################################### # 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_shifts_mic _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shifts_mic _Assigned_chem_shift_list.Entry_ID 7208 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $micelles _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _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 . . 4 $mic_N1513C isotropic 7208 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 . . 7208 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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.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 ARG HA H 1 4.142 0.020 . 1 . . . . 61 ARG HA . 7208 1 2 . 1 1 1 1 ARG HB2 H 1 1.940 0.020 . 1 . . . . 61 ARG HB2 . 7208 1 3 . 1 1 1 1 ARG HB3 H 1 1.940 0.020 . 1 . . . . 61 ARG HB3 . 7208 1 4 . 1 1 1 1 ARG HG2 H 1 1.676 0.020 . 1 . . . . 61 ARG HG2 . 7208 1 5 . 1 1 1 1 ARG HG3 H 1 1.676 0.020 . 1 . . . . 61 ARG HG3 . 7208 1 6 . 1 1 1 1 ARG HD2 H 1 3.238 0.020 . 1 . . . . 61 ARG HD2 . 7208 1 7 . 1 1 1 1 ARG HD3 H 1 3.238 0.020 . 1 . . . . 61 ARG HD3 . 7208 1 8 . 1 1 1 1 ARG CA C 13 55.651 0.400 . 1 . . . . 61 ARG CA . 7208 1 9 . 1 1 1 1 ARG CB C 13 31.391 0.400 . 1 . . . . 61 ARG CB . 7208 1 10 . 1 1 1 1 ARG CG C 13 26.506 0.400 . 1 . . . . 61 ARG CG . 7208 1 11 . 1 1 1 1 ARG CD C 13 43.475 0.400 . 1 . . . . 61 ARG CD . 7208 1 12 . 1 1 2 2 VAL HA H 1 4.118 0.020 . 1 . . . . 62 VAL HA . 7208 1 13 . 1 1 2 2 VAL HB H 1 2.094 0.020 . 1 . . . . 62 VAL HB . 7208 1 14 . 1 1 2 2 VAL HG11 H 1 0.923 0.020 . 2 . . . . 62 VAL HG1 . 7208 1 15 . 1 1 2 2 VAL HG12 H 1 0.923 0.020 . 2 . . . . 62 VAL HG1 . 7208 1 16 . 1 1 2 2 VAL HG13 H 1 0.923 0.020 . 2 . . . . 62 VAL HG1 . 7208 1 17 . 1 1 2 2 VAL HG21 H 1 0.923 0.020 . 2 . . . . 62 VAL HG2 . 7208 1 18 . 1 1 2 2 VAL HG22 H 1 0.923 0.020 . 2 . . . . 62 VAL HG2 . 7208 1 19 . 1 1 2 2 VAL HG23 H 1 0.923 0.020 . 2 . . . . 62 VAL HG2 . 7208 1 20 . 1 1 2 2 VAL CA C 13 62.856 0.400 . 1 . . . . 62 VAL CA . 7208 1 21 . 1 1 2 2 VAL CB C 13 32.771 0.400 . 1 . . . . 62 VAL CB . 7208 1 22 . 1 1 2 2 VAL CG1 C 13 21.319 0.400 . 1 . . . . 62 VAL CG1 . 7208 1 23 . 1 1 3 3 GLN H H 1 8.514 0.020 . 1 . . . . 63 GLN H . 7208 1 24 . 1 1 3 3 GLN HA H 1 4.431 0.020 . 1 . . . . 63 GLN HA . 7208 1 25 . 1 1 3 3 GLN HB2 H 1 1.997 0.020 . 1 . . . . 63 GLN HB2 . 7208 1 26 . 1 1 3 3 GLN HB3 H 1 1.997 0.020 . 1 . . . . 63 GLN HB3 . 7208 1 27 . 1 1 3 3 GLN HG2 H 1 2.055 0.020 . 2 . . . . 63 GLN HG2 . 7208 1 28 . 1 1 3 3 GLN HG3 H 1 1.904 0.020 . 2 . . . . 63 GLN HG3 . 7208 1 29 . 1 1 3 3 GLN CA C 13 55.722 0.400 . 1 . . . . 63 GLN CA . 7208 1 30 . 1 1 3 3 GLN CB C 13 30.021 0.400 . 1 . . . . 63 GLN CB . 7208 1 31 . 1 1 3 3 GLN N N 15 121.254 0.400 . 1 . . . . 63 GLN N . 7208 1 32 . 1 1 4 4 LEU H H 1 8.420 0.020 . 1 . . . . 64 LEU H . 7208 1 33 . 1 1 4 4 LEU HA H 1 4.319 0.020 . 1 . . . . 64 LEU HA . 7208 1 34 . 1 1 4 4 LEU HB2 H 1 1.623 0.020 . 1 . . . . 64 LEU HB2 . 7208 1 35 . 1 1 4 4 LEU HB3 H 1 1.623 0.020 . 1 . . . . 64 LEU HB3 . 7208 1 36 . 1 1 4 4 LEU HG H 1 1.532 0.020 . 1 . . . . 64 LEU HG . 7208 1 37 . 1 1 4 4 LEU HD11 H 1 0.918 0.020 . 2 . . . . 64 LEU HD1 . 7208 1 38 . 1 1 4 4 LEU HD12 H 1 0.918 0.020 . 2 . . . . 64 LEU HD1 . 7208 1 39 . 1 1 4 4 LEU HD13 H 1 0.918 0.020 . 2 . . . . 64 LEU HD1 . 7208 1 40 . 1 1 4 4 LEU HD21 H 1 0.918 0.020 . 2 . . . . 64 LEU HD2 . 7208 1 41 . 1 1 4 4 LEU HD22 H 1 0.918 0.020 . 2 . . . . 64 LEU HD2 . 7208 1 42 . 1 1 4 4 LEU HD23 H 1 0.918 0.020 . 2 . . . . 64 LEU HD2 . 7208 1 43 . 1 1 4 4 LEU CA C 13 55.690 0.400 . 1 . . . . 64 LEU CA . 7208 1 44 . 1 1 4 4 LEU CB C 13 43.240 0.400 . 1 . . . . 64 LEU CB . 7208 1 45 . 1 1 4 4 LEU CD1 C 13 24.481 0.400 . 1 . . . . 64 LEU CD1 . 7208 1 46 . 1 1 4 4 LEU N N 15 119.985 0.400 . 1 . . . . 64 LEU N . 7208 1 47 . 1 1 5 5 ALA H H 1 8.377 0.020 . 1 . . . . 65 ALA H . 7208 1 48 . 1 1 5 5 ALA HA H 1 4.192 0.020 . 1 . . . . 65 ALA HA . 7208 1 49 . 1 1 5 5 ALA HB1 H 1 1.313 0.020 . 1 . . . . 65 ALA HB . 7208 1 50 . 1 1 5 5 ALA HB2 H 1 1.313 0.020 . 1 . . . . 65 ALA HB . 7208 1 51 . 1 1 5 5 ALA HB3 H 1 1.313 0.020 . 1 . . . . 65 ALA HB . 7208 1 52 . 1 1 5 5 ALA CA C 13 53.043 0.400 . 1 . . . . 65 ALA CA . 7208 1 53 . 1 1 5 5 ALA CB C 13 19.179 0.400 . 1 . . . . 65 ALA CB . 7208 1 54 . 1 1 5 5 ALA N N 15 119.387 0.400 . 1 . . . . 65 ALA N . 7208 1 55 . 1 1 6 6 HIS H H 1 7.830 0.020 . 1 . . . . 66 HIS H . 7208 1 56 . 1 1 6 6 HIS HA H 1 4.398 0.020 . 1 . . . . 66 HIS HA . 7208 1 57 . 1 1 6 6 HIS HB2 H 1 2.918 0.020 . 2 . . . . 66 HIS HB2 . 7208 1 58 . 1 1 6 6 HIS HB3 H 1 2.812 0.020 . 2 . . . . 66 HIS HB3 . 7208 1 59 . 1 1 6 6 HIS HD2 H 1 6.988 0.020 . 1 . . . . 66 HIS HD2 . 7208 1 60 . 1 1 6 6 HIS CA C 13 56.260 0.400 . 1 . . . . 66 HIS CA . 7208 1 61 . 1 1 6 6 HIS CB C 13 30.005 0.400 . 1 . . . . 66 HIS CB . 7208 1 62 . 1 1 6 6 HIS N N 15 112.448 0.400 . 1 . . . . 66 HIS N . 7208 1 63 . 1 1 7 7 HIS H H 1 8.007 0.020 . 1 . . . . 67 HIS H . 7208 1 64 . 1 1 7 7 HIS HA H 1 4.539 0.020 . 1 . . . . 67 HIS HA . 7208 1 65 . 1 1 7 7 HIS HB2 H 1 3.012 0.020 . 2 . . . . 67 HIS HB2 . 7208 1 66 . 1 1 7 7 HIS HB3 H 1 2.845 0.020 . 2 . . . . 67 HIS HB3 . 7208 1 67 . 1 1 7 7 HIS HD1 H 1 7.059 0.020 . 1 . . . . 67 HIS HD1 . 7208 1 68 . 1 1 7 7 HIS CA C 13 55.659 0.400 . 1 . . . . 67 HIS CA . 7208 1 69 . 1 1 7 7 HIS CB C 13 29.825 0.400 . 1 . . . . 67 HIS CB . 7208 1 70 . 1 1 7 7 HIS N N 15 116.260 0.400 . 1 . . . . 67 HIS N . 7208 1 71 . 1 1 8 8 PHE H H 1 8.396 0.020 . 1 . . . . 68 PHE H . 7208 1 72 . 1 1 8 8 PHE HA H 1 4.685 0.020 . 1 . . . . 68 PHE HA . 7208 1 73 . 1 1 8 8 PHE HB2 H 1 2.853 0.020 . 2 . . . . 68 PHE HB2 . 7208 1 74 . 1 1 8 8 PHE HB3 H 1 3.126 0.020 . 2 . . . . 68 PHE HB3 . 7208 1 75 . 1 1 8 8 PHE HD1 H 1 7.337 0.020 . 1 . . . . 68 PHE HD1 . 7208 1 76 . 1 1 8 8 PHE HD2 H 1 7.337 0.020 . 1 . . . . 68 PHE HD2 . 7208 1 77 . 1 1 8 8 PHE HE1 H 1 7.201 0.020 . 1 . . . . 68 PHE HE1 . 7208 1 78 . 1 1 8 8 PHE HE2 H 1 7.201 0.020 . 1 . . . . 68 PHE HE2 . 7208 1 79 . 1 1 8 8 PHE HZ H 1 7.041 0.020 . 1 . . . . 68 PHE HZ . 7208 1 80 . 1 1 8 8 PHE CA C 13 58.338 0.400 . 1 . . . . 68 PHE CA . 7208 1 81 . 1 1 8 8 PHE CB C 13 40.673 0.400 . 1 . . . . 68 PHE CB . 7208 1 82 . 1 1 8 8 PHE N N 15 117.618 0.400 . 1 . . . . 68 PHE N . 7208 1 83 . 1 1 9 9 SER H H 1 8.721 0.020 . 1 . . . . 69 SER H . 7208 1 84 . 1 1 9 9 SER HA H 1 4.671 0.020 . 1 . . . . 69 SER HA . 7208 1 85 . 1 1 9 9 SER HB2 H 1 4.178 0.020 . 1 . . . . 69 SER HB2 . 7208 1 86 . 1 1 9 9 SER HB3 H 1 4.001 0.020 . 1 . . . . 69 SER HB3 . 7208 1 87 . 1 1 9 9 SER CA C 13 57.317 0.400 . 1 . . . . 69 SER CA . 7208 1 88 . 1 1 9 9 SER CB C 13 65.553 0.400 . 1 . . . . 69 SER CB . 7208 1 89 . 1 1 9 9 SER N N 15 113.918 0.400 . 1 . . . . 69 SER N . 7208 1 90 . 1 1 11 11 PRO HA H 1 4.305 0.020 . 1 . . . . 71 PRO HA . 7208 1 91 . 1 1 11 11 PRO HB2 H 1 2.380 0.020 . 1 . . . . 71 PRO HB2 . 7208 1 92 . 1 1 11 11 PRO HB3 H 1 1.866 0.020 . 1 . . . . 71 PRO HB3 . 7208 1 93 . 1 1 11 11 PRO HG2 H 1 2.031 0.020 . 1 . . . . 71 PRO HG2 . 7208 1 94 . 1 1 11 11 PRO HG3 H 1 2.187 0.020 . 1 . . . . 71 PRO HG3 . 7208 1 95 . 1 1 11 11 PRO HD2 H 1 3.983 0.020 . 1 . . . . 71 PRO HD2 . 7208 1 96 . 1 1 11 11 PRO HD3 H 1 3.851 0.020 . 1 . . . . 71 PRO HD3 . 7208 1 97 . 1 1 11 11 PRO CA C 13 66.738 0.400 . 1 . . . . 71 PRO CA . 7208 1 98 . 1 1 11 11 PRO CB C 13 31.573 0.400 . 1 . . . . 71 PRO CB . 7208 1 99 . 1 1 11 11 PRO CG C 13 28.467 0.400 . 1 . . . . 71 PRO CG . 7208 1 100 . 1 1 11 11 PRO CD C 13 50.527 0.400 . 1 . . . . 71 PRO CD . 7208 1 101 . 1 1 12 12 GLU HA H 1 3.912 0.020 . 1 . . . . 72 GLU HA . 7208 1 102 . 1 1 12 12 GLU HB2 H 1 2.334 0.020 . 2 . . . . 72 GLU HB2 . 7208 1 103 . 1 1 12 12 GLU HB3 H 1 2.395 0.020 . 2 . . . . 72 GLU HB3 . 7208 1 104 . 1 1 12 12 GLU HG2 H 1 1.989 0.020 . 1 . . . . 72 GLU HG2 . 7208 1 105 . 1 1 12 12 GLU HG3 H 1 1.989 0.020 . 1 . . . . 72 GLU HG3 . 7208 1 106 . 1 1 12 12 GLU CA C 13 60.190 0.400 . 1 . . . . 72 GLU CA . 7208 1 107 . 1 1 12 12 GLU CB C 13 37.319 0.400 . 1 . . . . 72 GLU CB . 7208 1 108 . 1 1 13 13 ILE H H 1 8.122 0.020 . 1 . . . . 73 ILE H . 7208 1 109 . 1 1 13 13 ILE HA H 1 3.560 0.020 . 1 . . . . 73 ILE HA . 7208 1 110 . 1 1 13 13 ILE HB H 1 1.943 0.020 . 1 . . . . 73 ILE HB . 7208 1 111 . 1 1 13 13 ILE HG12 H 1 1.663 0.020 . 2 . . . . 73 ILE HG12 . 7208 1 112 . 1 1 13 13 ILE HG13 H 1 1.063 0.020 . 2 . . . . 73 ILE HG13 . 7208 1 113 . 1 1 13 13 ILE HG21 H 1 0.887 0.020 . 1 . . . . 73 ILE HG2 . 7208 1 114 . 1 1 13 13 ILE HG22 H 1 0.887 0.020 . 1 . . . . 73 ILE HG2 . 7208 1 115 . 1 1 13 13 ILE HG23 H 1 0.887 0.020 . 1 . . . . 73 ILE HG2 . 7208 1 116 . 1 1 13 13 ILE HD11 H 1 0.762 0.020 . 1 . . . . 73 ILE HD1 . 7208 1 117 . 1 1 13 13 ILE HD12 H 1 0.762 0.020 . 1 . . . . 73 ILE HD1 . 7208 1 118 . 1 1 13 13 ILE HD13 H 1 0.762 0.020 . 1 . . . . 73 ILE HD1 . 7208 1 119 . 1 1 13 13 ILE CA C 13 64.686 0.400 . 1 . . . . 73 ILE CA . 7208 1 120 . 1 1 13 13 ILE CB C 13 37.997 0.400 . 1 . . . . 73 ILE CB . 7208 1 121 . 1 1 13 13 ILE CG1 C 13 29.339 0.400 . 1 . . . . 73 ILE CG1 . 7208 1 122 . 1 1 13 13 ILE CG2 C 13 17.891 0.400 . 1 . . . . 73 ILE CG2 . 7208 1 123 . 1 1 13 13 ILE CD1 C 13 13.814 0.400 . 1 . . . . 73 ILE CD1 . 7208 1 124 . 1 1 13 13 ILE N N 15 113.893 0.400 . 1 . . . . 73 ILE N . 7208 1 125 . 1 1 14 14 THR H H 1 8.022 0.020 . 1 . . . . 74 THR H . 7208 1 126 . 1 1 14 14 THR HA H 1 3.623 0.020 . 1 . . . . 74 THR HA . 7208 1 127 . 1 1 14 14 THR HB H 1 4.237 0.020 . 1 . . . . 74 THR HB . 7208 1 128 . 1 1 14 14 THR HG1 H 1 4.591 0.020 . 1 . . . . 74 THR HG1 . 7208 1 129 . 1 1 14 14 THR HG21 H 1 1.098 0.020 . 1 . . . . 74 THR HG2 . 7208 1 130 . 1 1 14 14 THR HG22 H 1 1.098 0.020 . 1 . . . . 74 THR HG2 . 7208 1 131 . 1 1 14 14 THR HG23 H 1 1.098 0.020 . 1 . . . . 74 THR HG2 . 7208 1 132 . 1 1 14 14 THR CA C 13 68.129 0.400 . 1 . . . . 74 THR CA . 7208 1 133 . 1 1 14 14 THR CB C 13 68.447 0.400 . 1 . . . . 74 THR CB . 7208 1 134 . 1 1 14 14 THR CG2 C 13 21.916 0.400 . 1 . . . . 74 THR CG2 . 7208 1 135 . 1 1 14 14 THR N N 15 111.801 0.400 . 1 . . . . 74 THR N . 7208 1 136 . 1 1 15 15 LEU H H 1 7.402 0.020 . 1 . . . . 75 LEU H . 7208 1 137 . 1 1 15 15 LEU HA H 1 3.970 0.020 . 1 . . . . 75 LEU HA . 7208 1 138 . 1 1 15 15 LEU HB2 H 1 2.097 0.020 . 1 . . . . 75 LEU HB2 . 7208 1 139 . 1 1 15 15 LEU HB3 H 1 1.930 0.020 . 1 . . . . 75 LEU HB3 . 7208 1 140 . 1 1 15 15 LEU HG H 1 1.404 0.020 . 1 . . . . 75 LEU HG . 7208 1 141 . 1 1 15 15 LEU HD11 H 1 1.053 0.020 . 1 . . . . 75 LEU HD1 . 7208 1 142 . 1 1 15 15 LEU HD12 H 1 1.053 0.020 . 1 . . . . 75 LEU HD1 . 7208 1 143 . 1 1 15 15 LEU HD13 H 1 1.053 0.020 . 1 . . . . 75 LEU HD1 . 7208 1 144 . 1 1 15 15 LEU HD21 H 1 0.817 0.020 . 1 . . . . 75 LEU HD2 . 7208 1 145 . 1 1 15 15 LEU HD22 H 1 0.817 0.020 . 1 . . . . 75 LEU HD2 . 7208 1 146 . 1 1 15 15 LEU HD23 H 1 0.817 0.020 . 1 . . . . 75 LEU HD2 . 7208 1 147 . 1 1 15 15 LEU CA C 13 59.008 0.400 . 1 . . . . 75 LEU CA . 7208 1 148 . 1 1 15 15 LEU CB C 13 42.197 0.400 . 1 . . . . 75 LEU CB . 7208 1 149 . 1 1 15 15 LEU CG C 13 41.997 0.400 . 1 . . . . 75 LEU CG . 7208 1 150 . 1 1 15 15 LEU CD1 C 13 26.493 0.400 . 1 . . . . 75 LEU CD1 . 7208 1 151 . 1 1 15 15 LEU CD2 C 13 23.457 0.400 . 1 . . . . 75 LEU CD2 . 7208 1 152 . 1 1 15 15 LEU N N 15 115.824 0.400 . 1 . . . . 75 LEU N . 7208 1 153 . 1 1 16 16 ILE H H 1 7.612 0.020 . 1 . . . . 76 ILE H . 7208 1 154 . 1 1 16 16 ILE HA H 1 3.693 0.020 . 1 . . . . 76 ILE HA . 7208 1 155 . 1 1 16 16 ILE HB H 1 1.940 0.020 . 1 . . . . 76 ILE HB . 7208 1 156 . 1 1 16 16 ILE HG12 H 1 1.039 0.020 . 1 . . . . 76 ILE HG12 . 7208 1 157 . 1 1 16 16 ILE HG13 H 1 1.039 0.020 . 1 . . . . 76 ILE HG13 . 7208 1 158 . 1 1 16 16 ILE HG21 H 1 0.797 0.020 . 1 . . . . 76 ILE HG2 . 7208 1 159 . 1 1 16 16 ILE HG22 H 1 0.797 0.020 . 1 . . . . 76 ILE HG2 . 7208 1 160 . 1 1 16 16 ILE HG23 H 1 0.797 0.020 . 1 . . . . 76 ILE HG2 . 7208 1 161 . 1 1 16 16 ILE HD11 H 1 0.563 0.020 . 1 . . . . 76 ILE HD1 . 7208 1 162 . 1 1 16 16 ILE HD12 H 1 0.563 0.020 . 1 . . . . 76 ILE HD1 . 7208 1 163 . 1 1 16 16 ILE HD13 H 1 0.563 0.020 . 1 . . . . 76 ILE HD1 . 7208 1 164 . 1 1 16 16 ILE CA C 13 66.122 0.400 . 1 . . . . 76 ILE CA . 7208 1 165 . 1 1 16 16 ILE CB C 13 38.432 0.400 . 1 . . . . 76 ILE CB . 7208 1 166 . 1 1 16 16 ILE CG1 C 13 29.442 0.400 . 1 . . . . 76 ILE CG1 . 7208 1 167 . 1 1 16 16 ILE CG2 C 13 17.221 0.400 . 1 . . . . 76 ILE CG2 . 7208 1 168 . 1 1 16 16 ILE CD1 C 13 13.521 0.400 . 1 . . . . 76 ILE CD1 . 7208 1 169 . 1 1 16 16 ILE N N 15 113.769 0.400 . 1 . . . . 76 ILE N . 7208 1 170 . 1 1 17 17 ILE H H 1 8.387 0.020 . 1 . . . . 77 ILE H . 7208 1 171 . 1 1 17 17 ILE HA H 1 3.516 0.020 . 1 . . . . 77 ILE HA . 7208 1 172 . 1 1 17 17 ILE HB H 1 1.962 0.020 . 1 . . . . 77 ILE HB . 7208 1 173 . 1 1 17 17 ILE HG12 H 1 1.735 0.020 . 1 . . . . 77 ILE HG12 . 7208 1 174 . 1 1 17 17 ILE HG13 H 1 1.080 0.020 . 1 . . . . 77 ILE HG13 . 7208 1 175 . 1 1 17 17 ILE HG21 H 1 0.866 0.020 . 1 . . . . 77 ILE HG2 . 7208 1 176 . 1 1 17 17 ILE HG22 H 1 0.866 0.020 . 1 . . . . 77 ILE HG2 . 7208 1 177 . 1 1 17 17 ILE HG23 H 1 0.866 0.020 . 1 . . . . 77 ILE HG2 . 7208 1 178 . 1 1 17 17 ILE HD11 H 1 0.778 0.020 . 1 . . . . 77 ILE HD1 . 7208 1 179 . 1 1 17 17 ILE HD12 H 1 0.778 0.020 . 1 . . . . 77 ILE HD1 . 7208 1 180 . 1 1 17 17 ILE HD13 H 1 0.778 0.020 . 1 . . . . 77 ILE HD1 . 7208 1 181 . 1 1 17 17 ILE CA C 13 65.867 0.400 . 1 . . . . 77 ILE CA . 7208 1 182 . 1 1 17 17 ILE CB C 13 36.996 0.400 . 1 . . . . 77 ILE CB . 7208 1 183 . 1 1 17 17 ILE CG1 C 13 29.441 0.400 . 1 . . . . 77 ILE CG1 . 7208 1 184 . 1 1 17 17 ILE CG2 C 13 17.395 0.400 . 1 . . . . 77 ILE CG2 . 7208 1 185 . 1 1 17 17 ILE CD1 C 13 12.729 0.400 . 1 . . . . 77 ILE CD1 . 7208 1 186 . 1 1 17 17 ILE N N 15 115.027 0.400 . 1 . . . . 77 ILE N . 7208 1 187 . 1 1 18 18 PHE H H 1 8.447 0.020 . 1 . . . . 78 PHE H . 7208 1 188 . 1 1 18 18 PHE HA H 1 4.235 0.020 . 1 . . . . 78 PHE HA . 7208 1 189 . 1 1 18 18 PHE HB2 H 1 3.168 0.020 . 1 . . . . 78 PHE HB2 . 7208 1 190 . 1 1 18 18 PHE HB3 H 1 3.168 0.020 . 1 . . . . 78 PHE HB3 . 7208 1 191 . 1 1 18 18 PHE HD1 H 1 7.148 0.020 . 1 . . . . 78 PHE HD1 . 7208 1 192 . 1 1 18 18 PHE HD2 H 1 7.148 0.020 . 1 . . . . 78 PHE HD2 . 7208 1 193 . 1 1 18 18 PHE HE1 H 1 7.093 0.020 . 1 . . . . 78 PHE HE1 . 7208 1 194 . 1 1 18 18 PHE HE2 H 1 7.093 0.020 . 1 . . . . 78 PHE HE2 . 7208 1 195 . 1 1 18 18 PHE HZ H 1 7.248 0.020 . 1 . . . . 78 PHE HZ . 7208 1 196 . 1 1 18 18 PHE CA C 13 61.656 0.400 . 1 . . . . 78 PHE CA . 7208 1 197 . 1 1 18 18 PHE CB C 13 38.807 0.400 . 1 . . . . 78 PHE CB . 7208 1 198 . 1 1 18 18 PHE N N 15 116.135 0.400 . 1 . . . . 78 PHE N . 7208 1 199 . 1 1 19 19 GLY H H 1 8.237 0.020 . 1 . . . . 79 GLY H . 7208 1 200 . 1 1 19 19 GLY HA2 H 1 3.543 0.020 . 2 . . . . 79 GLY HA2 . 7208 1 201 . 1 1 19 19 GLY HA3 H 1 4.168 0.020 . 2 . . . . 79 GLY HA3 . 7208 1 202 . 1 1 19 19 GLY CA C 13 48.210 0.400 . 1 . . . . 79 GLY CA . 7208 1 203 . 1 1 19 19 GLY N N 15 101.917 0.400 . 1 . . . . 79 GLY N . 7208 1 204 . 1 1 20 20 VAL H H 1 8.764 0.020 . 1 . . . . 80 VAL H . 7208 1 205 . 1 1 20 20 VAL HA H 1 3.547 0.020 . 1 . . . . 80 VAL HA . 7208 1 206 . 1 1 20 20 VAL HB H 1 2.215 0.020 . 1 . . . . 80 VAL HB . 7208 1 207 . 1 1 20 20 VAL HG11 H 1 0.735 0.020 . 1 . . . . 80 VAL HG1 . 7208 1 208 . 1 1 20 20 VAL HG12 H 1 0.735 0.020 . 1 . . . . 80 VAL HG1 . 7208 1 209 . 1 1 20 20 VAL HG13 H 1 0.735 0.020 . 1 . . . . 80 VAL HG1 . 7208 1 210 . 1 1 20 20 VAL HG21 H 1 1.005 0.020 . 1 . . . . 80 VAL HG2 . 7208 1 211 . 1 1 20 20 VAL HG22 H 1 1.005 0.020 . 1 . . . . 80 VAL HG2 . 7208 1 212 . 1 1 20 20 VAL HG23 H 1 1.005 0.020 . 1 . . . . 80 VAL HG2 . 7208 1 213 . 1 1 20 20 VAL CA C 13 66.760 0.400 . 1 . . . . 80 VAL CA . 7208 1 214 . 1 1 20 20 VAL CB C 13 31.523 0.400 . 1 . . . . 80 VAL CB . 7208 1 215 . 1 1 20 20 VAL CG1 C 13 23.173 0.400 . 1 . . . . 80 VAL CG1 . 7208 1 216 . 1 1 20 20 VAL CG2 C 13 21.825 0.400 . 1 . . . . 80 VAL CG2 . 7208 1 217 . 1 1 20 20 VAL N N 15 118.963 0.400 . 1 . . . . 80 VAL N . 7208 1 218 . 1 1 21 21 MET H H 1 8.265 0.020 . 1 . . . . 81 MET H . 7208 1 219 . 1 1 21 21 MET HA H 1 3.882 0.020 . 1 . . . . 81 MET HA . 7208 1 220 . 1 1 21 21 MET HB2 H 1 2.212 0.020 . 2 . . . . 81 MET HB2 . 7208 1 221 . 1 1 21 21 MET HB3 H 1 1.890 0.020 . 2 . . . . 81 MET HB3 . 7208 1 222 . 1 1 21 21 MET HG2 H 1 2.419 0.020 . 2 . . . . 81 MET HG2 . 7208 1 223 . 1 1 21 21 MET HG3 H 1 2.621 0.020 . 2 . . . . 81 MET HG3 . 7208 1 224 . 1 1 21 21 MET CA C 13 59.151 0.400 . 1 . . . . 81 MET CA . 7208 1 225 . 1 1 21 21 MET CB C 13 32.469 0.400 . 1 . . . . 81 MET CB . 7208 1 226 . 1 1 21 21 MET CG C 13 32.851 0.400 . 1 . . . . 81 MET CG . 7208 1 227 . 1 1 21 21 MET N N 15 112.810 0.400 . 1 . . . . 81 MET N . 7208 1 228 . 1 1 22 22 ALA H H 1 8.216 0.020 . 1 . . . . 82 ALA H . 7208 1 229 . 1 1 22 22 ALA HA H 1 3.840 0.020 . 1 . . . . 82 ALA HA . 7208 1 230 . 1 1 22 22 ALA HB1 H 1 1.219 0.020 . 1 . . . . 82 ALA HB . 7208 1 231 . 1 1 22 22 ALA HB2 H 1 1.219 0.020 . 1 . . . . 82 ALA HB . 7208 1 232 . 1 1 22 22 ALA HB3 H 1 1.219 0.020 . 1 . . . . 82 ALA HB . 7208 1 233 . 1 1 22 22 ALA CA C 13 55.722 0.400 . 1 . . . . 82 ALA CA . 7208 1 234 . 1 1 22 22 ALA CB C 13 17.578 0.400 . 1 . . . . 82 ALA CB . 7208 1 235 . 1 1 22 22 ALA N N 15 116.833 0.400 . 1 . . . . 82 ALA N . 7208 1 236 . 1 1 23 23 GLY H H 1 8.862 0.020 . 1 . . . . 83 GLY H . 7208 1 237 . 1 1 23 23 GLY HA2 H 1 4.013 0.020 . 2 . . . . 83 GLY HA2 . 7208 1 238 . 1 1 23 23 GLY HA3 H 1 3.688 0.020 . 2 . . . . 83 GLY HA3 . 7208 1 239 . 1 1 23 23 GLY CA C 13 48.065 0.400 . 1 . . . . 83 GLY CA . 7208 1 240 . 1 1 23 23 GLY N N 15 101.653 0.400 . 1 . . . . 83 GLY N . 7208 1 241 . 1 1 24 24 VAL H H 1 8.622 0.020 . 1 . . . . 84 VAL H . 7208 1 242 . 1 1 24 24 VAL HA H 1 3.869 0.020 . 1 . . . . 84 VAL HA . 7208 1 243 . 1 1 24 24 VAL HB H 1 2.088 0.020 . 1 . . . . 84 VAL HB . 7208 1 244 . 1 1 24 24 VAL HG11 H 1 0.797 0.020 . 1 . . . . 84 VAL HG1 . 7208 1 245 . 1 1 24 24 VAL HG12 H 1 0.797 0.020 . 1 . . . . 84 VAL HG1 . 7208 1 246 . 1 1 24 24 VAL HG13 H 1 0.797 0.020 . 1 . . . . 84 VAL HG1 . 7208 1 247 . 1 1 24 24 VAL HG21 H 1 0.962 0.020 . 1 . . . . 84 VAL HG2 . 7208 1 248 . 1 1 24 24 VAL HG22 H 1 0.962 0.020 . 1 . . . . 84 VAL HG2 . 7208 1 249 . 1 1 24 24 VAL HG23 H 1 0.962 0.020 . 1 . . . . 84 VAL HG2 . 7208 1 250 . 1 1 24 24 VAL CA C 13 66.345 0.400 . 1 . . . . 84 VAL CA . 7208 1 251 . 1 1 24 24 VAL CB C 13 31.652 0.400 . 1 . . . . 84 VAL CB . 7208 1 252 . 1 1 24 24 VAL CG1 C 13 20.663 0.400 . 1 . . . . 84 VAL CG1 . 7208 1 253 . 1 1 24 24 VAL CG2 C 13 21.247 0.400 . 1 . . . . 84 VAL CG2 . 7208 1 254 . 1 1 24 24 VAL N N 15 121.349 0.400 . 1 . . . . 84 VAL N . 7208 1 255 . 1 1 25 25 ILE H H 1 8.250 0.020 . 1 . . . . 85 ILE H . 7208 1 256 . 1 1 25 25 ILE HA H 1 3.464 0.020 . 1 . . . . 85 ILE HA . 7208 1 257 . 1 1 25 25 ILE HB H 1 1.785 0.020 . 1 . . . . 85 ILE HB . 7208 1 258 . 1 1 25 25 ILE HG12 H 1 1.008 0.020 . 1 . . . . 85 ILE HG12 . 7208 1 259 . 1 1 25 25 ILE HG13 H 1 1.008 0.020 . 1 . . . . 85 ILE HG13 . 7208 1 260 . 1 1 25 25 ILE HG21 H 1 0.791 0.020 . 1 . . . . 85 ILE HG2 . 7208 1 261 . 1 1 25 25 ILE HG22 H 1 0.791 0.020 . 1 . . . . 85 ILE HG2 . 7208 1 262 . 1 1 25 25 ILE HG23 H 1 0.791 0.020 . 1 . . . . 85 ILE HG2 . 7208 1 263 . 1 1 25 25 ILE HD11 H 1 0.633 0.020 . 1 . . . . 85 ILE HD1 . 7208 1 264 . 1 1 25 25 ILE HD12 H 1 0.633 0.020 . 1 . . . . 85 ILE HD1 . 7208 1 265 . 1 1 25 25 ILE HD13 H 1 0.633 0.020 . 1 . . . . 85 ILE HD1 . 7208 1 266 . 1 1 25 25 ILE CA C 13 65.624 0.400 . 1 . . . . 85 ILE CA . 7208 1 267 . 1 1 25 25 ILE CB C 13 37.822 0.400 . 1 . . . . 85 ILE CB . 7208 1 268 . 1 1 25 25 ILE CG1 C 13 29.319 0.400 . 1 . . . . 85 ILE CG1 . 7208 1 269 . 1 1 25 25 ILE CG2 C 13 17.136 0.400 . 1 . . . . 85 ILE CG2 . 7208 1 270 . 1 1 25 25 ILE CD1 C 13 13.117 0.400 . 1 . . . . 85 ILE CD1 . 7208 1 271 . 1 1 25 25 ILE N N 15 113.731 0.400 . 1 . . . . 85 ILE N . 7208 1 272 . 1 1 26 26 GLY H H 1 8.959 0.020 . 1 . . . . 86 GLY H . 7208 1 273 . 1 1 26 26 GLY HA2 H 1 3.593 0.020 . 1 . . . . 86 GLY HA2 . 7208 1 274 . 1 1 26 26 GLY HA3 H 1 3.593 0.020 . 1 . . . . 86 GLY HA3 . 7208 1 275 . 1 1 26 26 GLY CA C 13 47.747 0.400 . 1 . . . . 86 GLY CA . 7208 1 276 . 1 1 26 26 GLY N N 15 102.113 0.400 . 1 . . . . 86 GLY N . 7208 1 277 . 1 1 27 27 THR H H 1 7.903 0.020 . 1 . . . . 87 THR H . 7208 1 278 . 1 1 27 27 THR HA H 1 3.737 0.020 . 1 . . . . 87 THR HA . 7208 1 279 . 1 1 27 27 THR HB H 1 4.322 0.020 . 1 . . . . 87 THR HB . 7208 1 280 . 1 1 27 27 THR HG1 H 1 4.914 0.020 . 1 . . . . 87 THR HG1 . 7208 1 281 . 1 1 27 27 THR HG21 H 1 1.113 0.020 . 1 . . . . 87 THR HG2 . 7208 1 282 . 1 1 27 27 THR HG22 H 1 1.113 0.020 . 1 . . . . 87 THR HG2 . 7208 1 283 . 1 1 27 27 THR HG23 H 1 1.113 0.020 . 1 . . . . 87 THR HG2 . 7208 1 284 . 1 1 27 27 THR CA C 13 69.225 0.400 . 1 . . . . 87 THR CA . 7208 1 285 . 1 1 27 27 THR CB C 13 67.955 0.400 . 1 . . . . 87 THR CB . 7208 1 286 . 1 1 27 27 THR CG2 C 13 21.610 0.400 . 1 . . . . 87 THR CG2 . 7208 1 287 . 1 1 27 27 THR N N 15 114.653 0.400 . 1 . . . . 87 THR N . 7208 1 288 . 1 1 28 28 ILE H H 1 8.136 0.020 . 1 . . . . 88 ILE H . 7208 1 289 . 1 1 28 28 ILE HA H 1 3.570 0.020 . 1 . . . . 88 ILE HA . 7208 1 290 . 1 1 28 28 ILE HB H 1 2.014 0.020 . 1 . . . . 88 ILE HB . 7208 1 291 . 1 1 28 28 ILE HG12 H 1 1.828 0.020 . 2 . . . . 88 ILE HG12 . 7208 1 292 . 1 1 28 28 ILE HG13 H 1 1.109 0.020 . 2 . . . . 88 ILE HG13 . 7208 1 293 . 1 1 28 28 ILE HG21 H 1 0.856 0.020 . 1 . . . . 88 ILE HG2 . 7208 1 294 . 1 1 28 28 ILE HG22 H 1 0.856 0.020 . 1 . . . . 88 ILE HG2 . 7208 1 295 . 1 1 28 28 ILE HG23 H 1 0.856 0.020 . 1 . . . . 88 ILE HG2 . 7208 1 296 . 1 1 28 28 ILE HD11 H 1 0.769 0.020 . 1 . . . . 88 ILE HD1 . 7208 1 297 . 1 1 28 28 ILE HD12 H 1 0.769 0.020 . 1 . . . . 88 ILE HD1 . 7208 1 298 . 1 1 28 28 ILE HD13 H 1 0.769 0.020 . 1 . . . . 88 ILE HD1 . 7208 1 299 . 1 1 28 28 ILE CA C 13 65.931 0.400 . 1 . . . . 88 ILE CA . 7208 1 300 . 1 1 28 28 ILE CB C 13 37.330 0.400 . 1 . . . . 88 ILE CB . 7208 1 301 . 1 1 28 28 ILE CG1 C 13 29.115 0.400 . 1 . . . . 88 ILE CG1 . 7208 1 302 . 1 1 28 28 ILE CG2 C 13 17.129 0.400 . 1 . . . . 88 ILE CG2 . 7208 1 303 . 1 1 28 28 ILE CD1 C 13 12.858 0.400 . 1 . . . . 88 ILE CD1 . 7208 1 304 . 1 1 28 28 ILE N N 15 117.164 0.400 . 1 . . . . 88 ILE N . 7208 1 305 . 1 1 29 29 LEU H H 1 8.606 0.020 . 1 . . . . 89 LEU H . 7208 1 306 . 1 1 29 29 LEU HA H 1 3.973 0.020 . 1 . . . . 89 LEU HA . 7208 1 307 . 1 1 29 29 LEU HB2 H 1 2.013 0.020 . 1 . . . . 89 LEU HB2 . 7208 1 308 . 1 1 29 29 LEU HB3 H 1 1.455 0.020 . 1 . . . . 89 LEU HB3 . 7208 1 309 . 1 1 29 29 LEU HG H 1 1.861 0.020 . 1 . . . . 89 LEU HG . 7208 1 310 . 1 1 29 29 LEU HD11 H 1 0.861 0.020 . 2 . . . . 89 LEU HD1 . 7208 1 311 . 1 1 29 29 LEU HD12 H 1 0.861 0.020 . 2 . . . . 89 LEU HD1 . 7208 1 312 . 1 1 29 29 LEU HD13 H 1 0.861 0.020 . 2 . . . . 89 LEU HD1 . 7208 1 313 . 1 1 29 29 LEU CA C 13 58.785 0.400 . 1 . . . . 89 LEU CA . 7208 1 314 . 1 1 29 29 LEU CB C 13 41.917 0.400 . 1 . . . . 89 LEU CB . 7208 1 315 . 1 1 29 29 LEU CG C 13 26.751 0.400 . 1 . . . . 89 LEU CG . 7208 1 316 . 1 1 29 29 LEU CD1 C 13 23.319 0.400 . 1 . . . . 89 LEU CD1 . 7208 1 317 . 1 1 29 29 LEU N N 15 117.380 0.400 . 1 . . . . 89 LEU N . 7208 1 318 . 1 1 30 30 LEU H H 1 8.438 0.020 . 1 . . . . 90 LEU H . 7208 1 319 . 1 1 30 30 LEU HA H 1 4.052 0.020 . 1 . . . . 90 LEU HA . 7208 1 320 . 1 1 30 30 LEU HB2 H 1 1.737 0.020 . 1 . . . . 90 LEU HB2 . 7208 1 321 . 1 1 30 30 LEU HB3 H 1 1.911 0.020 . 1 . . . . 90 LEU HB3 . 7208 1 322 . 1 1 30 30 LEU HG H 1 1.829 0.020 . 1 . . . . 90 LEU HG . 7208 1 323 . 1 1 30 30 LEU HD11 H 1 0.849 0.020 . 2 . . . . 90 LEU HD1 . 7208 1 324 . 1 1 30 30 LEU HD12 H 1 0.849 0.020 . 2 . . . . 90 LEU HD1 . 7208 1 325 . 1 1 30 30 LEU HD13 H 1 0.849 0.020 . 2 . . . . 90 LEU HD1 . 7208 1 326 . 1 1 30 30 LEU HD21 H 1 0.849 0.020 . 2 . . . . 90 LEU HD2 . 7208 1 327 . 1 1 30 30 LEU HD22 H 1 0.849 0.020 . 2 . . . . 90 LEU HD2 . 7208 1 328 . 1 1 30 30 LEU HD23 H 1 0.849 0.020 . 2 . . . . 90 LEU HD2 . 7208 1 329 . 1 1 30 30 LEU CA C 13 59.072 0.400 . 1 . . . . 90 LEU CA . 7208 1 330 . 1 1 30 30 LEU CB C 13 42.201 0.400 . 1 . . . . 90 LEU CB . 7208 1 331 . 1 1 30 30 LEU CG C 13 27.262 0.400 . 1 . . . . 90 LEU CG . 7208 1 332 . 1 1 30 30 LEU CD1 C 13 23.352 0.400 . 1 . . . . 90 LEU CD1 . 7208 1 333 . 1 1 30 30 LEU N N 15 116.958 0.400 . 1 . . . . 90 LEU N . 7208 1 334 . 1 1 31 31 ILE H H 1 8.514 0.020 . 1 . . . . 91 ILE H . 7208 1 335 . 1 1 31 31 ILE HA H 1 3.637 0.020 . 1 . . . . 91 ILE HA . 7208 1 336 . 1 1 31 31 ILE HB H 1 1.928 0.020 . 1 . . . . 91 ILE HB . 7208 1 337 . 1 1 31 31 ILE HG12 H 1 1.957 0.020 . 2 . . . . 91 ILE HG12 . 7208 1 338 . 1 1 31 31 ILE HG13 H 1 0.990 0.020 . 2 . . . . 91 ILE HG13 . 7208 1 339 . 1 1 31 31 ILE HG21 H 1 0.841 0.020 . 1 . . . . 91 ILE HG2 . 7208 1 340 . 1 1 31 31 ILE HG22 H 1 0.841 0.020 . 1 . . . . 91 ILE HG2 . 7208 1 341 . 1 1 31 31 ILE HG23 H 1 0.841 0.020 . 1 . . . . 91 ILE HG2 . 7208 1 342 . 1 1 31 31 ILE HD11 H 1 0.725 0.020 . 1 . . . . 91 ILE HD1 . 7208 1 343 . 1 1 31 31 ILE HD12 H 1 0.725 0.020 . 1 . . . . 91 ILE HD1 . 7208 1 344 . 1 1 31 31 ILE HD13 H 1 0.725 0.020 . 1 . . . . 91 ILE HD1 . 7208 1 345 . 1 1 31 31 ILE CA C 13 66.218 0.400 . 1 . . . . 91 ILE CA . 7208 1 346 . 1 1 31 31 ILE CB C 13 38.018 0.400 . 1 . . . . 91 ILE CB . 7208 1 347 . 1 1 31 31 ILE CG1 C 13 29.319 0.400 . 1 . . . . 91 ILE CG1 . 7208 1 348 . 1 1 31 31 ILE CG2 C 13 17.524 0.400 . 1 . . . . 91 ILE CG2 . 7208 1 349 . 1 1 31 31 ILE CD1 C 13 12.845 0.400 . 1 . . . . 91 ILE CD1 . 7208 1 350 . 1 1 31 31 ILE N N 15 114.691 0.400 . 1 . . . . 91 ILE N . 7208 1 351 . 1 1 32 32 SER H H 1 8.368 0.020 . 1 . . . . 92 SER H . 7208 1 352 . 1 1 32 32 SER HA H 1 3.994 0.020 . 1 . . . . 92 SER HA . 7208 1 353 . 1 1 32 32 SER HB2 H 1 3.811 0.020 . 1 . . . . 92 SER HB2 . 7208 1 354 . 1 1 32 32 SER HB3 H 1 3.811 0.020 . 1 . . . . 92 SER HB3 . 7208 1 355 . 1 1 32 32 SER HG H 1 4.625 0.020 . 1 . . . . 92 SER HG . 7208 1 356 . 1 1 32 32 SER CA C 13 63.217 0.400 . 1 . . . . 92 SER CA . 7208 1 357 . 1 1 32 32 SER CB C 13 63.328 0.400 . 1 . . . . 92 SER CB . 7208 1 358 . 1 1 32 32 SER N N 15 111.489 0.400 . 1 . . . . 92 SER N . 7208 1 359 . 1 1 33 33 TYR H H 1 8.244 0.020 . 1 . . . . 93 TYR H . 7208 1 360 . 1 1 33 33 TYR HA H 1 4.164 0.020 . 1 . . . . 93 TYR HA . 7208 1 361 . 1 1 33 33 TYR HB2 H 1 3.184 0.020 . 2 . . . . 93 TYR HB2 . 7208 1 362 . 1 1 33 33 TYR HB3 H 1 3.074 0.020 . 2 . . . . 93 TYR HB3 . 7208 1 363 . 1 1 33 33 TYR HD1 H 1 7.046 0.020 . 1 . . . . 93 TYR HD1 . 7208 1 364 . 1 1 33 33 TYR HD2 H 1 7.046 0.020 . 1 . . . . 93 TYR HD2 . 7208 1 365 . 1 1 33 33 TYR HE1 H 1 6.751 0.020 . 1 . . . . 93 TYR HE1 . 7208 1 366 . 1 1 33 33 TYR HE2 H 1 6.751 0.020 . 1 . . . . 93 TYR HE2 . 7208 1 367 . 1 1 33 33 TYR CA C 13 61.624 0.400 . 1 . . . . 93 TYR CA . 7208 1 368 . 1 1 33 33 TYR CB C 13 39.055 0.400 . 1 . . . . 93 TYR CB . 7208 1 369 . 1 1 33 33 TYR CD1 C 13 118.058 0.400 . 1 . . . . 93 TYR CD1 . 7208 1 370 . 1 1 33 33 TYR N N 15 117.630 0.400 . 1 . . . . 93 TYR N . 7208 1 371 . 1 1 34 34 GLY H H 1 8.604 0.020 . 1 . . . . 94 GLY H . 7208 1 372 . 1 1 34 34 GLY HA2 H 1 3.620 0.020 . 2 . . . . 94 GLY HA2 . 7208 1 373 . 1 1 34 34 GLY HA3 H 1 3.670 0.020 . 2 . . . . 94 GLY HA3 . 7208 1 374 . 1 1 34 34 GLY CA C 13 47.811 0.400 . 1 . . . . 94 GLY CA . 7208 1 375 . 1 1 34 34 GLY N N 15 102.867 0.400 . 1 . . . . 94 GLY N . 7208 1 376 . 1 1 35 35 ILE H H 1 8.459 0.020 . 1 . . . . 95 ILE H . 7208 1 377 . 1 1 35 35 ILE HA H 1 3.889 0.020 . 1 . . . . 95 ILE HA . 7208 1 378 . 1 1 35 35 ILE HB H 1 1.974 0.020 . 1 . . . . 95 ILE HB . 7208 1 379 . 1 1 35 35 ILE HG12 H 1 1.669 0.020 . 1 . . . . 95 ILE HG12 . 7208 1 380 . 1 1 35 35 ILE HG13 H 1 1.291 0.020 . 1 . . . . 95 ILE HG13 . 7208 1 381 . 1 1 35 35 ILE HG21 H 1 0.930 0.020 . 1 . . . . 95 ILE HG2 . 7208 1 382 . 1 1 35 35 ILE HG22 H 1 0.930 0.020 . 1 . . . . 95 ILE HG2 . 7208 1 383 . 1 1 35 35 ILE HG23 H 1 0.930 0.020 . 1 . . . . 95 ILE HG2 . 7208 1 384 . 1 1 35 35 ILE HD11 H 1 0.875 0.020 . 1 . . . . 95 ILE HD1 . 7208 1 385 . 1 1 35 35 ILE HD12 H 1 0.875 0.020 . 1 . . . . 95 ILE HD1 . 7208 1 386 . 1 1 35 35 ILE HD13 H 1 0.875 0.020 . 1 . . . . 95 ILE HD1 . 7208 1 387 . 1 1 35 35 ILE CA C 13 64.272 0.400 . 1 . . . . 95 ILE CA . 7208 1 388 . 1 1 35 35 ILE CB C 13 38.153 0.400 . 1 . . . . 95 ILE CB . 7208 1 389 . 1 1 35 35 ILE CG1 C 13 28.823 0.400 . 1 . . . . 95 ILE CG1 . 7208 1 390 . 1 1 35 35 ILE CD1 C 13 13.669 0.400 . 1 . . . . 95 ILE CD1 . 7208 1 391 . 1 1 35 35 ILE N N 15 114.533 0.400 . 1 . . . . 95 ILE N . 7208 1 392 . 1 1 36 36 ARG H H 1 7.487 0.020 . 1 . . . . 96 ARG H . 7208 1 393 . 1 1 36 36 ARG HA H 1 4.162 0.020 . 1 . . . . 96 ARG HA . 7208 1 394 . 1 1 36 36 ARG HB2 H 1 1.831 0.020 . 1 . . . . 96 ARG HB2 . 7208 1 395 . 1 1 36 36 ARG HB3 H 1 1.955 0.020 . 1 . . . . 96 ARG HB3 . 7208 1 396 . 1 1 36 36 ARG HG2 H 1 1.693 0.020 . 1 . . . . 96 ARG HG2 . 7208 1 397 . 1 1 36 36 ARG HG3 H 1 1.693 0.020 . 1 . . . . 96 ARG HG3 . 7208 1 398 . 1 1 36 36 ARG HD2 H 1 3.195 0.020 . 1 . . . . 96 ARG HD2 . 7208 1 399 . 1 1 36 36 ARG HD3 H 1 3.195 0.020 . 1 . . . . 96 ARG HD3 . 7208 1 400 . 1 1 36 36 ARG HE H 1 7.421 0.020 . 1 . . . . 96 ARG HE . 7208 1 401 . 1 1 36 36 ARG CA C 13 57.796 0.400 . 1 . . . . 96 ARG CA . 7208 1 402 . 1 1 36 36 ARG CB C 13 30.392 0.400 . 1 . . . . 96 ARG CB . 7208 1 403 . 1 1 36 36 ARG CG C 13 26.424 0.400 . 1 . . . . 96 ARG CG . 7208 1 404 . 1 1 36 36 ARG CD C 13 43.631 0.400 . 1 . . . . 96 ARG CD . 7208 1 405 . 1 1 36 36 ARG N N 15 113.881 0.400 . 1 . . . . 96 ARG N . 7208 1 406 . 1 1 37 37 ARG H H 1 7.672 0.020 . 1 . . . . 97 ARG H . 7208 1 407 . 1 1 37 37 ARG HA H 1 4.283 0.020 . 1 . . . . 97 ARG HA . 7208 1 408 . 1 1 37 37 ARG HB2 H 1 1.662 0.020 . 1 . . . . 97 ARG HB2 . 7208 1 409 . 1 1 37 37 ARG HB3 H 1 1.976 0.020 . 1 . . . . 97 ARG HB3 . 7208 1 410 . 1 1 37 37 ARG HG2 H 1 1.697 0.020 . 2 . . . . 97 ARG HG2 . 7208 1 411 . 1 1 37 37 ARG HG3 H 1 1.505 0.020 . 2 . . . . 97 ARG HG3 . 7208 1 412 . 1 1 37 37 ARG HD2 H 1 3.031 0.020 . 1 . . . . 97 ARG HD2 . 7208 1 413 . 1 1 37 37 ARG HD3 H 1 3.031 0.020 . 1 . . . . 97 ARG HD3 . 7208 1 414 . 1 1 37 37 ARG HE H 1 7.397 0.020 . 1 . . . . 97 ARG HE . 7208 1 415 . 1 1 37 37 ARG HH21 H 1 7.334 0.020 . 1 . . . . 97 ARG HH21 . 7208 1 416 . 1 1 37 37 ARG HH22 H 1 7.334 0.020 . 1 . . . . 97 ARG HH22 . 7208 1 417 . 1 1 37 37 ARG CA C 13 55.946 0.400 . 1 . . . . 97 ARG CA . 7208 1 418 . 1 1 37 37 ARG CB C 13 31.000 0.400 . 1 . . . . 97 ARG CB . 7208 1 419 . 1 1 37 37 ARG CG C 13 27.266 0.400 . 1 . . . . 97 ARG CG . 7208 1 420 . 1 1 37 37 ARG CD C 13 43.120 0.400 . 1 . . . . 97 ARG CD . 7208 1 421 . 1 1 37 37 ARG N N 15 114.304 0.400 . 1 . . . . 97 ARG N . 7208 1 422 . 1 1 38 38 LEU H H 1 7.244 0.020 . 1 . . . . 98 LEU H . 7208 1 423 . 1 1 38 38 LEU HA H 1 4.092 0.020 . 1 . . . . 98 LEU HA . 7208 1 424 . 1 1 38 38 LEU HB2 H 1 1.798 0.020 . 1 . . . . 98 LEU HB2 . 7208 1 425 . 1 1 38 38 LEU HB3 H 1 1.535 0.020 . 1 . . . . 98 LEU HB3 . 7208 1 426 . 1 1 38 38 LEU HG H 1 1.688 0.020 . 1 . . . . 98 LEU HG . 7208 1 427 . 1 1 38 38 LEU HD11 H 1 0.880 0.020 . 2 . . . . 98 LEU HD1 . 7208 1 428 . 1 1 38 38 LEU HD12 H 1 0.880 0.020 . 2 . . . . 98 LEU HD1 . 7208 1 429 . 1 1 38 38 LEU HD13 H 1 0.880 0.020 . 2 . . . . 98 LEU HD1 . 7208 1 430 . 1 1 38 38 LEU HD21 H 1 0.880 0.020 . 2 . . . . 98 LEU HD2 . 7208 1 431 . 1 1 38 38 LEU HD22 H 1 0.880 0.020 . 2 . . . . 98 LEU HD2 . 7208 1 432 . 1 1 38 38 LEU HD23 H 1 0.880 0.020 . 2 . . . . 98 LEU HD2 . 7208 1 433 . 1 1 38 38 LEU CA C 13 57.117 0.400 . 1 . . . . 98 LEU CA . 7208 1 434 . 1 1 38 38 LEU CB C 13 43.452 0.400 . 1 . . . . 98 LEU CB . 7208 1 435 . 1 1 38 38 LEU CG C 13 26.625 0.400 . 1 . . . . 98 LEU CG . 7208 1 436 . 1 1 38 38 LEU CD1 C 13 23.313 0.400 . 1 . . . . 98 LEU CD1 . 7208 1 437 . 1 1 38 38 LEU N N 15 121.612 0.400 . 1 . . . . 98 LEU N . 7208 1 stop_ save_ ################################### # 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_shifts_bic _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shifts_bic _Assigned_chem_shift_list.Entry_ID 7208 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $bicelles _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _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 . . 4 $bic_15N13C isotropic 7208 2 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 . . 7208 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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.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 ARG HA H 1 4.140 0.020 . 1 . . . . 61 ARG HA . 7208 2 2 . 1 1 1 1 ARG HB2 H 1 1.961 0.020 . 1 . . . . 61 ARG HB2 . 7208 2 3 . 1 1 1 1 ARG HB3 H 1 1.961 0.020 . 1 . . . . 61 ARG HB3 . 7208 2 4 . 1 1 1 1 ARG HG2 H 1 1.671 0.020 . 1 . . . . 61 ARG HG2 . 7208 2 5 . 1 1 1 1 ARG HG3 H 1 1.671 0.020 . 1 . . . . 61 ARG HG3 . 7208 2 6 . 1 1 1 1 ARG HD2 H 1 3.225 0.020 . 1 . . . . 61 ARG HD2 . 7208 2 7 . 1 1 1 1 ARG HD3 H 1 3.225 0.020 . 1 . . . . 61 ARG HD3 . 7208 2 8 . 1 1 1 1 ARG CA C 13 55.133 0.400 . 1 . . . . 61 ARG CA . 7208 2 9 . 1 1 1 1 ARG CB C 13 30.993 0.400 . 1 . . . . 61 ARG CB . 7208 2 10 . 1 1 1 1 ARG CG C 13 26.072 0.400 . 1 . . . . 61 ARG CG . 7208 2 11 . 1 1 1 1 ARG CD C 13 43.071 0.400 . 1 . . . . 61 ARG CD . 7208 2 12 . 1 1 2 2 VAL HA H 1 4.174 0.020 . 1 . . . . 62 VAL HA . 7208 2 13 . 1 1 2 2 VAL HB H 1 2.045 0.020 . 1 . . . . 62 VAL HB . 7208 2 14 . 1 1 2 2 VAL HG11 H 1 0.951 0.020 . 2 . . . . 62 VAL HG1 . 7208 2 15 . 1 1 2 2 VAL HG12 H 1 0.951 0.020 . 2 . . . . 62 VAL HG1 . 7208 2 16 . 1 1 2 2 VAL HG13 H 1 0.951 0.020 . 2 . . . . 62 VAL HG1 . 7208 2 17 . 1 1 2 2 VAL C C 13 174.070 0.400 . 1 . . . . 62 VAL C . 7208 2 18 . 1 1 2 2 VAL CA C 13 62.182 0.400 . 1 . . . . 62 VAL CA . 7208 2 19 . 1 1 2 2 VAL CB C 13 32.539 0.400 . 1 . . . . 62 VAL CB . 7208 2 20 . 1 1 2 2 VAL CG1 C 13 21.274 0.400 . 1 . . . . 62 VAL CG1 . 7208 2 21 . 1 1 3 3 GLN H H 1 8.466 0.020 . 1 . . . . 63 GLN H . 7208 2 22 . 1 1 3 3 GLN HA H 1 4.457 0.020 . 1 . . . . 63 GLN HA . 7208 2 23 . 1 1 3 3 GLN HB2 H 1 2.082 0.020 . 2 . . . . 63 GLN HB2 . 7208 2 24 . 1 1 3 3 GLN HB3 H 1 1.961 0.020 . 2 . . . . 63 GLN HB3 . 7208 2 25 . 1 1 3 3 GLN HG2 H 1 2.331 0.020 . 1 . . . . 63 GLN HG2 . 7208 2 26 . 1 1 3 3 GLN HG3 H 1 2.331 0.020 . 1 . . . . 63 GLN HG3 . 7208 2 27 . 1 1 3 3 GLN HE21 H 1 7.464 0.020 . 2 . . . . 63 GLN HE21 . 7208 2 28 . 1 1 3 3 GLN HE22 H 1 6.803 0.020 . 2 . . . . 63 GLN HE22 . 7208 2 29 . 1 1 3 3 GLN C C 13 174.243 0.400 . 1 . . . . 63 GLN C . 7208 2 30 . 1 1 3 3 GLN CA C 13 55.104 0.400 . 1 . . . . 63 GLN CA . 7208 2 31 . 1 1 3 3 GLN CB C 13 29.799 0.400 . 1 . . . . 63 GLN CB . 7208 2 32 . 1 1 3 3 GLN CG C 13 33.593 0.400 . 1 . . . . 63 GLN CG . 7208 2 33 . 1 1 3 3 GLN N N 15 120.821 0.400 . 1 . . . . 63 GLN N . 7208 2 34 . 1 1 3 3 GLN NE2 N 15 107.494 0.400 . 1 . . . . 63 GLN NE2 . 7208 2 35 . 1 1 4 4 LEU H H 1 8.350 0.020 . 1 . . . . 64 LEU H . 7208 2 36 . 1 1 4 4 LEU HA H 1 4.385 0.020 . 1 . . . . 64 LEU HA . 7208 2 37 . 1 1 4 4 LEU HB2 H 1 1.616 0.020 . 1 . . . . 64 LEU HB2 . 7208 2 38 . 1 1 4 4 LEU HB3 H 1 1.616 0.020 . 1 . . . . 64 LEU HB3 . 7208 2 39 . 1 1 4 4 LEU HG H 1 1.681 0.020 . 1 . . . . 64 LEU HG . 7208 2 40 . 1 1 4 4 LEU HD11 H 1 0.923 0.020 . 2 . . . . 64 LEU HD1 . 7208 2 41 . 1 1 4 4 LEU HD12 H 1 0.923 0.020 . 2 . . . . 64 LEU HD1 . 7208 2 42 . 1 1 4 4 LEU HD13 H 1 0.923 0.020 . 2 . . . . 64 LEU HD1 . 7208 2 43 . 1 1 4 4 LEU C C 13 175.551 0.400 . 1 . . . . 64 LEU C . 7208 2 44 . 1 1 4 4 LEU CA C 13 54.759 0.400 . 1 . . . . 64 LEU CA . 7208 2 45 . 1 1 4 4 LEU CB C 13 42.888 0.400 . 1 . . . . 64 LEU CB . 7208 2 46 . 1 1 4 4 LEU CG C 13 26.972 0.400 . 1 . . . . 64 LEU CG . 7208 2 47 . 1 1 4 4 LEU CD1 C 13 25.132 0.400 . 1 . . . . 64 LEU CD1 . 7208 2 48 . 1 1 4 4 LEU N N 15 119.818 0.400 . 1 . . . . 64 LEU N . 7208 2 49 . 1 1 5 5 ALA H H 1 8.293 0.020 . 1 . . . . 65 ALA H . 7208 2 50 . 1 1 5 5 ALA HA H 1 4.286 0.020 . 1 . . . . 65 ALA HA . 7208 2 51 . 1 1 5 5 ALA HB1 H 1 1.324 0.020 . 1 . . . . 65 ALA HB . 7208 2 52 . 1 1 5 5 ALA HB2 H 1 1.324 0.020 . 1 . . . . 65 ALA HB . 7208 2 53 . 1 1 5 5 ALA HB3 H 1 1.324 0.020 . 1 . . . . 65 ALA HB . 7208 2 54 . 1 1 5 5 ALA C C 13 175.999 0.400 . 1 . . . . 65 ALA C . 7208 2 55 . 1 1 5 5 ALA CA C 13 52.289 0.400 . 1 . . . . 65 ALA CA . 7208 2 56 . 1 1 5 5 ALA CB C 13 19.439 0.400 . 1 . . . . 65 ALA CB . 7208 2 57 . 1 1 5 5 ALA N N 15 119.785 0.400 . 1 . . . . 65 ALA N . 7208 2 58 . 1 1 6 6 HIS H H 1 8.005 0.020 . 1 . . . . 66 HIS H . 7208 2 59 . 1 1 6 6 HIS HA H 1 4.462 0.020 . 1 . . . . 66 HIS HA . 7208 2 60 . 1 1 6 6 HIS HB2 H 1 3.006 0.020 . 2 . . . . 66 HIS HB2 . 7208 2 61 . 1 1 6 6 HIS HB3 H 1 2.855 0.020 . 2 . . . . 66 HIS HB3 . 7208 2 62 . 1 1 6 6 HIS C C 13 172.348 0.400 . 1 . . . . 66 HIS C . 7208 2 63 . 1 1 6 6 HIS CA C 13 55.324 0.400 . 1 . . . . 66 HIS CA . 7208 2 64 . 1 1 6 6 HIS CB C 13 29.322 0.400 . 1 . . . . 66 HIS CB . 7208 2 65 . 1 1 6 6 HIS N N 15 112.484 0.400 . 1 . . . . 66 HIS N . 7208 2 66 . 1 1 7 7 HIS H H 1 8.165 0.020 . 1 . . . . 67 HIS H . 7208 2 67 . 1 1 7 7 HIS HA H 1 4.677 0.020 . 1 . . . . 67 HIS HA . 7208 2 68 . 1 1 7 7 HIS HB2 H 1 3.073 0.020 . 2 . . . . 67 HIS HB2 . 7208 2 69 . 1 1 7 7 HIS HB3 H 1 2.990 0.020 . 2 . . . . 67 HIS HB3 . 7208 2 70 . 1 1 7 7 HIS C C 13 172.815 0.400 . 1 . . . . 67 HIS C . 7208 2 71 . 1 1 7 7 HIS CA C 13 54.340 0.400 . 1 . . . . 67 HIS CA . 7208 2 72 . 1 1 7 7 HIS CB C 13 29.030 0.400 . 1 . . . . 67 HIS CB . 7208 2 73 . 1 1 7 7 HIS N N 15 116.988 0.400 . 1 . . . . 67 HIS N . 7208 2 74 . 1 1 8 8 PHE H H 1 8.483 0.020 . 1 . . . . 68 PHE H . 7208 2 75 . 1 1 8 8 PHE HB2 H 1 2.914 0.020 . 2 . . . . 68 PHE HB2 . 7208 2 76 . 1 1 8 8 PHE HB3 H 1 3.117 0.020 . 2 . . . . 68 PHE HB3 . 7208 2 77 . 1 1 8 8 PHE HD1 H 1 7.357 0.020 . 1 . . . . 68 PHE HD1 . 7208 2 78 . 1 1 8 8 PHE C C 13 174.056 0.400 . 1 . . . . 68 PHE C . 7208 2 79 . 1 1 8 8 PHE CA C 13 58.126 0.400 . 1 . . . . 68 PHE CA . 7208 2 80 . 1 1 8 8 PHE CB C 13 40.008 0.400 . 1 . . . . 68 PHE CB . 7208 2 81 . 1 1 8 8 PHE N N 15 118.665 0.400 . 1 . . . . 68 PHE N . 7208 2 82 . 1 1 9 9 SER H H 1 8.589 0.020 . 1 . . . . 69 SER H . 7208 2 83 . 1 1 9 9 SER HA H 1 4.678 0.020 . 1 . . . . 69 SER HA . 7208 2 84 . 1 1 9 9 SER HB2 H 1 4.051 0.020 . 1 . . . . 69 SER HB2 . 7208 2 85 . 1 1 9 9 SER HB3 H 1 4.241 0.020 . 1 . . . . 69 SER HB3 . 7208 2 86 . 1 1 9 9 SER C C 13 173.571 0.400 . 1 . . . . 69 SER C . 7208 2 87 . 1 1 9 9 SER CA C 13 56.529 0.400 . 1 . . . . 69 SER CA . 7208 2 88 . 1 1 9 9 SER N N 15 113.795 0.400 . 1 . . . . 69 SER N . 7208 2 89 . 1 1 10 10 GLU H H 1 9.236 0.020 . 1 . . . . 70 GLU H . 7208 2 90 . 1 1 10 10 GLU HA H 1 4.298 0.020 . 1 . . . . 70 GLU HA . 7208 2 91 . 1 1 10 10 GLU HB2 H 1 2.385 0.020 . 2 . . . . 70 GLU HB2 . 7208 2 92 . 1 1 10 10 GLU HB3 H 1 2.461 0.020 . 2 . . . . 70 GLU HB3 . 7208 2 93 . 1 1 10 10 GLU HG2 H 1 2.212 0.020 . 1 . . . . 70 GLU HG2 . 7208 2 94 . 1 1 10 10 GLU HG3 H 1 2.212 0.020 . 1 . . . . 70 GLU HG3 . 7208 2 95 . 1 1 10 10 GLU CA C 13 61.132 0.400 . 1 . . . . 70 GLU CA . 7208 2 96 . 1 1 10 10 GLU CB C 13 35.210 0.400 . 1 . . . . 70 GLU CB . 7208 2 97 . 1 1 10 10 GLU N N 15 116.736 0.400 . 1 . . . . 70 GLU N . 7208 2 98 . 1 1 11 11 PRO HA H 1 4.306 0.020 . 1 . . . . 71 PRO HA . 7208 2 99 . 1 1 11 11 PRO HB2 H 1 2.363 0.020 . 1 . . . . 71 PRO HB2 . 7208 2 100 . 1 1 11 11 PRO HB3 H 1 1.868 0.020 . 1 . . . . 71 PRO HB3 . 7208 2 101 . 1 1 11 11 PRO HG2 H 1 2.010 0.020 . 1 . . . . 71 PRO HG2 . 7208 2 102 . 1 1 11 11 PRO HG3 H 1 2.215 0.020 . 1 . . . . 71 PRO HG3 . 7208 2 103 . 1 1 11 11 PRO HD2 H 1 3.882 0.020 . 1 . . . . 71 PRO HD2 . 7208 2 104 . 1 1 11 11 PRO HD3 H 1 3.990 0.020 . 1 . . . . 71 PRO HD3 . 7208 2 105 . 1 1 11 11 PRO C C 13 178.081 0.400 . 1 . . . . 71 PRO C . 7208 2 106 . 1 1 11 11 PRO CA C 13 66.209 0.400 . 1 . . . . 71 PRO CA . 7208 2 107 . 1 1 11 11 PRO CB C 13 31.503 0.400 . 1 . . . . 71 PRO CB . 7208 2 108 . 1 1 11 11 PRO CG C 13 28.463 0.400 . 1 . . . . 71 PRO CG . 7208 2 109 . 1 1 11 11 PRO CD C 13 50.010 0.400 . 1 . . . . 71 PRO CD . 7208 2 110 . 1 1 12 12 GLU H H 1 7.465 0.020 . 1 . . . . 72 GLU H . 7208 2 111 . 1 1 12 12 GLU HA H 1 3.953 0.020 . 1 . . . . 72 GLU HA . 7208 2 112 . 1 1 12 12 GLU HB2 H 1 2.336 0.020 . 2 . . . . 72 GLU HB2 . 7208 2 113 . 1 1 12 12 GLU HB3 H 1 2.454 0.020 . 2 . . . . 72 GLU HB3 . 7208 2 114 . 1 1 12 12 GLU C C 13 177.343 0.400 . 1 . . . . 72 GLU C . 7208 2 115 . 1 1 12 12 GLU CA C 13 59.835 0.400 . 1 . . . . 72 GLU CA . 7208 2 116 . 1 1 12 12 GLU CB C 13 36.743 0.400 . 1 . . . . 72 GLU CB . 7208 2 117 . 1 1 12 12 GLU N N 15 111.252 0.400 . 1 . . . . 72 GLU N . 7208 2 118 . 1 1 13 13 ILE H H 1 8.246 0.020 . 1 . . . . 73 ILE H . 7208 2 119 . 1 1 13 13 ILE HA H 1 3.628 0.020 . 1 . . . . 73 ILE HA . 7208 2 120 . 1 1 13 13 ILE HB H 1 2.023 0.020 . 1 . . . . 73 ILE HB . 7208 2 121 . 1 1 13 13 ILE HG12 H 1 1.708 0.020 . 2 . . . . 73 ILE HG12 . 7208 2 122 . 1 1 13 13 ILE HG13 H 1 1.121 0.020 . 2 . . . . 73 ILE HG13 . 7208 2 123 . 1 1 13 13 ILE HG21 H 1 0.855 0.020 . 1 . . . . 73 ILE HG2 . 7208 2 124 . 1 1 13 13 ILE HG22 H 1 0.855 0.020 . 1 . . . . 73 ILE HG2 . 7208 2 125 . 1 1 13 13 ILE HG23 H 1 0.855 0.020 . 1 . . . . 73 ILE HG2 . 7208 2 126 . 1 1 13 13 ILE HD11 H 1 0.772 0.020 . 1 . . . . 73 ILE HD1 . 7208 2 127 . 1 1 13 13 ILE HD12 H 1 0.772 0.020 . 1 . . . . 73 ILE HD1 . 7208 2 128 . 1 1 13 13 ILE HD13 H 1 0.772 0.020 . 1 . . . . 73 ILE HD1 . 7208 2 129 . 1 1 13 13 ILE C C 13 176.727 0.400 . 1 . . . . 73 ILE C . 7208 2 130 . 1 1 13 13 ILE CA C 13 64.245 0.400 . 1 . . . . 73 ILE CA . 7208 2 131 . 1 1 13 13 ILE CB C 13 37.375 0.400 . 1 . . . . 73 ILE CB . 7208 2 132 . 1 1 13 13 ILE CG1 C 13 29.327 0.400 . 1 . . . . 73 ILE CG1 . 7208 2 133 . 1 1 13 13 ILE CG2 C 13 17.620 0.400 . 1 . . . . 73 ILE CG2 . 7208 2 134 . 1 1 13 13 ILE CD1 C 13 12.940 0.400 . 1 . . . . 73 ILE CD1 . 7208 2 135 . 1 1 13 13 ILE N N 15 113.452 0.400 . 1 . . . . 73 ILE N . 7208 2 136 . 1 1 14 14 THR H H 1 8.249 0.020 . 1 . . . . 74 THR H . 7208 2 137 . 1 1 14 14 THR HA H 1 3.647 0.020 . 1 . . . . 74 THR HA . 7208 2 138 . 1 1 14 14 THR HB H 1 4.249 0.020 . 1 . . . . 74 THR HB . 7208 2 139 . 1 1 14 14 THR HG1 H 1 4.620 0.020 . 1 . . . . 74 THR HG1 . 7208 2 140 . 1 1 14 14 THR HG21 H 1 1.106 0.020 . 1 . . . . 74 THR HG2 . 7208 2 141 . 1 1 14 14 THR HG22 H 1 1.106 0.020 . 1 . . . . 74 THR HG2 . 7208 2 142 . 1 1 14 14 THR HG23 H 1 1.106 0.020 . 1 . . . . 74 THR HG2 . 7208 2 143 . 1 1 14 14 THR C C 13 174.654 0.400 . 1 . . . . 74 THR C . 7208 2 144 . 1 1 14 14 THR CA C 13 67.677 0.400 . 1 . . . . 74 THR CA . 7208 2 145 . 1 1 14 14 THR CB C 13 67.796 0.400 . 1 . . . . 74 THR CB . 7208 2 146 . 1 1 14 14 THR CG2 C 13 22.052 0.400 . 1 . . . . 74 THR CG2 . 7208 2 147 . 1 1 14 14 THR N N 15 112.050 0.400 . 1 . . . . 74 THR N . 7208 2 148 . 1 1 15 15 LEU H H 1 7.653 0.020 . 1 . . . . 75 LEU H . 7208 2 149 . 1 1 15 15 LEU HA H 1 4.000 0.020 . 1 . . . . 75 LEU HA . 7208 2 150 . 1 1 15 15 LEU HB2 H 1 2.154 0.020 . 1 . . . . 75 LEU HB2 . 7208 2 151 . 1 1 15 15 LEU HB3 H 1 1.928 0.020 . 1 . . . . 75 LEU HB3 . 7208 2 152 . 1 1 15 15 LEU HG H 1 1.457 0.020 . 1 . . . . 75 LEU HG . 7208 2 153 . 1 1 15 15 LEU HD11 H 1 1.053 0.020 . 1 . . . . 75 LEU HD1 . 7208 2 154 . 1 1 15 15 LEU HD12 H 1 1.053 0.020 . 1 . . . . 75 LEU HD1 . 7208 2 155 . 1 1 15 15 LEU HD13 H 1 1.053 0.020 . 1 . . . . 75 LEU HD1 . 7208 2 156 . 1 1 15 15 LEU HD21 H 1 0.861 0.020 . 1 . . . . 75 LEU HD2 . 7208 2 157 . 1 1 15 15 LEU HD22 H 1 0.861 0.020 . 1 . . . . 75 LEU HD2 . 7208 2 158 . 1 1 15 15 LEU HD23 H 1 0.861 0.020 . 1 . . . . 75 LEU HD2 . 7208 2 159 . 1 1 15 15 LEU C C 13 177.764 0.400 . 1 . . . . 75 LEU C . 7208 2 160 . 1 1 15 15 LEU CA C 13 58.602 0.400 . 1 . . . . 75 LEU CA . 7208 2 161 . 1 1 15 15 LEU CB C 13 42.036 0.400 . 1 . . . . 75 LEU CB . 7208 2 162 . 1 1 15 15 LEU CD1 C 13 26.508 0.400 . 1 . . . . 75 LEU CD1 . 7208 2 163 . 1 1 15 15 LEU CD2 C 13 23.496 0.400 . 1 . . . . 75 LEU CD2 . 7208 2 164 . 1 1 15 15 LEU N N 15 116.007 0.400 . 1 . . . . 75 LEU N . 7208 2 165 . 1 1 16 16 ILE H H 1 7.752 0.020 . 1 . . . . 76 ILE H . 7208 2 166 . 1 1 16 16 ILE HA H 1 3.741 0.020 . 1 . . . . 76 ILE HA . 7208 2 167 . 1 1 16 16 ILE HB H 1 2.036 0.020 . 1 . . . . 76 ILE HB . 7208 2 168 . 1 1 16 16 ILE HG12 H 1 1.079 0.020 . 1 . . . . 76 ILE HG12 . 7208 2 169 . 1 1 16 16 ILE HG13 H 1 1.079 0.020 . 1 . . . . 76 ILE HG13 . 7208 2 170 . 1 1 16 16 ILE HG21 H 1 0.843 0.020 . 1 . . . . 76 ILE HG2 . 7208 2 171 . 1 1 16 16 ILE HG22 H 1 0.843 0.020 . 1 . . . . 76 ILE HG2 . 7208 2 172 . 1 1 16 16 ILE HG23 H 1 0.843 0.020 . 1 . . . . 76 ILE HG2 . 7208 2 173 . 1 1 16 16 ILE HD11 H 1 0.687 0.020 . 1 . . . . 76 ILE HD1 . 7208 2 174 . 1 1 16 16 ILE HD12 H 1 0.687 0.020 . 1 . . . . 76 ILE HD1 . 7208 2 175 . 1 1 16 16 ILE HD13 H 1 0.687 0.020 . 1 . . . . 76 ILE HD1 . 7208 2 176 . 1 1 16 16 ILE C C 13 177.502 0.400 . 1 . . . . 76 ILE C . 7208 2 177 . 1 1 16 16 ILE CA C 13 65.579 0.400 . 1 . . . . 76 ILE CA . 7208 2 178 . 1 1 16 16 ILE CB C 13 36.717 0.400 . 1 . . . . 76 ILE CB . 7208 2 179 . 1 1 16 16 ILE CG1 C 13 29.568 0.400 . 1 . . . . 76 ILE CG1 . 7208 2 180 . 1 1 16 16 ILE CG2 C 13 17.416 0.400 . 1 . . . . 76 ILE CG2 . 7208 2 181 . 1 1 16 16 ILE CD1 C 13 13.545 0.400 . 1 . . . . 76 ILE CD1 . 7208 2 182 . 1 1 16 16 ILE N N 15 113.529 0.400 . 1 . . . . 76 ILE N . 7208 2 183 . 1 1 17 17 ILE H H 1 8.530 0.020 . 1 . . . . 77 ILE H . 7208 2 184 . 1 1 17 17 ILE HA H 1 3.557 0.020 . 1 . . . . 77 ILE HA . 7208 2 185 . 1 1 17 17 ILE HB H 1 2.020 0.020 . 1 . . . . 77 ILE HB . 7208 2 186 . 1 1 17 17 ILE HG12 H 1 1.792 0.020 . 1 . . . . 77 ILE HG12 . 7208 2 187 . 1 1 17 17 ILE HG13 H 1 1.128 0.020 . 1 . . . . 77 ILE HG13 . 7208 2 188 . 1 1 17 17 ILE HG21 H 1 0.898 0.020 . 1 . . . . 77 ILE HG2 . 7208 2 189 . 1 1 17 17 ILE HG22 H 1 0.898 0.020 . 1 . . . . 77 ILE HG2 . 7208 2 190 . 1 1 17 17 ILE HG23 H 1 0.898 0.020 . 1 . . . . 77 ILE HG2 . 7208 2 191 . 1 1 17 17 ILE HD11 H 1 0.740 0.020 . 1 . . . . 77 ILE HD1 . 7208 2 192 . 1 1 17 17 ILE HD12 H 1 0.740 0.020 . 1 . . . . 77 ILE HD1 . 7208 2 193 . 1 1 17 17 ILE HD13 H 1 0.740 0.020 . 1 . . . . 77 ILE HD1 . 7208 2 194 . 1 1 17 17 ILE C C 13 176.708 0.400 . 1 . . . . 77 ILE C . 7208 2 195 . 1 1 17 17 ILE CA C 13 65.134 0.400 . 1 . . . . 77 ILE CA . 7208 2 196 . 1 1 17 17 ILE CB C 13 38.484 0.400 . 1 . . . . 77 ILE CB . 7208 2 197 . 1 1 17 17 ILE CG1 C 13 29.288 0.400 . 1 . . . . 77 ILE CG1 . 7208 2 198 . 1 1 17 17 ILE CG2 C 13 17.926 0.400 . 1 . . . . 77 ILE CG2 . 7208 2 199 . 1 1 17 17 ILE CD1 C 13 13.007 0.400 . 1 . . . . 77 ILE CD1 . 7208 2 200 . 1 1 17 17 ILE N N 15 114.682 0.400 . 1 . . . . 77 ILE N . 7208 2 201 . 1 1 18 18 PHE H H 1 8.683 0.020 . 1 . . . . 78 PHE H . 7208 2 202 . 1 1 18 18 PHE HA H 1 4.215 0.020 . 1 . . . . 78 PHE HA . 7208 2 203 . 1 1 18 18 PHE HB2 H 1 3.232 0.020 . 1 . . . . 78 PHE HB2 . 7208 2 204 . 1 1 18 18 PHE HB3 H 1 3.232 0.020 . 1 . . . . 78 PHE HB3 . 7208 2 205 . 1 1 18 18 PHE C C 13 176.512 0.400 . 1 . . . . 78 PHE C . 7208 2 206 . 1 1 18 18 PHE CA C 13 61.309 0.400 . 1 . . . . 78 PHE CA . 7208 2 207 . 1 1 18 18 PHE CB C 13 38.451 0.400 . 1 . . . . 78 PHE CB . 7208 2 208 . 1 1 18 18 PHE N N 15 116.209 0.400 . 1 . . . . 78 PHE N . 7208 2 209 . 1 1 19 19 GLY H H 1 8.340 0.020 . 1 . . . . 79 GLY H . 7208 2 210 . 1 1 19 19 GLY HA2 H 1 3.557 0.020 . 2 . . . . 79 GLY HA2 . 7208 2 211 . 1 1 19 19 GLY HA3 H 1 4.240 0.020 . 2 . . . . 79 GLY HA3 . 7208 2 212 . 1 1 19 19 GLY C C 13 173.506 0.400 . 1 . . . . 79 GLY C . 7208 2 213 . 1 1 19 19 GLY CA C 13 47.853 0.400 . 1 . . . . 79 GLY CA . 7208 2 214 . 1 1 19 19 GLY N N 15 101.766 0.400 . 1 . . . . 79 GLY N . 7208 2 215 . 1 1 20 20 VAL H H 1 8.845 0.020 . 1 . . . . 80 VAL H . 7208 2 216 . 1 1 20 20 VAL HA H 1 3.609 0.020 . 1 . . . . 80 VAL HA . 7208 2 217 . 1 1 20 20 VAL HB H 1 2.246 0.020 . 1 . . . . 80 VAL HB . 7208 2 218 . 1 1 20 20 VAL HG11 H 1 0.759 0.020 . 1 . . . . 80 VAL HG1 . 7208 2 219 . 1 1 20 20 VAL HG12 H 1 0.759 0.020 . 1 . . . . 80 VAL HG1 . 7208 2 220 . 1 1 20 20 VAL HG13 H 1 0.759 0.020 . 1 . . . . 80 VAL HG1 . 7208 2 221 . 1 1 20 20 VAL HG21 H 1 1.046 0.020 . 1 . . . . 80 VAL HG2 . 7208 2 222 . 1 1 20 20 VAL HG22 H 1 1.046 0.020 . 1 . . . . 80 VAL HG2 . 7208 2 223 . 1 1 20 20 VAL HG23 H 1 1.046 0.020 . 1 . . . . 80 VAL HG2 . 7208 2 224 . 1 1 20 20 VAL C C 13 177.511 0.400 . 1 . . . . 80 VAL C . 7208 2 225 . 1 1 20 20 VAL CA C 13 66.035 0.400 . 1 . . . . 80 VAL CA . 7208 2 226 . 1 1 20 20 VAL CB C 13 31.753 0.400 . 1 . . . . 80 VAL CB . 7208 2 227 . 1 1 20 20 VAL CG1 C 13 22.109 0.400 . 1 . . . . 80 VAL CG1 . 7208 2 228 . 1 1 20 20 VAL CG2 C 13 23.383 0.400 . 1 . . . . 80 VAL CG2 . 7208 2 229 . 1 1 20 20 VAL N N 15 118.310 0.400 . 1 . . . . 80 VAL N . 7208 2 230 . 1 1 21 21 MET H H 1 8.381 0.020 . 1 . . . . 81 MET H . 7208 2 231 . 1 1 21 21 MET HA H 1 3.903 0.020 . 1 . . . . 81 MET HA . 7208 2 232 . 1 1 21 21 MET HB2 H 1 2.287 0.020 . 2 . . . . 81 MET HB2 . 7208 2 233 . 1 1 21 21 MET HB3 H 1 1.896 0.020 . 2 . . . . 81 MET HB3 . 7208 2 234 . 1 1 21 21 MET HG2 H 1 2.376 0.020 . 2 . . . . 81 MET HG2 . 7208 2 235 . 1 1 21 21 MET HG3 H 1 2.677 0.020 . 2 . . . . 81 MET HG3 . 7208 2 236 . 1 1 21 21 MET HE1 H 1 1.879 0.020 . 1 . . . . 81 MET HE . 7208 2 237 . 1 1 21 21 MET HE2 H 1 1.879 0.020 . 1 . . . . 81 MET HE . 7208 2 238 . 1 1 21 21 MET HE3 H 1 1.879 0.020 . 1 . . . . 81 MET HE . 7208 2 239 . 1 1 21 21 MET C C 13 176.764 0.400 . 1 . . . . 81 MET C . 7208 2 240 . 1 1 21 21 MET CA C 13 58.941 0.400 . 1 . . . . 81 MET CA . 7208 2 241 . 1 1 21 21 MET CB C 13 31.390 0.400 . 1 . . . . 81 MET CB . 7208 2 242 . 1 1 21 21 MET CG C 13 32.873 0.400 . 1 . . . . 81 MET CG . 7208 2 243 . 1 1 21 21 MET CE C 13 16.441 0.400 . 1 . . . . 81 MET CE . 7208 2 244 . 1 1 21 21 MET N N 15 112.329 0.400 . 1 . . . . 81 MET N . 7208 2 245 . 1 1 22 22 ALA H H 1 8.281 0.020 . 1 . . . . 82 ALA H . 7208 2 246 . 1 1 22 22 ALA HA H 1 3.838 0.020 . 1 . . . . 82 ALA HA . 7208 2 247 . 1 1 22 22 ALA HB1 H 1 1.254 0.020 . 1 . . . . 82 ALA HB . 7208 2 248 . 1 1 22 22 ALA HB2 H 1 1.254 0.020 . 1 . . . . 82 ALA HB . 7208 2 249 . 1 1 22 22 ALA HB3 H 1 1.254 0.020 . 1 . . . . 82 ALA HB . 7208 2 250 . 1 1 22 22 ALA C C 13 178.529 0.400 . 1 . . . . 82 ALA C . 7208 2 251 . 1 1 22 22 ALA CA C 13 55.192 0.400 . 1 . . . . 82 ALA CA . 7208 2 252 . 1 1 22 22 ALA CB C 13 17.742 0.400 . 1 . . . . 82 ALA CB . 7208 2 253 . 1 1 22 22 ALA N N 15 116.323 0.400 . 1 . . . . 82 ALA N . 7208 2 254 . 1 1 23 23 GLY H H 1 8.874 0.020 . 1 . . . . 83 GLY H . 7208 2 255 . 1 1 23 23 GLY HA2 H 1 4.188 0.020 . 2 . . . . 83 GLY HA2 . 7208 2 256 . 1 1 23 23 GLY HA3 H 1 3.726 0.020 . 2 . . . . 83 GLY HA3 . 7208 2 257 . 1 1 23 23 GLY C C 13 174.785 0.400 . 1 . . . . 83 GLY C . 7208 2 258 . 1 1 23 23 GLY CA C 13 47.571 0.400 . 1 . . . . 83 GLY CA . 7208 2 259 . 1 1 23 23 GLY N N 15 100.839 0.400 . 1 . . . . 83 GLY N . 7208 2 260 . 1 1 24 24 VAL H H 1 8.665 0.020 . 1 . . . . 84 VAL H . 7208 2 261 . 1 1 24 24 VAL HA H 1 3.904 0.020 . 1 . . . . 84 VAL HA . 7208 2 262 . 1 1 24 24 VAL HB H 1 2.074 0.020 . 1 . . . . 84 VAL HB . 7208 2 263 . 1 1 24 24 VAL HG11 H 1 0.857 0.020 . 1 . . . . 84 VAL HG1 . 7208 2 264 . 1 1 24 24 VAL HG12 H 1 0.857 0.020 . 1 . . . . 84 VAL HG1 . 7208 2 265 . 1 1 24 24 VAL HG13 H 1 0.857 0.020 . 1 . . . . 84 VAL HG1 . 7208 2 266 . 1 1 24 24 VAL HG21 H 1 0.994 0.020 . 1 . . . . 84 VAL HG2 . 7208 2 267 . 1 1 24 24 VAL HG22 H 1 0.994 0.020 . 1 . . . . 84 VAL HG2 . 7208 2 268 . 1 1 24 24 VAL HG23 H 1 0.994 0.020 . 1 . . . . 84 VAL HG2 . 7208 2 269 . 1 1 24 24 VAL C C 13 176.830 0.400 . 1 . . . . 84 VAL C . 7208 2 270 . 1 1 24 24 VAL CA C 13 65.671 0.400 . 1 . . . . 84 VAL CA . 7208 2 271 . 1 1 24 24 VAL CB C 13 32.342 0.400 . 1 . . . . 84 VAL CB . 7208 2 272 . 1 1 24 24 VAL CG1 C 13 20.620 0.400 . 1 . . . . 84 VAL CG1 . 7208 2 273 . 1 1 24 24 VAL CG2 C 13 21.759 0.400 . 1 . . . . 84 VAL CG2 . 7208 2 274 . 1 1 24 24 VAL N N 15 120.335 0.400 . 1 . . . . 84 VAL N . 7208 2 275 . 1 1 25 25 ILE H H 1 8.293 0.020 . 1 . . . . 85 ILE H . 7208 2 276 . 1 1 25 25 ILE HA H 1 3.573 0.020 . 1 . . . . 85 ILE HA . 7208 2 277 . 1 1 25 25 ILE HB H 1 1.844 0.020 . 1 . . . . 85 ILE HB . 7208 2 278 . 1 1 25 25 ILE HG12 H 1 1.036 0.020 . 1 . . . . 85 ILE HG12 . 7208 2 279 . 1 1 25 25 ILE HG13 H 1 1.036 0.020 . 1 . . . . 85 ILE HG13 . 7208 2 280 . 1 1 25 25 ILE HG21 H 1 0.861 0.020 . 1 . . . . 85 ILE HG2 . 7208 2 281 . 1 1 25 25 ILE HG22 H 1 0.861 0.020 . 1 . . . . 85 ILE HG2 . 7208 2 282 . 1 1 25 25 ILE HG23 H 1 0.861 0.020 . 1 . . . . 85 ILE HG2 . 7208 2 283 . 1 1 25 25 ILE HD11 H 1 0.761 0.020 . 1 . . . . 85 ILE HD1 . 7208 2 284 . 1 1 25 25 ILE HD12 H 1 0.761 0.020 . 1 . . . . 85 ILE HD1 . 7208 2 285 . 1 1 25 25 ILE HD13 H 1 0.761 0.020 . 1 . . . . 85 ILE HD1 . 7208 2 286 . 1 1 25 25 ILE C C 13 177.101 0.400 . 1 . . . . 85 ILE C . 7208 2 287 . 1 1 25 25 ILE CA C 13 65.313 0.400 . 1 . . . . 85 ILE CA . 7208 2 288 . 1 1 25 25 ILE CB C 13 37.490 0.400 . 1 . . . . 85 ILE CB . 7208 2 289 . 1 1 25 25 ILE CG2 C 13 17.676 0.400 . 1 . . . . 85 ILE CG2 . 7208 2 290 . 1 1 25 25 ILE CD1 C 13 13.015 0.400 . 1 . . . . 85 ILE CD1 . 7208 2 291 . 1 1 25 25 ILE N N 15 112.968 0.400 . 1 . . . . 85 ILE N . 7208 2 292 . 1 1 26 26 GLY H H 1 8.899 0.020 . 1 . . . . 86 GLY H . 7208 2 293 . 1 1 26 26 GLY HA2 H 1 3.544 0.020 . 1 . . . . 86 GLY HA2 . 7208 2 294 . 1 1 26 26 GLY HA3 H 1 3.544 0.020 . 1 . . . . 86 GLY HA3 . 7208 2 295 . 1 1 26 26 GLY C C 13 173.281 0.400 . 1 . . . . 86 GLY C . 7208 2 296 . 1 1 26 26 GLY CA C 13 47.616 0.400 . 1 . . . . 86 GLY CA . 7208 2 297 . 1 1 26 26 GLY N N 15 101.320 0.400 . 1 . . . . 86 GLY N . 7208 2 298 . 1 1 27 27 THR H H 1 7.851 0.020 . 1 . . . . 87 THR H . 7208 2 299 . 1 1 27 27 THR HA H 1 3.784 0.020 . 1 . . . . 87 THR HA . 7208 2 300 . 1 1 27 27 THR HB H 1 4.338 0.020 . 1 . . . . 87 THR HB . 7208 2 301 . 1 1 27 27 THR HG1 H 1 4.940 0.020 . 1 . . . . 87 THR HG1 . 7208 2 302 . 1 1 27 27 THR HG21 H 1 1.160 0.020 . 1 . . . . 87 THR HG2 . 7208 2 303 . 1 1 27 27 THR HG22 H 1 1.160 0.020 . 1 . . . . 87 THR HG2 . 7208 2 304 . 1 1 27 27 THR HG23 H 1 1.160 0.020 . 1 . . . . 87 THR HG2 . 7208 2 305 . 1 1 27 27 THR C C 13 175.298 0.400 . 1 . . . . 87 THR C . 7208 2 306 . 1 1 27 27 THR CA C 13 68.577 0.400 . 1 . . . . 87 THR CA . 7208 2 307 . 1 1 27 27 THR CB C 13 67.303 0.400 . 1 . . . . 87 THR CB . 7208 2 308 . 1 1 27 27 THR CG2 C 13 21.804 0.400 . 1 . . . . 87 THR CG2 . 7208 2 309 . 1 1 27 27 THR N N 15 113.612 0.400 . 1 . . . . 87 THR N . 7208 2 310 . 1 1 28 28 ILE H H 1 8.169 0.020 . 1 . . . . 88 ILE H . 7208 2 311 . 1 1 28 28 ILE HA H 1 3.573 0.020 . 1 . . . . 88 ILE HA . 7208 2 312 . 1 1 28 28 ILE HB H 1 2.054 0.020 . 1 . . . . 88 ILE HB . 7208 2 313 . 1 1 28 28 ILE HG12 H 1 1.825 0.020 . 2 . . . . 88 ILE HG12 . 7208 2 314 . 1 1 28 28 ILE HG13 H 1 1.166 0.020 . 2 . . . . 88 ILE HG13 . 7208 2 315 . 1 1 28 28 ILE HG21 H 1 0.850 0.020 . 1 . . . . 88 ILE HG2 . 7208 2 316 . 1 1 28 28 ILE HG22 H 1 0.850 0.020 . 1 . . . . 88 ILE HG2 . 7208 2 317 . 1 1 28 28 ILE HG23 H 1 0.850 0.020 . 1 . . . . 88 ILE HG2 . 7208 2 318 . 1 1 28 28 ILE HD11 H 1 0.759 0.020 . 1 . . . . 88 ILE HD1 . 7208 2 319 . 1 1 28 28 ILE HD12 H 1 0.759 0.020 . 1 . . . . 88 ILE HD1 . 7208 2 320 . 1 1 28 28 ILE HD13 H 1 0.759 0.020 . 1 . . . . 88 ILE HD1 . 7208 2 321 . 1 1 28 28 ILE C C 13 177.708 0.400 . 1 . . . . 88 ILE C . 7208 2 322 . 1 1 28 28 ILE CA C 13 65.188 0.400 . 1 . . . . 88 ILE CA . 7208 2 323 . 1 1 28 28 ILE CB C 13 37.012 0.400 . 1 . . . . 88 ILE CB . 7208 2 324 . 1 1 28 28 ILE CG1 C 13 29.365 0.400 . 1 . . . . 88 ILE CG1 . 7208 2 325 . 1 1 28 28 ILE CG2 C 13 17.578 0.400 . 1 . . . . 88 ILE CG2 . 7208 2 326 . 1 1 28 28 ILE CD1 C 13 13.761 0.400 . 1 . . . . 88 ILE CD1 . 7208 2 327 . 1 1 28 28 ILE N N 15 115.978 0.400 . 1 . . . . 88 ILE N . 7208 2 328 . 1 1 29 29 LEU H H 1 8.524 0.020 . 1 . . . . 89 LEU H . 7208 2 329 . 1 1 29 29 LEU HA H 1 4.025 0.020 . 1 . . . . 89 LEU HA . 7208 2 330 . 1 1 29 29 LEU HB2 H 1 1.920 0.020 . 1 . . . . 89 LEU HB2 . 7208 2 331 . 1 1 29 29 LEU HB3 H 1 1.468 0.020 . 1 . . . . 89 LEU HB3 . 7208 2 332 . 1 1 29 29 LEU HG H 1 1.892 0.020 . 1 . . . . 89 LEU HG . 7208 2 333 . 1 1 29 29 LEU HD11 H 1 0.847 0.020 . 2 . . . . 89 LEU HD1 . 7208 2 334 . 1 1 29 29 LEU HD12 H 1 0.847 0.020 . 2 . . . . 89 LEU HD1 . 7208 2 335 . 1 1 29 29 LEU HD13 H 1 0.847 0.020 . 2 . . . . 89 LEU HD1 . 7208 2 336 . 1 1 29 29 LEU HD21 H 1 0.847 0.020 . 2 . . . . 89 LEU HD2 . 7208 2 337 . 1 1 29 29 LEU HD22 H 1 0.847 0.020 . 2 . . . . 89 LEU HD2 . 7208 2 338 . 1 1 29 29 LEU HD23 H 1 0.847 0.020 . 2 . . . . 89 LEU HD2 . 7208 2 339 . 1 1 29 29 LEU C C 13 177.483 0.400 . 1 . . . . 89 LEU C . 7208 2 340 . 1 1 29 29 LEU CA C 13 58.197 0.400 . 1 . . . . 89 LEU CA . 7208 2 341 . 1 1 29 29 LEU CB C 13 41.808 0.400 . 1 . . . . 89 LEU CB . 7208 2 342 . 1 1 29 29 LEU CG C 13 27.079 0.400 . 1 . . . . 89 LEU CG . 7208 2 343 . 1 1 29 29 LEU CD1 C 13 25.944 0.400 . 1 . . . . 89 LEU CD1 . 7208 2 344 . 1 1 29 29 LEU N N 15 116.454 0.400 . 1 . . . . 89 LEU N . 7208 2 345 . 1 1 30 30 LEU H H 1 8.230 0.020 . 1 . . . . 90 LEU H . 7208 2 346 . 1 1 30 30 LEU HA H 1 4.083 0.020 . 1 . . . . 90 LEU HA . 7208 2 347 . 1 1 30 30 LEU HB2 H 1 1.737 0.020 . 1 . . . . 90 LEU HB2 . 7208 2 348 . 1 1 30 30 LEU HB3 H 1 1.915 0.020 . 1 . . . . 90 LEU HB3 . 7208 2 349 . 1 1 30 30 LEU HG H 1 1.785 0.020 . 1 . . . . 90 LEU HG . 7208 2 350 . 1 1 30 30 LEU HD11 H 1 0.843 0.020 . 2 . . . . 90 LEU HD1 . 7208 2 351 . 1 1 30 30 LEU HD12 H 1 0.843 0.020 . 2 . . . . 90 LEU HD1 . 7208 2 352 . 1 1 30 30 LEU HD13 H 1 0.843 0.020 . 2 . . . . 90 LEU HD1 . 7208 2 353 . 1 1 30 30 LEU HD21 H 1 0.843 0.020 . 2 . . . . 90 LEU HD2 . 7208 2 354 . 1 1 30 30 LEU HD22 H 1 0.843 0.020 . 2 . . . . 90 LEU HD2 . 7208 2 355 . 1 1 30 30 LEU HD23 H 1 0.843 0.020 . 2 . . . . 90 LEU HD2 . 7208 2 356 . 1 1 30 30 LEU C C 13 177.922 0.400 . 1 . . . . 90 LEU C . 7208 2 357 . 1 1 30 30 LEU CA C 13 58.415 0.400 . 1 . . . . 90 LEU CA . 7208 2 358 . 1 1 30 30 LEU CB C 13 42.029 0.400 . 1 . . . . 90 LEU CB . 7208 2 359 . 1 1 30 30 LEU CG C 13 27.134 0.400 . 1 . . . . 90 LEU CG . 7208 2 360 . 1 1 30 30 LEU CD1 C 13 24.850 0.400 . 1 . . . . 90 LEU CD1 . 7208 2 361 . 1 1 30 30 LEU N N 15 115.204 0.400 . 1 . . . . 90 LEU N . 7208 2 362 . 1 1 31 31 ILE H H 1 8.362 0.020 . 1 . . . . 91 ILE H . 7208 2 363 . 1 1 31 31 ILE HA H 1 3.685 0.020 . 1 . . . . 91 ILE HA . 7208 2 364 . 1 1 31 31 ILE HB H 1 1.920 0.020 . 1 . . . . 91 ILE HB . 7208 2 365 . 1 1 31 31 ILE HG12 H 1 1.044 0.020 . 1 . . . . 91 ILE HG12 . 7208 2 366 . 1 1 31 31 ILE HG13 H 1 1.044 0.020 . 1 . . . . 91 ILE HG13 . 7208 2 367 . 1 1 31 31 ILE HG21 H 1 0.847 0.020 . 1 . . . . 91 ILE HG2 . 7208 2 368 . 1 1 31 31 ILE HG22 H 1 0.847 0.020 . 1 . . . . 91 ILE HG2 . 7208 2 369 . 1 1 31 31 ILE HG23 H 1 0.847 0.020 . 1 . . . . 91 ILE HG2 . 7208 2 370 . 1 1 31 31 ILE HD11 H 1 0.759 0.020 . 1 . . . . 91 ILE HD1 . 7208 2 371 . 1 1 31 31 ILE HD12 H 1 0.759 0.020 . 1 . . . . 91 ILE HD1 . 7208 2 372 . 1 1 31 31 ILE HD13 H 1 0.759 0.020 . 1 . . . . 91 ILE HD1 . 7208 2 373 . 1 1 31 31 ILE C C 13 176.382 0.400 . 1 . . . . 91 ILE C . 7208 2 374 . 1 1 31 31 ILE CA C 13 65.464 0.400 . 1 . . . . 91 ILE CA . 7208 2 375 . 1 1 31 31 ILE CB C 13 37.942 0.400 . 1 . . . . 91 ILE CB . 7208 2 376 . 1 1 31 31 ILE CG2 C 13 17.648 0.400 . 1 . . . . 91 ILE CG2 . 7208 2 377 . 1 1 31 31 ILE CD1 C 13 13.940 0.400 . 1 . . . . 91 ILE CD1 . 7208 2 378 . 1 1 31 31 ILE N N 15 113.157 0.400 . 1 . . . . 91 ILE N . 7208 2 379 . 1 1 32 32 SER H H 1 8.271 0.020 . 1 . . . . 92 SER H . 7208 2 380 . 1 1 32 32 SER HA H 1 4.024 0.020 . 1 . . . . 92 SER HA . 7208 2 381 . 1 1 32 32 SER HB2 H 1 3.826 0.020 . 1 . . . . 92 SER HB2 . 7208 2 382 . 1 1 32 32 SER HB3 H 1 3.826 0.020 . 1 . . . . 92 SER HB3 . 7208 2 383 . 1 1 32 32 SER HG H 1 4.635 0.020 . 1 . . . . 92 SER HG . 7208 2 384 . 1 1 32 32 SER C C 13 174.626 0.400 . 1 . . . . 92 SER C . 7208 2 385 . 1 1 32 32 SER CA C 13 62.873 0.400 . 1 . . . . 92 SER CA . 7208 2 386 . 1 1 32 32 SER CB C 13 62.942 0.400 . 1 . . . . 92 SER CB . 7208 2 387 . 1 1 32 32 SER N N 15 110.355 0.400 . 1 . . . . 92 SER N . 7208 2 388 . 1 1 33 33 TYR H H 1 8.175 0.020 . 1 . . . . 93 TYR H . 7208 2 389 . 1 1 33 33 TYR HA H 1 4.209 0.020 . 1 . . . . 93 TYR HA . 7208 2 390 . 1 1 33 33 TYR HB2 H 1 3.090 0.020 . 1 . . . . 93 TYR HB2 . 7208 2 391 . 1 1 33 33 TYR HB3 H 1 3.090 0.020 . 1 . . . . 93 TYR HB3 . 7208 2 392 . 1 1 33 33 TYR HD1 H 1 7.048 0.020 . 1 . . . . 93 TYR HD1 . 7208 2 393 . 1 1 33 33 TYR HD2 H 1 7.048 0.020 . 1 . . . . 93 TYR HD2 . 7208 2 394 . 1 1 33 33 TYR HE1 H 1 6.758 0.020 . 1 . . . . 93 TYR HE1 . 7208 2 395 . 1 1 33 33 TYR C C 13 176.634 0.400 . 1 . . . . 93 TYR C . 7208 2 396 . 1 1 33 33 TYR CA C 13 61.153 0.400 . 1 . . . . 93 TYR CA . 7208 2 397 . 1 1 33 33 TYR CB C 13 39.079 0.400 . 1 . . . . 93 TYR CB . 7208 2 398 . 1 1 33 33 TYR N N 15 115.868 0.400 . 1 . . . . 93 TYR N . 7208 2 399 . 1 1 34 34 GLY H H 1 8.386 0.020 . 1 . . . . 94 GLY H . 7208 2 400 . 1 1 34 34 GLY HA2 H 1 3.793 0.020 . 2 . . . . 94 GLY HA2 . 7208 2 401 . 1 1 34 34 GLY HA3 H 1 3.669 0.020 . 2 . . . . 94 GLY HA3 . 7208 2 402 . 1 1 34 34 GLY C C 13 173.870 0.400 . 1 . . . . 94 GLY C . 7208 2 403 . 1 1 34 34 GLY CA C 13 46.944 0.400 . 1 . . . . 94 GLY CA . 7208 2 404 . 1 1 34 34 GLY N N 15 101.611 0.400 . 1 . . . . 94 GLY N . 7208 2 405 . 1 1 35 35 ILE H H 1 8.160 0.020 . 1 . . . . 95 ILE H . 7208 2 406 . 1 1 35 35 ILE HA H 1 4.009 0.020 . 1 . . . . 95 ILE HA . 7208 2 407 . 1 1 35 35 ILE HB H 1 2.053 0.020 . 1 . . . . 95 ILE HB . 7208 2 408 . 1 1 35 35 ILE HG12 H 1 1.324 0.020 . 1 . . . . 95 ILE HG12 . 7208 2 409 . 1 1 35 35 ILE HG13 H 1 1.658 0.020 . 1 . . . . 95 ILE HG13 . 7208 2 410 . 1 1 35 35 ILE HG21 H 1 0.953 0.020 . 1 . . . . 95 ILE HG2 . 7208 2 411 . 1 1 35 35 ILE HG22 H 1 0.953 0.020 . 1 . . . . 95 ILE HG2 . 7208 2 412 . 1 1 35 35 ILE HG23 H 1 0.953 0.020 . 1 . . . . 95 ILE HG2 . 7208 2 413 . 1 1 35 35 ILE HD11 H 1 0.833 0.020 . 1 . . . . 95 ILE HD1 . 7208 2 414 . 1 1 35 35 ILE HD12 H 1 0.833 0.020 . 1 . . . . 95 ILE HD1 . 7208 2 415 . 1 1 35 35 ILE HD13 H 1 0.833 0.020 . 1 . . . . 95 ILE HD1 . 7208 2 416 . 1 1 35 35 ILE C C 13 175.821 0.400 . 1 . . . . 95 ILE C . 7208 2 417 . 1 1 35 35 ILE CA C 13 63.238 0.400 . 1 . . . . 95 ILE CA . 7208 2 418 . 1 1 35 35 ILE CB C 13 37.899 0.400 . 1 . . . . 95 ILE CB . 7208 2 419 . 1 1 35 35 ILE CG1 C 13 28.207 0.400 . 1 . . . . 95 ILE CG1 . 7208 2 420 . 1 1 35 35 ILE CG2 C 13 17.934 0.400 . 1 . . . . 95 ILE CG2 . 7208 2 421 . 1 1 35 35 ILE CD1 C 13 14.052 0.400 . 1 . . . . 95 ILE CD1 . 7208 2 422 . 1 1 35 35 ILE N N 15 113.349 0.400 . 1 . . . . 95 ILE N . 7208 2 423 . 1 1 36 36 ARG H H 1 7.565 0.020 . 1 . . . . 96 ARG H . 7208 2 424 . 1 1 36 36 ARG HA H 1 4.225 0.020 . 1 . . . . 96 ARG HA . 7208 2 425 . 1 1 36 36 ARG HB2 H 1 1.858 0.020 . 1 . . . . 96 ARG HB2 . 7208 2 426 . 1 1 36 36 ARG HB3 H 1 1.978 0.020 . 1 . . . . 96 ARG HB3 . 7208 2 427 . 1 1 36 36 ARG HG2 H 1 1.730 0.020 . 2 . . . . 96 ARG HG2 . 7208 2 428 . 1 1 36 36 ARG HG3 H 1 1.683 0.020 . 2 . . . . 96 ARG HG3 . 7208 2 429 . 1 1 36 36 ARG HD2 H 1 3.191 0.020 . 1 . . . . 96 ARG HD2 . 7208 2 430 . 1 1 36 36 ARG HD3 H 1 3.191 0.020 . 1 . . . . 96 ARG HD3 . 7208 2 431 . 1 1 36 36 ARG HE H 1 7.350 0.020 . 1 . . . . 96 ARG HE . 7208 2 432 . 1 1 36 36 ARG HH11 H 1 6.820 0.020 . 1 . . . . 96 ARG HH11 . 7208 2 433 . 1 1 36 36 ARG HH12 H 1 6.820 0.020 . 1 . . . . 96 ARG HH12 . 7208 2 434 . 1 1 36 36 ARG C C 13 175.532 0.400 . 1 . . . . 96 ARG C . 7208 2 435 . 1 1 36 36 ARG CA C 13 56.986 0.400 . 1 . . . . 96 ARG CA . 7208 2 436 . 1 1 36 36 ARG CB C 13 30.181 0.400 . 1 . . . . 96 ARG CB . 7208 2 437 . 1 1 36 36 ARG CG C 13 27.637 0.400 . 1 . . . . 96 ARG CG . 7208 2 438 . 1 1 36 36 ARG CD C 13 43.552 0.400 . 1 . . . . 96 ARG CD . 7208 2 439 . 1 1 36 36 ARG N N 15 114.358 0.400 . 1 . . . . 96 ARG N . 7208 2 440 . 1 1 36 36 ARG NE N 15 80.739 0.400 . 1 . . . . 96 ARG NE . 7208 2 441 . 1 1 37 37 ARG H H 1 7.737 0.020 . 1 . . . . 97 ARG H . 7208 2 442 . 1 1 37 37 ARG HA H 1 4.341 0.020 . 1 . . . . 97 ARG HA . 7208 2 443 . 1 1 37 37 ARG HB2 H 1 1.721 0.020 . 1 . . . . 97 ARG HB2 . 7208 2 444 . 1 1 37 37 ARG HB3 H 1 1.895 0.020 . 1 . . . . 97 ARG HB3 . 7208 2 445 . 1 1 37 37 ARG HG2 H 1 1.557 0.020 . 1 . . . . 97 ARG HG2 . 7208 2 446 . 1 1 37 37 ARG HG3 H 1 1.557 0.020 . 1 . . . . 97 ARG HG3 . 7208 2 447 . 1 1 37 37 ARG HD2 H 1 3.059 0.020 . 1 . . . . 97 ARG HD2 . 7208 2 448 . 1 1 37 37 ARG HD3 H 1 3.059 0.020 . 1 . . . . 97 ARG HD3 . 7208 2 449 . 1 1 37 37 ARG HE H 1 7.324 0.020 . 1 . . . . 97 ARG HE . 7208 2 450 . 1 1 37 37 ARG HH11 H 1 6.679 0.020 . 1 . . . . 97 ARG HH11 . 7208 2 451 . 1 1 37 37 ARG HH12 H 1 6.679 0.020 . 1 . . . . 97 ARG HH12 . 7208 2 452 . 1 1 37 37 ARG CA C 13 55.340 0.400 . 1 . . . . 97 ARG CA . 7208 2 453 . 1 1 37 37 ARG CB C 13 30.579 0.400 . 1 . . . . 97 ARG CB . 7208 2 454 . 1 1 37 37 ARG CG C 13 26.872 0.400 . 1 . . . . 97 ARG CG . 7208 2 455 . 1 1 37 37 ARG CD C 13 43.146 0.400 . 1 . . . . 97 ARG CD . 7208 2 456 . 1 1 37 37 ARG N N 15 113.967 0.400 . 1 . . . . 97 ARG N . 7208 2 457 . 1 1 37 37 ARG NE N 15 80.691 0.400 . 1 . . . . 97 ARG NE . 7208 2 458 . 1 1 38 38 LEU H H 1 7.404 0.020 . 1 . . . . 98 LEU H . 7208 2 459 . 1 1 38 38 LEU HA H 1 4.181 0.020 . 1 . . . . 98 LEU HA . 7208 2 460 . 1 1 38 38 LEU HB2 H 1 1.713 0.020 . 1 . . . . 98 LEU HB2 . 7208 2 461 . 1 1 38 38 LEU HB3 H 1 1.603 0.020 . 1 . . . . 98 LEU HB3 . 7208 2 462 . 1 1 38 38 LEU HG H 1 1.579 0.020 . 1 . . . . 98 LEU HG . 7208 2 463 . 1 1 38 38 LEU HD11 H 1 0.873 0.020 . 2 . . . . 98 LEU HD1 . 7208 2 464 . 1 1 38 38 LEU HD12 H 1 0.873 0.020 . 2 . . . . 98 LEU HD1 . 7208 2 465 . 1 1 38 38 LEU HD13 H 1 0.873 0.020 . 2 . . . . 98 LEU HD1 . 7208 2 466 . 1 1 38 38 LEU CA C 13 56.092 0.400 . 1 . . . . 98 LEU CA . 7208 2 467 . 1 1 38 38 LEU CB C 13 43.162 0.400 . 1 . . . . 98 LEU CB . 7208 2 468 . 1 1 38 38 LEU CD1 C 13 23.733 0.400 . 1 . . . . 98 LEU CD1 . 7208 2 469 . 1 1 38 38 LEU N N 15 120.975 0.400 . 1 . . . . 98 LEU N . 7208 2 stop_ save_