################################### # 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 50476 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'E. coli NfsB chemical shift' _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 'Differences between different spectra' _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCACB' . . . 50476 1 2 '3D HN(CO)CACB' . . . 50476 1 3 '2D 1H-15N HSQC' . . . 50476 1 4 '2D 1H-15N HSQC' . . . 50476 1 5 '3D HNCO' . . . 50476 1 6 '3D HNCA' . . . 50476 1 7 '3D HN(CO)CA' . . . 50476 1 8 '3D HN(CA)CO' . . . 50476 1 9 '3D 15N-separated NOESY' . . . 50476 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 2 $software_2 . . 50476 1 3 $software_3 . . 50476 1 7 $software_7 . . 50476 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 ASP C C 13 176.600 0.000 . 1 . . . . . 2 ASP C . 50476 1 2 . 1 . 1 2 2 ASP CA C 13 52.369 0.000 . 1 . . . . . 2 ASP CA . 50476 1 3 . 1 . 1 2 2 ASP CB C 13 40.716 0.000 . 1 . . . . . 2 ASP CB . 50476 1 4 . 1 . 1 3 3 ILE H H 1 8.542 0.011 . 1 . . . . . 3 ILE H . 50476 1 5 . 1 . 1 3 3 ILE C C 13 175.577 0.000 . 1 . . . . . 3 ILE C . 50476 1 6 . 1 . 1 3 3 ILE CA C 13 58.693 0.019 . 1 . . . . . 3 ILE CA . 50476 1 7 . 1 . 1 3 3 ILE CB C 13 38.875 0.004 . 1 . . . . . 3 ILE CB . 50476 1 8 . 1 . 1 3 3 ILE N N 15 121.798 0.023 . 1 . . . . . 3 ILE N . 50476 1 9 . 1 . 1 4 4 ILE H H 1 7.783 0.002 . 1 . . . . . 4 ILE H . 50476 1 10 . 1 . 1 4 4 ILE C C 13 177.637 0.000 . 1 . . . . . 4 ILE C . 50476 1 11 . 1 . 1 4 4 ILE CA C 13 61.059 0.000 . 1 . . . . . 4 ILE CA . 50476 1 12 . 1 . 1 4 4 ILE CB C 13 32.989 0.018 . 1 . . . . . 4 ILE CB . 50476 1 13 . 1 . 1 4 4 ILE N N 15 123.319 0.023 . 1 . . . . . 4 ILE N . 50476 1 14 . 1 . 1 5 5 SER H H 1 7.616 0.004 . 1 . . . . . 5 SER H . 50476 1 15 . 1 . 1 5 5 SER C C 13 176.804 0.000 . 1 . . . . . 5 SER C . 50476 1 16 . 1 . 1 5 5 SER CA C 13 61.706 0.042 . 1 . . . . . 5 SER CA . 50476 1 17 . 1 . 1 5 5 SER N N 15 115.100 0.025 . 1 . . . . . 5 SER N . 50476 1 18 . 1 . 1 6 6 VAL H H 1 7.230 0.003 . 1 . . . . . 6 VAL H . 50476 1 19 . 1 . 1 6 6 VAL C C 13 178.068 0.000 . 1 . . . . . 6 VAL C . 50476 1 20 . 1 . 1 6 6 VAL CA C 13 65.636 0.001 . 1 . . . . . 6 VAL CA . 50476 1 21 . 1 . 1 6 6 VAL CB C 13 30.412 0.009 . 1 . . . . . 6 VAL CB . 50476 1 22 . 1 . 1 6 6 VAL N N 15 119.227 0.028 . 1 . . . . . 6 VAL N . 50476 1 23 . 1 . 1 7 7 ALA H H 1 8.141 0.011 . 1 . . . . . 7 ALA H . 50476 1 24 . 1 . 1 7 7 ALA C C 13 178.707 0.000 . 1 . . . . . 7 ALA C . 50476 1 25 . 1 . 1 7 7 ALA CA C 13 54.904 0.018 . 1 . . . . . 7 ALA CA . 50476 1 26 . 1 . 1 7 7 ALA CB C 13 16.896 0.006 . 1 . . . . . 7 ALA CB . 50476 1 27 . 1 . 1 7 7 ALA N N 15 122.970 0.104 . 1 . . . . . 7 ALA N . 50476 1 28 . 1 . 1 8 8 LEU H H 1 7.836 0.006 . 1 . . . . . 8 LEU H . 50476 1 29 . 1 . 1 8 8 LEU C C 13 177.452 0.000 . 1 . . . . . 8 LEU C . 50476 1 30 . 1 . 1 8 8 LEU CA C 13 55.629 0.015 . 1 . . . . . 8 LEU CA . 50476 1 31 . 1 . 1 8 8 LEU CB C 13 41.033 0.009 . 1 . . . . . 8 LEU CB . 50476 1 32 . 1 . 1 8 8 LEU N N 15 113.915 0.039 . 1 . . . . . 8 LEU N . 50476 1 33 . 1 . 1 9 9 LYS H H 1 7.530 0.015 . 1 . . . . . 9 LYS H . 50476 1 34 . 1 . 1 9 9 LYS C C 13 178.046 0.000 . 1 . . . . . 9 LYS C . 50476 1 35 . 1 . 1 9 9 LYS CA C 13 55.960 0.032 . 1 . . . . . 9 LYS CA . 50476 1 36 . 1 . 1 9 9 LYS CB C 13 33.445 0.058 . 1 . . . . . 9 LYS CB . 50476 1 37 . 1 . 1 9 9 LYS N N 15 117.165 0.014 . 1 . . . . . 9 LYS N . 50476 1 38 . 1 . 1 10 10 ARG H H 1 7.954 0.004 . 1 . . . . . 10 ARG H . 50476 1 39 . 1 . 1 10 10 ARG CA C 13 56.369 0.000 . 1 . . . . . 10 ARG CA . 50476 1 40 . 1 . 1 10 10 ARG CB C 13 28.057 0.000 . 1 . . . . . 10 ARG CB . 50476 1 41 . 1 . 1 10 10 ARG N N 15 118.504 0.051 . 1 . . . . . 10 ARG N . 50476 1 42 . 1 . 1 11 11 HIS C C 13 174.653 0.000 . 1 . . . . . 11 HIS C . 50476 1 43 . 1 . 1 11 11 HIS CA C 13 54.815 0.000 . 1 . . . . . 11 HIS CA . 50476 1 44 . 1 . 1 11 11 HIS CB C 13 33.572 0.000 . 1 . . . . . 11 HIS CB . 50476 1 45 . 1 . 1 12 12 SER H H 1 10.039 0.007 . 1 . . . . . 12 SER H . 50476 1 46 . 1 . 1 12 12 SER C C 13 174.175 0.000 . 1 . . . . . 12 SER C . 50476 1 47 . 1 . 1 12 12 SER CA C 13 61.417 0.009 . 1 . . . . . 12 SER CA . 50476 1 48 . 1 . 1 12 12 SER CB C 13 63.014 0.016 . 1 . . . . . 12 SER CB . 50476 1 49 . 1 . 1 12 12 SER N N 15 120.812 0.019 . 1 . . . . . 12 SER N . 50476 1 50 . 1 . 1 13 13 THR H H 1 7.627 0.005 . 1 . . . . . 13 THR H . 50476 1 51 . 1 . 1 13 13 THR C C 13 173.243 0.000 . 1 . . . . . 13 THR C . 50476 1 52 . 1 . 1 13 13 THR CA C 13 63.848 0.007 . 1 . . . . . 13 THR CA . 50476 1 53 . 1 . 1 13 13 THR CB C 13 69.264 0.021 . 1 . . . . . 13 THR CB . 50476 1 54 . 1 . 1 13 13 THR N N 15 128.237 0.050 . 1 . . . . . 13 THR N . 50476 1 55 . 1 . 1 14 14 LYS H H 1 8.127 0.009 . 1 . . . . . 14 LYS H . 50476 1 56 . 1 . 1 14 14 LYS C C 13 176.707 0.000 . 1 . . . . . 14 LYS C . 50476 1 57 . 1 . 1 14 14 LYS CA C 13 53.204 0.022 . 1 . . . . . 14 LYS CA . 50476 1 58 . 1 . 1 14 14 LYS CB C 13 31.077 0.005 . 1 . . . . . 14 LYS CB . 50476 1 59 . 1 . 1 14 14 LYS N N 15 120.867 0.014 . 1 . . . . . 14 LYS N . 50476 1 60 . 1 . 1 15 15 ALA H H 1 6.856 0.006 . 1 . . . . . 15 ALA H . 50476 1 61 . 1 . 1 15 15 ALA C C 13 175.083 0.000 . 1 . . . . . 15 ALA C . 50476 1 62 . 1 . 1 15 15 ALA CA C 13 52.073 0.008 . 1 . . . . . 15 ALA CA . 50476 1 63 . 1 . 1 15 15 ALA CB C 13 20.159 0.019 . 1 . . . . . 15 ALA CB . 50476 1 64 . 1 . 1 15 15 ALA N N 15 119.614 0.016 . 1 . . . . . 15 ALA N . 50476 1 65 . 1 . 1 16 16 PHE H H 1 9.301 0.009 . 1 . . . . . 16 PHE H . 50476 1 66 . 1 . 1 16 16 PHE C C 13 174.394 0.000 . 1 . . . . . 16 PHE C . 50476 1 67 . 1 . 1 16 16 PHE CA C 13 57.685 0.012 . 1 . . . . . 16 PHE CA . 50476 1 68 . 1 . 1 16 16 PHE CB C 13 41.960 0.009 . 1 . . . . . 16 PHE CB . 50476 1 69 . 1 . 1 16 16 PHE N N 15 121.391 0.040 . 1 . . . . . 16 PHE N . 50476 1 70 . 1 . 1 17 17 ASP H H 1 8.981 0.003 . 1 . . . . . 17 ASP H . 50476 1 71 . 1 . 1 17 17 ASP C C 13 176.553 0.000 . 1 . . . . . 17 ASP C . 50476 1 72 . 1 . 1 17 17 ASP CA C 13 52.264 0.016 . 1 . . . . . 17 ASP CA . 50476 1 73 . 1 . 1 17 17 ASP CB C 13 40.695 0.007 . 1 . . . . . 17 ASP CB . 50476 1 74 . 1 . 1 17 17 ASP N N 15 119.202 0.030 . 1 . . . . . 17 ASP N . 50476 1 75 . 1 . 1 18 18 ALA H H 1 8.874 0.022 . 1 . . . . . 18 ALA H . 50476 1 76 . 1 . 1 18 18 ALA C C 13 177.842 0.000 . 1 . . . . . 18 ALA C . 50476 1 77 . 1 . 1 18 18 ALA CA C 13 53.185 0.010 . 1 . . . . . 18 ALA CA . 50476 1 78 . 1 . 1 18 18 ALA CB C 13 18.187 0.012 . 1 . . . . . 18 ALA CB . 50476 1 79 . 1 . 1 18 18 ALA N N 15 130.752 0.041 . 1 . . . . . 18 ALA N . 50476 1 80 . 1 . 1 19 19 SER H H 1 8.726 0.004 . 1 . . . . . 19 SER H . 50476 1 81 . 1 . 1 19 19 SER C C 13 174.615 0.000 . 1 . . . . . 19 SER C . 50476 1 82 . 1 . 1 19 19 SER CA C 13 58.884 0.011 . 1 . . . . . 19 SER CA . 50476 1 83 . 1 . 1 19 19 SER CB C 13 64.402 0.002 . 1 . . . . . 19 SER CB . 50476 1 84 . 1 . 1 19 19 SER N N 15 111.886 0.064 . 1 . . . . . 19 SER N . 50476 1 85 . 1 . 1 20 20 LYS H H 1 7.309 0.005 . 1 . . . . . 20 LYS H . 50476 1 86 . 1 . 1 20 20 LYS C C 13 175.171 0.000 . 1 . . . . . 20 LYS C . 50476 1 87 . 1 . 1 20 20 LYS CA C 13 55.201 0.017 . 1 . . . . . 20 LYS CA . 50476 1 88 . 1 . 1 20 20 LYS CB C 13 32.946 0.013 . 1 . . . . . 20 LYS CB . 50476 1 89 . 1 . 1 20 20 LYS N N 15 122.681 0.020 . 1 . . . . . 20 LYS N . 50476 1 90 . 1 . 1 21 21 LYS H H 1 8.505 0.027 . 1 . . . . . 21 LYS H . 50476 1 91 . 1 . 1 21 21 LYS C C 13 175.804 0.000 . 1 . . . . . 21 LYS C . 50476 1 92 . 1 . 1 21 21 LYS CA C 13 52.908 0.008 . 1 . . . . . 21 LYS CA . 50476 1 93 . 1 . 1 21 21 LYS CB C 13 33.659 0.022 . 1 . . . . . 21 LYS CB . 50476 1 94 . 1 . 1 21 21 LYS N N 15 122.844 0.037 . 1 . . . . . 21 LYS N . 50476 1 95 . 1 . 1 22 22 LEU H H 1 8.633 0.018 . 1 . . . . . 22 LEU H . 50476 1 96 . 1 . 1 22 22 LEU C C 13 178.112 0.000 . 1 . . . . . 22 LEU C . 50476 1 97 . 1 . 1 22 22 LEU CA C 13 56.206 0.097 . 1 . . . . . 22 LEU CA . 50476 1 98 . 1 . 1 22 22 LEU CB C 13 39.873 0.005 . 1 . . . . . 22 LEU CB . 50476 1 99 . 1 . 1 22 22 LEU N N 15 122.102 0.048 . 1 . . . . . 22 LEU N . 50476 1 100 . 1 . 1 23 23 THR H H 1 8.635 0.007 . 1 . . . . . 23 THR H . 50476 1 101 . 1 . 1 23 23 THR C C 13 173.702 0.000 . 1 . . . . . 23 THR C . 50476 1 102 . 1 . 1 23 23 THR CA C 13 59.831 0.000 . 1 . . . . . 23 THR CA . 50476 1 103 . 1 . 1 23 23 THR CB C 13 67.739 0.000 . 1 . . . . . 23 THR CB . 50476 1 104 . 1 . 1 23 23 THR N N 15 113.344 0.029 . 1 . . . . . 23 THR N . 50476 1 105 . 1 . 1 24 24 PRO C C 13 179.569 0.000 . 1 . . . . . 24 PRO C . 50476 1 106 . 1 . 1 24 24 PRO CA C 13 65.285 0.001 . 1 . . . . . 24 PRO CA . 50476 1 107 . 1 . 1 24 24 PRO CB C 13 30.700 0.000 . 1 . . . . . 24 PRO CB . 50476 1 108 . 1 . 1 25 25 GLU H H 1 8.374 0.012 . 1 . . . . . 25 GLU H . 50476 1 109 . 1 . 1 25 25 GLU N N 15 116.905 0.226 . 1 . . . . . 25 GLU N . 50476 1 110 . 1 . 1 26 26 GLN H H 1 7.739 0.006 . 1 . . . . . 26 GLN H . 50476 1 111 . 1 . 1 26 26 GLN C C 13 178.361 0.000 . 1 . . . . . 26 GLN C . 50476 1 112 . 1 . 1 26 26 GLN CA C 13 57.655 0.007 . 1 . . . . . 26 GLN CA . 50476 1 113 . 1 . 1 26 26 GLN CB C 13 27.582 0.007 . 1 . . . . . 26 GLN CB . 50476 1 114 . 1 . 1 26 26 GLN N N 15 119.500 0.018 . 1 . . . . . 26 GLN N . 50476 1 115 . 1 . 1 27 27 ALA H H 1 8.282 0.006 . 1 . . . . . 27 ALA H . 50476 1 116 . 1 . 1 27 27 ALA C C 13 178.984 0.000 . 1 . . . . . 27 ALA C . 50476 1 117 . 1 . 1 27 27 ALA CA C 13 54.534 0.007 . 1 . . . . . 27 ALA CA . 50476 1 118 . 1 . 1 27 27 ALA CB C 13 16.819 0.003 . 1 . . . . . 27 ALA CB . 50476 1 119 . 1 . 1 27 27 ALA N N 15 120.745 0.026 . 1 . . . . . 27 ALA N . 50476 1 120 . 1 . 1 28 28 GLU H H 1 7.443 0.012 . 1 . . . . . 28 GLU H . 50476 1 121 . 1 . 1 28 28 GLU C C 13 179.694 0.000 . 1 . . . . . 28 GLU C . 50476 1 122 . 1 . 1 28 28 GLU CA C 13 58.495 0.000 . 1 . . . . . 28 GLU CA . 50476 1 123 . 1 . 1 28 28 GLU CB C 13 28.543 0.001 . 1 . . . . . 28 GLU CB . 50476 1 124 . 1 . 1 28 28 GLU N N 15 115.262 0.047 . 1 . . . . . 28 GLU N . 50476 1 125 . 1 . 1 29 29 GLN H H 1 8.061 0.025 . 1 . . . . . 29 GLN H . 50476 1 126 . 1 . 1 29 29 GLN C C 13 178.691 0.000 . 1 . . . . . 29 GLN C . 50476 1 127 . 1 . 1 29 29 GLN CA C 13 59.227 0.012 . 1 . . . . . 29 GLN CA . 50476 1 128 . 1 . 1 29 29 GLN CB C 13 27.595 0.007 . 1 . . . . . 29 GLN CB . 50476 1 129 . 1 . 1 29 29 GLN N N 15 120.092 0.063 . 1 . . . . . 29 GLN N . 50476 1 130 . 1 . 1 30 30 ILE H H 1 8.192 0.009 . 1 . . . . . 30 ILE H . 50476 1 131 . 1 . 1 30 30 ILE C C 13 177.322 0.000 . 1 . . . . . 30 ILE C . 50476 1 132 . 1 . 1 30 30 ILE CA C 13 65.092 0.024 . 1 . . . . . 30 ILE CA . 50476 1 133 . 1 . 1 30 30 ILE CB C 13 36.754 0.023 . 1 . . . . . 30 ILE CB . 50476 1 134 . 1 . 1 30 30 ILE N N 15 112.634 0.090 . 1 . . . . . 30 ILE N . 50476 1 135 . 1 . 1 31 31 LYS H H 1 7.019 0.017 . 1 . . . . . 31 LYS H . 50476 1 136 . 1 . 1 31 31 LYS C C 13 177.978 0.000 . 1 . . . . . 31 LYS C . 50476 1 137 . 1 . 1 31 31 LYS CA C 13 60.080 0.001 . 1 . . . . . 31 LYS CA . 50476 1 138 . 1 . 1 31 31 LYS CB C 13 30.660 0.009 . 1 . . . . . 31 LYS CB . 50476 1 139 . 1 . 1 31 31 LYS N N 15 119.732 0.035 . 1 . . . . . 31 LYS N . 50476 1 140 . 1 . 1 32 32 THR H H 1 7.810 0.004 . 1 . . . . . 32 THR H . 50476 1 141 . 1 . 1 32 32 THR C C 13 175.927 0.000 . 1 . . . . . 32 THR C . 50476 1 142 . 1 . 1 32 32 THR CA C 13 67.039 0.009 . 1 . . . . . 32 THR CA . 50476 1 143 . 1 . 1 32 32 THR CB C 13 68.026 0.004 . 1 . . . . . 32 THR CB . 50476 1 144 . 1 . 1 32 32 THR N N 15 116.556 0.042 . 1 . . . . . 32 THR N . 50476 1 145 . 1 . 1 33 33 LEU H H 1 7.643 0.013 . 1 . . . . . 33 LEU H . 50476 1 146 . 1 . 1 33 33 LEU C C 13 180.712 0.000 . 1 . . . . . 33 LEU C . 50476 1 147 . 1 . 1 33 33 LEU CA C 13 56.937 0.009 . 1 . . . . . 33 LEU CA . 50476 1 148 . 1 . 1 33 33 LEU CB C 13 41.854 0.003 . 1 . . . . . 33 LEU CB . 50476 1 149 . 1 . 1 33 33 LEU N N 15 119.004 0.060 . 1 . . . . . 33 LEU N . 50476 1 150 . 1 . 1 34 34 LEU H H 1 7.139 0.004 . 1 . . . . . 34 LEU H . 50476 1 151 . 1 . 1 34 34 LEU C C 13 177.321 0.000 . 1 . . . . . 34 LEU C . 50476 1 152 . 1 . 1 34 34 LEU CA C 13 56.802 0.000 . 1 . . . . . 34 LEU CA . 50476 1 153 . 1 . 1 34 34 LEU CB C 13 38.656 0.005 . 1 . . . . . 34 LEU CB . 50476 1 154 . 1 . 1 34 34 LEU N N 15 119.541 0.081 . 1 . . . . . 34 LEU N . 50476 1 155 . 1 . 1 35 35 GLN H H 1 7.271 0.007 . 1 . . . . . 35 GLN H . 50476 1 156 . 1 . 1 35 35 GLN C C 13 179.022 0.000 . 1 . . . . . 35 GLN C . 50476 1 157 . 1 . 1 35 35 GLN CA C 13 57.619 0.007 . 1 . . . . . 35 GLN CA . 50476 1 158 . 1 . 1 35 35 GLN CB C 13 28.538 0.015 . 1 . . . . . 35 GLN CB . 50476 1 159 . 1 . 1 35 35 GLN N N 15 114.263 0.020 . 1 . . . . . 35 GLN N . 50476 1 160 . 1 . 1 36 36 TYR H H 1 8.030 0.006 . 1 . . . . . 36 TYR H . 50476 1 161 . 1 . 1 36 36 TYR C C 13 176.493 0.000 . 1 . . . . . 36 TYR C . 50476 1 162 . 1 . 1 36 36 TYR CA C 13 60.894 0.010 . 1 . . . . . 36 TYR CA . 50476 1 163 . 1 . 1 36 36 TYR CB C 13 36.367 0.040 . 1 . . . . . 36 TYR CB . 50476 1 164 . 1 . 1 36 36 TYR N N 15 110.170 0.026 . 1 . . . . . 36 TYR N . 50476 1 165 . 1 . 1 37 37 SER H H 1 6.718 0.006 . 1 . . . . . 37 SER H . 50476 1 166 . 1 . 1 37 37 SER C C 13 175.122 0.000 . 1 . . . . . 37 SER C . 50476 1 167 . 1 . 1 37 37 SER CA C 13 56.995 0.000 . 1 . . . . . 37 SER CA . 50476 1 168 . 1 . 1 37 37 SER CB C 13 64.443 0.000 . 1 . . . . . 37 SER CB . 50476 1 169 . 1 . 1 37 37 SER N N 15 117.306 0.065 . 1 . . . . . 37 SER N . 50476 1 170 . 1 . 1 38 38 PRO C C 13 173.892 0.000 . 1 . . . . . 38 PRO C . 50476 1 171 . 1 . 1 38 38 PRO CA C 13 63.707 0.000 . 1 . . . . . 38 PRO CA . 50476 1 172 . 1 . 1 38 38 PRO CB C 13 31.854 0.000 . 1 . . . . . 38 PRO CB . 50476 1 173 . 1 . 1 39 39 SER H H 1 6.907 0.006 . 1 . . . . . 39 SER H . 50476 1 174 . 1 . 1 39 39 SER C C 13 173.962 0.000 . 1 . . . . . 39 SER C . 50476 1 175 . 1 . 1 39 39 SER CA C 13 58.398 0.041 . 1 . . . . . 39 SER CA . 50476 1 176 . 1 . 1 39 39 SER CB C 13 65.038 0.012 . 1 . . . . . 39 SER CB . 50476 1 177 . 1 . 1 39 39 SER N N 15 105.419 0.045 . 1 . . . . . 39 SER N . 50476 1 178 . 1 . 1 40 40 SER H H 1 8.692 0.003 . 1 . . . . . 40 SER H . 50476 1 179 . 1 . 1 40 40 SER CA C 13 59.092 0.000 . 1 . . . . . 40 SER CA . 50476 1 180 . 1 . 1 40 40 SER CB C 13 62.976 0.000 . 1 . . . . . 40 SER CB . 50476 1 181 . 1 . 1 40 40 SER N N 15 117.479 0.045 . 1 . . . . . 40 SER N . 50476 1 182 . 1 . 1 41 41 THR C C 13 173.881 0.000 . 1 . . . . . 41 THR C . 50476 1 183 . 1 . 1 41 41 THR CA C 13 63.623 0.000 . 1 . . . . . 41 THR CA . 50476 1 184 . 1 . 1 41 41 THR CB C 13 70.789 0.000 . 1 . . . . . 41 THR CB . 50476 1 185 . 1 . 1 42 42 ASN H H 1 8.743 0.008 . 1 . . . . . 42 ASN H . 50476 1 186 . 1 . 1 42 42 ASN C C 13 175.838 0.000 . 1 . . . . . 42 ASN C . 50476 1 187 . 1 . 1 42 42 ASN CA C 13 53.458 0.027 . 1 . . . . . 42 ASN CA . 50476 1 188 . 1 . 1 42 42 ASN CB C 13 37.880 0.019 . 1 . . . . . 42 ASN CB . 50476 1 189 . 1 . 1 42 42 ASN N N 15 120.138 0.031 . 1 . . . . . 42 ASN N . 50476 1 190 . 1 . 1 43 43 SER H H 1 7.413 0.011 . 1 . . . . . 43 SER H . 50476 1 191 . 1 . 1 43 43 SER C C 13 172.273 0.000 . 1 . . . . . 43 SER C . 50476 1 192 . 1 . 1 43 43 SER CA C 13 61.267 0.013 . 1 . . . . . 43 SER CA . 50476 1 193 . 1 . 1 43 43 SER CB C 13 63.174 0.010 . 1 . . . . . 43 SER CB . 50476 1 194 . 1 . 1 43 43 SER N N 15 110.649 0.069 . 1 . . . . . 43 SER N . 50476 1 195 . 1 . 1 44 44 GLN H H 1 8.117 0.015 . 1 . . . . . 44 GLN H . 50476 1 196 . 1 . 1 44 44 GLN CA C 13 53.832 0.000 . 1 . . . . . 44 GLN CA . 50476 1 197 . 1 . 1 44 44 GLN CB C 13 29.993 0.000 . 1 . . . . . 44 GLN CB . 50476 1 198 . 1 . 1 44 44 GLN N N 15 112.403 0.031 . 1 . . . . . 44 GLN N . 50476 1 199 . 1 . 1 45 45 PRO C C 13 175.926 0.000 . 1 . . . . . 45 PRO C . 50476 1 200 . 1 . 1 45 45 PRO CA C 13 62.489 0.000 . 1 . . . . . 45 PRO CA . 50476 1 201 . 1 . 1 45 45 PRO CB C 13 27.714 0.000 . 1 . . . . . 45 PRO CB . 50476 1 202 . 1 . 1 46 46 TRP H H 1 8.633 0.006 . 1 . . . . . 46 TRP H . 50476 1 203 . 1 . 1 46 46 TRP C C 13 175.182 0.000 . 1 . . . . . 46 TRP C . 50476 1 204 . 1 . 1 46 46 TRP CA C 13 51.739 0.025 . 1 . . . . . 46 TRP CA . 50476 1 205 . 1 . 1 46 46 TRP CB C 13 32.169 0.000 . 1 . . . . . 46 TRP CB . 50476 1 206 . 1 . 1 46 46 TRP N N 15 117.816 0.044 . 1 . . . . . 46 TRP N . 50476 1 207 . 1 . 1 47 47 HIS H H 1 7.917 0.009 . 1 . . . . . 47 HIS H . 50476 1 208 . 1 . 1 47 47 HIS C C 13 171.288 0.000 . 1 . . . . . 47 HIS C . 50476 1 209 . 1 . 1 47 47 HIS CA C 13 53.765 0.010 . 1 . . . . . 47 HIS CA . 50476 1 210 . 1 . 1 47 47 HIS CB C 13 31.432 0.010 . 1 . . . . . 47 HIS CB . 50476 1 211 . 1 . 1 47 47 HIS N N 15 117.348 0.106 . 1 . . . . . 47 HIS N . 50476 1 212 . 1 . 1 48 48 PHE H H 1 8.432 0.004 . 1 . . . . . 48 PHE H . 50476 1 213 . 1 . 1 48 48 PHE C C 13 174.889 0.000 . 1 . . . . . 48 PHE C . 50476 1 214 . 1 . 1 48 48 PHE CA C 13 53.618 0.028 . 1 . . . . . 48 PHE CA . 50476 1 215 . 1 . 1 48 48 PHE CB C 13 40.574 0.021 . 1 . . . . . 48 PHE CB . 50476 1 216 . 1 . 1 48 48 PHE N N 15 123.567 0.064 . 1 . . . . . 48 PHE N . 50476 1 217 . 1 . 1 49 49 ILE H H 1 8.317 0.015 . 1 . . . . . 49 ILE H . 50476 1 218 . 1 . 1 49 49 ILE C C 13 175.387 0.000 . 1 . . . . . 49 ILE C . 50476 1 219 . 1 . 1 49 49 ILE CA C 13 58.683 0.017 . 1 . . . . . 49 ILE CA . 50476 1 220 . 1 . 1 49 49 ILE CB C 13 38.307 0.003 . 1 . . . . . 49 ILE CB . 50476 1 221 . 1 . 1 49 49 ILE N N 15 122.529 0.052 . 1 . . . . . 49 ILE N . 50476 1 222 . 1 . 1 50 50 VAL H H 1 9.061 0.005 . 1 . . . . . 50 VAL H . 50476 1 223 . 1 . 1 50 50 VAL C C 13 174.693 0.000 . 1 . . . . . 50 VAL C . 50476 1 224 . 1 . 1 50 50 VAL CA C 13 60.794 0.015 . 1 . . . . . 50 VAL CA . 50476 1 225 . 1 . 1 50 50 VAL CB C 13 31.650 0.032 . 1 . . . . . 50 VAL CB . 50476 1 226 . 1 . 1 50 50 VAL N N 15 126.266 0.014 . 1 . . . . . 50 VAL N . 50476 1 227 . 1 . 1 51 51 ALA H H 1 9.549 0.005 . 1 . . . . . 51 ALA H . 50476 1 228 . 1 . 1 51 51 ALA C C 13 175.951 0.000 . 1 . . . . . 51 ALA C . 50476 1 229 . 1 . 1 51 51 ALA CA C 13 49.465 0.020 . 1 . . . . . 51 ALA CA . 50476 1 230 . 1 . 1 51 51 ALA CB C 13 18.875 0.002 . 1 . . . . . 51 ALA CB . 50476 1 231 . 1 . 1 51 51 ALA N N 15 132.142 0.077 . 1 . . . . . 51 ALA N . 50476 1 232 . 1 . 1 52 52 SER H H 1 9.325 0.005 . 1 . . . . . 52 SER H . 50476 1 233 . 1 . 1 52 52 SER C C 13 174.805 0.000 . 1 . . . . . 52 SER C . 50476 1 234 . 1 . 1 52 52 SER CA C 13 57.544 0.017 . 1 . . . . . 52 SER CA . 50476 1 235 . 1 . 1 52 52 SER CB C 13 63.439 0.062 . 1 . . . . . 52 SER CB . 50476 1 236 . 1 . 1 52 52 SER N N 15 116.234 0.021 . 1 . . . . . 52 SER N . 50476 1 237 . 1 . 1 53 53 THR H H 1 7.637 0.013 . 1 . . . . . 53 THR H . 50476 1 238 . 1 . 1 53 53 THR C C 13 175.259 0.000 . 1 . . . . . 53 THR C . 50476 1 239 . 1 . 1 53 53 THR CA C 13 60.467 0.025 . 1 . . . . . 53 THR CA . 50476 1 240 . 1 . 1 53 53 THR CB C 13 71.055 0.000 . 1 . . . . . 53 THR CB . 50476 1 241 . 1 . 1 53 53 THR N N 15 114.236 0.066 . 1 . . . . . 53 THR N . 50476 1 242 . 1 . 1 54 54 GLU H H 1 9.010 0.018 . 1 . . . . . 54 GLU H . 50476 1 243 . 1 . 1 54 54 GLU C C 13 179.831 0.000 . 1 . . . . . 54 GLU C . 50476 1 244 . 1 . 1 54 54 GLU CA C 13 59.666 0.003 . 1 . . . . . 54 GLU CA . 50476 1 245 . 1 . 1 54 54 GLU CB C 13 28.184 0.003 . 1 . . . . . 54 GLU CB . 50476 1 246 . 1 . 1 54 54 GLU N N 15 121.846 0.028 . 1 . . . . . 54 GLU N . 50476 1 247 . 1 . 1 55 55 GLU H H 1 9.023 0.026 . 1 . . . . . 55 GLU H . 50476 1 248 . 1 . 1 55 55 GLU C C 13 179.043 0.000 . 1 . . . . . 55 GLU C . 50476 1 249 . 1 . 1 55 55 GLU CA C 13 59.146 0.008 . 1 . . . . . 55 GLU CA . 50476 1 250 . 1 . 1 55 55 GLU CB C 13 28.295 0.015 . 1 . . . . . 55 GLU CB . 50476 1 251 . 1 . 1 55 55 GLU N N 15 119.076 0.047 . 1 . . . . . 55 GLU N . 50476 1 252 . 1 . 1 56 56 GLY H H 1 8.871 0.014 . 1 . . . . . 56 GLY H . 50476 1 253 . 1 . 1 56 56 GLY C C 13 175.987 0.000 . 1 . . . . . 56 GLY C . 50476 1 254 . 1 . 1 56 56 GLY CA C 13 47.043 0.012 . 1 . . . . . 56 GLY CA . 50476 1 255 . 1 . 1 56 56 GLY N N 15 109.969 0.046 . 1 . . . . . 56 GLY N . 50476 1 256 . 1 . 1 57 57 LYS H H 1 8.391 0.004 . 1 . . . . . 57 LYS H . 50476 1 257 . 1 . 1 57 57 LYS C C 13 178.599 0.000 . 1 . . . . . 57 LYS C . 50476 1 258 . 1 . 1 57 57 LYS CA C 13 60.630 0.000 . 1 . . . . . 57 LYS CA . 50476 1 259 . 1 . 1 57 57 LYS CB C 13 30.466 0.004 . 1 . . . . . 57 LYS CB . 50476 1 260 . 1 . 1 57 57 LYS N N 15 120.077 0.041 . 1 . . . . . 57 LYS N . 50476 1 261 . 1 . 1 58 58 ALA H H 1 7.800 0.004 . 1 . . . . . 58 ALA H . 50476 1 262 . 1 . 1 58 58 ALA C C 13 180.592 0.000 . 1 . . . . . 58 ALA C . 50476 1 263 . 1 . 1 58 58 ALA CA C 13 54.692 0.016 . 1 . . . . . 58 ALA CA . 50476 1 264 . 1 . 1 58 58 ALA CB C 13 16.769 0.001 . 1 . . . . . 58 ALA CB . 50476 1 265 . 1 . 1 58 58 ALA N N 15 120.276 0.021 . 1 . . . . . 58 ALA N . 50476 1 266 . 1 . 1 59 59 ARG H H 1 7.655 0.008 . 1 . . . . . 59 ARG H . 50476 1 267 . 1 . 1 59 59 ARG C C 13 178.140 0.000 . 1 . . . . . 59 ARG C . 50476 1 268 . 1 . 1 59 59 ARG CA C 13 59.746 0.016 . 1 . . . . . 59 ARG CA . 50476 1 269 . 1 . 1 59 59 ARG CB C 13 30.826 0.021 . 1 . . . . . 59 ARG CB . 50476 1 270 . 1 . 1 59 59 ARG N N 15 117.345 0.117 . 1 . . . . . 59 ARG N . 50476 1 271 . 1 . 1 60 60 VAL H H 1 7.500 0.013 . 1 . . . . . 60 VAL H . 50476 1 272 . 1 . 1 60 60 VAL C C 13 178.888 0.000 . 1 . . . . . 60 VAL C . 50476 1 273 . 1 . 1 60 60 VAL CA C 13 65.565 0.009 . 1 . . . . . 60 VAL CA . 50476 1 274 . 1 . 1 60 60 VAL CB C 13 30.834 0.019 . 1 . . . . . 60 VAL CB . 50476 1 275 . 1 . 1 60 60 VAL N N 15 117.119 0.027 . 1 . . . . . 60 VAL N . 50476 1 276 . 1 . 1 61 61 ALA H H 1 8.670 0.004 . 1 . . . . . 61 ALA H . 50476 1 277 . 1 . 1 61 61 ALA C C 13 179.374 0.000 . 1 . . . . . 61 ALA C . 50476 1 278 . 1 . 1 61 61 ALA CA C 13 53.729 0.003 . 1 . . . . . 61 ALA CA . 50476 1 279 . 1 . 1 61 61 ALA CB C 13 17.612 0.009 . 1 . . . . . 61 ALA CB . 50476 1 280 . 1 . 1 61 61 ALA N N 15 121.395 0.022 . 1 . . . . . 61 ALA N . 50476 1 281 . 1 . 1 62 62 LYS H H 1 7.417 0.009 . 1 . . . . . 62 LYS H . 50476 1 282 . 1 . 1 62 62 LYS C C 13 177.605 0.000 . 1 . . . . . 62 LYS C . 50476 1 283 . 1 . 1 62 62 LYS CA C 13 59.081 0.003 . 1 . . . . . 62 LYS CA . 50476 1 284 . 1 . 1 62 62 LYS CB C 13 31.687 0.018 . 1 . . . . . 62 LYS CB . 50476 1 285 . 1 . 1 62 62 LYS N N 15 120.777 0.080 . 1 . . . . . 62 LYS N . 50476 1 286 . 1 . 1 63 63 SER H H 1 8.112 0.004 . 1 . . . . . 63 SER H . 50476 1 287 . 1 . 1 63 63 SER C C 13 175.265 0.000 . 1 . . . . . 63 SER C . 50476 1 288 . 1 . 1 63 63 SER CA C 13 60.299 0.014 . 1 . . . . . 63 SER CA . 50476 1 289 . 1 . 1 63 63 SER CB C 13 64.056 0.019 . 1 . . . . . 63 SER CB . 50476 1 290 . 1 . 1 63 63 SER N N 15 110.583 0.045 . 1 . . . . . 63 SER N . 50476 1 291 . 1 . 1 64 64 ALA H H 1 8.034 0.008 . 1 . . . . . 64 ALA H . 50476 1 292 . 1 . 1 64 64 ALA C C 13 173.743 0.000 . 1 . . . . . 64 ALA C . 50476 1 293 . 1 . 1 64 64 ALA CA C 13 50.589 0.019 . 1 . . . . . 64 ALA CA . 50476 1 294 . 1 . 1 64 64 ALA CB C 13 15.542 0.018 . 1 . . . . . 64 ALA CB . 50476 1 295 . 1 . 1 64 64 ALA N N 15 131.205 0.083 . 1 . . . . . 64 ALA N . 50476 1 296 . 1 . 1 65 65 ALA H H 1 6.967 0.004 . 1 . . . . . 65 ALA H . 50476 1 297 . 1 . 1 65 65 ALA C C 13 179.283 0.000 . 1 . . . . . 65 ALA C . 50476 1 298 . 1 . 1 65 65 ALA CA C 13 50.661 0.054 . 1 . . . . . 65 ALA CA . 50476 1 299 . 1 . 1 65 65 ALA CB C 13 20.897 0.010 . 1 . . . . . 65 ALA CB . 50476 1 300 . 1 . 1 65 65 ALA N N 15 120.267 0.051 . 1 . . . . . 65 ALA N . 50476 1 301 . 1 . 1 66 66 GLY H H 1 8.920 0.021 . 1 . . . . . 66 GLY H . 50476 1 302 . 1 . 1 66 66 GLY C C 13 176.792 0.000 . 1 . . . . . 66 GLY C . 50476 1 303 . 1 . 1 66 66 GLY CA C 13 46.573 0.000 . 1 . . . . . 66 GLY CA . 50476 1 304 . 1 . 1 66 66 GLY N N 15 109.634 0.020 . 1 . . . . . 66 GLY N . 50476 1 305 . 1 . 1 67 67 ASN C C 13 175.584 0.000 . 1 . . . . . 67 ASN C . 50476 1 306 . 1 . 1 67 67 ASN CA C 13 54.591 0.000 . 1 . . . . . 67 ASN CA . 50476 1 307 . 1 . 1 67 67 ASN CB C 13 37.849 0.000 . 1 . . . . . 67 ASN CB . 50476 1 308 . 1 . 1 68 68 TYR H H 1 7.658 0.001 . 1 . . . . . 68 TYR H . 50476 1 309 . 1 . 1 68 68 TYR C C 13 176.433 0.000 . 1 . . . . . 68 TYR C . 50476 1 310 . 1 . 1 68 68 TYR CA C 13 56.014 0.011 . 1 . . . . . 68 TYR CA . 50476 1 311 . 1 . 1 68 68 TYR CB C 13 37.066 0.020 . 1 . . . . . 68 TYR CB . 50476 1 312 . 1 . 1 68 68 TYR N N 15 116.256 0.079 . 1 . . . . . 68 TYR N . 50476 1 313 . 1 . 1 69 69 VAL H H 1 7.243 0.004 . 1 . . . . . 69 VAL H . 50476 1 314 . 1 . 1 69 69 VAL C C 13 177.443 0.000 . 1 . . . . . 69 VAL C . 50476 1 315 . 1 . 1 69 69 VAL CA C 13 64.687 0.017 . 1 . . . . . 69 VAL CA . 50476 1 316 . 1 . 1 69 69 VAL CB C 13 31.099 0.004 . 1 . . . . . 69 VAL CB . 50476 1 317 . 1 . 1 69 69 VAL N N 15 119.959 0.026 . 1 . . . . . 69 VAL N . 50476 1 318 . 1 . 1 70 70 PHE H H 1 7.664 0.005 . 1 . . . . . 70 PHE H . 50476 1 319 . 1 . 1 70 70 PHE C C 13 176.215 0.000 . 1 . . . . . 70 PHE C . 50476 1 320 . 1 . 1 70 70 PHE CA C 13 58.359 0.028 . 1 . . . . . 70 PHE CA . 50476 1 321 . 1 . 1 70 70 PHE CB C 13 37.162 0.048 . 1 . . . . . 70 PHE CB . 50476 1 322 . 1 . 1 70 70 PHE N N 15 118.201 0.076 . 1 . . . . . 70 PHE N . 50476 1 323 . 1 . 1 71 71 ASN H H 1 8.273 0.016 . 1 . . . . . 71 ASN H . 50476 1 324 . 1 . 1 71 71 ASN C C 13 174.984 0.000 . 1 . . . . . 71 ASN C . 50476 1 325 . 1 . 1 71 71 ASN CA C 13 52.714 0.022 . 1 . . . . . 71 ASN CA . 50476 1 326 . 1 . 1 71 71 ASN CB C 13 39.825 0.009 . 1 . . . . . 71 ASN CB . 50476 1 327 . 1 . 1 71 71 ASN N N 15 117.233 0.034 . 1 . . . . . 71 ASN N . 50476 1 328 . 1 . 1 72 72 GLU H H 1 8.127 0.008 . 1 . . . . . 72 GLU H . 50476 1 329 . 1 . 1 72 72 GLU C C 13 176.107 0.000 . 1 . . . . . 72 GLU C . 50476 1 330 . 1 . 1 72 72 GLU CA C 13 61.021 0.016 . 1 . . . . . 72 GLU CA . 50476 1 331 . 1 . 1 72 72 GLU CB C 13 30.091 0.005 . 1 . . . . . 72 GLU CB . 50476 1 332 . 1 . 1 72 72 GLU N N 15 123.160 0.033 . 1 . . . . . 72 GLU N . 50476 1 333 . 1 . 1 73 73 ARG H H 1 8.798 0.008 . 1 . . . . . 73 ARG H . 50476 1 334 . 1 . 1 73 73 ARG C C 13 178.274 0.000 . 1 . . . . . 73 ARG C . 50476 1 335 . 1 . 1 73 73 ARG CA C 13 59.912 0.011 . 1 . . . . . 73 ARG CA . 50476 1 336 . 1 . 1 73 73 ARG CB C 13 28.011 0.001 . 1 . . . . . 73 ARG CB . 50476 1 337 . 1 . 1 73 73 ARG N N 15 116.078 0.046 . 1 . . . . . 73 ARG N . 50476 1 338 . 1 . 1 74 74 LYS H H 1 7.373 0.009 . 1 . . . . . 74 LYS H . 50476 1 339 . 1 . 1 74 74 LYS C C 13 175.477 0.000 . 1 . . . . . 74 LYS C . 50476 1 340 . 1 . 1 74 74 LYS CA C 13 59.589 0.013 . 1 . . . . . 74 LYS CA . 50476 1 341 . 1 . 1 74 74 LYS CB C 13 32.997 0.011 . 1 . . . . . 74 LYS CB . 50476 1 342 . 1 . 1 74 74 LYS N N 15 116.495 0.027 . 1 . . . . . 74 LYS N . 50476 1 343 . 1 . 1 75 75 MET H H 1 6.669 0.005 . 1 . . . . . 75 MET H . 50476 1 344 . 1 . 1 75 75 MET C C 13 174.793 0.000 . 1 . . . . . 75 MET C . 50476 1 345 . 1 . 1 75 75 MET CA C 13 57.795 0.017 . 1 . . . . . 75 MET CA . 50476 1 346 . 1 . 1 75 75 MET CB C 13 32.710 0.000 . 1 . . . . . 75 MET CB . 50476 1 347 . 1 . 1 75 75 MET N N 15 109.648 0.017 . 1 . . . . . 75 MET N . 50476 1 348 . 1 . 1 76 76 LEU H H 1 7.167 0.004 . 1 . . . . . 76 LEU H . 50476 1 349 . 1 . 1 76 76 LEU C C 13 179.641 0.000 . 1 . . . . . 76 LEU C . 50476 1 350 . 1 . 1 76 76 LEU CA C 13 56.337 0.006 . 1 . . . . . 76 LEU CA . 50476 1 351 . 1 . 1 76 76 LEU CB C 13 42.896 0.003 . 1 . . . . . 76 LEU CB . 50476 1 352 . 1 . 1 76 76 LEU N N 15 111.945 0.023 . 1 . . . . . 76 LEU N . 50476 1 353 . 1 . 1 77 77 ASP H H 1 8.218 0.011 . 1 . . . . . 77 ASP H . 50476 1 354 . 1 . 1 77 77 ASP C C 13 175.589 0.000 . 1 . . . . . 77 ASP C . 50476 1 355 . 1 . 1 77 77 ASP CA C 13 55.303 0.009 . 1 . . . . . 77 ASP CA . 50476 1 356 . 1 . 1 77 77 ASP CB C 13 40.971 0.011 . 1 . . . . . 77 ASP CB . 50476 1 357 . 1 . 1 77 77 ASP N N 15 116.733 0.061 . 1 . . . . . 77 ASP N . 50476 1 358 . 1 . 1 78 78 ALA H H 1 6.063 0.003 . 1 . . . . . 78 ALA H . 50476 1 359 . 1 . 1 78 78 ALA C C 13 174.604 0.000 . 1 . . . . . 78 ALA C . 50476 1 360 . 1 . 1 78 78 ALA CA C 13 51.294 0.008 . 1 . . . . . 78 ALA CA . 50476 1 361 . 1 . 1 78 78 ALA CB C 13 18.376 0.003 . 1 . . . . . 78 ALA CB . 50476 1 362 . 1 . 1 78 78 ALA N N 15 118.512 0.028 . 1 . . . . . 78 ALA N . 50476 1 363 . 1 . 1 79 79 SER H H 1 6.926 0.004 . 1 . . . . . 79 SER H . 50476 1 364 . 1 . 1 79 79 SER C C 13 175.101 0.000 . 1 . . . . . 79 SER C . 50476 1 365 . 1 . 1 79 79 SER CA C 13 60.020 0.022 . 1 . . . . . 79 SER CA . 50476 1 366 . 1 . 1 79 79 SER CB C 13 63.922 0.070 . 1 . . . . . 79 SER CB . 50476 1 367 . 1 . 1 79 79 SER N N 15 110.479 0.028 . 1 . . . . . 79 SER N . 50476 1 368 . 1 . 1 80 80 HIS H H 1 8.113 0.003 . 1 . . . . . 80 HIS H . 50476 1 369 . 1 . 1 80 80 HIS C C 13 173.594 0.000 . 1 . . . . . 80 HIS C . 50476 1 370 . 1 . 1 80 80 HIS CA C 13 54.803 0.000 . 1 . . . . . 80 HIS CA . 50476 1 371 . 1 . 1 80 80 HIS CB C 13 34.482 0.003 . 1 . . . . . 80 HIS CB . 50476 1 372 . 1 . 1 80 80 HIS N N 15 116.125 0.043 . 1 . . . . . 80 HIS N . 50476 1 373 . 1 . 1 81 81 VAL H H 1 9.176 0.008 . 1 . . . . . 81 VAL H . 50476 1 374 . 1 . 1 81 81 VAL C C 13 173.707 0.000 . 1 . . . . . 81 VAL C . 50476 1 375 . 1 . 1 81 81 VAL CA C 13 61.321 0.008 . 1 . . . . . 81 VAL CA . 50476 1 376 . 1 . 1 81 81 VAL CB C 13 33.411 0.009 . 1 . . . . . 81 VAL CB . 50476 1 377 . 1 . 1 81 81 VAL N N 15 121.605 0.033 . 1 . . . . . 81 VAL N . 50476 1 378 . 1 . 1 82 82 VAL H H 1 7.816 0.009 . 1 . . . . . 82 VAL H . 50476 1 379 . 1 . 1 82 82 VAL C C 13 174.970 0.000 . 1 . . . . . 82 VAL C . 50476 1 380 . 1 . 1 82 82 VAL CA C 13 60.693 0.008 . 1 . . . . . 82 VAL CA . 50476 1 381 . 1 . 1 82 82 VAL CB C 13 31.911 0.008 . 1 . . . . . 82 VAL CB . 50476 1 382 . 1 . 1 82 82 VAL N N 15 127.507 0.146 . 1 . . . . . 82 VAL N . 50476 1 383 . 1 . 1 83 83 VAL H H 1 9.797 0.004 . 1 . . . . . 83 VAL H . 50476 1 384 . 1 . 1 83 83 VAL C C 13 175.469 0.000 . 1 . . . . . 83 VAL C . 50476 1 385 . 1 . 1 83 83 VAL CA C 13 60.975 0.040 . 1 . . . . . 83 VAL CA . 50476 1 386 . 1 . 1 83 83 VAL CB C 13 31.845 0.001 . 1 . . . . . 83 VAL CB . 50476 1 387 . 1 . 1 83 83 VAL N N 15 127.747 0.013 . 1 . . . . . 83 VAL N . 50476 1 388 . 1 . 1 84 84 PHE H H 1 9.368 0.005 . 1 . . . . . 84 PHE H . 50476 1 389 . 1 . 1 84 84 PHE C C 13 175.241 0.000 . 1 . . . . . 84 PHE C . 50476 1 390 . 1 . 1 84 84 PHE CA C 13 58.249 0.001 . 1 . . . . . 84 PHE CA . 50476 1 391 . 1 . 1 84 84 PHE CB C 13 38.600 0.044 . 1 . . . . . 84 PHE CB . 50476 1 392 . 1 . 1 84 84 PHE N N 15 126.364 0.060 . 1 . . . . . 84 PHE N . 50476 1 393 . 1 . 1 85 85 CYS H H 1 8.411 0.025 . 1 . . . . . 85 CYS H . 50476 1 394 . 1 . 1 85 85 CYS C C 13 173.304 0.000 . 1 . . . . . 85 CYS C . 50476 1 395 . 1 . 1 85 85 CYS CA C 13 55.519 0.020 . 1 . . . . . 85 CYS CA . 50476 1 396 . 1 . 1 85 85 CYS CB C 13 29.865 0.009 . 1 . . . . . 85 CYS CB . 50476 1 397 . 1 . 1 85 85 CYS N N 15 120.709 0.247 . 1 . . . . . 85 CYS N . 50476 1 398 . 1 . 1 86 86 ALA H H 1 8.873 0.017 . 1 . . . . . 86 ALA H . 50476 1 399 . 1 . 1 86 86 ALA C C 13 178.080 0.000 . 1 . . . . . 86 ALA C . 50476 1 400 . 1 . 1 86 86 ALA CA C 13 49.208 0.026 . 1 . . . . . 86 ALA CA . 50476 1 401 . 1 . 1 86 86 ALA CB C 13 23.088 0.029 . 1 . . . . . 86 ALA CB . 50476 1 402 . 1 . 1 86 86 ALA N N 15 122.263 0.058 . 1 . . . . . 86 ALA N . 50476 1 403 . 1 . 1 87 87 LYS H H 1 7.313 0.004 . 1 . . . . . 87 LYS H . 50476 1 404 . 1 . 1 87 87 LYS C C 13 176.650 0.000 . 1 . . . . . 87 LYS C . 50476 1 405 . 1 . 1 87 87 LYS CA C 13 56.513 0.014 . 1 . . . . . 87 LYS CA . 50476 1 406 . 1 . 1 87 87 LYS CB C 13 31.587 0.008 . 1 . . . . . 87 LYS CB . 50476 1 407 . 1 . 1 87 87 LYS N N 15 119.492 0.040 . 1 . . . . . 87 LYS N . 50476 1 408 . 1 . 1 88 88 THR H H 1 7.530 0.006 . 1 . . . . . 88 THR H . 50476 1 409 . 1 . 1 88 88 THR C C 13 175.066 0.000 . 1 . . . . . 88 THR C . 50476 1 410 . 1 . 1 88 88 THR CA C 13 61.695 0.010 . 1 . . . . . 88 THR CA . 50476 1 411 . 1 . 1 88 88 THR CB C 13 68.169 0.001 . 1 . . . . . 88 THR CB . 50476 1 412 . 1 . 1 88 88 THR N N 15 107.662 0.048 . 1 . . . . . 88 THR N . 50476 1 413 . 1 . 1 89 89 ALA H H 1 7.374 0.006 . 1 . . . . . 89 ALA H . 50476 1 414 . 1 . 1 89 89 ALA C C 13 175.704 0.000 . 1 . . . . . 89 ALA C . 50476 1 415 . 1 . 1 89 89 ALA CA C 13 51.942 0.008 . 1 . . . . . 89 ALA CA . 50476 1 416 . 1 . 1 89 89 ALA CB C 13 20.928 0.003 . 1 . . . . . 89 ALA CB . 50476 1 417 . 1 . 1 89 89 ALA N N 15 122.152 0.041 . 1 . . . . . 89 ALA N . 50476 1 418 . 1 . 1 90 90 MET H H 1 9.041 0.007 . 1 . . . . . 90 MET H . 50476 1 419 . 1 . 1 90 90 MET C C 13 173.553 0.000 . 1 . . . . . 90 MET C . 50476 1 420 . 1 . 1 90 90 MET CA C 13 53.904 0.025 . 1 . . . . . 90 MET CA . 50476 1 421 . 1 . 1 90 90 MET CB C 13 29.942 0.011 . 1 . . . . . 90 MET CB . 50476 1 422 . 1 . 1 90 90 MET N N 15 121.389 0.038 . 1 . . . . . 90 MET N . 50476 1 423 . 1 . 1 91 91 ASP H H 1 8.554 0.020 . 1 . . . . . 91 ASP H . 50476 1 424 . 1 . 1 91 91 ASP C C 13 175.592 0.000 . 1 . . . . . 91 ASP C . 50476 1 425 . 1 . 1 91 91 ASP CA C 13 51.410 0.000 . 1 . . . . . 91 ASP CA . 50476 1 426 . 1 . 1 91 91 ASP CB C 13 42.427 0.000 . 1 . . . . . 91 ASP CB . 50476 1 427 . 1 . 1 91 91 ASP N N 15 127.344 0.085 . 1 . . . . . 91 ASP N . 50476 1 428 . 1 . 1 92 92 ASP C C 13 179.394 0.000 . 1 . . . . . 92 ASP C . 50476 1 429 . 1 . 1 92 92 ASP CA C 13 57.028 0.000 . 1 . . . . . 92 ASP CA . 50476 1 430 . 1 . 1 92 92 ASP CB C 13 39.640 0.000 . 1 . . . . . 92 ASP CB . 50476 1 431 . 1 . 1 93 93 VAL H H 1 7.898 0.002 . 1 . . . . . 93 VAL H . 50476 1 432 . 1 . 1 93 93 VAL C C 13 178.234 0.000 . 1 . . . . . 93 VAL C . 50476 1 433 . 1 . 1 93 93 VAL CA C 13 66.269 0.002 . 1 . . . . . 93 VAL CA . 50476 1 434 . 1 . 1 93 93 VAL CB C 13 30.246 0.001 . 1 . . . . . 93 VAL CB . 50476 1 435 . 1 . 1 93 93 VAL N N 15 122.151 0.052 . 1 . . . . . 93 VAL N . 50476 1 436 . 1 . 1 94 94 TRP H H 1 8.062 0.016 . 1 . . . . . 94 TRP H . 50476 1 437 . 1 . 1 94 94 TRP C C 13 177.279 0.000 . 1 . . . . . 94 TRP C . 50476 1 438 . 1 . 1 94 94 TRP CA C 13 59.975 0.014 . 1 . . . . . 94 TRP CA . 50476 1 439 . 1 . 1 94 94 TRP CB C 13 29.795 0.049 . 1 . . . . . 94 TRP CB . 50476 1 440 . 1 . 1 94 94 TRP N N 15 123.929 0.032 . 1 . . . . . 94 TRP N . 50476 1 441 . 1 . 1 95 95 LEU H H 1 7.277 0.006 . 1 . . . . . 95 LEU H . 50476 1 442 . 1 . 1 95 95 LEU C C 13 179.922 0.000 . 1 . . . . . 95 LEU C . 50476 1 443 . 1 . 1 95 95 LEU CA C 13 57.671 0.000 . 1 . . . . . 95 LEU CA . 50476 1 444 . 1 . 1 95 95 LEU CB C 13 40.030 0.005 . 1 . . . . . 95 LEU CB . 50476 1 445 . 1 . 1 95 95 LEU N N 15 113.231 0.043 . 1 . . . . . 95 LEU N . 50476 1 446 . 1 . 1 96 96 LYS H H 1 7.745 0.007 . 1 . . . . . 96 LYS H . 50476 1 447 . 1 . 1 96 96 LYS C C 13 176.826 0.000 . 1 . . . . . 96 LYS C . 50476 1 448 . 1 . 1 96 96 LYS CA C 13 57.840 0.033 . 1 . . . . . 96 LYS CA . 50476 1 449 . 1 . 1 96 96 LYS CB C 13 31.601 0.008 . 1 . . . . . 96 LYS CB . 50476 1 450 . 1 . 1 96 96 LYS N N 15 122.197 0.030 . 1 . . . . . 96 LYS N . 50476 1 451 . 1 . 1 97 97 LEU H H 1 8.034 0.003 . 1 . . . . . 97 LEU H . 50476 1 452 . 1 . 1 97 97 LEU C C 13 180.509 0.000 . 1 . . . . . 97 LEU C . 50476 1 453 . 1 . 1 97 97 LEU CA C 13 57.585 0.016 . 1 . . . . . 97 LEU CA . 50476 1 454 . 1 . 1 97 97 LEU CB C 13 41.328 0.012 . 1 . . . . . 97 LEU CB . 50476 1 455 . 1 . 1 97 97 LEU N N 15 120.880 0.021 . 1 . . . . . 97 LEU N . 50476 1 456 . 1 . 1 98 98 VAL H H 1 7.814 0.005 . 1 . . . . . 98 VAL H . 50476 1 457 . 1 . 1 98 98 VAL C C 13 178.337 0.000 . 1 . . . . . 98 VAL C . 50476 1 458 . 1 . 1 98 98 VAL CA C 13 67.239 0.010 . 1 . . . . . 98 VAL CA . 50476 1 459 . 1 . 1 98 98 VAL CB C 13 31.611 0.010 . 1 . . . . . 98 VAL CB . 50476 1 460 . 1 . 1 98 98 VAL N N 15 115.509 0.022 . 1 . . . . . 98 VAL N . 50476 1 461 . 1 . 1 99 99 VAL H H 1 7.485 0.004 . 1 . . . . . 99 VAL H . 50476 1 462 . 1 . 1 99 99 VAL C C 13 177.594 0.000 . 1 . . . . . 99 VAL C . 50476 1 463 . 1 . 1 99 99 VAL CA C 13 64.775 0.001 . 1 . . . . . 99 VAL CA . 50476 1 464 . 1 . 1 99 99 VAL CB C 13 30.753 0.003 . 1 . . . . . 99 VAL CB . 50476 1 465 . 1 . 1 99 99 VAL N N 15 120.391 0.023 . 1 . . . . . 99 VAL N . 50476 1 466 . 1 . 1 100 100 ASP H H 1 8.788 0.003 . 1 . . . . . 100 ASP H . 50476 1 467 . 1 . 1 100 100 ASP C C 13 179.336 0.000 . 1 . . . . . 100 ASP C . 50476 1 468 . 1 . 1 100 100 ASP CA C 13 57.188 0.014 . 1 . . . . . 100 ASP CA . 50476 1 469 . 1 . 1 100 100 ASP CB C 13 38.184 0.009 . 1 . . . . . 100 ASP CB . 50476 1 470 . 1 . 1 100 100 ASP N N 15 124.825 0.042 . 1 . . . . . 100 ASP N . 50476 1 471 . 1 . 1 101 101 GLN H H 1 8.072 0.014 . 1 . . . . . 101 GLN H . 50476 1 472 . 1 . 1 101 101 GLN C C 13 178.925 0.000 . 1 . . . . . 101 GLN C . 50476 1 473 . 1 . 1 101 101 GLN CA C 13 57.707 0.023 . 1 . . . . . 101 GLN CA . 50476 1 474 . 1 . 1 101 101 GLN CB C 13 27.069 0.006 . 1 . . . . . 101 GLN CB . 50476 1 475 . 1 . 1 101 101 GLN N N 15 124.686 0.019 . 1 . . . . . 101 GLN N . 50476 1 476 . 1 . 1 102 102 GLU H H 1 8.090 0.005 . 1 . . . . . 102 GLU H . 50476 1 477 . 1 . 1 102 102 GLU C C 13 178.485 0.000 . 1 . . . . . 102 GLU C . 50476 1 478 . 1 . 1 102 102 GLU CA C 13 60.919 0.000 . 1 . . . . . 102 GLU CA . 50476 1 479 . 1 . 1 102 102 GLU CB C 13 28.677 0.073 . 1 . . . . . 102 GLU CB . 50476 1 480 . 1 . 1 102 102 GLU N N 15 119.848 0.045 . 1 . . . . . 102 GLU N . 50476 1 481 . 1 . 1 103 103 ASP H H 1 8.100 0.004 . 1 . . . . . 103 ASP H . 50476 1 482 . 1 . 1 103 103 ASP C C 13 180.004 0.000 . 1 . . . . . 103 ASP C . 50476 1 483 . 1 . 1 103 103 ASP CA C 13 55.501 0.009 . 1 . . . . . 103 ASP CA . 50476 1 484 . 1 . 1 103 103 ASP CB C 13 42.104 0.009 . 1 . . . . . 103 ASP CB . 50476 1 485 . 1 . 1 103 103 ASP N N 15 117.596 0.051 . 1 . . . . . 103 ASP N . 50476 1 486 . 1 . 1 104 104 ALA H H 1 8.479 0.005 . 1 . . . . . 104 ALA H . 50476 1 487 . 1 . 1 104 104 ALA C C 13 179.634 0.000 . 1 . . . . . 104 ALA C . 50476 1 488 . 1 . 1 104 104 ALA CA C 13 54.776 0.011 . 1 . . . . . 104 ALA CA . 50476 1 489 . 1 . 1 104 104 ALA CB C 13 16.964 0.010 . 1 . . . . . 104 ALA CB . 50476 1 490 . 1 . 1 104 104 ALA N N 15 125.645 0.029 . 1 . . . . . 104 ALA N . 50476 1 491 . 1 . 1 105 105 ASP H H 1 8.074 0.007 . 1 . . . . . 105 ASP H . 50476 1 492 . 1 . 1 105 105 ASP C C 13 176.054 0.000 . 1 . . . . . 105 ASP C . 50476 1 493 . 1 . 1 105 105 ASP CA C 13 55.024 0.030 . 1 . . . . . 105 ASP CA . 50476 1 494 . 1 . 1 105 105 ASP CB C 13 40.833 0.004 . 1 . . . . . 105 ASP CB . 50476 1 495 . 1 . 1 105 105 ASP N N 15 115.319 0.055 . 1 . . . . . 105 ASP N . 50476 1 496 . 1 . 1 106 106 GLY H H 1 7.876 0.006 . 1 . . . . . 106 GLY H . 50476 1 497 . 1 . 1 106 106 GLY C C 13 176.914 0.000 . 1 . . . . . 106 GLY C . 50476 1 498 . 1 . 1 106 106 GLY CA C 13 45.893 0.000 . 1 . . . . . 106 GLY CA . 50476 1 499 . 1 . 1 106 106 GLY N N 15 106.026 0.156 . 1 . . . . . 106 GLY N . 50476 1 500 . 1 . 1 107 107 ARG H H 1 7.549 0.005 . 1 . . . . . 107 ARG H . 50476 1 501 . 1 . 1 107 107 ARG C C 13 175.045 0.000 . 1 . . . . . 107 ARG C . 50476 1 502 . 1 . 1 107 107 ARG CA C 13 58.276 0.014 . 1 . . . . . 107 ARG CA . 50476 1 503 . 1 . 1 107 107 ARG CB C 13 28.006 0.001 . 1 . . . . . 107 ARG CB . 50476 1 504 . 1 . 1 107 107 ARG N N 15 115.231 0.026 . 1 . . . . . 107 ARG N . 50476 1 505 . 1 . 1 108 108 PHE H H 1 8.682 0.010 . 1 . . . . . 108 PHE H . 50476 1 506 . 1 . 1 108 108 PHE CA C 13 53.807 0.000 . 1 . . . . . 108 PHE CA . 50476 1 507 . 1 . 1 108 108 PHE CB C 13 39.723 0.000 . 1 . . . . . 108 PHE CB . 50476 1 508 . 1 . 1 108 108 PHE N N 15 117.129 0.034 . 1 . . . . . 108 PHE N . 50476 1 509 . 1 . 1 109 109 ALA H H 1 7.101 0.000 . 1 . . . . . 109 ALA H . 50476 1 510 . 1 . 1 109 109 ALA C C 13 177.480 0.000 . 1 . . . . . 109 ALA C . 50476 1 511 . 1 . 1 109 109 ALA CA C 13 53.674 0.000 . 1 . . . . . 109 ALA CA . 50476 1 512 . 1 . 1 109 109 ALA CB C 13 18.827 0.000 . 1 . . . . . 109 ALA CB . 50476 1 513 . 1 . 1 110 110 THR H H 1 7.183 0.005 . 1 . . . . . 110 THR H . 50476 1 514 . 1 . 1 110 110 THR C C 13 173.837 0.000 . 1 . . . . . 110 THR C . 50476 1 515 . 1 . 1 110 110 THR CA C 13 57.429 0.000 . 1 . . . . . 110 THR CA . 50476 1 516 . 1 . 1 110 110 THR CB C 13 70.769 0.000 . 1 . . . . . 110 THR CB . 50476 1 517 . 1 . 1 111 111 PRO C C 13 179.980 0.000 . 1 . . . . . 111 PRO C . 50476 1 518 . 1 . 1 111 111 PRO CA C 13 64.017 0.000 . 1 . . . . . 111 PRO CA . 50476 1 519 . 1 . 1 111 111 PRO CB C 13 31.133 0.000 . 1 . . . . . 111 PRO CB . 50476 1 520 . 1 . 1 112 112 GLU H H 1 8.646 0.008 . 1 . . . . . 112 GLU H . 50476 1 521 . 1 . 1 112 112 GLU C C 13 179.027 0.000 . 1 . . . . . 112 GLU C . 50476 1 522 . 1 . 1 112 112 GLU CA C 13 59.819 0.020 . 1 . . . . . 112 GLU CA . 50476 1 523 . 1 . 1 112 112 GLU CB C 13 27.661 0.000 . 1 . . . . . 112 GLU CB . 50476 1 524 . 1 . 1 112 112 GLU N N 15 118.905 0.063 . 1 . . . . . 112 GLU N . 50476 1 525 . 1 . 1 113 113 ALA H H 1 8.013 0.015 . 1 . . . . . 113 ALA H . 50476 1 526 . 1 . 1 113 113 ALA C C 13 180.228 0.000 . 1 . . . . . 113 ALA C . 50476 1 527 . 1 . 1 113 113 ALA CA C 13 54.283 0.038 . 1 . . . . . 113 ALA CA . 50476 1 528 . 1 . 1 113 113 ALA CB C 13 17.500 0.072 . 1 . . . . . 113 ALA CB . 50476 1 529 . 1 . 1 113 113 ALA N N 15 124.061 0.133 . 1 . . . . . 113 ALA N . 50476 1 530 . 1 . 1 114 114 LYS H H 1 6.997 0.001 . 1 . . . . . 114 LYS H . 50476 1 531 . 1 . 1 114 114 LYS C C 13 177.271 0.000 . 1 . . . . . 114 LYS C . 50476 1 532 . 1 . 1 114 114 LYS CA C 13 58.539 0.011 . 1 . . . . . 114 LYS CA . 50476 1 533 . 1 . 1 114 114 LYS CB C 13 31.621 0.019 . 1 . . . . . 114 LYS CB . 50476 1 534 . 1 . 1 114 114 LYS N N 15 121.163 0.018 . 1 . . . . . 114 LYS N . 50476 1 535 . 1 . 1 115 115 ALA H H 1 7.770 0.017 . 1 . . . . . 115 ALA H . 50476 1 536 . 1 . 1 115 115 ALA C C 13 180.543 0.000 . 1 . . . . . 115 ALA C . 50476 1 537 . 1 . 1 115 115 ALA CA C 13 54.295 0.005 . 1 . . . . . 115 ALA CA . 50476 1 538 . 1 . 1 115 115 ALA CB C 13 17.065 0.007 . 1 . . . . . 115 ALA CB . 50476 1 539 . 1 . 1 115 115 ALA N N 15 120.281 0.022 . 1 . . . . . 115 ALA N . 50476 1 540 . 1 . 1 116 116 ALA H H 1 8.016 0.003 . 1 . . . . . 116 ALA H . 50476 1 541 . 1 . 1 116 116 ALA C C 13 180.678 0.000 . 1 . . . . . 116 ALA C . 50476 1 542 . 1 . 1 116 116 ALA CA C 13 54.407 0.020 . 1 . . . . . 116 ALA CA . 50476 1 543 . 1 . 1 116 116 ALA CB C 13 17.214 0.030 . 1 . . . . . 116 ALA CB . 50476 1 544 . 1 . 1 116 116 ALA N N 15 120.040 0.024 . 1 . . . . . 116 ALA N . 50476 1 545 . 1 . 1 117 117 ASN H H 1 7.559 0.004 . 1 . . . . . 117 ASN H . 50476 1 546 . 1 . 1 117 117 ASN C C 13 177.737 0.000 . 1 . . . . . 117 ASN C . 50476 1 547 . 1 . 1 117 117 ASN CA C 13 57.111 0.016 . 1 . . . . . 117 ASN CA . 50476 1 548 . 1 . 1 117 117 ASN CB C 13 41.062 0.005 . 1 . . . . . 117 ASN CB . 50476 1 549 . 1 . 1 117 117 ASN N N 15 120.556 0.024 . 1 . . . . . 117 ASN N . 50476 1 550 . 1 . 1 118 118 ASP H H 1 8.262 0.013 . 1 . . . . . 118 ASP H . 50476 1 551 . 1 . 1 118 118 ASP C C 13 177.155 0.000 . 1 . . . . . 118 ASP C . 50476 1 552 . 1 . 1 118 118 ASP CA C 13 57.185 0.030 . 1 . . . . . 118 ASP CA . 50476 1 553 . 1 . 1 118 118 ASP CB C 13 42.140 0.024 . 1 . . . . . 118 ASP CB . 50476 1 554 . 1 . 1 118 118 ASP N N 15 120.094 0.039 . 1 . . . . . 118 ASP N . 50476 1 555 . 1 . 1 119 119 LYS H H 1 8.340 0.004 . 1 . . . . . 119 LYS H . 50476 1 556 . 1 . 1 119 119 LYS C C 13 180.172 0.000 . 1 . . . . . 119 LYS C . 50476 1 557 . 1 . 1 119 119 LYS CA C 13 59.399 0.005 . 1 . . . . . 119 LYS CA . 50476 1 558 . 1 . 1 119 119 LYS CB C 13 31.694 0.010 . 1 . . . . . 119 LYS CB . 50476 1 559 . 1 . 1 120 120 GLY H H 1 8.222 0.007 . 1 . . . . . 120 GLY H . 50476 1 560 . 1 . 1 120 120 GLY C C 13 175.552 0.000 . 1 . . . . . 120 GLY C . 50476 1 561 . 1 . 1 120 120 GLY CA C 13 46.672 0.015 . 1 . . . . . 120 GLY CA . 50476 1 562 . 1 . 1 120 120 GLY N N 15 107.362 0.038 . 1 . . . . . 120 GLY N . 50476 1 563 . 1 . 1 121 121 ARG H H 1 8.164 0.007 . 1 . . . . . 121 ARG H . 50476 1 564 . 1 . 1 121 121 ARG C C 13 179.313 0.000 . 1 . . . . . 121 ARG C . 50476 1 565 . 1 . 1 121 121 ARG CA C 13 59.859 0.005 . 1 . . . . . 121 ARG CA . 50476 1 566 . 1 . 1 121 121 ARG CB C 13 27.974 0.020 . 1 . . . . . 121 ARG CB . 50476 1 567 . 1 . 1 121 121 ARG N N 15 123.968 0.000 . 1 . . . . . 121 ARG N . 50476 1 568 . 1 . 1 122 122 LYS H H 1 8.731 0.005 . 1 . . . . . 122 LYS H . 50476 1 569 . 1 . 1 123 123 PHE H H 1 8.088 0.005 . 1 . . . . . 123 PHE H . 50476 1 570 . 1 . 1 123 123 PHE C C 13 178.291 0.000 . 1 . . . . . 123 PHE C . 50476 1 571 . 1 . 1 123 123 PHE CA C 13 60.945 0.020 . 1 . . . . . 123 PHE CA . 50476 1 572 . 1 . 1 123 123 PHE CB C 13 37.594 0.018 . 1 . . . . . 123 PHE CB . 50476 1 573 . 1 . 1 123 123 PHE N N 15 119.881 0.079 . 1 . . . . . 123 PHE N . 50476 1 574 . 1 . 1 124 124 PHE H H 1 7.429 0.013 . 1 . . . . . 124 PHE H . 50476 1 575 . 1 . 1 124 124 PHE C C 13 177.518 0.000 . 1 . . . . . 124 PHE C . 50476 1 576 . 1 . 1 124 124 PHE CA C 13 61.795 0.004 . 1 . . . . . 124 PHE CA . 50476 1 577 . 1 . 1 124 124 PHE CB C 13 39.566 0.002 . 1 . . . . . 124 PHE CB . 50476 1 578 . 1 . 1 124 124 PHE N N 15 117.642 0.040 . 1 . . . . . 124 PHE N . 50476 1 579 . 1 . 1 125 125 ALA H H 1 9.139 0.007 . 1 . . . . . 125 ALA H . 50476 1 580 . 1 . 1 125 125 ALA C C 13 179.984 0.000 . 1 . . . . . 125 ALA C . 50476 1 581 . 1 . 1 125 125 ALA CA C 13 55.501 0.018 . 1 . . . . . 125 ALA CA . 50476 1 582 . 1 . 1 125 125 ALA CB C 13 17.780 0.002 . 1 . . . . . 125 ALA CB . 50476 1 583 . 1 . 1 125 125 ALA N N 15 120.186 0.046 . 1 . . . . . 125 ALA N . 50476 1 584 . 1 . 1 126 126 ASP H H 1 9.424 0.015 . 1 . . . . . 126 ASP H . 50476 1 585 . 1 . 1 126 126 ASP C C 13 178.136 0.000 . 1 . . . . . 126 ASP C . 50476 1 586 . 1 . 1 126 126 ASP CA C 13 57.397 0.030 . 1 . . . . . 126 ASP CA . 50476 1 587 . 1 . 1 126 126 ASP CB C 13 38.314 0.023 . 1 . . . . . 126 ASP CB . 50476 1 588 . 1 . 1 126 126 ASP N N 15 118.339 0.111 . 1 . . . . . 126 ASP N . 50476 1 589 . 1 . 1 127 127 MET C C 13 177.595 0.000 . 1 . . . . . 127 MET C . 50476 1 590 . 1 . 1 127 127 MET CA C 13 58.762 0.012 . 1 . . . . . 127 MET CA . 50476 1 591 . 1 . 1 127 127 MET CB C 13 31.526 0.029 . 1 . . . . . 127 MET CB . 50476 1 592 . 1 . 1 127 127 MET N N 15 122.206 0.027 . 1 . . . . . 127 MET N . 50476 1 593 . 1 . 1 128 128 HIS H H 1 6.959 0.027 . 1 . . . . . 128 HIS H . 50476 1 594 . 1 . 1 128 128 HIS C C 13 176.082 0.000 . 1 . . . . . 128 HIS C . 50476 1 595 . 1 . 1 128 128 HIS CA C 13 58.862 0.020 . 1 . . . . . 128 HIS CA . 50476 1 596 . 1 . 1 128 128 HIS CB C 13 27.740 0.005 . 1 . . . . . 128 HIS CB . 50476 1 597 . 1 . 1 128 128 HIS N N 15 112.330 0.096 . 1 . . . . . 128 HIS N . 50476 1 598 . 1 . 1 129 129 ARG H H 1 9.341 0.010 . 1 . . . . . 129 ARG H . 50476 1 599 . 1 . 1 129 129 ARG C C 13 175.243 0.000 . 1 . . . . . 129 ARG C . 50476 1 600 . 1 . 1 129 129 ARG CA C 13 58.223 0.002 . 1 . . . . . 129 ARG CA . 50476 1 601 . 1 . 1 129 129 ARG CB C 13 30.169 0.012 . 1 . . . . . 129 ARG CB . 50476 1 602 . 1 . 1 129 129 ARG N N 15 116.721 0.092 . 1 . . . . . 129 ARG N . 50476 1 603 . 1 . 1 130 130 LYS H H 1 8.644 0.003 . 1 . . . . . 130 LYS H . 50476 1 604 . 1 . 1 130 130 LYS C C 13 176.240 0.000 . 1 . . . . . 130 LYS C . 50476 1 605 . 1 . 1 130 130 LYS CA C 13 57.107 0.011 . 1 . . . . . 130 LYS CA . 50476 1 606 . 1 . 1 130 130 LYS CB C 13 32.342 0.000 . 1 . . . . . 130 LYS CB . 50476 1 607 . 1 . 1 130 130 LYS N N 15 117.800 0.043 . 1 . . . . . 130 LYS N . 50476 1 608 . 1 . 1 131 131 ASP H H 1 6.932 0.008 . 1 . . . . . 131 ASP H . 50476 1 609 . 1 . 1 131 131 ASP C C 13 177.519 0.000 . 1 . . . . . 131 ASP C . 50476 1 610 . 1 . 1 131 131 ASP CA C 13 56.542 0.008 . 1 . . . . . 131 ASP CA . 50476 1 611 . 1 . 1 131 131 ASP CB C 13 39.994 0.001 . 1 . . . . . 131 ASP CB . 50476 1 612 . 1 . 1 131 131 ASP N N 15 116.734 0.023 . 1 . . . . . 131 ASP N . 50476 1 613 . 1 . 1 132 132 LEU H H 1 8.084 0.013 . 1 . . . . . 132 LEU H . 50476 1 614 . 1 . 1 132 132 LEU C C 13 176.642 0.000 . 1 . . . . . 132 LEU C . 50476 1 615 . 1 . 1 132 132 LEU CA C 13 55.057 0.000 . 1 . . . . . 132 LEU CA . 50476 1 616 . 1 . 1 132 132 LEU CB C 13 41.639 0.001 . 1 . . . . . 132 LEU CB . 50476 1 617 . 1 . 1 132 132 LEU N N 15 115.814 0.064 . 1 . . . . . 132 LEU N . 50476 1 618 . 1 . 1 133 133 HIS H H 1 6.929 0.012 . 1 . . . . . 133 HIS H . 50476 1 619 . 1 . 1 133 133 HIS C C 13 174.155 0.000 . 1 . . . . . 133 HIS C . 50476 1 620 . 1 . 1 133 133 HIS CA C 13 56.740 0.021 . 1 . . . . . 133 HIS CA . 50476 1 621 . 1 . 1 133 133 HIS CB C 13 25.760 0.006 . 1 . . . . . 133 HIS CB . 50476 1 622 . 1 . 1 133 133 HIS N N 15 112.188 0.050 . 1 . . . . . 133 HIS N . 50476 1 623 . 1 . 1 134 134 ASP H H 1 8.829 0.007 . 1 . . . . . 134 ASP H . 50476 1 624 . 1 . 1 134 134 ASP C C 13 177.760 0.000 . 1 . . . . . 134 ASP C . 50476 1 625 . 1 . 1 134 134 ASP CA C 13 52.377 0.023 . 1 . . . . . 134 ASP CA . 50476 1 626 . 1 . 1 134 134 ASP CB C 13 41.399 0.004 . 1 . . . . . 134 ASP CB . 50476 1 627 . 1 . 1 134 134 ASP N N 15 119.214 0.071 . 1 . . . . . 134 ASP N . 50476 1 628 . 1 . 1 135 135 ASP H H 1 8.809 0.000 . 1 . . . . . 135 ASP H . 50476 1 629 . 1 . 1 135 135 ASP C C 13 177.170 0.000 . 1 . . . . . 135 ASP C . 50476 1 630 . 1 . 1 135 135 ASP CA C 13 57.946 0.007 . 1 . . . . . 135 ASP CA . 50476 1 631 . 1 . 1 135 135 ASP CB C 13 38.538 0.010 . 1 . . . . . 135 ASP CB . 50476 1 632 . 1 . 1 135 135 ASP N N 15 117.465 0.045 . 1 . . . . . 135 ASP N . 50476 1 633 . 1 . 1 136 136 ALA H H 1 8.543 0.012 . 1 . . . . . 136 ALA H . 50476 1 634 . 1 . 1 136 136 ALA C C 13 180.555 0.000 . 1 . . . . . 136 ALA C . 50476 1 635 . 1 . 1 136 136 ALA CA C 13 56.181 0.005 . 1 . . . . . 136 ALA CA . 50476 1 636 . 1 . 1 136 136 ALA CB C 13 16.859 0.007 . 1 . . . . . 136 ALA CB . 50476 1 637 . 1 . 1 136 136 ALA N N 15 123.380 0.044 . 1 . . . . . 136 ALA N . 50476 1 638 . 1 . 1 137 137 GLU H H 1 8.417 0.018 . 1 . . . . . 137 GLU H . 50476 1 639 . 1 . 1 137 137 GLU C C 13 178.862 0.000 . 1 . . . . . 137 GLU C . 50476 1 640 . 1 . 1 137 137 GLU CA C 13 59.248 0.017 . 1 . . . . . 137 GLU CA . 50476 1 641 . 1 . 1 137 137 GLU CB C 13 28.399 0.013 . 1 . . . . . 137 GLU CB . 50476 1 642 . 1 . 1 137 137 GLU N N 15 121.137 0.052 . 1 . . . . . 137 GLU N . 50476 1 643 . 1 . 1 138 138 TRP H H 1 8.923 0.003 . 1 . . . . . 138 TRP H . 50476 1 644 . 1 . 1 138 138 TRP C C 13 178.778 0.000 . 1 . . . . . 138 TRP C . 50476 1 645 . 1 . 1 138 138 TRP CA C 13 60.198 0.017 . 1 . . . . . 138 TRP CA . 50476 1 646 . 1 . 1 138 138 TRP CB C 13 27.476 0.074 . 1 . . . . . 138 TRP CB . 50476 1 647 . 1 . 1 138 138 TRP N N 15 122.420 0.029 . 1 . . . . . 138 TRP N . 50476 1 648 . 1 . 1 139 139 MET H H 1 8.443 0.003 . 1 . . . . . 139 MET H . 50476 1 649 . 1 . 1 139 139 MET C C 13 178.120 0.000 . 1 . . . . . 139 MET C . 50476 1 650 . 1 . 1 139 139 MET CA C 13 59.582 0.006 . 1 . . . . . 139 MET CA . 50476 1 651 . 1 . 1 139 139 MET CB C 13 31.388 0.016 . 1 . . . . . 139 MET CB . 50476 1 652 . 1 . 1 139 139 MET N N 15 117.197 0.024 . 1 . . . . . 139 MET N . 50476 1 653 . 1 . 1 140 140 ALA H H 1 8.077 0.015 . 1 . . . . . 140 ALA H . 50476 1 654 . 1 . 1 140 140 ALA C C 13 180.265 0.000 . 1 . . . . . 140 ALA C . 50476 1 655 . 1 . 1 140 140 ALA CA C 13 55.154 0.011 . 1 . . . . . 140 ALA CA . 50476 1 656 . 1 . 1 140 140 ALA CB C 13 18.122 0.016 . 1 . . . . . 140 ALA CB . 50476 1 657 . 1 . 1 140 140 ALA N N 15 121.072 0.107 . 1 . . . . . 140 ALA N . 50476 1 658 . 1 . 1 141 141 LYS H H 1 7.983 0.005 . 1 . . . . . 141 LYS H . 50476 1 659 . 1 . 1 141 141 LYS C C 13 177.698 0.000 . 1 . . . . . 141 LYS C . 50476 1 660 . 1 . 1 141 141 LYS CA C 13 60.906 0.020 . 1 . . . . . 141 LYS CA . 50476 1 661 . 1 . 1 141 141 LYS N N 15 117.668 0.015 . 1 . . . . . 141 LYS N . 50476 1 662 . 1 . 1 142 142 GLN H H 1 7.105 0.006 . 1 . . . . . 142 GLN H . 50476 1 663 . 1 . 1 142 142 GLN C C 13 178.985 0.000 . 1 . . . . . 142 GLN C . 50476 1 664 . 1 . 1 142 142 GLN CA C 13 56.274 0.011 . 1 . . . . . 142 GLN CA . 50476 1 665 . 1 . 1 142 142 GLN CB C 13 25.659 0.013 . 1 . . . . . 142 GLN CB . 50476 1 666 . 1 . 1 142 142 GLN N N 15 113.541 0.022 . 1 . . . . . 142 GLN N . 50476 1 667 . 1 . 1 143 143 VAL H H 1 7.774 0.004 . 1 . . . . . 143 VAL H . 50476 1 668 . 1 . 1 143 143 VAL C C 13 177.695 0.000 . 1 . . . . . 143 VAL C . 50476 1 669 . 1 . 1 143 143 VAL CA C 13 67.054 0.002 . 1 . . . . . 143 VAL CA . 50476 1 670 . 1 . 1 143 143 VAL CB C 13 29.873 0.004 . 1 . . . . . 143 VAL CB . 50476 1 671 . 1 . 1 143 143 VAL N N 15 117.302 0.032 . 1 . . . . . 143 VAL N . 50476 1 672 . 1 . 1 144 144 TYR H H 1 8.302 0.005 . 1 . . . . . 144 TYR H . 50476 1 673 . 1 . 1 144 144 TYR C C 13 177.696 0.000 . 1 . . . . . 144 TYR C . 50476 1 674 . 1 . 1 144 144 TYR CA C 13 63.419 0.004 . 1 . . . . . 144 TYR CA . 50476 1 675 . 1 . 1 144 144 TYR CB C 13 38.129 0.060 . 1 . . . . . 144 TYR CB . 50476 1 676 . 1 . 1 144 144 TYR N N 15 121.069 0.132 . 1 . . . . . 144 TYR N . 50476 1 677 . 1 . 1 145 145 LEU H H 1 7.837 0.004 . 1 . . . . . 145 LEU H . 50476 1 678 . 1 . 1 145 145 LEU C C 13 179.040 0.000 . 1 . . . . . 145 LEU C . 50476 1 679 . 1 . 1 145 145 LEU CA C 13 59.984 0.023 . 1 . . . . . 145 LEU CA . 50476 1 680 . 1 . 1 145 145 LEU CB C 13 41.397 0.023 . 1 . . . . . 145 LEU CB . 50476 1 681 . 1 . 1 145 145 LEU N N 15 121.894 0.029 . 1 . . . . . 145 LEU N . 50476 1 682 . 1 . 1 146 146 ASN H H 1 7.757 0.002 . 1 . . . . . 146 ASN H . 50476 1 683 . 1 . 1 146 146 ASN C C 13 177.125 0.000 . 1 . . . . . 146 ASN C . 50476 1 684 . 1 . 1 146 146 ASN CA C 13 56.061 0.018 . 1 . . . . . 146 ASN CA . 50476 1 685 . 1 . 1 146 146 ASN CB C 13 37.456 0.008 . 1 . . . . . 146 ASN CB . 50476 1 686 . 1 . 1 146 146 ASN N N 15 121.132 0.098 . 1 . . . . . 146 ASN N . 50476 1 687 . 1 . 1 147 147 VAL H H 1 8.202 0.004 . 1 . . . . . 147 VAL H . 50476 1 688 . 1 . 1 147 147 VAL C C 13 177.644 0.000 . 1 . . . . . 147 VAL C . 50476 1 689 . 1 . 1 147 147 VAL CA C 13 65.950 0.009 . 1 . . . . . 147 VAL CA . 50476 1 690 . 1 . 1 147 147 VAL CB C 13 29.280 0.000 . 1 . . . . . 147 VAL CB . 50476 1 691 . 1 . 1 147 147 VAL N N 15 117.584 0.050 . 1 . . . . . 147 VAL N . 50476 1 692 . 1 . 1 148 148 GLY H H 1 8.280 0.005 . 1 . . . . . 148 GLY H . 50476 1 693 . 1 . 1 148 148 GLY C C 13 175.970 0.000 . 1 . . . . . 148 GLY C . 50476 1 694 . 1 . 1 148 148 GLY CA C 13 47.973 0.003 . 1 . . . . . 148 GLY CA . 50476 1 695 . 1 . 1 148 148 GLY N N 15 107.015 0.034 . 1 . . . . . 148 GLY N . 50476 1 696 . 1 . 1 149 149 ASN H H 1 7.873 0.006 . 1 . . . . . 149 ASN H . 50476 1 697 . 1 . 1 149 149 ASN C C 13 175.867 0.000 . 1 . . . . . 149 ASN C . 50476 1 698 . 1 . 1 149 149 ASN CA C 13 57.367 0.020 . 1 . . . . . 149 ASN CA . 50476 1 699 . 1 . 1 149 149 ASN CB C 13 39.487 0.029 . 1 . . . . . 149 ASN CB . 50476 1 700 . 1 . 1 149 149 ASN N N 15 120.808 0.032 . 1 . . . . . 149 ASN N . 50476 1 701 . 1 . 1 150 150 PHE H H 1 9.396 0.007 . 1 . . . . . 150 PHE H . 50476 1 702 . 1 . 1 150 150 PHE C C 13 177.448 0.000 . 1 . . . . . 150 PHE C . 50476 1 703 . 1 . 1 150 150 PHE CA C 13 62.086 0.025 . 1 . . . . . 150 PHE CA . 50476 1 704 . 1 . 1 150 150 PHE CB C 13 39.479 0.007 . 1 . . . . . 150 PHE CB . 50476 1 705 . 1 . 1 150 150 PHE N N 15 119.690 0.026 . 1 . . . . . 150 PHE N . 50476 1 706 . 1 . 1 151 151 LEU H H 1 8.942 0.005 . 1 . . . . . 151 LEU H . 50476 1 707 . 1 . 1 151 151 LEU C C 13 180.585 0.000 . 1 . . . . . 151 LEU C . 50476 1 708 . 1 . 1 151 151 LEU CA C 13 56.987 0.002 . 1 . . . . . 151 LEU CA . 50476 1 709 . 1 . 1 151 151 LEU CB C 13 40.698 0.045 . 1 . . . . . 151 LEU CB . 50476 1 710 . 1 . 1 151 151 LEU N N 15 115.368 0.031 . 1 . . . . . 151 LEU N . 50476 1 711 . 1 . 1 152 152 LEU H H 1 7.228 0.006 . 1 . . . . . 152 LEU H . 50476 1 712 . 1 . 1 152 152 LEU C C 13 177.906 0.000 . 1 . . . . . 152 LEU C . 50476 1 713 . 1 . 1 152 152 LEU CA C 13 56.871 0.037 . 1 . . . . . 152 LEU CA . 50476 1 714 . 1 . 1 152 152 LEU CB C 13 38.685 0.033 . 1 . . . . . 152 LEU CB . 50476 1 715 . 1 . 1 152 152 LEU N N 15 120.553 0.039 . 1 . . . . . 152 LEU N . 50476 1 716 . 1 . 1 153 153 GLY H H 1 8.424 0.009 . 1 . . . . . 153 GLY H . 50476 1 717 . 1 . 1 153 153 GLY C C 13 174.968 0.000 . 1 . . . . . 153 GLY C . 50476 1 718 . 1 . 1 153 153 GLY CA C 13 47.459 0.000 . 1 . . . . . 153 GLY CA . 50476 1 719 . 1 . 1 153 153 GLY N N 15 107.284 0.029 . 1 . . . . . 153 GLY N . 50476 1 720 . 1 . 1 154 154 VAL H H 1 8.854 0.005 . 1 . . . . . 154 VAL H . 50476 1 721 . 1 . 1 154 154 VAL C C 13 178.212 0.000 . 1 . . . . . 154 VAL C . 50476 1 722 . 1 . 1 154 154 VAL CA C 13 65.324 0.010 . 1 . . . . . 154 VAL CA . 50476 1 723 . 1 . 1 154 154 VAL CB C 13 29.844 0.073 . 1 . . . . . 154 VAL CB . 50476 1 724 . 1 . 1 154 154 VAL N N 15 116.405 0.050 . 1 . . . . . 154 VAL N . 50476 1 725 . 1 . 1 155 155 ALA H H 1 6.939 0.004 . 1 . . . . . 155 ALA H . 50476 1 726 . 1 . 1 155 155 ALA C C 13 182.235 0.000 . 1 . . . . . 155 ALA C . 50476 1 727 . 1 . 1 155 155 ALA CA C 13 54.219 0.016 . 1 . . . . . 155 ALA CA . 50476 1 728 . 1 . 1 155 155 ALA CB C 13 18.347 0.003 . 1 . . . . . 155 ALA CB . 50476 1 729 . 1 . 1 155 155 ALA N N 15 122.117 0.040 . 1 . . . . . 155 ALA N . 50476 1 730 . 1 . 1 156 156 ALA H H 1 8.289 0.006 . 1 . . . . . 156 ALA H . 50476 1 731 . 1 . 1 156 156 ALA C C 13 178.496 0.000 . 1 . . . . . 156 ALA C . 50476 1 732 . 1 . 1 156 156 ALA CA C 13 53.835 0.015 . 1 . . . . . 156 ALA CA . 50476 1 733 . 1 . 1 156 156 ALA CB C 13 16.447 0.045 . 1 . . . . . 156 ALA CB . 50476 1 734 . 1 . 1 156 156 ALA N N 15 122.303 0.126 . 1 . . . . . 156 ALA N . 50476 1 735 . 1 . 1 157 157 LEU H H 1 7.542 0.002 . 1 . . . . . 157 LEU H . 50476 1 736 . 1 . 1 157 157 LEU C C 13 176.955 0.000 . 1 . . . . . 157 LEU C . 50476 1 737 . 1 . 1 157 157 LEU CA C 13 54.855 0.013 . 1 . . . . . 157 LEU CA . 50476 1 738 . 1 . 1 157 157 LEU CB C 13 42.194 0.032 . 1 . . . . . 157 LEU CB . 50476 1 739 . 1 . 1 157 157 LEU N N 15 118.478 0.028 . 1 . . . . . 157 LEU N . 50476 1 740 . 1 . 1 158 158 GLY H H 1 7.932 0.004 . 1 . . . . . 158 GLY H . 50476 1 741 . 1 . 1 158 158 GLY C C 13 174.136 0.000 . 1 . . . . . 158 GLY C . 50476 1 742 . 1 . 1 158 158 GLY CA C 13 44.960 0.004 . 1 . . . . . 158 GLY CA . 50476 1 743 . 1 . 1 158 158 GLY N N 15 106.664 0.058 . 1 . . . . . 158 GLY N . 50476 1 744 . 1 . 1 159 159 LEU H H 1 7.559 0.006 . 1 . . . . . 159 LEU H . 50476 1 745 . 1 . 1 159 159 LEU C C 13 175.316 0.000 . 1 . . . . . 159 LEU C . 50476 1 746 . 1 . 1 159 159 LEU CA C 13 52.334 0.013 . 1 . . . . . 159 LEU CA . 50476 1 747 . 1 . 1 159 159 LEU CB C 13 43.637 0.000 . 1 . . . . . 159 LEU CB . 50476 1 748 . 1 . 1 159 159 LEU N N 15 118.964 0.072 . 1 . . . . . 159 LEU N . 50476 1 749 . 1 . 1 160 160 ASP H H 1 8.447 0.002 . 1 . . . . . 160 ASP H . 50476 1 750 . 1 . 1 160 160 ASP C C 13 174.255 0.000 . 1 . . . . . 160 ASP C . 50476 1 751 . 1 . 1 160 160 ASP CA C 13 53.478 0.021 . 1 . . . . . 160 ASP CA . 50476 1 752 . 1 . 1 160 160 ASP CB C 13 42.843 0.014 . 1 . . . . . 160 ASP CB . 50476 1 753 . 1 . 1 160 160 ASP N N 15 118.663 0.036 . 1 . . . . . 160 ASP N . 50476 1 754 . 1 . 1 161 161 ALA H H 1 8.325 0.011 . 1 . . . . . 161 ALA H . 50476 1 755 . 1 . 1 161 161 ALA C C 13 178.021 0.000 . 1 . . . . . 161 ALA C . 50476 1 756 . 1 . 1 161 161 ALA CA C 13 50.740 0.019 . 1 . . . . . 161 ALA CA . 50476 1 757 . 1 . 1 161 161 ALA CB C 13 23.056 0.001 . 1 . . . . . 161 ALA CB . 50476 1 758 . 1 . 1 161 161 ALA N N 15 118.229 0.020 . 1 . . . . . 161 ALA N . 50476 1 759 . 1 . 1 162 162 VAL H H 1 7.582 0.016 . 1 . . . . . 162 VAL H . 50476 1 760 . 1 . 1 162 162 VAL CA C 13 57.059 0.000 . 1 . . . . . 162 VAL CA . 50476 1 761 . 1 . 1 162 162 VAL CB C 13 34.223 0.000 . 1 . . . . . 162 VAL CB . 50476 1 762 . 1 . 1 162 162 VAL N N 15 118.328 0.068 . 1 . . . . . 162 VAL N . 50476 1 763 . 1 . 1 163 163 PRO C C 13 175.672 0.000 . 1 . . . . . 163 PRO C . 50476 1 764 . 1 . 1 163 163 PRO CA C 13 59.662 0.000 . 1 . . . . . 163 PRO CA . 50476 1 765 . 1 . 1 163 163 PRO CB C 13 28.900 0.000 . 1 . . . . . 163 PRO CB . 50476 1 766 . 1 . 1 164 164 ILE H H 1 8.360 0.000 . 1 . . . . . 164 ILE H . 50476 1 767 . 1 . 1 164 164 ILE C C 13 177.722 0.000 . 1 . . . . . 164 ILE C . 50476 1 768 . 1 . 1 164 164 ILE CA C 13 60.149 0.542 . 1 . . . . . 164 ILE CA . 50476 1 769 . 1 . 1 164 164 ILE CB C 13 39.722 0.000 . 1 . . . . . 164 ILE CB . 50476 1 770 . 1 . 1 164 164 ILE N N 15 116.721 0.068 . 1 . . . . . 164 ILE N . 50476 1 771 . 1 . 1 165 165 GLU H H 1 9.163 0.003 . 1 . . . . . 165 GLU H . 50476 1 772 . 1 . 1 165 165 GLU C C 13 178.068 0.000 . 1 . . . . . 165 GLU C . 50476 1 773 . 1 . 1 165 165 GLU CA C 13 55.462 0.013 . 1 . . . . . 165 GLU CA . 50476 1 774 . 1 . 1 165 165 GLU CB C 13 32.246 0.008 . 1 . . . . . 165 GLU CB . 50476 1 775 . 1 . 1 165 165 GLU N N 15 124.589 0.043 . 1 . . . . . 165 GLU N . 50476 1 776 . 1 . 1 166 166 GLY H H 1 8.781 0.007 . 1 . . . . . 166 GLY H . 50476 1 777 . 1 . 1 166 166 GLY C C 13 169.199 0.000 . 1 . . . . . 166 GLY C . 50476 1 778 . 1 . 1 166 166 GLY CA C 13 47.592 0.005 . 1 . . . . . 166 GLY CA . 50476 1 779 . 1 . 1 166 166 GLY N N 15 108.891 0.071 . 1 . . . . . 166 GLY N . 50476 1 780 . 1 . 1 167 167 PHE H H 1 7.438 0.008 . 1 . . . . . 167 PHE H . 50476 1 781 . 1 . 1 167 167 PHE C C 13 170.796 0.000 . 1 . . . . . 167 PHE C . 50476 1 782 . 1 . 1 167 167 PHE CA C 13 55.608 0.002 . 1 . . . . . 167 PHE CA . 50476 1 783 . 1 . 1 167 167 PHE CB C 13 38.716 0.001 . 1 . . . . . 167 PHE CB . 50476 1 784 . 1 . 1 167 167 PHE N N 15 120.952 0.045 . 1 . . . . . 167 PHE N . 50476 1 785 . 1 . 1 168 168 ASP H H 1 9.195 0.002 . 1 . . . . . 168 ASP H . 50476 1 786 . 1 . 1 168 168 ASP C C 13 175.729 0.000 . 1 . . . . . 168 ASP C . 50476 1 787 . 1 . 1 168 168 ASP CA C 13 52.847 0.002 . 1 . . . . . 168 ASP CA . 50476 1 788 . 1 . 1 168 168 ASP CB C 13 41.041 0.055 . 1 . . . . . 168 ASP CB . 50476 1 789 . 1 . 1 168 168 ASP N N 15 120.314 0.026 . 1 . . . . . 168 ASP N . 50476 1 790 . 1 . 1 169 169 ALA H H 1 8.237 0.021 . 1 . . . . . 169 ALA H . 50476 1 791 . 1 . 1 169 169 ALA C C 13 178.885 0.000 . 1 . . . . . 169 ALA C . 50476 1 792 . 1 . 1 169 169 ALA CA C 13 54.485 0.014 . 1 . . . . . 169 ALA CA . 50476 1 793 . 1 . 1 169 169 ALA CB C 13 18.524 0.018 . 1 . . . . . 169 ALA CB . 50476 1 794 . 1 . 1 169 169 ALA N N 15 130.873 0.137 . 1 . . . . . 169 ALA N . 50476 1 795 . 1 . 1 170 170 ALA H H 1 8.108 0.004 . 1 . . . . . 170 ALA H . 50476 1 796 . 1 . 1 170 170 ALA C C 13 182.573 0.000 . 1 . . . . . 170 ALA C . 50476 1 797 . 1 . 1 170 170 ALA CA C 13 54.776 0.037 . 1 . . . . . 170 ALA CA . 50476 1 798 . 1 . 1 170 170 ALA CB C 13 17.070 0.005 . 1 . . . . . 170 ALA CB . 50476 1 799 . 1 . 1 170 170 ALA N N 15 119.286 0.123 . 1 . . . . . 170 ALA N . 50476 1 800 . 1 . 1 171 171 ILE H H 1 7.677 0.005 . 1 . . . . . 171 ILE H . 50476 1 801 . 1 . 1 171 171 ILE C C 13 178.381 0.000 . 1 . . . . . 171 ILE C . 50476 1 802 . 1 . 1 171 171 ILE CA C 13 64.194 0.005 . 1 . . . . . 171 ILE CA . 50476 1 803 . 1 . 1 171 171 ILE CB C 13 37.679 0.006 . 1 . . . . . 171 ILE CB . 50476 1 804 . 1 . 1 171 171 ILE N N 15 120.233 0.033 . 1 . . . . . 171 ILE N . 50476 1 805 . 1 . 1 172 172 LEU H H 1 7.987 0.015 . 1 . . . . . 172 LEU H . 50476 1 806 . 1 . 1 172 172 LEU C C 13 179.114 0.000 . 1 . . . . . 172 LEU C . 50476 1 807 . 1 . 1 172 172 LEU CA C 13 58.783 0.019 . 1 . . . . . 172 LEU CA . 50476 1 808 . 1 . 1 172 172 LEU CB C 13 40.522 0.010 . 1 . . . . . 172 LEU CB . 50476 1 809 . 1 . 1 172 172 LEU N N 15 123.554 0.083 . 1 . . . . . 172 LEU N . 50476 1 810 . 1 . 1 173 173 ASP H H 1 9.386 0.003 . 1 . . . . . 173 ASP H . 50476 1 811 . 1 . 1 173 173 ASP C C 13 180.722 0.000 . 1 . . . . . 173 ASP C . 50476 1 812 . 1 . 1 173 173 ASP CA C 13 57.094 0.000 . 1 . . . . . 173 ASP CA . 50476 1 813 . 1 . 1 173 173 ASP CB C 13 39.009 0.003 . 1 . . . . . 173 ASP CB . 50476 1 814 . 1 . 1 173 173 ASP N N 15 118.006 0.018 . 1 . . . . . 173 ASP N . 50476 1 815 . 1 . 1 174 174 ALA H H 1 7.744 0.003 . 1 . . . . . 174 ALA H . 50476 1 816 . 1 . 1 174 174 ALA C C 13 180.280 0.000 . 1 . . . . . 174 ALA C . 50476 1 817 . 1 . 1 174 174 ALA CA C 13 54.685 0.014 . 1 . . . . . 174 ALA CA . 50476 1 818 . 1 . 1 174 174 ALA CB C 13 17.561 0.001 . 1 . . . . . 174 ALA CB . 50476 1 819 . 1 . 1 174 174 ALA N N 15 122.151 0.077 . 1 . . . . . 174 ALA N . 50476 1 820 . 1 . 1 175 175 GLU H H 1 8.400 0.008 . 1 . . . . . 175 GLU H . 50476 1 821 . 1 . 1 175 175 GLU C C 13 177.422 0.000 . 1 . . . . . 175 GLU C . 50476 1 822 . 1 . 1 175 175 GLU CA C 13 57.789 0.016 . 1 . . . . . 175 GLU CA . 50476 1 823 . 1 . 1 175 175 GLU CB C 13 28.272 0.009 . 1 . . . . . 175 GLU CB . 50476 1 824 . 1 . 1 175 175 GLU N N 15 120.634 0.059 . 1 . . . . . 175 GLU N . 50476 1 825 . 1 . 1 176 176 PHE H H 1 7.464 0.003 . 1 . . . . . 176 PHE H . 50476 1 826 . 1 . 1 176 176 PHE C C 13 174.987 0.000 . 1 . . . . . 176 PHE C . 50476 1 827 . 1 . 1 176 176 PHE CA C 13 57.776 0.013 . 1 . . . . . 176 PHE CA . 50476 1 828 . 1 . 1 176 176 PHE CB C 13 39.032 0.016 . 1 . . . . . 176 PHE CB . 50476 1 829 . 1 . 1 176 176 PHE N N 15 112.236 0.027 . 1 . . . . . 176 PHE N . 50476 1 830 . 1 . 1 177 177 GLY H H 1 7.720 0.004 . 1 . . . . . 177 GLY H . 50476 1 831 . 1 . 1 177 177 GLY C C 13 176.252 0.000 . 1 . . . . . 177 GLY C . 50476 1 832 . 1 . 1 177 177 GLY CA C 13 47.177 0.009 . 1 . . . . . 177 GLY CA . 50476 1 833 . 1 . 1 177 177 GLY N N 15 111.607 0.033 . 1 . . . . . 177 GLY N . 50476 1 834 . 1 . 1 178 178 LEU H H 1 8.478 0.004 . 1 . . . . . 178 LEU H . 50476 1 835 . 1 . 1 178 178 LEU C C 13 179.391 0.000 . 1 . . . . . 178 LEU C . 50476 1 836 . 1 . 1 178 178 LEU CA C 13 57.672 0.000 . 1 . . . . . 178 LEU CA . 50476 1 837 . 1 . 1 178 178 LEU CB C 13 40.631 0.011 . 1 . . . . . 178 LEU CB . 50476 1 838 . 1 . 1 178 178 LEU N N 15 115.360 0.096 . 1 . . . . . 178 LEU N . 50476 1 839 . 1 . 1 179 179 LYS H H 1 8.521 0.000 . 1 . . . . . 179 LYS H . 50476 1 840 . 1 . 1 179 179 LYS C C 13 181.509 0.000 . 1 . . . . . 179 LYS C . 50476 1 841 . 1 . 1 179 179 LYS CA C 13 59.876 0.007 . 1 . . . . . 179 LYS CA . 50476 1 842 . 1 . 1 179 179 LYS CB C 13 30.659 0.016 . 1 . . . . . 179 LYS CB . 50476 1 843 . 1 . 1 179 179 LYS N N 15 120.664 0.066 . 1 . . . . . 179 LYS N . 50476 1 844 . 1 . 1 180 180 GLU H H 1 8.827 0.023 . 1 . . . . . 180 GLU H . 50476 1 845 . 1 . 1 180 180 GLU C C 13 177.859 0.000 . 1 . . . . . 180 GLU C . 50476 1 846 . 1 . 1 180 180 GLU CA C 13 58.814 0.009 . 1 . . . . . 180 GLU CA . 50476 1 847 . 1 . 1 180 180 GLU CB C 13 28.057 0.009 . 1 . . . . . 180 GLU CB . 50476 1 848 . 1 . 1 180 180 GLU N N 15 119.607 0.133 . 1 . . . . . 180 GLU N . 50476 1 849 . 1 . 1 181 181 LYS H H 1 7.137 0.004 . 1 . . . . . 181 LYS H . 50476 1 850 . 1 . 1 181 181 LYS C C 13 175.622 0.000 . 1 . . . . . 181 LYS C . 50476 1 851 . 1 . 1 181 181 LYS CA C 13 56.275 0.010 . 1 . . . . . 181 LYS CA . 50476 1 852 . 1 . 1 181 181 LYS CB C 13 33.284 0.019 . 1 . . . . . 181 LYS CB . 50476 1 853 . 1 . 1 181 181 LYS N N 15 116.698 0.011 . 1 . . . . . 181 LYS N . 50476 1 854 . 1 . 1 182 182 GLY H H 1 7.718 0.005 . 1 . . . . . 182 GLY H . 50476 1 855 . 1 . 1 182 182 GLY C C 13 174.087 0.000 . 1 . . . . . 182 GLY C . 50476 1 856 . 1 . 1 182 182 GLY CA C 13 44.650 0.007 . 1 . . . . . 182 GLY CA . 50476 1 857 . 1 . 1 182 182 GLY N N 15 105.424 0.027 . 1 . . . . . 182 GLY N . 50476 1 858 . 1 . 1 183 183 TYR H H 1 8.097 0.007 . 1 . . . . . 183 TYR H . 50476 1 859 . 1 . 1 183 183 TYR C C 13 173.073 0.000 . 1 . . . . . 183 TYR C . 50476 1 860 . 1 . 1 183 183 TYR CA C 13 56.224 0.003 . 1 . . . . . 183 TYR CA . 50476 1 861 . 1 . 1 183 183 TYR CB C 13 43.392 0.021 . 1 . . . . . 183 TYR CB . 50476 1 862 . 1 . 1 183 183 TYR N N 15 118.677 0.044 . 1 . . . . . 183 TYR N . 50476 1 863 . 1 . 1 184 184 THR H H 1 8.764 0.005 . 1 . . . . . 184 THR H . 50476 1 864 . 1 . 1 184 184 THR C C 13 172.031 0.000 . 1 . . . . . 184 THR C . 50476 1 865 . 1 . 1 184 184 THR CA C 13 59.206 0.026 . 1 . . . . . 184 THR CA . 50476 1 866 . 1 . 1 184 184 THR CB C 13 69.763 0.019 . 1 . . . . . 184 THR CB . 50476 1 867 . 1 . 1 184 184 THR N N 15 111.391 0.033 . 1 . . . . . 184 THR N . 50476 1 868 . 1 . 1 185 185 SER H H 1 10.680 0.006 . 1 . . . . . 185 SER H . 50476 1 869 . 1 . 1 185 185 SER C C 13 173.616 0.000 . 1 . . . . . 185 SER C . 50476 1 870 . 1 . 1 185 185 SER CA C 13 59.670 0.052 . 1 . . . . . 185 SER CA . 50476 1 871 . 1 . 1 185 185 SER CB C 13 65.427 0.050 . 1 . . . . . 185 SER CB . 50476 1 872 . 1 . 1 185 185 SER N N 15 128.688 0.020 . 1 . . . . . 185 SER N . 50476 1 873 . 1 . 1 186 186 LEU H H 1 8.807 0.006 . 1 . . . . . 186 LEU H . 50476 1 874 . 1 . 1 186 186 LEU C C 13 176.014 0.000 . 1 . . . . . 186 LEU C . 50476 1 875 . 1 . 1 186 186 LEU CA C 13 55.702 0.017 . 1 . . . . . 186 LEU CA . 50476 1 876 . 1 . 1 186 186 LEU CB C 13 46.281 0.027 . 1 . . . . . 186 LEU CB . 50476 1 877 . 1 . 1 186 186 LEU N N 15 117.821 0.133 . 1 . . . . . 186 LEU N . 50476 1 878 . 1 . 1 187 187 VAL H H 1 7.234 0.006 . 1 . . . . . 187 VAL H . 50476 1 879 . 1 . 1 187 187 VAL C C 13 173.500 0.000 . 1 . . . . . 187 VAL C . 50476 1 880 . 1 . 1 187 187 VAL CA C 13 60.567 0.006 . 1 . . . . . 187 VAL CA . 50476 1 881 . 1 . 1 187 187 VAL CB C 13 36.743 0.005 . 1 . . . . . 187 VAL CB . 50476 1 882 . 1 . 1 187 187 VAL N N 15 113.776 0.036 . 1 . . . . . 187 VAL N . 50476 1 883 . 1 . 1 188 188 VAL H H 1 8.324 0.010 . 1 . . . . . 188 VAL H . 50476 1 884 . 1 . 1 188 188 VAL C C 13 174.679 0.000 . 1 . . . . . 188 VAL C . 50476 1 885 . 1 . 1 188 188 VAL CA C 13 60.475 0.041 . 1 . . . . . 188 VAL CA . 50476 1 886 . 1 . 1 188 188 VAL CB C 13 33.217 0.052 . 1 . . . . . 188 VAL CB . 50476 1 887 . 1 . 1 188 188 VAL N N 15 127.435 0.080 . 1 . . . . . 188 VAL N . 50476 1 888 . 1 . 1 189 189 VAL H H 1 10.044 0.003 . 1 . . . . . 189 VAL H . 50476 1 889 . 1 . 1 189 189 VAL CA C 13 58.447 0.000 . 1 . . . . . 189 VAL CA . 50476 1 890 . 1 . 1 189 189 VAL N N 15 126.087 0.061 . 1 . . . . . 189 VAL N . 50476 1 891 . 1 . 1 190 190 PRO C C 13 174.987 0.000 . 1 . . . . . 190 PRO C . 50476 1 892 . 1 . 1 190 190 PRO CA C 13 61.520 0.000 . 1 . . . . . 190 PRO CA . 50476 1 893 . 1 . 1 190 190 PRO CB C 13 31.915 0.000 . 1 . . . . . 190 PRO CB . 50476 1 894 . 1 . 1 191 191 VAL H H 1 8.981 0.003 . 1 . . . . . 191 VAL H . 50476 1 895 . 1 . 1 191 191 VAL C C 13 175.901 0.000 . 1 . . . . . 191 VAL C . 50476 1 896 . 1 . 1 191 191 VAL CA C 13 59.924 0.022 . 1 . . . . . 191 VAL CA . 50476 1 897 . 1 . 1 191 191 VAL CB C 13 34.634 0.002 . 1 . . . . . 191 VAL CB . 50476 1 898 . 1 . 1 191 191 VAL N N 15 120.228 0.161 . 1 . . . . . 191 VAL N . 50476 1 899 . 1 . 1 192 192 GLY H H 1 8.825 0.003 . 1 . . . . . 192 GLY H . 50476 1 900 . 1 . 1 192 192 GLY C C 13 169.103 0.000 . 1 . . . . . 192 GLY C . 50476 1 901 . 1 . 1 192 192 GLY CA C 13 46.203 0.010 . 1 . . . . . 192 GLY CA . 50476 1 902 . 1 . 1 192 192 GLY N N 15 112.751 0.087 . 1 . . . . . 192 GLY N . 50476 1 903 . 1 . 1 193 193 HIS H H 1 9.862 0.015 . 1 . . . . . 193 HIS H . 50476 1 904 . 1 . 1 193 193 HIS C C 13 175.106 0.000 . 1 . . . . . 193 HIS C . 50476 1 905 . 1 . 1 193 193 HIS CA C 13 54.972 0.004 . 1 . . . . . 193 HIS CA . 50476 1 906 . 1 . 1 193 193 HIS CB C 13 33.957 0.007 . 1 . . . . . 193 HIS CB . 50476 1 907 . 1 . 1 193 193 HIS N N 15 124.400 0.036 . 1 . . . . . 193 HIS N . 50476 1 908 . 1 . 1 194 194 HIS H H 1 10.627 0.006 . 1 . . . . . 194 HIS H . 50476 1 909 . 1 . 1 194 194 HIS C C 13 173.488 0.000 . 1 . . . . . 194 HIS C . 50476 1 910 . 1 . 1 194 194 HIS CA C 13 55.944 0.000 . 1 . . . . . 194 HIS CA . 50476 1 911 . 1 . 1 194 194 HIS CB C 13 28.688 0.001 . 1 . . . . . 194 HIS CB . 50476 1 912 . 1 . 1 194 194 HIS N N 15 123.380 0.045 . 1 . . . . . 194 HIS N . 50476 1 913 . 1 . 1 195 195 SER H H 1 8.155 0.000 . 1 . . . . . 195 SER H . 50476 1 914 . 1 . 1 195 195 SER CA C 13 55.452 0.000 . 1 . . . . . 195 SER CA . 50476 1 915 . 1 . 1 195 195 SER CB C 13 65.633 0.000 . 1 . . . . . 195 SER CB . 50476 1 916 . 1 . 1 195 195 SER N N 15 116.163 0.023 . 1 . . . . . 195 SER N . 50476 1 917 . 1 . 1 196 196 VAL C C 13 176.830 0.000 . 1 . . . . . 196 VAL C . 50476 1 918 . 1 . 1 196 196 VAL CA C 13 63.862 0.000 . 1 . . . . . 196 VAL CA . 50476 1 919 . 1 . 1 196 196 VAL CB C 13 30.721 0.000 . 1 . . . . . 196 VAL CB . 50476 1 920 . 1 . 1 197 197 GLU H H 1 7.898 0.004 . 1 . . . . . 197 GLU H . 50476 1 921 . 1 . 1 197 197 GLU C C 13 176.262 0.000 . 1 . . . . . 197 GLU C . 50476 1 922 . 1 . 1 197 197 GLU CA C 13 56.038 0.003 . 1 . . . . . 197 GLU CA . 50476 1 923 . 1 . 1 197 197 GLU CB C 13 28.361 0.015 . 1 . . . . . 197 GLU CB . 50476 1 924 . 1 . 1 197 197 GLU N N 15 117.626 0.012 . 1 . . . . . 197 GLU N . 50476 1 925 . 1 . 1 198 198 ASP H H 1 7.713 0.004 . 1 . . . . . 198 ASP H . 50476 1 926 . 1 . 1 198 198 ASP C C 13 176.783 0.000 . 1 . . . . . 198 ASP C . 50476 1 927 . 1 . 1 198 198 ASP CA C 13 52.957 0.024 . 1 . . . . . 198 ASP CA . 50476 1 928 . 1 . 1 198 198 ASP CB C 13 39.351 0.006 . 1 . . . . . 198 ASP CB . 50476 1 929 . 1 . 1 198 198 ASP N N 15 118.446 0.046 . 1 . . . . . 198 ASP N . 50476 1 930 . 1 . 1 199 199 PHE H H 1 7.769 0.003 . 1 . . . . . 199 PHE H . 50476 1 931 . 1 . 1 199 199 PHE C C 13 176.188 0.000 . 1 . . . . . 199 PHE C . 50476 1 932 . 1 . 1 199 199 PHE CA C 13 57.728 0.007 . 1 . . . . . 199 PHE CA . 50476 1 933 . 1 . 1 199 199 PHE CB C 13 37.886 0.019 . 1 . . . . . 199 PHE CB . 50476 1 934 . 1 . 1 199 199 PHE N N 15 127.846 0.019 . 1 . . . . . 199 PHE N . 50476 1 935 . 1 . 1 200 200 ASN H H 1 7.672 0.003 . 1 . . . . . 200 ASN H . 50476 1 936 . 1 . 1 200 200 ASN C C 13 176.099 0.000 . 1 . . . . . 200 ASN C . 50476 1 937 . 1 . 1 200 200 ASN CA C 13 52.796 0.000 . 1 . . . . . 200 ASN CA . 50476 1 938 . 1 . 1 200 200 ASN CB C 13 39.881 0.039 . 1 . . . . . 200 ASN CB . 50476 1 939 . 1 . 1 200 200 ASN N N 15 118.438 0.041 . 1 . . . . . 200 ASN N . 50476 1 940 . 1 . 1 201 201 ALA H H 1 6.972 0.005 . 1 . . . . . 201 ALA H . 50476 1 941 . 1 . 1 201 201 ALA C C 13 177.764 0.000 . 1 . . . . . 201 ALA C . 50476 1 942 . 1 . 1 201 201 ALA CA C 13 53.079 0.034 . 1 . . . . . 201 ALA CA . 50476 1 943 . 1 . 1 201 201 ALA CB C 13 17.214 0.008 . 1 . . . . . 201 ALA CB . 50476 1 944 . 1 . 1 201 201 ALA N N 15 119.813 0.061 . 1 . . . . . 201 ALA N . 50476 1 945 . 1 . 1 202 202 THR H H 1 6.960 0.003 . 1 . . . . . 202 THR H . 50476 1 946 . 1 . 1 202 202 THR C C 13 174.596 0.000 . 1 . . . . . 202 THR C . 50476 1 947 . 1 . 1 202 202 THR CA C 13 60.018 0.017 . 1 . . . . . 202 THR CA . 50476 1 948 . 1 . 1 202 202 THR CB C 13 68.572 0.018 . 1 . . . . . 202 THR CB . 50476 1 949 . 1 . 1 202 202 THR N N 15 102.115 0.059 . 1 . . . . . 202 THR N . 50476 1 950 . 1 . 1 203 203 LEU H H 1 6.465 0.007 . 1 . . . . . 203 LEU H . 50476 1 951 . 1 . 1 203 203 LEU CA C 13 52.044 0.000 . 1 . . . . . 203 LEU CA . 50476 1 952 . 1 . 1 203 203 LEU CB C 13 42.616 0.000 . 1 . . . . . 203 LEU CB . 50476 1 953 . 1 . 1 203 203 LEU N N 15 121.992 0.050 . 1 . . . . . 203 LEU N . 50476 1 954 . 1 . 1 204 204 PRO C C 13 178.034 0.000 . 1 . . . . . 204 PRO C . 50476 1 955 . 1 . 1 204 204 PRO CA C 13 62.193 0.000 . 1 . . . . . 204 PRO CA . 50476 1 956 . 1 . 1 204 204 PRO CB C 13 31.813 0.000 . 1 . . . . . 204 PRO CB . 50476 1 957 . 1 . 1 205 205 LYS H H 1 8.619 0.000 . 1 . . . . . 205 LYS H . 50476 1 958 . 1 . 1 205 205 LYS C C 13 178.225 0.000 . 1 . . . . . 205 LYS C . 50476 1 959 . 1 . 1 205 205 LYS CA C 13 56.411 0.000 . 1 . . . . . 205 LYS CA . 50476 1 960 . 1 . 1 205 205 LYS CB C 13 29.284 0.014 . 1 . . . . . 205 LYS CB . 50476 1 961 . 1 . 1 205 205 LYS N N 15 122.176 0.013 . 1 . . . . . 205 LYS N . 50476 1 962 . 1 . 1 206 206 SER H H 1 8.815 0.005 . 1 . . . . . 206 SER H . 50476 1 963 . 1 . 1 206 206 SER C C 13 175.347 0.000 . 1 . . . . . 206 SER C . 50476 1 964 . 1 . 1 206 206 SER CA C 13 55.885 0.035 . 1 . . . . . 206 SER CA . 50476 1 965 . 1 . 1 206 206 SER CB C 13 65.679 0.036 . 1 . . . . . 206 SER CB . 50476 1 966 . 1 . 1 206 206 SER N N 15 116.136 0.029 . 1 . . . . . 206 SER N . 50476 1 967 . 1 . 1 207 207 ARG H H 1 8.418 0.011 . 1 . . . . . 207 ARG H . 50476 1 968 . 1 . 1 207 207 ARG C C 13 174.437 0.000 . 1 . . . . . 207 ARG C . 50476 1 969 . 1 . 1 207 207 ARG CA C 13 52.120 0.012 . 1 . . . . . 207 ARG CA . 50476 1 970 . 1 . 1 207 207 ARG CB C 13 34.844 0.013 . 1 . . . . . 207 ARG CB . 50476 1 971 . 1 . 1 207 207 ARG N N 15 129.029 0.058 . 1 . . . . . 207 ARG N . 50476 1 972 . 1 . 1 208 208 LEU H H 1 9.617 0.009 . 1 . . . . . 208 LEU H . 50476 1 973 . 1 . 1 208 208 LEU CA C 13 52.842 0.000 . 1 . . . . . 208 LEU CA . 50476 1 974 . 1 . 1 208 208 LEU CB C 13 40.597 0.000 . 1 . . . . . 208 LEU CB . 50476 1 975 . 1 . 1 208 208 LEU N N 15 120.288 0.033 . 1 . . . . . 208 LEU N . 50476 1 976 . 1 . 1 209 209 PRO C C 13 177.230 0.000 . 1 . . . . . 209 PRO C . 50476 1 977 . 1 . 1 209 209 PRO CA C 13 62.198 0.000 . 1 . . . . . 209 PRO CA . 50476 1 978 . 1 . 1 209 209 PRO CB C 13 31.402 0.000 . 1 . . . . . 209 PRO CB . 50476 1 979 . 1 . 1 210 210 GLN H H 1 8.637 0.018 . 1 . . . . . 210 GLN H . 50476 1 980 . 1 . 1 210 210 GLN C C 13 176.935 0.000 . 1 . . . . . 210 GLN C . 50476 1 981 . 1 . 1 210 210 GLN CA C 13 57.521 0.015 . 1 . . . . . 210 GLN CA . 50476 1 982 . 1 . 1 210 210 GLN CB C 13 27.457 0.009 . 1 . . . . . 210 GLN CB . 50476 1 983 . 1 . 1 210 210 GLN N N 15 119.478 0.039 . 1 . . . . . 210 GLN N . 50476 1 984 . 1 . 1 211 211 ASN H H 1 8.132 0.016 . 1 . . . . . 211 ASN H . 50476 1 985 . 1 . 1 211 211 ASN C C 13 176.928 0.000 . 1 . . . . . 211 ASN C . 50476 1 986 . 1 . 1 211 211 ASN CA C 13 55.198 0.058 . 1 . . . . . 211 ASN CA . 50476 1 987 . 1 . 1 211 211 ASN CB C 13 36.657 0.018 . 1 . . . . . 211 ASN CB . 50476 1 988 . 1 . 1 211 211 ASN N N 15 111.446 0.045 . 1 . . . . . 211 ASN N . 50476 1 989 . 1 . 1 212 212 ILE H H 1 7.687 0.004 . 1 . . . . . 212 ILE H . 50476 1 990 . 1 . 1 212 212 ILE C C 13 176.833 0.000 . 1 . . . . . 212 ILE C . 50476 1 991 . 1 . 1 212 212 ILE CA C 13 62.907 0.005 . 1 . . . . . 212 ILE CA . 50476 1 992 . 1 . 1 212 212 ILE CB C 13 38.194 0.009 . 1 . . . . . 212 ILE CB . 50476 1 993 . 1 . 1 212 212 ILE N N 15 118.698 0.060 . 1 . . . . . 212 ILE N . 50476 1 994 . 1 . 1 213 213 THR H H 1 7.124 0.003 . 1 . . . . . 213 THR H . 50476 1 995 . 1 . 1 213 213 THR C C 13 173.413 0.000 . 1 . . . . . 213 THR C . 50476 1 996 . 1 . 1 213 213 THR CA C 13 62.077 0.001 . 1 . . . . . 213 THR CA . 50476 1 997 . 1 . 1 213 213 THR CB C 13 70.366 0.002 . 1 . . . . . 213 THR CB . 50476 1 998 . 1 . 1 213 213 THR N N 15 105.927 0.036 . 1 . . . . . 213 THR N . 50476 1 999 . 1 . 1 214 214 LEU H H 1 8.252 0.013 . 1 . . . . . 214 LEU H . 50476 1 1000 . 1 . 1 214 214 LEU C C 13 176.301 0.000 . 1 . . . . . 214 LEU C . 50476 1 1001 . 1 . 1 214 214 LEU CA C 13 54.867 0.017 . 1 . . . . . 214 LEU CA . 50476 1 1002 . 1 . 1 214 214 LEU CB C 13 45.039 0.006 . 1 . . . . . 214 LEU CB . 50476 1 1003 . 1 . 1 214 214 LEU N N 15 122.463 0.019 . 1 . . . . . 214 LEU N . 50476 1 1004 . 1 . 1 215 215 THR H H 1 8.900 0.005 . 1 . . . . . 215 THR H . 50476 1 1005 . 1 . 1 215 215 THR C C 13 172.835 0.000 . 1 . . . . . 215 THR C . 50476 1 1006 . 1 . 1 215 215 THR CA C 13 62.248 0.005 . 1 . . . . . 215 THR CA . 50476 1 1007 . 1 . 1 215 215 THR CB C 13 70.776 0.001 . 1 . . . . . 215 THR CB . 50476 1 1008 . 1 . 1 215 215 THR N N 15 124.392 0.065 . 1 . . . . . 215 THR N . 50476 1 1009 . 1 . 1 216 216 GLU H H 1 8.807 0.024 . 1 . . . . . 216 GLU H . 50476 1 1010 . 1 . 1 216 216 GLU C C 13 175.534 0.000 . 1 . . . . . 216 GLU C . 50476 1 1011 . 1 . 1 216 216 GLU CA C 13 55.317 0.014 . 1 . . . . . 216 GLU CA . 50476 1 1012 . 1 . 1 216 216 GLU CB C 13 30.824 0.009 . 1 . . . . . 216 GLU CB . 50476 1 1013 . 1 . 1 216 216 GLU N N 15 127.434 0.060 . 1 . . . . . 216 GLU N . 50476 1 1014 . 1 . 1 217 217 VAL H H 1 8.444 0.007 . 1 . . . . . 217 VAL H . 50476 1 1015 . 1 . 1 217 217 VAL C C 13 178.691 0.000 . 1 . . . . . 217 VAL C . 50476 1 1016 . 1 . 1 217 217 VAL CA C 13 61.303 0.000 . 1 . . . . . 217 VAL CA . 50476 1 1017 . 1 . 1 217 217 VAL CB C 13 34.223 0.000 . 1 . . . . . 217 VAL CB . 50476 1 1018 . 1 . 1 217 217 VAL N N 15 122.953 0.029 . 1 . . . . . 217 VAL N . 50476 1 stop_ save_