . . . 8 GLU H . 53613 1 35 . 1 . 1 8 8 GLU C C 13 177.51003 0.4 . 1 . . . . . 8 GLU C . 53613 1 36 . 1 . 1 8 8 GLU CA C 13 59.27988 0.4 . 1 . . . . . 8 GLU CA . 53613 1 37 . 1 . 1 8 8 GLU CB C 13 29.36168 0.4 . 1 . . . . . 8 GLU CB . 53613 1 38 . 1 . 1 8 8 GLU N N 15 119.87824 0.2 . 1 . . . . . 8 GLU N . 53613 1 39 . 1 . 1 9 9 TYR H H 1 8.61084 0.04 . 1 . . . . . 9 TYR H . 53613 1 40 . 1 . 1 9 9 TYR C C 13 178.93674 0.4 . 1 . . . . . 9 TYR C . 53613 1 41 . 1 . 1 9 9 TYR CA C 13 60.4954 0.4 . 1 . . . . . 9 TYR CA . 53613 1 42 . 1 . 1 9 9 TYR CB C 13 39.25864 0.4 . 1 . . . . . 9 TYR CB . 53613 1 43 . 1 . 1 9 9 TYR N N 15 121.81936 0.2 . 1 . . . . . 9 TYR N . 53613 1 44 . 1 . 1 10 10 GLU H H 1 8.84116 0.04 . 1 . . . . . 10 GLU H . 53613 1 45 . 1 . 1 10 10 GLU C C 13 177.86537 0.4 . 1 . . . . . 10 GLU C . 53613 1 46 . 1 . 1 10 10 GLU CA C 13 59.2181 0.4 . 1 . . . . . 10 GLU CA . 53613 1 47 . 1 . 1 10 10 GLU CB C 13 29.27419 0.4 . 1 . . . . . 10 GLU CB . 53613 1 48 . 1 . 1 10 10 GLU N N 15 121.93561 0.2 . 1 . . . . . 10 GLU N . 53613 1 49 . 1 . 1 11 11 LYS H H 1 7.44247 0.04 . 1 . . . . . 11 LYS H . 53613 1 50 . 1 . 1 11 11 LYS C C 13 180.02208 0.4 . 1 . . . . . 11 LYS C . 53613 1 51 . 1 . 1 11 11 LYS CA C 13 59.87719 0.4 . 1 . . . . . 11 LYS CA . 53613 1 52 . 1 . 1 11 11 LYS CB C 13 32.52208 0.4 . 1 . . . . . 11 LYS CB . 53613 1 53 . 1 . 1 11 11 LYS N N 15 119.35098 0.2 . 1 . . . . . 11 LYS N . 53613 1 54 . 1 . 1 12 12 ILE H H 1 8.22266 0.04 . 1 . . . . . 12 ILE H . 53613 1 55 . 1 . 1 12 12 ILE C C 13 177.49827 0.4 . 1 . . . . . 12 ILE C . 53613 1 56 . 1 . 1 12 12 ILE CA C 13 65.01358 0.4 . 1 . . . . . 12 ILE CA . 53613 1 57 . 1 . 1 12 12 ILE CB C 13 37.18504 0.4 . 1 . . . . . 12 ILE CB . 53613 1 58 . 1 . 1 12 12 ILE N N 15 121.08516 0.2 . 1 . . . . . 12 ILE N . 53613 1 59 . 1 . 1 13 13 GLY H H 1 7.69301 0.04 . 1 . . . . . 13 GLY H . 53613 1 60 . 1 . 1 13 13 GLY C C 13 175.06128 0.4 . 1 . . . . . 13 GLY C . 53613 1 61 . 1 . 1 13 13 GLY CA C 13 47.14753 0.4 . 1 . . . . . 13 GLY CA . 53613 1 62 . 1 . 1 13 13 GLY N N 15 107.46125 0.2 . 1 . . . . . 13 GLY N . 53613 1 63 . 1 . 1 14 14 LYS H H 1 7.60913 0.04 . 1 . . . . . 14 LYS H . 53613 1 64 . 1 . 1 14 14 LYS C C 13 178.98551 0.4 . 1 . . . . . 14 LYS C . 53613 1 65 . 1 . 1 14 14 LYS CA C 13 59.65399 0.4 . 1 . . . . . 14 LYS CA . 53613 1 66 . 1 . 1 14 14 LYS CB C 13 32.36166 0.4 . 1 . . . . . 14 LYS CB . 53613 1 67 . 1 . 1 14 14 LYS N N 15 119.00497 0.2 . 1 . . . . . 14 LYS N . 53613 1 68 . 1 . 1 15 15 ARG H H 1 7.56958 0.04 . 1 . . . . . 15 ARG H . 53613 1 69 . 1 . 1 15 15 ARG C C 13 177.82618 0.4 . 1 . . . . . 15 ARG C . 53613 1 70 . 1 . 1 15 15 ARG CA C 13 58.08341 0.4 . 1 . . . . . 15 ARG CA . 53613 1 71 . 1 . 1 15 15 ARG CB C 13 29.25116 0.4 . 1 . . . . . 15 ARG CB . 53613 1 72 . 1 . 1 15 15 ARG N N 15 121.26884 0.2 . 1 . . . . . 15 ARG N . 53613 1 73 . 1 . 1 16 16 ILE H H 1 8.43512 0.04 . 1 . . . . . 16 ILE H . 53613 1 74 . 1 . 1 16 16 ILE C C 13 177.33703 0.4 . 1 . . . . . 16 ILE C . 53613 1 75 . 1 . 1 16 16 ILE CA C 13 65.83421 0.4 . 1 . . . . . 16 ILE CA . 53613 1 76 . 1 . 1 16 16 ILE CB C 13 37.5026 0.4 . 1 . . . . . 16 ILE CB . 53613 1 77 . 1 . 1 16 16 ILE N N 15 119.74461 0.2 . 1 . . . . . 16 ILE N . 53613 1 78 . 1 . 1 17 17 LEU H H 1 7.23432 0.04 . 1 . . . . . 17 LEU H . 53613 1 79 . 1 . 1 17 17 LEU C C 13 179.61725 0.4 . 1 . . . . . 17 LEU C . 53613 1 80 . 1 . 1 17 17 LEU CA C 13 58.161 0.4 . 1 . . . . . 17 LEU CA . 53613 1 81 . 1 . 1 17 17 LEU CB C 13 41.29621 0.4 . 1 . . . . . 17 LEU CB . 53613 1 82 . 1 . 1 17 17 LEU N N 15 117.85047 0.2 . 1 . . . . . 17 LEU N . 53613 1 83 . 1 . 1 18 18 GLU H H 1 7.84255 0.04 . 1 . . . . . 18 GLU H . 53613 1 84 . 1 . 1 18 18 GLU C C 13 179.86777 0.4 . 1 . . . . . 18 GLU C . 53613 1 85 . 1 . 1 18 18 GLU CA C 13 59.63096 0.4 . 1 . . . . . 18 GLU CA . 53613 1 86 . 1 . 1 18 18 GLU CB C 13 29.7237 0.4 . 1 . . . . . 18 GLU CB . 53613 1 87 . 1 . 1 18 18 GLU N N 15 119.83877 0.2 . 1 . . . . . 18 GLU N . 53613 1 88 . 1 . 1 19 19 LEU H H 1 8.67872 0.04 . 1 . . . . . 19 LEU H . 53613 1 89 . 1 . 1 19 19 LEU C C 13 179.79296 0.4 . 1 . . . . . 19 LEU C . 53613 1 90 . 1 . 1 19 19 LEU CA C 13 57.86604 0.4 . 1 . . . . . 19 LEU CA . 53613 1 91 . 1 . 1 19 19 LEU CB C 13 41.4033 0.4 . 1 . . . . . 19 LEU CB . 53613 1 92 . 1 . 1 19 19 LEU N N 15 120.34492 0.2 . 1 . . . . . 19 LEU N . 53613 1 93 . 1 . 1 20 20 LEU H H 1 8.74752 0.04 . 1 . . . . . 20 LEU H . 53613 1 94 . 1 . 1 20 20 LEU C C 13 178.92174 0.4 . 1 . . . . . 20 LEU C . 53613 1 95 . 1 . 1 20 20 LEU CA C 13 58.3447 0.4 . 1 . . . . . 20 LEU CA . 53613 1 96 . 1 . 1 20 20 LEU CB C 13 42.85186 0.4 . 1 . . . . . 20 LEU CB . 53613 1 97 . 1 . 1 20 20 LEU N N 15 120.91941 0.2 . 1 . . . . . 20 LEU N . 53613 1 98 . 1 . 1 21 21 GLN H H 1 7.59034 0.04 . 1 . . . . . 21 GLN H . 53613 1 99 . 1 . 1 21 21 GLN C C 13 178.12648 0.4 . 1 . . . . . 21 GLN C . 53613 1 100 . 1 . 1 21 21 GLN CA C 13 59.22727 0.4 . 1 . . . . . 21 GLN CA . 53613 1 101 . 1 . 1 21 21 GLN CB C 13 28.57892 0.4 . 1 . . . . . 21 GLN CB . 53613 1 102 . 1 . 1 21 21 GLN N N 15 117.06183 0.2 . 1 . . . . . 21 GLN N . 53613 1 103 . 1 . 1 22 22 GLU H H 1 8.22902 0.04 . 1 . . . . . 22 GLU H . 53613 1 104 . 1 . 1 22 22 GLU C C 13 179.41135 0.4 . 1 . . . . . 22 GLU C . 53613 1 105 . 1 . 1 22 22 GLU CA C 13 59.74601 0.4 . 1 . . . . . 22 GLU CA . 53613 1 106 . 1 . 1 22 22 GLU CB C 13 29.15758 0.4 . 1 . . . . . 22 GLU CB . 53613 1 107 . 1 . 1 22 22 GLU N N 15 120.7843 0.2 . 1 . . . . . 22 GLU N . 53613 1 108 . 1 . 1 23 23 ALA H H 1 8.92381 0.04 . 1 . . . . . 23 ALA H . 53613 1 109 . 1 . 1 23 23 ALA C C 13 178.55567 0.4 . 1 . . . . . 23 ALA C . 53613 1 110 . 1 . 1 23 23 ALA CA C 13 55.42894 0.4 . 1 . . . . . 23 ALA CA . 53613 1 111 . 1 . 1 23 23 ALA CB C 13 16.30202 0.4 . 1 . . . . . 23 ALA CB . 53613 1 112 . 1 . 1 23 23 ALA N N 15 123.23104 0.2 . 1 . . . . . 23 ALA N . 53613 1 113 . 1 . 1 24 24 ARG H H 1 8.11249 0.04 . 1 . . . . . 24 ARG H . 53613 1 114 . 1 . 1 24 24 ARG C C 13 178.20467 0.4 . 1 . . . . . 24 ARG C . 53613 1 115 . 1 . 1 24 24 ARG CA C 13 60.16841 0.4 . 1 . . . . . 24 ARG CA . 53613 1 116 . 1 . 1 24 24 ARG CB C 13 29.3251 0.4 . 1 . . . . . 24 ARG CB . 53613 1 117 . 1 . 1 24 24 ARG N N 15 120.11985 0.2 . 1 . . . . . 24 ARG N . 53613 1 118 . 1 . 1 25 25 ASP H H 1 8.25249 0.04 . 1 . . . . . 25 ASP H . 53613 1 119 . 1 . 1 25 25 ASP C C 13 179.36669 0.4 . 1 . . . . . 25 ASP C . 53613 1 120 . 1 . 1 25 25 ASP CA C 13 57.66435 0.4 . 1 . . . . . 25 ASP CA . 53613 1 121 . 1 . 1 25 25 ASP CB C 13 39.96487 0.4 . 1 . . . . . 25 ASP CB . 53613 1 122 . 1 . 1 25 25 ASP N N 15 120.60827 0.2 . 1 . . . . . 25 ASP N . 53613 1 123 . 1 . 1 26 26 ALA H H 1 8.69243 0.04 . 1 . . . . . 26 ALA H . 53613 1 124 . 1 . 1 26 26 ALA C C 13 178.88765 0.4 . 1 . . . . . 26 ALA C . 53613 1 125 . 1 . 1 26 26 ALA CA C 13 55.05443 0.4 . 1 . . . . . 26 ALA CA . 53613 1 126 . 1 . 1 26 26 ALA CB C 13 17.47455 0.4 . 1 . . . . . 26 ALA CB . 53613 1 127 . 1 . 1 26 26 ALA N N 15 123.85533 0.2 . 1 . . . . . 26 ALA N . 53613 1 128 . 1 . 1 27 27 PHE H H 1 8.77405 0.04 . 1 . . . . . 27 PHE H . 53613 1 129 . 1 . 1 27 27 PHE C C 13 179.20468 0.4 . 1 . . . . . 27 PHE C . 53613 1 130 . 1 . 1 27 27 PHE CA C 13 61.63227 0.4 . 1 . . . . . 27 PHE CA . 53613 1 131 . 1 . 1 27 27 PHE CB C 13 39.19502 0.4 . 1 . . . . . 27 PHE CB . 53613 1 132 . 1 . 1 27 27 PHE N N 15 120.41695 0.2 . 1 . . . . . 27 PHE N . 53613 1 133 . 1 . 1 28 28 GLU H H 1 8.60227 0.04 . 1 . . . . . 28 GLU H . 53613 1 134 . 1 . 1 28 28 GLU C C 13 178.05064 0.4 . 1 . . . . . 28 GLU C . 53613 1 135 . 1 . 1 28 28 GLU CA C 13 59.24582 0.4 . 1 . . . . . 28 GLU CA . 53613 1 136 . 1 . 1 28 28 GLU CB C 13 29.11199 0.4 . 1 . . . . . 28 GLU CB . 53613 1 137 . 1 . 1 28 28 GLU N N 15 121.24081 0.2 . 1 . . . . . 28 GLU N . 53613 1 138 . 1 . 1 29 29 ALA H H 1 7.59471 0.04 . 1 . . . . . 29 ALA H . 53613 1 139 . 1 . 1 29 29 ALA C C 13 177.95706 0.4 . 1 . . . . . 29 ALA C . 53613 1 140 . 1 . 1 29 29 ALA CA C 13 52.42272 0.4 . 1 . . . . . 29 ALA CA . 53613 1 141 . 1 . 1 29 29 ALA CB C 13 18.95675 0.4 . 1 . . . . . 29 ALA CB . 53613 1 142 . 1 . 1 29 29 ALA N N 15 118.62212 0.2 . 1 . . . . . 29 ALA N . 53613 1 143 . 1 . 1 30 30 GLY H H 1 7.76652 0.04 . 1 . . . . . 30 GLY H . 53613 1 144 . 1 . 1 30 30 GLY C C 13 174.26016 0.4 . 1 . . . . . 30 GLY C . 53613 1 145 . 1 . 1 30 30 GLY CA C 13 45.34417 0.4 . 1 . . . . . 30 GLY CA . 53613 1 146 . 1 . 1 30 30 GLY N N 15 107.05544 0.2 . 1 . . . . . 30 GLY N . 53613 1 147 . 1 . 1 31 31 ASP H H 1 8.44115 0.04 . 1 . . . . . 31 ASP H . 53613 1 148 . 1 . 1 31 31 ASP C C 13 176.02152 0.4 . 1 . . . . . 31 ASP C . 53613 1 149 . 1 . 1 31 31 ASP CA C 13 51.72419 0.4 . 1 . . . . . 31 ASP CA . 53613 1 150 . 1 . 1 31 31 ASP CB C 13 38.79888 0.4 . 1 . . . . . 31 ASP CB . 53613 1 151 . 1 . 1 31 31 ASP N N 15 122.30034 0.2 . 1 . . . . . 31 ASP N . 53613 1 152 . 1 . 1 32 32 LEU H H 1 7.7913 0.04 . 1 . . . . . 32 LEU H . 53613 1 153 . 1 . 1 32 32 LEU C C 13 179.33643 0.4 . 1 . . . . . 32 LEU C . 53613 1 154 . 1 . 1 32 32 LEU CA C 13 57.96187 0.4 . 1 . . . . . 32 LEU CA . 53613 1 155 . 1 . 1 32 32 LEU CB C 13 40.28496 0.4 . 1 . . . . . 32 LEU CB . 53613 1 156 . 1 . 1 32 32 LEU N N 15 121.54537 0.2 . 1 . . . . . 32 LEU N . 53613 1 157 . 1 . 1 33 33 ALA H H 1 8.53346 0.04 . 1 . . . . . 33 ALA H . 53613 1 158 . 1 . 1 33 33 ALA C C 13 180.43755 0.4 . 1 . . . . . 33 ALA C . 53613 1 159 . 1 . 1 33 33 ALA CA C 13 55.16108 0.4 . 1 . . . . . 33 ALA CA . 53613 1 160 . 1 . 1 33 33 ALA CB C 13 17.93484 0.4 . 1 . . . . . 33 ALA CB . 53613 1 161 . 1 . 1 33 33 ALA N N 15 122.86838 0.2 . 1 . . . . . 33 ALA N . 53613 1 162 . 1 . 1 34 34 ARG H H 1 7.38766 0.04 . 1 . . . . . 34 ARG H . 53613 1 163 . 1 . 1 34 34 ARG C C 13 178.37674 0.4 . 1 . . . . . 34 ARG C . 53613 1 164 . 1 . 1 34 34 ARG CA C 13 57.49633 0.4 . 1 . . . . . 34 ARG CA . 53613 1 165 . 1 . 1 34 34 ARG CB C 13 30.06883 0.4 . 1 . . . . . 34 ARG CB . 53613 1 166 . 1 . 1 34 34 ARG N N 15 119.58536 0.2 . 1 . . . . . 34 ARG N . 53613 1 167 . 1 . 1 35 35 VAL H H 1 7.72408 0.04 . 1 . . . . . 35 VAL H . 53613 1 168 . 1 . 1 35 35 VAL C C 13 176.67868 0.4 . 1 . . . . . 35 VAL C . 53613 1 169 . 1 . 1 35 35 VAL CA C 13 67.92372 0.4 . 1 . . . . . 35 VAL CA . 53613 1 170 . 1 . 1 35 35 VAL CB C 13 30.85021 0.4 . 1 . . . . . 35 VAL CB . 53613 1 171 . 1 . 1 35 35 VAL N N 15 117.65898 0.2 . 1 . . . . . 35 VAL N . 53613 1 172 . 1 . 1 36 36 ASP H H 1 7.92983 0.04 . 1 . . . . . 36 ASP H . 53613 1 173 . 1 . 1 36 36 ASP C C 13 177.85836 0.4 . 1 . . . . . 36 ASP C . 53613 1 174 . 1 . 1 36 36 ASP CA C 13 58.19893 0.4 . 1 . . . . . 36 ASP CA . 53613 1 175 . 1 . 1 36 36 ASP CB C 13 42.57884 0.4 . 1 . . . . . 36 ASP CB . 53613 1 176 . 1 . 1 36 36 ASP N N 15 117.79173 0.2 . 1 . . . . . 36 ASP N . 53613 1 177 . 1 . 1 37 37 GLU H H 1 7.46962 0.04 . 1 . . . . . 37 GLU H . 53613 1 178 . 1 . 1 37 37 GLU C C 13 179.90668 0.4 . 1 . . . . . 37 GLU C . 53613 1 179 . 1 . 1 37 37 GLU CA C 13 59.62311 0.4 . 1 . . . . . 37 GLU CA . 53613 1 180 . 1 . 1 37 37 GLU CB C 13 30.01968 0.4 . 1 . . . . . 37 GLU CB . 53613 1 181 . 1 . 1 37 37 GLU N N 15 116.83218 0.2 . 1 . . . . . 37 GLU N . 53613 1 182 . 1 . 1 38 38 LEU H H 1 8.31339 0.04 . 1 . . . . . 38 LEU H . 53613 1 183 . 1 . 1 38 38 LEU C C 13 179.46986 0.4 . 1 . . . . . 38 LEU C . 53613 1 184 . 1 . 1 38 38 LEU CA C 13 58.0055 0.4 . 1 . . . . . 38 LEU CA . 53613 1 185 . 1 . 1 38 38 LEU CB C 13 42.41957 0.4 . 1 . . . . . 38 LEU CB . 53613 1 186 . 1 . 1 38 38 LEU N N 15 121.17048 0.2 . 1 . . . . . 38 LEU N . 53613 1 187 . 1 . 1 39 39 LEU H H 1 8.93156 0.04 . 1 . . . . . 39 LEU H . 53613 1 188 . 1 . 1 39 39 LEU C C 13 179.75563 0.4 . 1 . . . . . 39 LEU C . 53613 1 189 . 1 . 1 39 39 LEU CA C 13 58.48676 0.4 . 1 . . . . . 39 LEU CA . 53613 1 190 . 1 . 1 39 39 LEU CB C 13 40.7598 0.4 . 1 . . . . . 39 LEU CB . 53613 1 191 . 1 . 1 39 39 LEU N N 15 118.65563 0.2 . 1 . . . . . 39 LEU N . 53613 1 192 . 1 . 1 40 40 ARG H H 1 7.75812 0.04 . 1 . . . . . 40 ARG H . 53613 1 193 . 1 . 1 40 40 ARG C C 13 179.19702 0.4 . 1 . . . . . 40 ARG C . 53613 1 194 . 1 . 1 40 40 ARG CA C 13 60.26118 0.4 . 1 . . . . . 40 ARG CA . 53613 1 195 . 1 . 1 40 40 ARG CB C 13 29.96747 0.4 . 1 . . . . . 40 ARG CB . 53613 1 196 . 1 . 1 40 40 ARG N N 15 118.55758 0.2 . 1 . . . . . 40 ARG N . 53613 1 197 . 1 . 1 41 41 GLU H H 1 7.62708 0.04 . 1 . . . . . 41 GLU H . 53613 1 198 . 1 . 1 41 41 GLU C C 13 179.74061 0.4 . 1 . . . . . 41 GLU C . 53613 1 199 . 1 . 1 41 41 GLU CA C 13 59.44837 0.4 . 1 . . . . . 41 GLU CA . 53613 1 200 . 1 . 1 41 41 GLU CB C 13 29.56647 0.4 . 1 . . . . . 41 GLU CB . 53613 1 201 . 1 . 1 41 41 GLU N N 15 121.03412 0.2 . 1 . . . . . 41 GLU N . 53613 1 202 . 1 . 1 42 42 LEU H H 1 8.92326 0.04 . 1 . . . . . 42 LEU H . 53613 1 203 . 1 . 1 42 42 LEU C C 13 177.48199 0.4 . 1 . . . . . 42 LEU C . 53613 1 204 . 1 . 1 42 42 LEU CA C 13 58.41786 0.4 . 1 . . . . . 42 LEU CA . 53613 1 205 . 1 . 1 42 42 LEU CB C 13 43.59299 0.4 . 1 . . . . . 42 LEU CB . 53613 1 206 . 1 . 1 42 42 LEU N N 15 120.28018 0.2 . 1 . . . . . 42 LEU N . 53613 1 207 . 1 . 1 43 43 LYS H H 1 8.14562 0.04 . 1 . . . . . 43 LYS H . 53613 1 208 . 1 . 1 43 43 LYS C C 13 179.26148 0.4 . 1 . . . . . 43 LYS C . 53613 1 209 . 1 . 1 43 43 LYS CA C 13 60.51568 0.4 . 1 . . . . . 43 LYS CA . 53613 1 210 . 1 . 1 43 43 LYS CB C 13 32.86466 0.4 . 1 . . . . . 43 LYS CB . 53613 1 211 . 1 . 1 43 43 LYS N N 15 118.35722 0.2 . 1 . . . . . 43 LYS N . 53613 1 212 . 1 . 1 44 44 GLU H H 1 7.00265 0.04 . 1 . . . . . 44 GLU H . 53613 1 213 . 1 . 1 44 44 GLU C C 13 179.34275 0.4 . 1 . . . . . 44 GLU C . 53613 1 214 . 1 . 1 44 44 GLU CA C 13 58.23123 0.4 . 1 . . . . . 44 GLU CA . 53613 1 215 . 1 . 1 44 44 GLU CB C 13 29.25547 0.4 . 1 . . . . . 44 GLU CB . 53613 1 216 . 1 . 1 44 44 GLU N N 15 115.76662 0.2 . 1 . . . . . 44 GLU N . 53613 1 217 . 1 . 1 45 45 LEU H H 1 7.99958 0.04 . 1 . . . . . 45 LEU H . 53613 1 218 . 1 . 1 45 45 LEU C C 13 179.51772 0.4 . 1 . . . . . 45 LEU C . 53613 1 219 . 1 . 1 45 45 LEU CA C 13 58.17419 0.4 . 1 . . . . . 45 LEU CA . 53613 1 220 . 1 . 1 45 45 LEU CB C 13 41.67832 0.4 . 1 . . . . . 45 LEU CB . 53613 1 221 . 1 . 1 45 45 LEU N N 15 120.99509 0.2 . 1 . . . . . 45 LEU N . 53613 1 222 . 1 . 1 46 46 PHE H H 1 8.77186 0.04 . 1 . . . . . 46 PHE H . 53613 1 223 . 1 . 1 46 46 PHE C C 13 178.17656 0.4 . 1 . . . . . 46 PHE C . 53613 1 224 . 1 . 1 46 46 PHE CA C 13 63.58715 0.4 . 1 . . . . . 46 PHE CA . 53613 1 225 . 1 . 1 46 46 PHE CB C 13 38.87898 0.4 . 1 . . . . . 46 PHE CB . 53613 1 226 . 1 . 1 46 46 PHE N N 15 118.17391 0.2 . 1 . . . . . 46 PHE N . 53613 1 227 . 1 . 1 47 47 LYS H H 1 7.18815 0.04 . 1 . . . . . 47 LYS H . 53613 1 228 . 1 . 1 47 47 LYS C C 13 179.55079 0.4 . 1 . . . . . 47 LYS C . 53613 1 229 . 1 . 1 47 47 LYS CA C 13 60.07279 0.4 . 1 . . . . . 47 LYS CA . 53613 1 230 . 1 . 1 47 47 LYS CB C 13 32.40274 0.4 . 1 . . . . . 47 LYS CB . 53613 1 231 . 1 . 1 47 47 LYS N N 15 116.7854 0.2 . 1 . . . . . 47 LYS N . 53613 1 232 . 1 . 1 48 48 LYS H H 1 7.86796 0.04 . 1 . . . . . 48 LYS H . 53613 1 233 . 1 . 1 48 48 LYS C C 13 178.55214 0.4 . 1 . . . . . 48 LYS C . 53613 1 234 . 1 . 1 48 48 LYS CA C 13 59.49168 0.4 . 1 . . . . . 48 LYS CA . 53613 1 235 . 1 . 1 48 48 LYS CB C 13 33.04884 0.4 . 1 . . . . . 48 LYS CB . 53613 1 236 . 1 . 1 48 48 LYS N N 15 119.37177 0.2 . 1 . . . . . 48 LYS N . 53613 1 237 . 1 . 1 49 49 ASP H H 1 8.64409 0.04 . 1 . . . . . 49 ASP H . 53613 1 238 . 1 . 1 49 49 ASP C C 13 177.58273 0.4 . 1 . . . . . 49 ASP C . 53613 1 239 . 1 . 1 49 49 ASP CA C 13 56.52455 0.4 . 1 . . . . . 49 ASP CA . 53613 1 240 . 1 . 1 49 49 ASP CB C 13 38.61562 0.4 . 1 . . . . . 49 ASP CB . 53613 1 241 . 1 . 1 49 49 ASP N N 15 119.59144 0.2 . 1 . . . . . 49 ASP N . 53613 1 242 . 1 . 1 50 50 LEU H H 1 8.25895 0.04 . 1 . . . . . 50 LEU H . 53613 1 243 . 1 . 1 50 50 LEU C C 13 178.71737 0.4 . 1 . . . . . 50 LEU C . 53613 1 244 . 1 . 1 50 50 LEU CA C 13 58.62594 0.4 . 1 . . . . . 50 LEU CA . 53613 1 245 . 1 . 1 50 50 LEU CB C 13 41.89138 0.4 . 1 . . . . . 50 LEU CB . 53613 1 246 . 1 . 1 50 50 LEU N N 15 118.4031 0.2 . 1 . . . . . 50 LEU N . 53613 1 247 . 1 . 1 51 51 LYS H H 1 7.6297 0.04 . 1 . . . . . 51 LYS H . 53613 1 248 . 1 . 1 51 51 LYS C C 13 179.22656 0.4 . 1 . . . . . 51 LYS C . 53613 1 249 . 1 . 1 51 51 LYS CA C 13 59.21242 0.4 . 1 . . . . . 51 LYS CA . 53613 1 250 . 1 . 1 51 51 LYS CB C 13 32.34692 0.4 . 1 . . . . . 51 LYS CB . 53613 1 251 . 1 . 1 51 51 LYS N N 15 118.88306 0.2 . 1 . . . . . 51 LYS N . 53613 1 252 . 1 . 1 52 52 LEU H H 1 8.12928 0.04 . 1 . . . . . 52 LEU H . 53613 1 253 . 1 . 1 52 52 LEU C C 13 178.8059 0.4 . 1 . . . . . 52 LEU C . 53613 1 254 . 1 . 1 52 52 LEU CA C 13 58.00906 0.4 . 1 . . . . . 52 LEU CA . 53613 1 255 . 1 . 1 52 52 LEU CB C 13 43.07101 0.4 . 1 . . . . . 52 LEU CB . 53613 1 256 . 1 . 1 52 52 LEU N N 15 119.12542 0.2 . 1 . . . . . 52 LEU N . 53613 1 257 . 1 . 1 53 53 ALA H H 1 8.35079 0.04 . 1 . . . . . 53 ALA H . 53613 1 258 . 1 . 1 53 53 ALA C C 13 179.76404 0.4 . 1 . . . . . 53 ALA C . 53613 1 259 . 1 . 1 53 53 ALA CA C 13 55.90387 0.4 . 1 . . . . . 53 ALA CA . 53613 1 260 . 1 . 1 53 53 ALA CB C 13 17.36007 0.4 . 1 . . . . . 53 ALA CB . 53613 1 261 . 1 . 1 53 53 ALA N N 15 121.86097 0.2 . 1 . . . . . 53 ALA N . 53613 1 262 . 1 . 1 54 54 GLU H H 1 8.14962 0.04 . 1 . . . . . 54 GLU H . 53613 1 263 . 1 . 1 54 54 GLU C C 13 179.81532 0.4 . 1 . . . . . 54 GLU C . 53613 1 264 . 1 . 1 54 54 GLU CA C 13 59.89994 0.4 . 1 . . . . . 54 GLU CA . 53613 1 265 . 1 . 1 54 54 GLU CB C 13 29.72805 0.4 . 1 . . . . . 54 GLU CB . 53613 1 266 . 1 . 1 54 54 GLU N N 15 117.98596 0.2 . 1 . . . . . 54 GLU N . 53613 1 267 . 1 . 1 55 55 GLU H H 1 8.4225 0.04 . 1 . . . . . 55 GLU H . 53613 1 268 . 1 . 1 55 55 GLU C C 13 180.20155 0.4 . 1 . . . . . 55 GLU C . 53613 1 269 . 1 . 1 55 55 GLU CA C 13 59.55755 0.4 . 1 . . . . . 55 GLU CA . 53613 1 270 . 1 . 1 55 55 GLU CB C 13 29.80621 0.4 . 1 . . . . . 55 GLU CB . 53613 1 271 . 1 . 1 55 55 GLU N N 15 120.73823 0.2 . 1 . . . . . 55 GLU N . 53613 1 272 . 1 . 1 56 56 MET H H 1 8.83224 0.04 . 1 . . . . . 56 MET H . 53613 1 273 . 1 . 1 56 56 MET C C 13 177.05891 0.4 . 1 . . . . . 56 MET C . 53613 1 274 . 1 . 1 56 56 MET CA C 13 59.88064 0.4 . 1 . . . . . 56 MET CA . 53613 1 275 . 1 . 1 56 56 MET CB C 13 34.4362 0.4 . 1 . . . . . 56 MET CB . 53613 1 276 . 1 . 1 56 56 MET N N 15 118.46963 0.2 . 1 . . . . . 56 MET N . 53613 1 277 . 1 . 1 57 57 LYS H H 1 8.07375 0.04 . 1 . . . . . 57 LYS H . 53613 1 278 . 1 . 1 57 57 LYS C C 13 177.5709 0.4 . 1 . . . . . 57 LYS C . 53613 1 279 . 1 . 1 57 57 LYS CA C 13 61.04085 0.4 . 1 . . . . . 57 LYS CA . 53613 1 280 . 1 . 1 57 57 LYS CB C 13 31.66862 0.4 . 1 . . . . . 57 LYS CB . 53613 1 281 . 1 . 1 57 57 LYS N N 15 119.94265 0.2 . 1 . . . . . 57 LYS N . 53613 1 282 . 1 . 1 58 58 LYS H H 1 7.65586 0.04 . 1 . . . . . 58 LYS H . 53613 1 283 . 1 . 1 58 58 LYS C C 13 178.8919 0.4 . 1 . . . . . 58 LYS C . 53613 1 284 . 1 . 1 58 58 LYS CA C 13 59.20009 0.4 . 1 . . . . . 58 LYS CA . 53613 1 285 . 1 . 1 58 58 LYS CB C 13 32.24969 0.4 . 1 . . . . . 58 LYS CB . 53613 1 286 . 1 . 1 58 58 LYS N N 15 118.58405 0.2 . 1 . . . . . 58 LYS N . 53613 1 287 . 1 . 1 59 59 GLU H H 1 7.9795 0.04 . 1 . . . . . 59 GLU H . 53613 1 288 . 1 . 1 59 59 GLU C C 13 179.65024 0.4 . 1 . . . . . 59 GLU C . 53613 1 289 . 1 . 1 59 59 GLU CA C 13 59.55931 0.4 . 1 . . . . . 59 GLU CA . 53613 1 290 . 1 . 1 59 59 GLU CB C 13 29.3853 0.4 . 1 . . . . . 59 GLU CB . 53613 1 291 . 1 . 1 59 59 GLU N N 15 119.34927 0.2 . 1 . . . . . 59 GLU N . 53613 1 292 . 1 . 1 60 60 ALA H H 1 8.77621 0.04 . 1 . . . . . 60 ALA H . 53613 1 293 . 1 . 1 60 60 ALA C C 13 178.78933 0.4 . 1 . . . . . 60 ALA C . 53613 1 294 . 1 . 1 60 60 ALA CA C 13 55.32844 0.4 . 1 . . . . . 60 ALA CA . 53613 1 295 . 1 . 1 60 60 ALA CB C 13 18.01694 0.4 . 1 . . . . . 60 ALA CB . 53613 1 296 . 1 . 1 60 60 ALA N N 15 122.88895 0.2 . 1 . . . . . 60 ALA N . 53613 1 297 . 1 . 1 61 61 GLU H H 1 8.37471 0.04 . 1 . . . . . 61 GLU H . 53613 1 298 . 1 . 1 61 61 GLU C C 13 180.95713 0.4 . 1 . . . . . 61 GLU C . 53613 1 299 . 1 . 1 61 61 GLU CA C 13 59.57582 0.4 . 1 . . . . . 61 GLU CA . 53613 1 300 . 1 . 1 61 61 GLU CB C 13 29.62202 0.4 . 1 . . . . . 61 GLU CB . 53613 1 301 . 1 . 1 61 61 GLU N N 15 120.08469 0.2 . 1 . . . . . 61 GLU N . 53613 1 302 . 1 . 1 62 62 GLU H H 1 8.21739 0.04 . 1 . . . . . 62 GLU H . 53613 1 303 . 1 . 1 62 62 GLU C C 13 177.98204 0.4 . 1 . . . . . 62 GLU C . 53613 1 304 . 1 . 1 62 62 GLU CA C 13 59.18457 0.4 . 1 . . . . . 62 GLU CA . 53613 1 305 . 1 . 1 62 62 GLU CB C 13 29.29065 0.4 . 1 . . . . . 62 GLU CB . 53613 1 306 . 1 . 1 62 62 GLU N N 15 121.44956 0.2 . 1 . . . . . 62 GLU N . 53613 1 307 . 1 . 1 63 63 ALA H H 1 7.6803 0.04 . 1 . . . . . 63 ALA H . 53613 1 308 . 1 . 1 63 63 ALA C C 13 178.05535 0.4 . 1 . . . . . 63 ALA C . 53613 1 309 . 1 . 1 63 63 ALA CA C 13 52.24805 0.4 . 1 . . . . . 63 ALA CA . 53613 1 310 . 1 . 1 63 63 ALA CB C 13 19.00588 0.4 . 1 . . . . . 63 ALA CB . 53613 1 311 . 1 . 1 63 63 ALA N N 15 118.53372 0.2 . 1 . . . . . 63 ALA N . 53613 1 312 . 1 . 1 64 64 GLY H H 1 7.79826 0.04 . 1 . . . . . 64 GLY H . 53613 1 313 . 1 . 1 64 64 GLY C C 13 174.47362 0.4 . 1 . . . . . 64 GLY C . 53613 1 314 . 1 . 1 64 64 GLY CA C 13 45.88511 0.4 . 1 . . . . . 64 GLY CA . 53613 1 315 . 1 . 1 64 64 GLY N N 15 107.69252 0.2 . 1 . . . . . 64 GLY N . 53613 1 316 . 1 . 1 65 65 ASN H H 1 8.03556 0.04 . 1 . . . . . 65 ASN H . 53613 1 317 . 1 . 1 65 65 ASN C C 13 174.23707 0.4 . 1 . . . . . 65 ASN C . 53613 1 318 . 1 . 1 65 65 ASN CA C 13 51.13859 0.4 . 1 . . . . . 65 ASN CA . 53613 1 319 . 1 . 1 65 65 ASN CB C 13 36.73485 0.4 . 1 . . . . . 65 ASN CB . 53613 1 320 . 1 . 1 65 65 ASN N N 15 118.44703 0.2 . 1 . . . . . 65 ASN N . 53613 1 321 . 1 . 1 66 66 LYS H H 1 7.90058 0.04 . 1 . . . . . 66 LYS H . 53613 1 322 . 1 . 1 66 66 LYS C C 13 178.47236 0.4 . 1 . . . . . 66 LYS C . 53613 1 323 . 1 . 1 66 66 LYS CA C 13 59.57169 0.4 . 1 . . . . . 66 LYS CA . 53613 1 324 . 1 . 1 66 66 LYS CB C 13 32.53288 0.4 . 1 . . . . . 66 LYS CB . 53613 1 325 . 1 . 1 66 66 LYS N N 15 124.32417 0.2 . 1 . . . . . 66 LYS N . 53613 1 326 . 1 . 1 67 67 GLU H H 1 8.77333 0.04 . 1 . . . . . 67 GLU H . 53613 1 327 . 1 . 1 67 67 GLU C C 13 179.03757 0.4 . 1 . . . . . 67 GLU C . 53613 1 328 . 1 . 1 67 67 GLU CA C 13 59.9569 0.4 . 1 . . . . . 67 GLU CA . 53613 1 329 . 1 . 1 67 67 GLU CB C 13 29.01693 0.4 . 1 . . . . . 67 GLU CB . 53613 1 330 . 1 . 1 67 67 GLU N N 15 119.30711 0.2 . 1 . . . . . 67 GLU N . 53613 1 331 . 1 . 1 68 68 ALA H H 1 7.54565 0.04 . 1 . . . . . 68 ALA H . 53613 1 332 . 1 . 1 68 68 ALA C C 13 179.05723 0.4 . 1 . . . . . 68 ALA C . 53613 1 333 . 1 . 1 68 68 ALA CA C 13 54.84881 0.4 . 1 . . . . . 68 ALA CA . 53613 1 334 . 1 . 1 68 68 ALA CB C 13 17.8637 0.4 . 1 . . . . . 68 ALA CB . 53613 1 335 . 1 . 1 68 68 ALA N N 15 118.77883 0.2 . 1 . . . . . 68 ALA N . 53613 1 336 . 1 . 1 69 69 VAL H H 1 8.04012 0.04 . 1 . . . . . 69 VAL H . 53613 1 337 . 1 . 1 69 69 VAL C C 13 177.20183 0.4 . 1 . . . . . 69 VAL C . 53613 1 338 . 1 . 1 69 69 VAL CA C 13 68.36747 0.4 . 1 . . . . . 69 VAL CA . 53613 1 339 . 1 . 1 69 69 VAL CB C 13 31.57765 0.4 . 1 . . . . . 69 VAL CB . 53613 1 340 . 1 . 1 69 69 VAL N N 15 117.50834 0.2 . 1 . . . . . 69 VAL N . 53613 1 341 . 1 . 1 70 70 GLU H H 1 7.81712 0.04 . 1 . . . . . 70 GLU H . 53613 1 342 . 1 . 1 70 70 GLU C C 13 180.34017 0.4 . 1 . . . . . 70 GLU C . 53613 1 343 . 1 . 1 70 70 GLU CA C 13 59.74858 0.4 . 1 . . . . . 70 GLU CA . 53613 1 344 . 1 . 1 70 70 GLU CB C 13 29.50809 0.4 . 1 . . . . . 70 GLU CB . 53613 1 345 . 1 . 1 70 70 GLU N N 15 117.72983 0.2 . 1 . . . . . 70 GLU N . 53613 1 346 . 1 . 1 71 71 LEU H H 1 7.61533 0.04 . 1 . . . . . 71 LEU H . 53613 1 347 . 1 . 1 71 71 LEU C C 13 180.18837 0.4 . 1 . . . . . 71 LEU C . 53613 1 348 . 1 . 1 71 71 LEU CA C 13 57.70645 0.4 . 1 . . . . . 71 LEU CA . 53613 1 349 . 1 . 1 71 71 LEU CB C 13 43.06979 0.4 . 1 . . . . . 71 LEU CB . 53613 1 350 . 1 . 1 71 71 LEU N N 15 119.00439 0.2 . 1 . . . . . 71 LEU N . 53613 1 351 . 1 . 1 72 72 LEU H H 1 8.73327 0.04 . 1 . . . . . 72 LEU H . 53613 1 352 . 1 . 1 72 72 LEU C C 13 179.0533 0.4 . 1 . . . . . 72 LEU C . 53613 1 353 . 1 . 1 72 72 LEU CA C 13 58.11463 0.4 . 1 . . . . . 72 LEU CA . 53613 1 354 . 1 . 1 72 72 LEU CB C 13 41.44706 0.4 . 1 . . . . . 72 LEU CB . 53613 1 355 . 1 . 1 72 72 LEU N N 15 121.22917 0.2 . 1 . . . . . 72 LEU N . 53613 1 356 . 1 . 1 73 73 GLU H H 1 8.96163 0.04 . 1 . . . . . 73 GLU H . 53613 1 357 . 1 . 1 73 73 GLU C C 13 178.93823 0.4 . 1 . . . . . 73 GLU C . 53613 1 358 . 1 . 1 73 73 GLU CA C 13 59.8626 0.4 . 1 . . . . . 73 GLU CA . 53613 1 359 . 1 . 1 73 73 GLU CB C 13 29.20935 0.4 . 1 . . . . . 73 GLU CB . 53613 1 360 . 1 . 1 73 73 GLU N N 15 121.54453 0.2 . 1 . . . . . 73 GLU N . 53613 1 361 . 1 . 1 74 74 GLU H H 1 7.30061 0.04 . 1 . . . . . 74 GLU H . 53613 1 362 . 1 . 1 74 74 GLU C C 13 178.70156 0.4 . 1 . . . . . 74 GLU C . 53613 1 363 . 1 . 1 74 74 GLU CA C 13 59.23546 0.4 . 1 . . . . . 74 GLU CA . 53613 1 364 . 1 . 1 74 74 GLU CB C 13 28.81849 0.4 . 1 . . . . . 74 GLU CB . 53613 1 365 . 1 . 1 74 74 GLU N N 15 119.82996 0.2 . 1 . . . . . 74 GLU N . 53613 1 366 . 1 . 1 75 75 GLN H H 1 8.05231 0.04 . 1 . . . . . 75 GLN H . 53613 1 367 . 1 . 1 75 75 GLN C C 13 177.35404 0.4 . 1 . . . . . 75 GLN C . 53613 1 368 . 1 . 1 75 75 GLN CA C 13 59.6679 0.4 . 1 . . . . . 75 GLN CA . 53613 1 369 . 1 . 1 75 75 GLN CB C 13 28.27693 0.4 . 1 . . . . . 75 GLN CB . 53613 1 370 . 1 . 1 75 75 GLN N N 15 118.36214 0.2 . 1 . . . . . 75 GLN N . 53613 1 371 . 1 . 1 76 76 LEU H H 1 8.50961 0.04 . 1 . . . . . 76 LEU H . 53613 1 372 . 1 . 1 76 76 LEU C C 13 178.43154 0.4 . 1 . . . . . 76 LEU C . 53613 1 373 . 1 . 1 76 76 LEU CA C 13 58.83195 0.4 . 1 . . . . . 76 LEU CA . 53613 1 374 . 1 . 1 76 76 LEU CB C 13 42.33302 0.4 . 1 . . . . . 76 LEU CB . 53613 1 375 . 1 . 1 76 76 LEU N N 15 119.76321 0.2 . 1 . . . . . 76 LEU N . 53613 1 376 . 1 . 1 77 77 GLU H H 1 7.80862 0.04 . 1 . . . . . 77 GLU H . 53613 1 377 . 1 . 1 77 77 GLU C C 13 180.14462 0.4 . 1 . . . . . 77 GLU C . 53613 1 378 . 1 . 1 77 77 GLU CA C 13 59.60151 0.4 . 1 . . . . . 77 GLU CA . 53613 1 379 . 1 . 1 77 77 GLU CB C 13 29.31654 0.4 . 1 . . . . . 77 GLU CB . 53613 1 380 . 1 . 1 77 77 GLU N N 15 118.21193 0.2 . 1 . . . . . 77 GLU N . 53613 1 381 . 1 . 1 78 78 ARG H H 1 8.0676 0.04 . 1 . . . . . 78 ARG H . 53613 1 382 . 1 . 1 78 78 ARG C C 13 179.28541 0.4 . 1 . . . . . 78 ARG C . 53613 1 383 . 1 . 1 78 78 ARG CA C 13 59.41619 0.4 . 1 . . . . . 78 ARG CA . 53613 1 384 . 1 . 1 78 78 ARG CB C 13 30.53014 0.4 . 1 . . . . . 78 ARG CB . 53613 1 385 . 1 . 1 78 78 ARG N N 15 118.9726 0.2 . 1 . . . . . 78 ARG N . 53613 1 386 . 1 . 1 79 79 LEU H H 1 9.10857 0.04 . 1 . . . . . 79 LEU H . 53613 1 387 . 1 . 1 79 79 LEU C C 13 179.27037 0.4 . 1 . . . . . 79 LEU C . 53613 1 388 . 1 . 1 79 79 LEU CA C 13 58.01074 0.4 . 1 . . . . . 79 LEU CA . 53613 1 389 . 1 . 1 79 79 LEU CB C 13 42.84696 0.4 . 1 . . . . . 79 LEU CB . 53613 1 390 . 1 . 1 79 79 LEU N N 15 120.80968 0.2 . 1 . . . . . 79 LEU N . 53613 1 391 . 1 . 1 80 80 LYS H H 1 8.42685 0.04 . 1 . . . . . 80 LYS H . 53613 1 392 . 1 . 1 80 80 LYS C C 13 179.97819 0.4 . 1 . . . . . 80 LYS C . 53613 1 393 . 1 . 1 80 80 LYS CA C 13 60.39044 0.4 . 1 . . . . . 80 LYS CA . 53613 1 394 . 1 . 1 80 80 LYS CB C 13 32.31118 0.4 . 1 . . . . . 80 LYS CB . 53613 1 395 . 1 . 1 80 80 LYS N N 15 119.13389 0.2 . 1 . . . . . 80 LYS N . 53613 1 396 . 1 . 1 81 81 LYS H H 1 7.45854 0.04 . 1 . . . . . 81 LYS H . 53613 1 397 . 1 . 1 81 81 LYS C C 13 179.2823 0.4 . 1 . . . . . 81 LYS C . 53613 1 398 . 1 . 1 81 81 LYS CA C 13 59.63016 0.4 . 1 . . . . . 81 LYS CA . 53613 1 399 . 1 . 1 81 81 LYS CB C 13 32.2859 0.4 . 1 . . . . . 81 LYS CB . 53613 1 400 . 1 . 1 81 81 LYS N N 15 121.03865 0.2 . 1 . . . . . 81 LYS N . 53613 1 401 . 1 . 1 82 82 ILE H H 1 8.26674 0.04 . 1 . . . . . 82 ILE H . 53613 1 402 . 1 . 1 82 82 ILE C C 13 177.44314 0.4 . 1 . . . . . 82 ILE C . 53613 1 403 . 1 . 1 82 82 ILE CA C 13 66.1052 0.4 . 1 . . . . . 82 ILE CA . 53613 1 404 . 1 . 1 82 82 ILE CB C 13 38.38016 0.4 . 1 . . . . . 82 ILE CB . 53613 1 405 . 1 . 1 82 82 ILE N N 15 121.18725 0.2 . 1 . . . . . 82 ILE N . 53613 1 406 . 1 . 1 83 83 GLN H H 1 8.87205 0.04 . 1 . . . . . 83 GLN H . 53613 1 407 . 1 . 1 83 83 GLN C C 13 177.44286 0.4 . 1 . . . . . 83 GLN C . 53613 1 408 . 1 . 1 83 83 GLN CA C 13 59.45151 0.4 . 1 . . . . . 83 GLN CA . 53613 1 409 . 1 . 1 83 83 GLN CB C 13 28.39825 0.4 . 1 . . . . . 83 GLN CB . 53613 1 410 . 1 . 1 83 83 GLN N N 15 120.27066 0.2 . 1 . . . . . 83 GLN N . 53613 1 411 . 1 . 1 84 84 ALA H H 1 7.69367 0.04 . 1 . . . . . 84 ALA H . 53613 1 412 . 1 . 1 84 84 ALA C C 13 181.27434 0.4 . 1 . . . . . 84 ALA C . 53613 1 413 . 1 . 1 84 84 ALA CA C 13 55.32053 0.4 . 1 . . . . . 84 ALA CA . 53613 1 414 . 1 . 1 84 84 ALA CB C 13 17.81466 0.4 . 1 . . . . . 84 ALA CB . 53613 1 415 . 1 . 1 84 84 ALA N N 15 121.1233 0.2 . 1 . . . . . 84 ALA N . 53613 1 416 . 1 . 1 85 85 MET H H 1 7.85889 0.04 . 1 . . . . . 85 MET H . 53613 1 417 . 1 . 1 85 85 MET C C 13 178.01073 0.4 . 1 . . . . . 85 MET C . 53613 1 418 . 1 . 1 85 85 MET CA C 13 59.50737 0.4 . 1 . . . . . 85 MET CA . 53613 1 419 . 1 . 1 85 85 MET CB C 13 34.70422 0.4 . 1 . . . . . 85 MET CB . 53613 1 420 . 1 . 1 85 85 MET N N 15 119.58472 0.2 . 1 . . . . . 85 MET N . 53613 1 421 . 1 . 1 86 86 PHE H H 1 8.89718 0.04 . 1 . . . . . 86 PHE H . 53613 1 422 . 1 . 1 86 86 PHE C C 13 176.46516 0.4 . 1 . . . . . 86 PHE C . 53613 1 423 . 1 . 1 86 86 PHE CA C 13 61.90875 0.4 . 1 . . . . . 86 PHE CA . 53613 1 424 . 1 . 1 86 86 PHE CB C 13 38.57314 0.4 . 1 . . . . . 86 PHE CB . 53613 1 425 . 1 . 1 86 86 PHE N N 15 121.35935 0.2 . 1 . . . . . 86 PHE N . 53613 1 426 . 1 . 1 87 87 GLU H H 1 8.48717 0.04 . 1 . . . . . 87 GLU H . 53613 1 427 . 1 . 1 87 87 GLU C C 13 179.93197 0.4 . 1 . . . . . 87 GLU C . 53613 1 428 . 1 . 1 87 87 GLU CA C 13 59.8431 0.4 . 1 . . . . . 87 GLU CA . 53613 1 429 . 1 . 1 87 87 GLU CB C 13 28.86074 0.4 . 1 . . . . . 87 GLU CB . 53613 1 430 . 1 . 1 87 87 GLU N N 15 119.38021 0.2 . 1 . . . . . 87 GLU N . 53613 1 431 . 1 . 1 88 88 GLU H H 1 7.5775 0.04 . 1 . . . . . 88 GLU H . 53613 1 432 . 1 . 1 88 88 GLU C C 13 178.87637 0.4 . 1 . . . . . 88 GLU C . 53613 1 433 . 1 . 1 88 88 GLU CA C 13 59.53249 0.4 . 1 . . . . . 88 GLU CA . 53613 1 434 . 1 . 1 88 88 GLU CB C 13 29.01956 0.4 . 1 . . . . . 88 GLU CB . 53613 1 435 . 1 . 1 88 88 GLU N N 15 120.14751 0.2 . 1 . . . . . 88 GLU N . 53613 1 436 . 1 . 1 89 89 ALA H H 1 8.56488 0.04 . 1 . . . . . 89 ALA H . 53613 1 437 . 1 . 1 89 89 ALA C C 13 179.25366 0.4 . 1 . . . . . 89 ALA C . 53613 1 438 . 1 . 1 89 89 ALA CA C 13 55.56937 0.4 . 1 . . . . . 89 ALA CA . 53613 1 439 . 1 . 1 89 89 ALA CB C 13 16.50775 0.4 . 1 . . . . . 89 ALA CB . 53613 1 440 . 1 . 1 89 89 ALA N N 15 125.04777 0.2 . 1 . . . . . 89 ALA N . 53613 1 441 . 1 . 1 90 90 VAL H H 1 8.44618 0.04 . 1 . . . . . 90 VAL H . 53613 1 442 . 1 . 1 90 90 VAL C C 13 178.14789 0.4 . 1 . . . . . 90 VAL C . 53613 1 443 . 1 . 1 90 90 VAL CA C 13 67.38906 0.4 . 1 . . . . . 90 VAL CA . 53613 1 444 . 1 . 1 90 90 VAL CB C 13 31.2997 0.4 . 1 . . . . . 90 VAL CB . 53613 1 445 . 1 . 1 90 90 VAL N N 15 119.28505 0.2 . 1 . . . . . 90 VAL N . 53613 1 446 . 1 . 1 91 91 GLU H H 1 7.59597 0.04 . 1 . . . . . 91 GLU H . 53613 1 447 . 1 . 1 91 91 GLU C C 13 179.2087 0.4 . 1 . . . . . 91 GLU C . 53613 1 448 . 1 . 1 91 91 GLU CA C 13 59.34764 0.4 . 1 . . . . . 91 GLU CA . 53613 1 449 . 1 . 1 91 91 GLU CB C 13 28.84866 0.4 . 1 . . . . . 91 GLU CB . 53613 1 450 . 1 . 1 91 91 GLU N N 15 118.88887 0.2 . 1 . . . . . 91 GLU N . 53613 1 451 . 1 . 1 92 92 ALA H H 1 8.31447 0.04 . 1 . . . . . 92 ALA H . 53613 1 452 . 1 . 1 92 92 ALA C C 13 179.04877 0.4 . 1 . . . . . 92 ALA C . 53613 1 453 . 1 . 1 92 92 ALA CA C 13 55.32095 0.4 . 1 . . . . . 92 ALA CA . 53613 1 454 . 1 . 1 92 92 ALA CB C 13 17.25656 0.4 . 1 . . . . . 92 ALA CB . 53613 1 455 . 1 . 1 92 92 ALA N N 15 122.99022 0.2 . 1 . . . . . 92 ALA N . 53613 1 456 . 1 . 1 93 93 PHE H H 1 8.65336 0.04 . 1 . . . . . 93 PHE H . 53613 1 457 . 1 . 1 93 93 PHE C C 13 179.52742 0.4 . 1 . . . . . 93 PHE C . 53613 1 458 . 1 . 1 93 93 PHE CA C 13 61.65007 0.4 . 1 . . . . . 93 PHE CA . 53613 1 459 . 1 . 1 93 93 PHE CB C 13 38.87076 0.4 . 1 . . . . . 93 PHE CB . 53613 1 460 . 1 . 1 93 93 PHE N N 15 119.32588 0.2 . 1 . . . . . 93 PHE N . 53613 1 461 . 1 . 1 94 94 ARG H H 1 8.55227 0.04 . 1 . . . . . 94 ARG H . 53613 1 462 . 1 . 1 94 94 ARG C C 13 177.78221 0.4 . 1 . . . . . 94 ARG C . 53613 1 463 . 1 . 1 94 94 ARG CA C 13 58.934 0.4 . 1 . . . . . 94 ARG CA . 53613 1 464 . 1 . 1 94 94 ARG CB C 13 29.77676 0.4 . 1 . . . . . 94 ARG CB . 53613 1 465 . 1 . 1 94 94 ARG N N 15 119.9385 0.2 . 1 . . . . . 94 ARG N . 53613 1 466 . 1 . 1 95 95 ALA H H 1 7.80722 0.04 . 1 . . . . . 95 ALA H . 53613 1 467 . 1 . 1 95 95 ALA C C 13 177.90727 0.4 . 1 . . . . . 95 ALA C . 53613 1 468 . 1 . 1 95 95 ALA CA C 13 52.30439 0.4 . 1 . . . . . 95 ALA CA . 53613 1 469 . 1 . 1 95 95 ALA CB C 13 18.95402 0.4 . 1 . . . . . 95 ALA CB . 53613 1 470 . 1 . 1 95 95 ALA N N 15 118.95067 0.2 . 1 . . . . . 95 ALA N . 53613 1 471 . 1 . 1 96 96 GLY H H 1 7.63609 0.04 . 1 . . . . . 96 GLY H . 53613 1 472 . 1 . 1 96 96 GLY C C 13 174.27183 0.4 . 1 . . . . . 96 GLY C . 53613 1 473 . 1 . 1 96 96 GLY CA C 13 45.47847 0.4 . 1 . . . . . 96 GLY CA . 53613 1 474 . 1 . 1 96 96 GLY N N 15 107.01792 0.2 . 1 . . . . . 96 GLY N . 53613 1 475 . 1 . 1 97 97 ASP H H 1 8.25557 0.04 . 1 . . . . . 97 ASP H . 53613 1 476 . 1 . 1 97 97 ASP C C 13 175.24833 0.4 . 1 . . . . . 97 ASP C . 53613 1 477 . 1 . 1 97 97 ASP CA C 13 52.17419 0.4 . 1 . . . . . 97 ASP CA . 53613 1 478 . 1 . 1 97 97 ASP CB C 13 39.28747 0.4 . 1 . . . . . 97 ASP CB . 53613 1 479 . 1 . 1 97 97 ASP N N 15 121.6273 0.2 . 1 . . . . . 97 ASP N . 53613 1 480 . 1 . 1 98 98 ARG H H 1 7.87677 0.04 . 1 . . . . . 98 ARG H . 53613 1 481 . 1 . 1 98 98 ARG C C 13 178.6982 0.4 . 1 . . . . . 98 ARG C . 53613 1 482 . 1 . 1 98 98 ARG CA C 13 59.96447 0.4 . 1 . . . . . 98 ARG CA . 53613 1 483 . 1 . 1 98 98 ARG CB C 13 30.85784 0.4 . 1 . . . . . 98 ARG CB . 53613 1 484 . 1 . 1 98 98 ARG N N 15 123.65242 0.2 . 1 . . . . . 98 ARG N . 53613 1 485 . 1 . 1 99 99 GLU H H 1 8.7123 0.04 . 1 . . . . . 99 GLU H . 53613 1 486 . 1 . 1 99 99 GLU C C 13 179.04815 0.4 . 1 . . . . . 99 GLU C . 53613 1 487 . 1 . 1 99 99 GLU CA C 13 59.78538 0.4 . 1 . . . . . 99 GLU CA . 53613 1 488 . 1 . 1 99 99 GLU CB C 13 29.19151 0.4 . 1 . . . . . 99 GLU CB . 53613 1 489 . 1 . 1 99 99 GLU N N 15 119.36269 0.2 . 1 . . . . . 99 GLU N . 53613 1 490 . 1 . 1 100 100 ARG H H 1 7.68464 0.04 . 1 . . . . . 100 ARG H . 53613 1 491 . 1 . 1 100 100 ARG C C 13 178.00247 0.4 . 1 . . . . . 100 ARG C . 53613 1 492 . 1 . 1 100 100 ARG CA C 13 58.1189 0.4 . 1 . . . . . 100 ARG CA . 53613 1 493 . 1 . 1 100 100 ARG CB C 13 30.83111 0.4 . 1 . . . . . 100 ARG CB . 53613 1 494 . 1 . 1 100 100 ARG N N 15 120.45183 0.2 . 1 . . . . . 100 ARG N . 53613 1 495 . 1 . 1 101 101 PHE H H 1 8.37874 0.04 . 1 . . . . . 101 PHE H . 53613 1 496 . 1 . 1 101 101 PHE C C 13 176.0181 0.4 . 1 . . . . . 101 PHE C . 53613 1 497 . 1 . 1 101 101 PHE CA C 13 62.59904 0.4 . 1 . . . . . 101 PHE CA . 53613 1 498 . 1 . 1 101 101 PHE CB C 13 38.81669 0.4 . 1 . . . . . 101 PHE CB . 53613 1 499 . 1 . 1 101 101 PHE N N 15 117.8181 0.2 . 1 . . . . . 101 PHE N . 53613 1 500 . 1 . 1 102 102 GLY H H 1 8.20953 0.04 . 1 . . . . . 102 GLY H . 53613 1 501 . 1 . 1 102 102 GLY C C 13 176.01459 0.4 . 1 . . . . . 102 GLY C . 53613 1 502 . 1 . 1 102 102 GLY CA C 13 47.40144 0.4 . 1 . . . . . 102 GLY CA . 53613 1 503 . 1 . 1 102 102 GLY N N 15 103.4648 0.2 . 1 . . . . . 102 GLY N . 53613 1 504 . 1 . 1 103 103 GLU C C 13 179.54604 0.4 . 1 . . . . . 103 GLU C . 53613 1 505 . 1 . 1 103 103 GLU CA C 13 59.05674 0.4 . 1 . . . . . 103 GLU CA . 53613 1 506 . 1 . 1 103 103 GLU CB C 13 29.8465 0.4 . 1 . . . . . 103 GLU CB . 53613 1 507 . 1 . 1 104 104 LEU H H 1 8.18469 0.04 . 1 . . . . . 104 LEU H . 53613 1 508 . 1 . 1 104 104 LEU C C 13 178.66346 0.4 . 1 . . . . . 104 LEU C . 53613 1 509 . 1 . 1 104 104 LEU CA C 13 57.81353 0.4 . 1 . . . . . 104 LEU CA . 53613 1 510 . 1 . 1 104 104 LEU CB C 13 42.75069 0.4 . 1 . . . . . 104 LEU CB . 53613 1 511 . 1 . 1 104 104 LEU N N 15 119.68802 0.2 . 1 . . . . . 104 LEU N . 53613 1 512 . 1 . 1 105 105 LEU H H 1 8.39244 0.04 . 1 . . . . . 105 LEU H . 53613 1 513 . 1 . 1 105 105 LEU C C 13 178.23497 0.4 . 1 . . . . . 105 LEU C . 53613 1 514 . 1 . 1 105 105 LEU CA C 13 58.29729 0.4 . 1 . . . . . 105 LEU CA . 53613 1 515 . 1 . 1 105 105 LEU CB C 13 41.09566 0.4 . 1 . . . . . 105 LEU CB . 53613 1 516 . 1 . 1 105 105 LEU N N 15 119.24026 0.2 . 1 . . . . . 105 LEU N . 53613 1 517 . 1 . 1 106 106 GLU H H 1 7.37508 0.04 . 1 . . . . . 106 GLU H . 53613 1 518 . 1 . 1 106 106 GLU C C 13 179.12933 0.4 . 1 . . . . . 106 GLU C . 53613 1 519 . 1 . 1 106 106 GLU CA C 13 59.71081 0.4 . 1 . . . . . 106 GLU CA . 53613 1 520 . 1 . 1 106 106 GLU CB C 13 29.30236 0.4 . 1 . . . . . 106 GLU CB . 53613 1 521 . 1 . 1 106 106 GLU N N 15 115.61287 0.2 . 1 . . . . . 106 GLU N . 53613 1 522 . 1 . 1 107 107 LYS H H 1 7.55205 0.04 . 1 . . . . . 107 LYS H . 53613 1 523 . 1 . 1 107 107 LYS C C 13 179.02881 0.4 . 1 . . . . . 107 LYS C . 53613 1 524 . 1 . 1 107 107 LYS CA C 13 59.20324 0.4 . 1 . . . . . 107 LYS CA . 53613 1 525 . 1 . 1 107 107 LYS CB C 13 32.63947 0.4 . 1 . . . . . 107 LYS CB . 53613 1 526 . 1 . 1 107 107 LYS N N 15 119.34928 0.2 . 1 . . . . . 107 LYS N . 53613 1 527 . 1 . 1 108 108 ILE H H 1 8.83 0.04 . 1 . . . . . 108 ILE H . 53613 1 528 . 1 . 1 108 108 ILE C C 13 177.67175 0.4 . 1 . . . . . 108 ILE C . 53613 1 529 . 1 . 1 108 108 ILE CA C 13 66.26058 0.4 . 1 . . . . . 108 ILE CA . 53613 1 530 . 1 . 1 108 108 ILE CB C 13 38.26853 0.4 . 1 . . . . . 108 ILE CB . 53613 1 531 . 1 . 1 108 108 ILE N N 15 121.0814 0.2 . 1 . . . . . 108 ILE N . 53613 1 532 . 1 . 1 109 109 ILE H H 1 8.14944 0.04 . 1 . . . . . 109 ILE H . 53613 1 533 . 1 . 1 109 109 ILE C C 13 177.517 0.4 . 1 . . . . . 109 ILE C . 53613 1 534 . 1 . 1 109 109 ILE CA C 13 66.73962 0.4 . 1 . . . . . 109 ILE CA . 53613 1 535 . 1 . 1 109 109 ILE CB C 13 38.14688 0.4 . 1 . . . . . 109 ILE CB . 53613 1 536 . 1 . 1 109 109 ILE N N 15 119.78584 0.2 . 1 . . . . . 109 ILE N . 53613 1 537 . 1 . 1 110 110 GLU H H 1 7.80638 0.04 . 1 . . . . . 110 GLU H . 53613 1 538 . 1 . 1 110 110 GLU C C 13 180.22356 0.4 . 1 . . . . . 110 GLU C . 53613 1 539 . 1 . 1 110 110 GLU CA C 13 59.88508 0.4 . 1 . . . . . 110 GLU CA . 53613 1 540 . 1 . 1 110 110 GLU CB C 13 29.41391 0.4 . 1 . . . . . 110 GLU CB . 53613 1 541 . 1 . 1 110 110 GLU N N 15 118.5118 0.2 . 1 . . . . . 110 GLU N . 53613 1 542 . 1 . 1 111 111 GLU H H 1 8.43953 0.04 . 1 . . . . . 111 GLU H . 53613 1 543 . 1 . 1 111 111 GLU C C 13 179.8974 0.4 . 1 . . . . . 111 GLU C . 53613 1 544 . 1 . 1 111 111 GLU CA C 13 58.99063 0.4 . 1 . . . . . 111 GLU CA . 53613 1 545 . 1 . 1 111 111 GLU CB C 13 29.2706 0.4 . 1 . . . . . 111 GLU CB . 53613 1 546 . 1 . 1 111 111 GLU N N 15 120.06226 0.2 . 1 . . . . . 111 GLU N . 53613 1 547 . 1 . 1 112 112 GLY H H 1 9.18382 0.04 . 1 . . . . . 112 GLY H . 53613 1 548 . 1 . 1 112 112 GLY C C 13 176.31843 0.4 . 1 . . . . . 112 GLY C . 53613 1 549 . 1 . 1 112 112 GLY CA C 13 47.63337 0.4 . 1 . . . . . 112 GLY CA . 53613 1 550 . 1 . 1 112 112 GLY N N 15 109.92252 0.2 . 1 . . . . . 112 GLY N . 53613 1 551 . 1 . 1 113 113 LYS H H 1 8.64029 0.04 . 1 . . . . . 113 LYS H . 53613 1 552 . 1 . 1 113 113 LYS C C 13 179.79767 0.4 . 1 . . . . . 113 LYS C . 53613 1 553 . 1 . 1 113 113 LYS CA C 13 60.10182 0.4 . 1 . . . . . 113 LYS CA . 53613 1 554 . 1 . 1 113 113 LYS CB C 13 32.57825 0.4 . 1 . . . . . 113 LYS CB . 53613 1 555 . 1 . 1 113 113 LYS N N 15 120.94211 0.2 . 1 . . . . . 113 LYS N . 53613 1 556 . 1 . 1 114 114 ALA H H 1 7.60833 0.04 . 1 . . . . . 114 ALA H . 53613 1 557 . 1 . 1 114 114 ALA C C 13 178.42925 0.4 . 1 . . . . . 114 ALA C . 53613 1 558 . 1 . 1 114 114 ALA CA C 13 53.6406 0.4 . 1 . . . . . 114 ALA CA . 53613 1 559 . 1 . 1 114 114 ALA CB C 13 18.11934 0.4 . 1 . . . . . 114 ALA CB . 53613 1 560 . 1 . 1 114 114 ALA N N 15 120.52366 0.2 . 1 . . . . . 114 ALA N . 53613 1 561 . 1 . 1 115 115 LEU H H 1 7.47997 0.04 . 1 . . . . . 115 LEU H . 53613 1 562 . 1 . 1 115 115 LEU C C 13 178.72322 0.4 . 1 . . . . . 115 LEU C . 53613 1 563 . 1 . 1 115 115 LEU CA C 13 56.31447 0.4 . 1 . . . . . 115 LEU CA . 53613 1 564 . 1 . 1 115 115 LEU CB C 13 42.56345 0.4 . 1 . . . . . 115 LEU CB . 53613 1 565 . 1 . 1 115 115 LEU N N 15 117.20612 0.2 . 1 . . . . . 115 LEU N . 53613 1 566 . 1 . 1 116 116 LEU H H 1 7.43452 0.04 . 1 . . . . . 116 LEU H . 53613 1 567 . 1 . 1 116 116 LEU C C 13 176.53809 0.4 . 1 . . . . . 116 LEU C . 53613 1 568 . 1 . 1 116 116 LEU CA C 13 60.09326 0.4 . 1 . . . . . 116 LEU CA . 53613 1 569 . 1 . 1 116 116 LEU CB C 13 38.55575 0.4 . 1 . . . . . 116 LEU CB . 53613 1 570 . 1 . 1 116 116 LEU N N 15 118.39625 0.2 . 1 . . . . . 116 LEU N . 53613 1 571 . 1 . 1 117 117 PRO C C 13 179.2387 0.4 . 1 . . . . . 117 PRO C . 53613 1 572 . 1 . 1 117 117 PRO CA C 13 65.63842 0.4 . 1 . . . . . 117 PRO CA . 53613 1 573 . 1 . 1 117 117 PRO CB C 13 31.21626 0.4 . 1 . . . . . 117 PRO CB . 53613 1 574 . 1 . 1 118 118 LEU H H 1 7.09216 0.04 . 1 . . . . . 118 LEU H . 53613 1 575 . 1 . 1 118 118 LEU C C 13 178.96274 0.4 . 1 . . . . . 118 LEU C . 53613 1 576 . 1 . 1 118 118 LEU CA C 13 57.55769 0.4 . 1 . . . . . 118 LEU CA . 53613 1 577 . 1 . 1 118 118 LEU CB C 13 41.09285 0.4 . 1 . . . . . 118 LEU CB . 53613 1 578 . 1 . 1 118 118 LEU N N 15 117.90202 0.2 . 1 . . . . . 118 LEU N . 53613 1 579 . 1 . 1 119 119 VAL H H 1 8.08051 0.04 . 1 . . . . . 119 VAL H . 53613 1 580 . 1 . 1 119 119 VAL C C 13 178.10043 0.4 . 1 . . . . . 119 VAL C . 53613 1 581 . 1 . 1 119 119 VAL CA C 13 67.26716 0.4 . 1 . . . . . 119 VAL CA . 53613 1 582 . 1 . 1 119 119 VAL CB C 13 31.82322 0.4 . 1 . . . . . 119 VAL CB . 53613 1 583 . 1 . 1 119 119 VAL N N 15 121.18608 0.2 . 1 . . . . . 119 VAL N . 53613 1 584 . 1 . 1 120 120 GLU H H 1 7.67656 0.04 . 1 . . . . . 120 GLU H . 53613 1 585 . 1 . 1 120 120 GLU C C 13 178.86783 0.4 . 1 . . . . . 120 GLU C . 53613 1 586 . 1 . 1 120 120 GLU CA C 13 59.12298 0.4 . 1 . . . . . 120 GLU CA . 53613 1 587 . 1 . 1 120 120 GLU CB C 13 29.32859 0.4 . 1 . . . . . 120 GLU CB . 53613 1 588 . 1 . 1 120 120 GLU N N 15 116.44224 0.2 . 1 . . . . . 120 GLU N . 53613 1 589 . 1 . 1 121 121 LYS H H 1 7.42952 0.04 . 1 . . . . . 121 LYS H . 53613 1 590 . 1 . 1 121 121 LYS C C 13 179.5243 0.4 . 1 . . . . . 121 LYS C . 53613 1 591 . 1 . 1 121 121 LYS CA C 13 58.8842 0.4 . 1 . . . . . 121 LYS CA . 53613 1 592 . 1 . 1 121 121 LYS CB C 13 32.41286 0.4 . 1 . . . . . 121 LYS CB . 53613 1 593 . 1 . 1 121 121 LYS N N 15 117.99917 0.2 . 1 . . . . . 121 LYS N . 53613 1 594 . 1 . 1 122 122 ILE H H 1 8.02501 0.04 . 1 . . . . . 122 ILE H . 53613 1 595 . 1 . 1 122 122 ILE C C 13 176.91746 0.4 . 1 . . . . . 122 ILE C . 53613 1 596 . 1 . 1 122 122 ILE CA C 13 65.34477 0.4 . 1 . . . . . 122 ILE CA . 53613 1 597 . 1 . 1 122 122 ILE CB C 13 37.07965 0.4 . 1 . . . . . 122 ILE CB . 53613 1 598 . 1 . 1 122 122 ILE N N 15 119.95222 0.2 . 1 . . . . . 122 ILE N . 53613 1 599 . 1 . 1 123 123 LYS H H 1 7.39398 0.04 . 1 . . . . . 123 LYS H . 53613 1 600 . 1 . 1 123 123 LYS C C 13 177.79208 0.4 . 1 . . . . . 123 LYS C . 53613 1 601 . 1 . 1 123 123 LYS CA C 13 59.62031 0.4 . 1 . . . . . 123 LYS CA . 53613 1 602 . 1 . 1 123 123 LYS CB C 13 32.41975 0.4 . 1 . . . . . 123 LYS CB . 53613 1 603 . 1 . 1 123 123 LYS N N 15 118.11145 0.2 . 1 . . . . . 123 LYS N . 53613 1 604 . 1 . 1 124 124 GLU H H 1 7.03607 0.04 . 1 . . . . . 124 GLU H . 53613 1 605 . 1 . 1 124 124 GLU C C 13 176.46923 0.4 . 1 . . . . . 124 GLU C . 53613 1 606 . 1 . 1 124 124 GLU CA C 13 57.07328 0.4 . 1 . . . . . 124 GLU CA . 53613 1 607 . 1 . 1 124 124 GLU CB C 13 29.90506 0.4 . 1 . . . . . 124 GLU CB . 53613 1 608 . 1 . 1 124 124 GLU N N 15 113.37057 0.2 . 1 . . . . . 124 GLU N . 53613 1 609 . 1 . 1 125 125 ALA H H 1 7.63699 0.04 . 1 . . . . . 125 ALA H . 53613 1 610 . 1 . 1 125 125 ALA C C 13 176.87898 0.4 . 1 . . . . . 125 ALA C . 53613 1 611 . 1 . 1 125 125 ALA CA C 13 52.24357 0.4 . 1 . . . . . 125 ALA CA . 53613 1 612 . 1 . 1 125 125 ALA CB C 13 20.3797 0.4 . 1 . . . . . 125 ALA CB . 53613 1 613 . 1 . 1 125 125 ALA N N 15 120.99447 0.2 . 1 . . . . . 125 ALA N . 53613 1 614 . 1 . 1 126 126 ILE H H 1 6.84949 0.04 . 1 . . . . . 126 ILE H . 53613 1 615 . 1 . 1 126 126 ILE C C 13 179.86321 0.4 . 1 . . . . . 126 ILE C . 53613 1 616 . 1 . 1 126 126 ILE CA C 13 63.3014 0.4 . 1 . . . . . 126 ILE CA . 53613 1 617 . 1 . 1 126 126 ILE CB C 13 39.37696 0.4 . 1 . . . . . 126 ILE CB . 53613 1 618 . 1 . 1 126 126 ILE N N 15 118.80386 0.2 . 1 . . . . . 126 ILE N . 53613 1 stop_ save_