################################### # 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15850 _Assigned_chem_shift_list.ID 1 _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 $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.3 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 15850 1 2 '2D 1H-13C HSQC' . . . 15850 1 3 '3D 1H-13C NOESY ARO' . . . 15850 1 4 '3D 1H-13C-15N SIM NOESY' . . . 15850 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 7 $SPARKY . . 15850 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.690 0.02 . 1 . . . . . 1 Met HA . 15850 1 2 . 1 1 1 1 MET HB2 H 1 3.136 0.02 . 2 . . . . . 1 Met HB2 . 15850 1 3 . 1 1 1 1 MET HB3 H 1 3.136 0.02 . 2 . . . . . 1 Met HB3 . 15850 1 4 . 1 1 1 1 MET HE1 H 1 2.218 0.02 . 1 . . . . . 1 Met HE . 15850 1 5 . 1 1 1 1 MET HE2 H 1 2.218 0.02 . 1 . . . . . 1 Met HE . 15850 1 6 . 1 1 1 1 MET HE3 H 1 2.218 0.02 . 1 . . . . . 1 Met HE . 15850 1 7 . 1 1 1 1 MET CA C 13 56.060 0.3 . 1 . . . . . 1 Met CA . 15850 1 8 . 1 1 1 1 MET CB C 13 30.470 0.3 . 1 . . . . . 1 Met CB . 15850 1 9 . 1 1 1 1 MET CE C 13 16.985 0.3 . 1 . . . . . 1 Met CE . 15850 1 10 . 1 1 2 2 GLU HA H 1 4.420 0.02 . 1 . . . . . 2 Glu HA . 15850 1 11 . 1 1 2 2 GLU HB3 H 1 1.981 0.02 . 2 . . . . . 2 Glu HB3 . 15850 1 12 . 1 1 2 2 GLU C C 13 176.068 0.3 . 1 . . . . . 2 Glu C . 15850 1 13 . 1 1 2 2 GLU CA C 13 56.254 0.3 . 1 . . . . . 2 Glu CA . 15850 1 14 . 1 1 2 2 GLU CB C 13 30.433 0.3 . 1 . . . . . 2 Glu CB . 15850 1 15 . 1 1 3 3 ARG H H 1 8.658 0.02 . 1 . . . . . 3 Arg H . 15850 1 16 . 1 1 3 3 ARG HA H 1 4.398 0.02 . 1 . . . . . 3 Arg HA . 15850 1 17 . 1 1 3 3 ARG HB2 H 1 1.925 0.02 . 2 . . . . . 3 Arg HB2 . 15850 1 18 . 1 1 3 3 ARG HB3 H 1 1.972 0.02 . 2 . . . . . 3 Arg HB3 . 15850 1 19 . 1 1 3 3 ARG HD2 H 1 3.315 0.02 . 2 . . . . . 3 Arg HD2 . 15850 1 20 . 1 1 3 3 ARG HD3 H 1 3.315 0.02 . 2 . . . . . 3 Arg HD3 . 15850 1 21 . 1 1 3 3 ARG HG2 H 1 1.777 0.02 . 2 . . . . . 3 Arg HG2 . 15850 1 22 . 1 1 3 3 ARG HG3 H 1 1.777 0.02 . 2 . . . . . 3 Arg HG3 . 15850 1 23 . 1 1 3 3 ARG C C 13 176.175 0.3 . 1 . . . . . 3 Arg C . 15850 1 24 . 1 1 3 3 ARG CA C 13 56.378 0.3 . 1 . . . . . 3 Arg CA . 15850 1 25 . 1 1 3 3 ARG CB C 13 30.817 0.3 . 1 . . . . . 3 Arg CB . 15850 1 26 . 1 1 3 3 ARG CD C 13 43.579 0.3 . 1 . . . . . 3 Arg CD . 15850 1 27 . 1 1 3 3 ARG CG C 13 27.267 0.3 . 1 . . . . . 3 Arg CG . 15850 1 28 . 1 1 3 3 ARG N N 15 123.161 0.3 . 1 . . . . . 3 Arg N . 15850 1 29 . 1 1 4 4 ALA H H 1 8.555 0.02 . 1 . . . . . 4 Ala H . 15850 1 30 . 1 1 4 4 ALA HA H 1 4.423 0.02 . 1 . . . . . 4 Ala HA . 15850 1 31 . 1 1 4 4 ALA HB1 H 1 1.511 0.02 . 1 . . . . . 4 Ala HB . 15850 1 32 . 1 1 4 4 ALA HB2 H 1 1.511 0.02 . 1 . . . . . 4 Ala HB . 15850 1 33 . 1 1 4 4 ALA HB3 H 1 1.511 0.02 . 1 . . . . . 4 Ala HB . 15850 1 34 . 1 1 4 4 ALA C C 13 177.937 0.3 . 1 . . . . . 4 Ala C . 15850 1 35 . 1 1 4 4 ALA CA C 13 52.895 0.3 . 1 . . . . . 4 Ala CA . 15850 1 36 . 1 1 4 4 ALA CB C 13 19.351 0.3 . 1 . . . . . 4 Ala CB . 15850 1 37 . 1 1 4 4 ALA N N 15 125.466 0.3 . 1 . . . . . 4 Ala N . 15850 1 38 . 1 1 5 5 SER H H 1 8.343 0.02 . 1 . . . . . 5 Ser H . 15850 1 39 . 1 1 5 5 SER HA H 1 4.503 0.02 . 1 . . . . . 5 Ser HA . 15850 1 40 . 1 1 5 5 SER HB2 H 1 3.962 0.02 . 2 . . . . . 5 Ser HB2 . 15850 1 41 . 1 1 5 5 SER HB3 H 1 3.997 0.02 . 2 . . . . . 5 Ser HB3 . 15850 1 42 . 1 1 5 5 SER C C 13 174.781 0.3 . 1 . . . . . 5 Ser C . 15850 1 43 . 1 1 5 5 SER CA C 13 58.497 0.3 . 1 . . . . . 5 Ser CA . 15850 1 44 . 1 1 5 5 SER CB C 13 63.885 0.3 . 1 . . . . . 5 Ser CB . 15850 1 45 . 1 1 5 5 SER N N 15 114.871 0.3 . 1 . . . . . 5 Ser N . 15850 1 46 . 1 1 6 6 LEU H H 1 8.280 0.02 . 1 . . . . . 6 Leu H . 15850 1 47 . 1 1 6 6 LEU HA H 1 4.420 0.02 . 1 . . . . . 6 Leu HA . 15850 1 48 . 1 1 6 6 LEU HB2 H 1 1.691 0.02 . 2 . . . . . 6 Leu HB2 . 15850 1 49 . 1 1 6 6 LEU HB3 H 1 1.752 0.02 . 2 . . . . . 6 Leu HB3 . 15850 1 50 . 1 1 6 6 LEU HD11 H 1 0.980 0.02 . 1 . . . . . 6 Leu HD1 . 15850 1 51 . 1 1 6 6 LEU HD12 H 1 0.980 0.02 . 1 . . . . . 6 Leu HD1 . 15850 1 52 . 1 1 6 6 LEU HD13 H 1 0.980 0.02 . 1 . . . . . 6 Leu HD1 . 15850 1 53 . 1 1 6 6 LEU HD21 H 1 0.909 0.02 . 1 . . . . . 6 Leu HD2 . 15850 1 54 . 1 1 6 6 LEU HD22 H 1 0.909 0.02 . 1 . . . . . 6 Leu HD2 . 15850 1 55 . 1 1 6 6 LEU HD23 H 1 0.909 0.02 . 1 . . . . . 6 Leu HD2 . 15850 1 56 . 1 1 6 6 LEU C C 13 177.123 0.3 . 1 . . . . . 6 Leu C . 15850 1 57 . 1 1 6 6 LEU CA C 13 55.440 0.3 . 1 . . . . . 6 Leu CA . 15850 1 58 . 1 1 6 6 LEU CB C 13 42.460 0.3 . 1 . . . . . 6 Leu CB . 15850 1 59 . 1 1 6 6 LEU CD1 C 13 25.087 0.3 . 1 . . . . . 6 Leu CD1 . 15850 1 60 . 1 1 6 6 LEU CD2 C 13 23.682 0.3 . 1 . . . . . 6 Leu CD2 . 15850 1 61 . 1 1 6 6 LEU N N 15 123.798 0.3 . 1 . . . . . 6 Leu N . 15850 1 62 . 1 1 7 7 ASN H H 1 8.415 0.02 . 1 . . . . . 7 Asn H . 15850 1 63 . 1 1 7 7 ASN HA H 1 4.747 0.02 . 1 . . . . . 7 Asn HA . 15850 1 64 . 1 1 7 7 ASN HB2 H 1 2.896 0.02 . 2 . . . . . 7 Asn HB2 . 15850 1 65 . 1 1 7 7 ASN HB3 H 1 2.811 0.02 . 2 . . . . . 7 Asn HB3 . 15850 1 66 . 1 1 7 7 ASN HD21 H 1 7.649 0.02 . 1 . . . . . 7 Asn HD21 . 15850 1 67 . 1 1 7 7 ASN HD22 H 1 6.976 0.02 . 1 . . . . . 7 Asn HD22 . 15850 1 68 . 1 1 7 7 ASN C C 13 174.762 0.3 . 1 . . . . . 7 Asn C . 15850 1 69 . 1 1 7 7 ASN CA C 13 53.402 0.3 . 1 . . . . . 7 Asn CA . 15850 1 70 . 1 1 7 7 ASN CB C 13 38.856 0.3 . 1 . . . . . 7 Asn CB . 15850 1 71 . 1 1 7 7 ASN CG C 13 176.984 0.3 . 1 . . . . . 7 Asn CG . 15850 1 72 . 1 1 7 7 ASN N N 15 118.923 0.3 . 1 . . . . . 7 Asn N . 15850 1 73 . 1 1 7 7 ASN ND2 N 15 112.786 0.3 . 1 . . . . . 7 Asn ND2 . 15850 1 74 . 1 1 8 8 ARG H H 1 8.173 0.02 . 1 . . . . . 8 Arg H . 15850 1 75 . 1 1 8 8 ARG HA H 1 4.345 0.02 . 1 . . . . . 8 Arg HA . 15850 1 76 . 1 1 8 8 ARG HB2 H 1 2.021 0.02 . 2 . . . . . 8 Arg HB2 . 15850 1 77 . 1 1 8 8 ARG HB3 H 1 1.942 0.02 . 2 . . . . . 8 Arg HB3 . 15850 1 78 . 1 1 8 8 ARG HD2 H 1 3.315 0.02 . 2 . . . . . 8 Arg HD2 . 15850 1 79 . 1 1 8 8 ARG HD3 H 1 3.315 0.02 . 2 . . . . . 8 Arg HD3 . 15850 1 80 . 1 1 8 8 ARG C C 13 175.867 0.3 . 1 . . . . . 8 Arg C . 15850 1 81 . 1 1 8 8 ARG CA C 13 56.204 0.3 . 1 . . . . . 8 Arg CA . 15850 1 82 . 1 1 8 8 ARG CB C 13 30.860 0.3 . 1 . . . . . 8 Arg CB . 15850 1 83 . 1 1 8 8 ARG CD C 13 43.579 0.3 . 1 . . . . . 8 Arg CD . 15850 1 84 . 1 1 8 8 ARG N N 15 120.976 0.3 . 1 . . . . . 8 Arg N . 15850 1 85 . 1 1 9 9 ILE H H 1 8.113 0.02 . 1 . . . . . 9 Ile H . 15850 1 86 . 1 1 9 9 ILE HA H 1 4.219 0.02 . 1 . . . . . 9 Ile HA . 15850 1 87 . 1 1 9 9 ILE HB H 1 1.875 0.02 . 1 . . . . . 9 Ile HB . 15850 1 88 . 1 1 9 9 ILE HD11 H 1 0.912 0.02 . 1 . . . . . 9 Ile HD1 . 15850 1 89 . 1 1 9 9 ILE HD12 H 1 0.912 0.02 . 1 . . . . . 9 Ile HD1 . 15850 1 90 . 1 1 9 9 ILE HD13 H 1 0.912 0.02 . 1 . . . . . 9 Ile HD1 . 15850 1 91 . 1 1 9 9 ILE HG12 H 1 1.527 0.02 . 2 . . . . . 9 Ile HG12 . 15850 1 92 . 1 1 9 9 ILE HG13 H 1 1.235 0.02 . 2 . . . . . 9 Ile HG13 . 15850 1 93 . 1 1 9 9 ILE HG21 H 1 0.947 0.02 . 1 . . . . . 9 Ile HG2 . 15850 1 94 . 1 1 9 9 ILE HG22 H 1 0.947 0.02 . 1 . . . . . 9 Ile HG2 . 15850 1 95 . 1 1 9 9 ILE HG23 H 1 0.947 0.02 . 1 . . . . . 9 Ile HG2 . 15850 1 96 . 1 1 9 9 ILE C C 13 176.131 0.3 . 1 . . . . . 9 Ile C . 15850 1 97 . 1 1 9 9 ILE CA C 13 61.482 0.3 . 1 . . . . . 9 Ile CA . 15850 1 98 . 1 1 9 9 ILE CB C 13 38.658 0.3 . 1 . . . . . 9 Ile CB . 15850 1 99 . 1 1 9 9 ILE CD1 C 13 13.027 0.3 . 1 . . . . . 9 Ile CD1 . 15850 1 100 . 1 1 9 9 ILE CG1 C 13 27.385 0.3 . 1 . . . . . 9 Ile CG1 . 15850 1 101 . 1 1 9 9 ILE CG2 C 13 17.671 0.3 . 1 . . . . . 9 Ile CG2 . 15850 1 102 . 1 1 9 9 ILE N N 15 121.815 0.3 . 1 . . . . . 9 Ile N . 15850 1 103 . 1 1 10 10 GLY H H 1 8.648 0.02 . 1 . . . . . 10 Gly H . 15850 1 104 . 1 1 10 10 GLY HA2 H 1 3.958 0.02 . 2 . . . . . 10 Gly HA2 . 15850 1 105 . 1 1 10 10 GLY HA3 H 1 3.958 0.02 . 2 . . . . . 10 Gly HA3 . 15850 1 106 . 1 1 10 10 GLY C C 13 173.279 0.3 . 1 . . . . . 10 Gly C . 15850 1 107 . 1 1 10 10 GLY CA C 13 45.289 0.3 . 1 . . . . . 10 Gly CA . 15850 1 108 . 1 1 10 10 GLY N N 15 113.366 0.3 . 1 . . . . . 10 Gly N . 15850 1 109 . 1 1 11 11 LYS H H 1 8.424 0.02 . 1 . . . . . 11 Lys H . 15850 1 110 . 1 1 11 11 LYS HA H 1 4.434 0.02 . 1 . . . . . 11 Lys HA . 15850 1 111 . 1 1 11 11 LYS HB2 H 1 2.048 0.02 . 2 . . . . . 11 Lys HB2 . 15850 1 112 . 1 1 11 11 LYS HB3 H 1 2.016 0.02 . 2 . . . . . 11 Lys HB3 . 15850 1 113 . 1 1 11 11 LYS HD2 H 1 1.824 0.02 . 2 . . . . . 11 Lys HD2 . 15850 1 114 . 1 1 11 11 LYS HD3 H 1 1.824 0.02 . 2 . . . . . 11 Lys HD3 . 15850 1 115 . 1 1 11 11 LYS HE2 H 1 3.150 0.02 . 2 . . . . . 11 Lys HE2 . 15850 1 116 . 1 1 11 11 LYS HE3 H 1 3.150 0.02 . 2 . . . . . 11 Lys HE3 . 15850 1 117 . 1 1 11 11 LYS HG2 H 1 1.707 0.02 . 2 . . . . . 11 Lys HG2 . 15850 1 118 . 1 1 11 11 LYS HG3 H 1 1.575 0.02 . 2 . . . . . 11 Lys HG3 . 15850 1 119 . 1 1 11 11 LYS C C 13 176.426 0.3 . 1 . . . . . 11 Lys C . 15850 1 120 . 1 1 11 11 LYS CA C 13 57.428 0.3 . 1 . . . . . 11 Lys CA . 15850 1 121 . 1 1 11 11 LYS CB C 13 33.430 0.3 . 1 . . . . . 11 Lys CB . 15850 1 122 . 1 1 11 11 LYS CD C 13 28.840 0.3 . 1 . . . . . 11 Lys CD . 15850 1 123 . 1 1 11 11 LYS CE C 13 42.010 0.3 . 1 . . . . . 11 Lys CE . 15850 1 124 . 1 1 11 11 LYS CG C 13 25.549 0.3 . 1 . . . . . 11 Lys CG . 15850 1 125 . 1 1 11 11 LYS N N 15 121.351 0.3 . 1 . . . . . 11 Lys N . 15850 1 126 . 1 1 12 12 ASP H H 1 8.892 0.02 . 1 . . . . . 12 Asp H . 15850 1 127 . 1 1 12 12 ASP HA H 1 5.067 0.02 . 1 . . . . . 12 Asp HA . 15850 1 128 . 1 1 12 12 ASP HB2 H 1 2.845 0.02 . 2 . . . . . 12 Asp HB2 . 15850 1 129 . 1 1 12 12 ASP HB3 H 1 2.957 0.02 . 2 . . . . . 12 Asp HB3 . 15850 1 130 . 1 1 12 12 ASP C C 13 174.469 0.3 . 1 . . . . . 12 Asp C . 15850 1 131 . 1 1 12 12 ASP CA C 13 54.164 0.3 . 1 . . . . . 12 Asp CA . 15850 1 132 . 1 1 12 12 ASP CB C 13 42.856 0.3 . 1 . . . . . 12 Asp CB . 15850 1 133 . 1 1 12 12 ASP N N 15 119.962 0.3 . 1 . . . . . 12 Asp N . 15850 1 134 . 1 1 13 13 VAL H H 1 7.745 0.02 . 1 . . . . . 13 Val H . 15850 1 135 . 1 1 13 13 VAL HA H 1 4.863 0.02 . 1 . . . . . 13 Val HA . 15850 1 136 . 1 1 13 13 VAL HB H 1 1.767 0.02 . 1 . . . . . 13 Val HB . 15850 1 137 . 1 1 13 13 VAL HG11 H 1 0.484 0.02 . 1 . . . . . 13 Val HG1 . 15850 1 138 . 1 1 13 13 VAL HG12 H 1 0.484 0.02 . 1 . . . . . 13 Val HG1 . 15850 1 139 . 1 1 13 13 VAL HG13 H 1 0.484 0.02 . 1 . . . . . 13 Val HG1 . 15850 1 140 . 1 1 13 13 VAL HG21 H 1 0.867 0.02 . 1 . . . . . 13 Val HG2 . 15850 1 141 . 1 1 13 13 VAL HG22 H 1 0.867 0.02 . 1 . . . . . 13 Val HG2 . 15850 1 142 . 1 1 13 13 VAL HG23 H 1 0.867 0.02 . 1 . . . . . 13 Val HG2 . 15850 1 143 . 1 1 13 13 VAL C C 13 174.815 0.3 . 1 . . . . . 13 Val C . 15850 1 144 . 1 1 13 13 VAL CA C 13 61.236 0.3 . 1 . . . . . 13 Val CA . 15850 1 145 . 1 1 13 13 VAL CB C 13 33.908 0.3 . 1 . . . . . 13 Val CB . 15850 1 146 . 1 1 13 13 VAL CG1 C 13 21.434 0.3 . 1 . . . . . 13 Val CG1 . 15850 1 147 . 1 1 13 13 VAL CG2 C 13 21.781 0.3 . 1 . . . . . 13 Val CG2 . 15850 1 148 . 1 1 13 13 VAL N N 15 120.886 0.3 . 1 . . . . . 13 Val N . 15850 1 149 . 1 1 14 14 TYR H H 1 8.718 0.02 . 1 . . . . . 14 Tyr H . 15850 1 150 . 1 1 14 14 TYR HA H 1 4.892 0.02 . 1 . . . . . 14 Tyr HA . 15850 1 151 . 1 1 14 14 TYR HB2 H 1 2.764 0.02 . 2 . . . . . 14 Tyr HB2 . 15850 1 152 . 1 1 14 14 TYR HB3 H 1 2.236 0.02 . 2 . . . . . 14 Tyr HB3 . 15850 1 153 . 1 1 14 14 TYR HD1 H 1 6.684 0.02 . 3 . . . . . 14 Tyr HD1 . 15850 1 154 . 1 1 14 14 TYR HD2 H 1 6.684 0.02 . 3 . . . . . 14 Tyr HD2 . 15850 1 155 . 1 1 14 14 TYR HE1 H 1 6.691 0.02 . 3 . . . . . 14 Tyr HE1 . 15850 1 156 . 1 1 14 14 TYR HE2 H 1 6.691 0.02 . 3 . . . . . 14 Tyr HE2 . 15850 1 157 . 1 1 14 14 TYR C C 13 173.922 0.3 . 1 . . . . . 14 Tyr C . 15850 1 158 . 1 1 14 14 TYR CA C 13 56.661 0.3 . 1 . . . . . 14 Tyr CA . 15850 1 159 . 1 1 14 14 TYR CB C 13 44.704 0.3 . 1 . . . . . 14 Tyr CB . 15850 1 160 . 1 1 14 14 TYR CD1 C 13 132.368 0.3 . 3 . . . . . 14 Tyr CD1 . 15850 1 161 . 1 1 14 14 TYR CD2 C 13 132.368 0.3 . 3 . . . . . 14 Tyr CD2 . 15850 1 162 . 1 1 14 14 TYR CE1 C 13 118.200 0.3 . 3 . . . . . 14 Tyr CE1 . 15850 1 163 . 1 1 14 14 TYR CE2 C 13 118.200 0.3 . 3 . . . . . 14 Tyr CE2 . 15850 1 164 . 1 1 14 14 TYR N N 15 123.305 0.3 . 1 . . . . . 14 Tyr N . 15850 1 165 . 1 1 15 15 TYR H H 1 9.633 0.02 . 1 . . . . . 15 Tyr H . 15850 1 166 . 1 1 15 15 TYR HA H 1 5.616 0.02 . 1 . . . . . 15 Tyr HA . 15850 1 167 . 1 1 15 15 TYR HB2 H 1 2.974 0.02 . 2 . . . . . 15 Tyr HB2 . 15850 1 168 . 1 1 15 15 TYR HB3 H 1 3.165 0.02 . 2 . . . . . 15 Tyr HB3 . 15850 1 169 . 1 1 15 15 TYR HD1 H 1 7.276 0.02 . 3 . . . . . 15 Tyr HD1 . 15850 1 170 . 1 1 15 15 TYR HD2 H 1 7.268 0.02 . 3 . . . . . 15 Tyr HD2 . 15850 1 171 . 1 1 15 15 TYR HE1 H 1 6.684 0.02 . 3 . . . . . 15 Tyr HE1 . 15850 1 172 . 1 1 15 15 TYR HE2 H 1 6.684 0.02 . 3 . . . . . 15 Tyr HE2 . 15850 1 173 . 1 1 15 15 TYR C C 13 175.280 0.3 . 1 . . . . . 15 Tyr C . 15850 1 174 . 1 1 15 15 TYR CA C 13 57.552 0.3 . 1 . . . . . 15 Tyr CA . 15850 1 175 . 1 1 15 15 TYR CB C 13 42.336 0.3 . 1 . . . . . 15 Tyr CB . 15850 1 176 . 1 1 15 15 TYR CD1 C 13 133.810 0.3 . 3 . . . . . 15 Tyr CD1 . 15850 1 177 . 1 1 15 15 TYR CD2 C 13 133.818 0.3 . 3 . . . . . 15 Tyr CD2 . 15850 1 178 . 1 1 15 15 TYR CE1 C 13 117.597 0.3 . 3 . . . . . 15 Tyr CE1 . 15850 1 179 . 1 1 15 15 TYR CE2 C 13 117.597 0.3 . 3 . . . . . 15 Tyr CE2 . 15850 1 180 . 1 1 15 15 TYR N N 15 117.808 0.3 . 1 . . . . . 15 Tyr N . 15850 1 181 . 1 1 16 16 MET H H 1 9.001 0.02 . 1 . . . . . 16 Met H . 15850 1 182 . 1 1 16 16 MET HA H 1 5.198 0.02 . 1 . . . . . 16 Met HA . 15850 1 183 . 1 1 16 16 MET HB2 H 1 2.068 0.02 . 2 . . . . . 16 Met HB2 . 15850 1 184 . 1 1 16 16 MET HB3 H 1 1.716 0.02 . 2 . . . . . 16 Met HB3 . 15850 1 185 . 1 1 16 16 MET HE1 H 1 1.847 0.02 . 1 . . . . . 16 Met HE . 15850 1 186 . 1 1 16 16 MET HE2 H 1 1.847 0.02 . 1 . . . . . 16 Met HE . 15850 1 187 . 1 1 16 16 MET HE3 H 1 1.847 0.02 . 1 . . . . . 16 Met HE . 15850 1 188 . 1 1 16 16 MET HG2 H 1 2.637 0.02 . 2 . . . . . 16 Met HG2 . 15850 1 189 . 1 1 16 16 MET HG3 H 1 2.637 0.02 . 2 . . . . . 16 Met HG3 . 15850 1 190 . 1 1 16 16 MET C C 13 172.659 0.3 . 1 . . . . . 16 Met C . 15850 1 191 . 1 1 16 16 MET CA C 13 54.829 0.3 . 1 . . . . . 16 Met CA . 15850 1 192 . 1 1 16 16 MET CB C 13 42.112 0.3 . 1 . . . . . 16 Met CB . 15850 1 193 . 1 1 16 16 MET CE C 13 17.715 0.3 . 1 . . . . . 16 Met CE . 15850 1 194 . 1 1 16 16 MET CG C 13 30.614 0.3 . 1 . . . . . 16 Met CG . 15850 1 195 . 1 1 16 16 MET N N 15 122.443 0.3 . 1 . . . . . 16 Met N . 15850 1 196 . 1 1 17 17 GLN H H 1 8.725 0.02 . 1 . . . . . 17 Gln H . 15850 1 197 . 1 1 17 17 GLN HA H 1 5.017 0.02 . 1 . . . . . 17 Gln HA . 15850 1 198 . 1 1 17 17 GLN HB2 H 1 1.832 0.02 . 2 . . . . . 17 Gln HB2 . 15850 1 199 . 1 1 17 17 GLN HB3 H 1 0.949 0.02 . 2 . . . . . 17 Gln HB3 . 15850 1 200 . 1 1 17 17 GLN HE21 H 1 7.327 0.02 . 1 . . . . . 17 Gln HE21 . 15850 1 201 . 1 1 17 17 GLN HE22 H 1 6.844 0.02 . 1 . . . . . 17 Gln HE22 . 15850 1 202 . 1 1 17 17 GLN HG2 H 1 1.770 0.02 . 2 . . . . . 17 Gln HG2 . 15850 1 203 . 1 1 17 17 GLN HG3 H 1 1.346 0.02 . 2 . . . . . 17 Gln HG3 . 15850 1 204 . 1 1 17 17 GLN C C 13 175.345 0.3 . 1 . . . . . 17 Gln C . 15850 1 205 . 1 1 17 17 GLN CA C 13 53.412 0.3 . 1 . . . . . 17 Gln CA . 15850 1 206 . 1 1 17 17 GLN CB C 13 31.460 0.3 . 1 . . . . . 17 Gln CB . 15850 1 207 . 1 1 17 17 GLN CG C 13 34.004 0.3 . 1 . . . . . 17 Gln CG . 15850 1 208 . 1 1 17 17 GLN N N 15 124.981 0.3 . 1 . . . . . 17 Gln N . 15850 1 209 . 1 1 17 17 GLN NE2 N 15 113.500 0.3 . 1 . . . . . 17 Gln NE2 . 15850 1 210 . 1 1 18 18 ILE H H 1 8.811 0.02 . 1 . . . . . 18 Ile H . 15850 1 211 . 1 1 18 18 ILE HA H 1 3.720 0.02 . 1 . . . . . 18 Ile HA . 15850 1 212 . 1 1 18 18 ILE HB H 1 2.063 0.02 . 1 . . . . . 18 Ile HB . 15850 1 213 . 1 1 18 18 ILE HD11 H 1 0.278 0.02 . 1 . . . . . 18 Ile HD1 . 15850 1 214 . 1 1 18 18 ILE HD12 H 1 0.278 0.02 . 1 . . . . . 18 Ile HD1 . 15850 1 215 . 1 1 18 18 ILE HD13 H 1 0.278 0.02 . 1 . . . . . 18 Ile HD1 . 15850 1 216 . 1 1 18 18 ILE HG12 H 1 1.041 0.02 . 2 . . . . . 18 Ile HG12 . 15850 1 217 . 1 1 18 18 ILE HG13 H 1 1.286 0.02 . 2 . . . . . 18 Ile HG13 . 15850 1 218 . 1 1 18 18 ILE HG21 H 1 0.504 0.02 . 1 . . . . . 18 Ile HG2 . 15850 1 219 . 1 1 18 18 ILE HG22 H 1 0.504 0.02 . 1 . . . . . 18 Ile HG2 . 15850 1 220 . 1 1 18 18 ILE HG23 H 1 0.504 0.02 . 1 . . . . . 18 Ile HG2 . 15850 1 221 . 1 1 18 18 ILE C C 13 175.870 0.3 . 1 . . . . . 18 Ile C . 15850 1 222 . 1 1 18 18 ILE CA C 13 60.335 0.3 . 1 . . . . . 18 Ile CA . 15850 1 223 . 1 1 18 18 ILE CB C 13 35.428 0.3 . 1 . . . . . 18 Ile CB . 15850 1 224 . 1 1 18 18 ILE CD1 C 13 9.210 0.3 . 1 . . . . . 18 Ile CD1 . 15850 1 225 . 1 1 18 18 ILE CG1 C 13 25.925 0.3 . 1 . . . . . 18 Ile CG1 . 15850 1 226 . 1 1 18 18 ILE CG2 C 13 17.587 0.3 . 1 . . . . . 18 Ile CG2 . 15850 1 227 . 1 1 18 18 ILE N N 15 126.576 0.3 . 1 . . . . . 18 Ile N . 15850 1 228 . 1 1 19 19 LYS H H 1 6.892 0.02 . 1 . . . . . 19 Lys H . 15850 1 229 . 1 1 19 19 LYS HA H 1 4.466 0.02 . 1 . . . . . 19 Lys HA . 15850 1 230 . 1 1 19 19 LYS HB2 H 1 1.985 0.02 . 2 . . . . . 19 Lys HB2 . 15850 1 231 . 1 1 19 19 LYS HB3 H 1 1.792 0.02 . 2 . . . . . 19 Lys HB3 . 15850 1 232 . 1 1 19 19 LYS HE2 H 1 3.190 0.02 . 2 . . . . . 19 Lys HE2 . 15850 1 233 . 1 1 19 19 LYS HE3 H 1 3.190 0.02 . 2 . . . . . 19 Lys HE3 . 15850 1 234 . 1 1 19 19 LYS HG2 H 1 1.484 0.02 . 2 . . . . . 19 Lys HG2 . 15850 1 235 . 1 1 19 19 LYS HG3 H 1 1.522 0.02 . 2 . . . . . 19 Lys HG3 . 15850 1 236 . 1 1 19 19 LYS C C 13 175.681 0.3 . 1 . . . . . 19 Lys C . 15850 1 237 . 1 1 19 19 LYS CA C 13 55.053 0.3 . 1 . . . . . 19 Lys CA . 15850 1 238 . 1 1 19 19 LYS CB C 13 36.074 0.3 . 1 . . . . . 19 Lys CB . 15850 1 239 . 1 1 19 19 LYS CE C 13 42.330 0.3 . 1 . . . . . 19 Lys CE . 15850 1 240 . 1 1 19 19 LYS CG C 13 24.890 0.3 . 1 . . . . . 19 Lys CG . 15850 1 241 . 1 1 19 19 LYS N N 15 125.959 0.3 . 1 . . . . . 19 Lys N . 15850 1 242 . 1 1 20 20 GLY H H 1 8.498 0.02 . 1 . . . . . 20 Gly H . 15850 1 243 . 1 1 20 20 GLY HA2 H 1 4.326 0.02 . 2 . . . . . 20 Gly HA2 . 15850 1 244 . 1 1 20 20 GLY HA3 H 1 4.061 0.02 . 2 . . . . . 20 Gly HA3 . 15850 1 245 . 1 1 20 20 GLY C C 13 172.778 0.3 . 1 . . . . . 20 Gly C . 15850 1 246 . 1 1 20 20 GLY CA C 13 45.228 0.3 . 1 . . . . . 20 Gly CA . 15850 1 247 . 1 1 20 20 GLY N N 15 108.333 0.3 . 1 . . . . . 20 Gly N . 15850 1 248 . 1 1 21 21 GLU H H 1 8.539 0.02 . 1 . . . . . 21 Glu H . 15850 1 249 . 1 1 21 21 GLU HA H 1 4.649 0.02 . 1 . . . . . 21 Glu HA . 15850 1 250 . 1 1 21 21 GLU HB2 H 1 2.223 0.02 . 2 . . . . . 21 Glu HB2 . 15850 1 251 . 1 1 21 21 GLU HB3 H 1 1.926 0.02 . 2 . . . . . 21 Glu HB3 . 15850 1 252 . 1 1 21 21 GLU HG2 H 1 2.387 0.02 . 2 . . . . . 21 Glu HG2 . 15850 1 253 . 1 1 21 21 GLU HG3 H 1 2.300 0.02 . 2 . . . . . 21 Glu HG3 . 15850 1 254 . 1 1 21 21 GLU C C 13 175.687 0.3 . 1 . . . . . 21 Glu C . 15850 1 255 . 1 1 21 21 GLU CA C 13 55.633 0.3 . 1 . . . . . 21 Glu CA . 15850 1 256 . 1 1 21 21 GLU CB C 13 31.520 0.3 . 1 . . . . . 21 Glu CB . 15850 1 257 . 1 1 21 21 GLU CG C 13 36.590 0.3 . 1 . . . . . 21 Glu CG . 15850 1 258 . 1 1 21 21 GLU N N 15 116.471 0.3 . 1 . . . . . 21 Glu N . 15850 1 259 . 1 1 22 22 GLY H H 1 8.576 0.02 . 1 . . . . . 22 Gly H . 15850 1 260 . 1 1 22 22 GLY HA2 H 1 3.583 0.02 . 2 . . . . . 22 Gly HA2 . 15850 1 261 . 1 1 22 22 GLY HA3 H 1 3.153 0.02 . 2 . . . . . 22 Gly HA3 . 15850 1 262 . 1 1 22 22 GLY C C 13 173.642 0.3 . 1 . . . . . 22 Gly C . 15850 1 263 . 1 1 22 22 GLY CA C 13 44.916 0.3 . 1 . . . . . 22 Gly CA . 15850 1 264 . 1 1 22 22 GLY N N 15 108.944 0.3 . 1 . . . . . 22 Gly N . 15850 1 265 . 1 1 23 23 THR H H 1 8.909 0.02 . 1 . . . . . 23 Thr H . 15850 1 266 . 1 1 23 23 THR HA H 1 4.581 0.02 . 1 . . . . . 23 Thr HA . 15850 1 267 . 1 1 23 23 THR HB H 1 3.974 0.02 . 1 . . . . . 23 Thr HB . 15850 1 268 . 1 1 23 23 THR HG21 H 1 1.210 0.02 . 1 . . . . . 23 Thr HG2 . 15850 1 269 . 1 1 23 23 THR HG22 H 1 1.210 0.02 . 1 . . . . . 23 Thr HG2 . 15850 1 270 . 1 1 23 23 THR HG23 H 1 1.210 0.02 . 1 . . . . . 23 Thr HG2 . 15850 1 271 . 1 1 23 23 THR C C 13 173.098 0.3 . 1 . . . . . 23 Thr C . 15850 1 272 . 1 1 23 23 THR CA C 13 61.139 0.3 . 1 . . . . . 23 Thr CA . 15850 1 273 . 1 1 23 23 THR CB C 13 71.821 0.3 . 1 . . . . . 23 Thr CB . 15850 1 274 . 1 1 23 23 THR CG2 C 13 21.788 0.3 . 1 . . . . . 23 Thr CG2 . 15850 1 275 . 1 1 23 23 THR N N 15 114.982 0.3 . 1 . . . . . 23 Thr N . 15850 1 276 . 1 1 24 24 ILE H H 1 8.502 0.02 . 1 . . . . . 24 Ile H . 15850 1 277 . 1 1 24 24 ILE HA H 1 4.855 0.02 . 1 . . . . . 24 Ile HA . 15850 1 278 . 1 1 24 24 ILE HB H 1 1.847 0.02 . 1 . . . . . 24 Ile HB . 15850 1 279 . 1 1 24 24 ILE HD11 H 1 0.824 0.02 . 1 . . . . . 24 Ile HD1 . 15850 1 280 . 1 1 24 24 ILE HD12 H 1 0.824 0.02 . 1 . . . . . 24 Ile HD1 . 15850 1 281 . 1 1 24 24 ILE HD13 H 1 0.824 0.02 . 1 . . . . . 24 Ile HD1 . 15850 1 282 . 1 1 24 24 ILE HG12 H 1 1.551 0.02 . 2 . . . . . 24 Ile HG12 . 15850 1 283 . 1 1 24 24 ILE HG13 H 1 1.224 0.02 . 2 . . . . . 24 Ile HG13 . 15850 1 284 . 1 1 24 24 ILE HG21 H 1 0.844 0.02 . 1 . . . . . 24 Ile HG2 . 15850 1 285 . 1 1 24 24 ILE HG22 H 1 0.844 0.02 . 1 . . . . . 24 Ile HG2 . 15850 1 286 . 1 1 24 24 ILE HG23 H 1 0.844 0.02 . 1 . . . . . 24 Ile HG2 . 15850 1 287 . 1 1 24 24 ILE C C 13 175.796 0.3 . 1 . . . . . 24 Ile C . 15850 1 288 . 1 1 24 24 ILE CA C 13 59.745 0.3 . 1 . . . . . 24 Ile CA . 15850 1 289 . 1 1 24 24 ILE CB C 13 38.463 0.3 . 1 . . . . . 24 Ile CB . 15850 1 290 . 1 1 24 24 ILE CD1 C 13 11.985 0.3 . 1 . . . . . 24 Ile CD1 . 15850 1 291 . 1 1 24 24 ILE CG1 C 13 27.442 0.3 . 1 . . . . . 24 Ile CG1 . 15850 1 292 . 1 1 24 24 ILE CG2 C 13 17.607 0.3 . 1 . . . . . 24 Ile CG2 . 15850 1 293 . 1 1 24 24 ILE N N 15 124.537 0.3 . 1 . . . . . 24 Ile N . 15850 1 294 . 1 1 25 25 GLU H H 1 8.982 0.02 . 1 . . . . . 25 Glu H . 15850 1 295 . 1 1 25 25 GLU HA H 1 4.567 0.02 . 1 . . . . . 25 Glu HA . 15850 1 296 . 1 1 25 25 GLU HB2 H 1 1.926 0.02 . 2 . . . . . 25 Glu HB2 . 15850 1 297 . 1 1 25 25 GLU HB3 H 1 1.772 0.02 . 2 . . . . . 25 Glu HB3 . 15850 1 298 . 1 1 25 25 GLU HG2 H 1 2.204 0.02 . 2 . . . . . 25 Glu HG2 . 15850 1 299 . 1 1 25 25 GLU HG3 H 1 2.071 0.02 . 2 . . . . . 25 Glu HG3 . 15850 1 300 . 1 1 25 25 GLU C C 13 173.942 0.3 . 1 . . . . . 25 Glu C . 15850 1 301 . 1 1 25 25 GLU CA C 13 54.803 0.3 . 1 . . . . . 25 Glu CA . 15850 1 302 . 1 1 25 25 GLU CB C 13 33.059 0.3 . 1 . . . . . 25 Glu CB . 15850 1 303 . 1 1 25 25 GLU CG C 13 35.795 0.3 . 1 . . . . . 25 Glu CG . 15850 1 304 . 1 1 25 25 GLU N N 15 128.960 0.3 . 1 . . . . . 25 Glu N . 15850 1 305 . 1 1 26 26 LYS H H 1 8.635 0.02 . 1 . . . . . 26 Lys H . 15850 1 306 . 1 1 26 26 LYS HA H 1 5.057 0.02 . 1 . . . . . 26 Lys HA . 15850 1 307 . 1 1 26 26 LYS HB2 H 1 1.778 0.02 . 2 . . . . . 26 Lys HB2 . 15850 1 308 . 1 1 26 26 LYS HB3 H 1 1.778 0.02 . 2 . . . . . 26 Lys HB3 . 15850 1 309 . 1 1 26 26 LYS HD2 H 1 1.691 0.02 . 2 . . . . . 26 Lys HD2 . 15850 1 310 . 1 1 26 26 LYS HD3 H 1 1.691 0.02 . 2 . . . . . 26 Lys HD3 . 15850 1 311 . 1 1 26 26 LYS HE2 H 1 3.008 0.02 . 2 . . . . . 26 Lys HE2 . 15850 1 312 . 1 1 26 26 LYS HE3 H 1 3.008 0.02 . 2 . . . . . 26 Lys HE3 . 15850 1 313 . 1 1 26 26 LYS HG2 H 1 1.369 0.02 . 2 . . . . . 26 Lys HG2 . 15850 1 314 . 1 1 26 26 LYS HG3 H 1 1.296 0.02 . 2 . . . . . 26 Lys HG3 . 15850 1 315 . 1 1 26 26 LYS C C 13 176.481 0.3 . 1 . . . . . 26 Lys C . 15850 1 316 . 1 1 26 26 LYS CA C 13 55.952 0.3 . 1 . . . . . 26 Lys CA . 15850 1 317 . 1 1 26 26 LYS CB C 13 32.900 0.3 . 1 . . . . . 26 Lys CB . 15850 1 318 . 1 1 26 26 LYS CD C 13 29.175 0.3 . 1 . . . . . 26 Lys CD . 15850 1 319 . 1 1 26 26 LYS CE C 13 41.733 0.3 . 1 . . . . . 26 Lys CE . 15850 1 320 . 1 1 26 26 LYS CG C 13 24.716 0.3 . 1 . . . . . 26 Lys CG . 15850 1 321 . 1 1 26 26 LYS N N 15 125.722 0.3 . 1 . . . . . 26 Lys N . 15850 1 322 . 1 1 27 27 VAL H H 1 8.823 0.02 . 1 . . . . . 27 Val H . 15850 1 323 . 1 1 27 27 VAL HA H 1 4.302 0.02 . 1 . . . . . 27 Val HA . 15850 1 324 . 1 1 27 27 VAL HB H 1 1.972 0.02 . 1 . . . . . 27 Val HB . 15850 1 325 . 1 1 27 27 VAL HG11 H 1 0.944 0.02 . 1 . . . . . 27 Val HG1 . 15850 1 326 . 1 1 27 27 VAL HG12 H 1 0.944 0.02 . 1 . . . . . 27 Val HG1 . 15850 1 327 . 1 1 27 27 VAL HG13 H 1 0.944 0.02 . 1 . . . . . 27 Val HG1 . 15850 1 328 . 1 1 27 27 VAL HG21 H 1 0.898 0.02 . 1 . . . . . 27 Val HG2 . 15850 1 329 . 1 1 27 27 VAL HG22 H 1 0.898 0.02 . 1 . . . . . 27 Val HG2 . 15850 1 330 . 1 1 27 27 VAL HG23 H 1 0.898 0.02 . 1 . . . . . 27 Val HG2 . 15850 1 331 . 1 1 27 27 VAL C C 13 175.772 0.3 . 1 . . . . . 27 Val C . 15850 1 332 . 1 1 27 27 VAL CA C 13 61.600 0.3 . 1 . . . . . 27 Val CA . 15850 1 333 . 1 1 27 27 VAL CB C 13 34.313 0.3 . 1 . . . . . 27 Val CB . 15850 1 334 . 1 1 27 27 VAL CG1 C 13 20.860 0.3 . 1 . . . . . 27 Val CG1 . 15850 1 335 . 1 1 27 27 VAL CG2 C 13 20.960 0.3 . 1 . . . . . 27 Val CG2 . 15850 1 336 . 1 1 27 27 VAL N N 15 126.679 0.3 . 1 . . . . . 27 Val N . 15850 1 337 . 1 1 28 28 ASP H H 1 9.328 0.02 . 1 . . . . . 28 Asp H . 15850 1 338 . 1 1 28 28 ASP HA H 1 4.417 0.02 . 1 . . . . . 28 Asp HA . 15850 1 339 . 1 1 28 28 ASP HB2 H 1 3.024 0.02 . 2 . . . . . 28 Asp HB2 . 15850 1 340 . 1 1 28 28 ASP HB3 H 1 2.712 0.02 . 2 . . . . . 28 Asp HB3 . 15850 1 341 . 1 1 28 28 ASP C C 13 176.041 0.3 . 1 . . . . . 28 Asp C . 15850 1 342 . 1 1 28 28 ASP CA C 13 55.557 0.3 . 1 . . . . . 28 Asp CA . 15850 1 343 . 1 1 28 28 ASP CB C 13 40.097 0.3 . 1 . . . . . 28 Asp CB . 15850 1 344 . 1 1 28 28 ASP N N 15 128.011 0.3 . 1 . . . . . 28 Asp N . 15850 1 345 . 1 1 29 29 GLY H H 1 8.589 0.02 . 1 . . . . . 29 Gly H . 15850 1 346 . 1 1 29 29 GLY HA2 H 1 4.240 0.02 . 2 . . . . . 29 Gly HA2 . 15850 1 347 . 1 1 29 29 GLY HA3 H 1 3.683 0.02 . 2 . . . . . 29 Gly HA3 . 15850 1 348 . 1 1 29 29 GLY C C 13 173.921 0.3 . 1 . . . . . 29 Gly C . 15850 1 349 . 1 1 29 29 GLY CA C 13 45.745 0.3 . 1 . . . . . 29 Gly CA . 15850 1 350 . 1 1 29 29 GLY N N 15 103.728 0.3 . 1 . . . . . 29 Gly N . 15850 1 351 . 1 1 30 30 ARG H H 1 8.061 0.02 . 1 . . . . . 30 Arg H . 15850 1 352 . 1 1 30 30 ARG HA H 1 4.695 0.02 . 1 . . . . . 30 Arg HA . 15850 1 353 . 1 1 30 30 ARG HB2 H 1 1.909 0.02 . 2 . . . . . 30 Arg HB2 . 15850 1 354 . 1 1 30 30 ARG HB3 H 1 1.909 0.02 . 2 . . . . . 30 Arg HB3 . 15850 1 355 . 1 1 30 30 ARG HD2 H 1 3.315 0.02 . 2 . . . . . 30 Arg HD2 . 15850 1 356 . 1 1 30 30 ARG HD3 H 1 3.315 0.02 . 2 . . . . . 30 Arg HD3 . 15850 1 357 . 1 1 30 30 ARG C C 13 174.483 0.3 . 1 . . . . . 30 Arg C . 15850 1 358 . 1 1 30 30 ARG CA C 13 54.730 0.3 . 1 . . . . . 30 Arg CA . 15850 1 359 . 1 1 30 30 ARG CB C 13 32.582 0.3 . 1 . . . . . 30 Arg CB . 15850 1 360 . 1 1 30 30 ARG CD C 13 43.579 0.3 . 1 . . . . . 30 Arg CD . 15850 1 361 . 1 1 30 30 ARG N N 15 120.588 0.3 . 1 . . . . . 30 Arg N . 15850 1 362 . 1 1 31 31 ASN H H 1 8.670 0.02 . 1 . . . . . 31 Asn H . 15850 1 363 . 1 1 31 31 ASN HA H 1 5.105 0.02 . 1 . . . . . 31 Asn HA . 15850 1 364 . 1 1 31 31 ASN HB2 H 1 2.917 0.02 . 2 . . . . . 31 Asn HB2 . 15850 1 365 . 1 1 31 31 ASN HB3 H 1 2.556 0.02 . 2 . . . . . 31 Asn HB3 . 15850 1 366 . 1 1 31 31 ASN HD21 H 1 6.866 0.02 . 1 . . . . . 31 Asn HD21 . 15850 1 367 . 1 1 31 31 ASN HD22 H 1 7.613 0.02 . 1 . . . . . 31 Asn HD22 . 15850 1 368 . 1 1 31 31 ASN C C 13 174.404 0.3 . 1 . . . . . 31 Asn C . 15850 1 369 . 1 1 31 31 ASN CA C 13 52.946 0.3 . 1 . . . . . 31 Asn CA . 15850 1 370 . 1 1 31 31 ASN CB C 13 39.022 0.3 . 1 . . . . . 31 Asn CB . 15850 1 371 . 1 1 31 31 ASN CG C 13 175.952 0.3 . 1 . . . . . 31 Asn CG . 15850 1 372 . 1 1 31 31 ASN N N 15 120.623 0.3 . 1 . . . . . 31 Asn N . 15850 1 373 . 1 1 31 31 ASN ND2 N 15 111.930 0.3 . 1 . . . . . 31 Asn ND2 . 15850 1 374 . 1 1 32 32 LEU H H 1 8.974 0.02 . 1 . . . . . 32 Leu H . 15850 1 375 . 1 1 32 32 LEU HA H 1 4.510 0.02 . 1 . . . . . 32 Leu HA . 15850 1 376 . 1 1 32 32 LEU HB2 H 1 1.495 0.02 . 2 . . . . . 32 Leu HB2 . 15850 1 377 . 1 1 32 32 LEU HB3 H 1 1.760 0.02 . 2 . . . . . 32 Leu HB3 . 15850 1 378 . 1 1 32 32 LEU HD11 H 1 0.871 0.02 . 1 . . . . . 32 Leu HD1 . 15850 1 379 . 1 1 32 32 LEU HD12 H 1 0.871 0.02 . 1 . . . . . 32 Leu HD1 . 15850 1 380 . 1 1 32 32 LEU HD13 H 1 0.871 0.02 . 1 . . . . . 32 Leu HD1 . 15850 1 381 . 1 1 32 32 LEU HD21 H 1 0.829 0.02 . 1 . . . . . 32 Leu HD2 . 15850 1 382 . 1 1 32 32 LEU HD22 H 1 0.829 0.02 . 1 . . . . . 32 Leu HD2 . 15850 1 383 . 1 1 32 32 LEU HD23 H 1 0.829 0.02 . 1 . . . . . 32 Leu HD2 . 15850 1 384 . 1 1 32 32 LEU HG H 1 1.692 0.02 . 1 . . . . . 32 Leu HG . 15850 1 385 . 1 1 32 32 LEU CA C 13 53.986 0.3 . 1 . . . . . 32 Leu CA . 15850 1 386 . 1 1 32 32 LEU CB C 13 43.588 0.3 . 1 . . . . . 32 Leu CB . 15850 1 387 . 1 1 32 32 LEU CD1 C 13 25.448 0.3 . 1 . . . . . 32 Leu CD1 . 15850 1 388 . 1 1 32 32 LEU CD2 C 13 23.909 0.3 . 1 . . . . . 32 Leu CD2 . 15850 1 389 . 1 1 32 32 LEU CG C 13 26.924 0.3 . 1 . . . . . 32 Leu CG . 15850 1 390 . 1 1 32 32 LEU N N 15 124.748 0.3 . 1 . . . . . 32 Leu N . 15850 1 391 . 1 1 33 33 ARG HB2 H 1 1.765 0.02 . 2 . . . . . 33 Arg HB2 . 15850 1 392 . 1 1 33 33 ARG HB3 H 1 1.765 0.02 . 2 . . . . . 33 Arg HB3 . 15850 1 393 . 1 1 33 33 ARG C C 13 174.103 0.3 . 1 . . . . . 33 Arg C . 15850 1 394 . 1 1 33 33 ARG CB C 13 33.725 0.3 . 1 . . . . . 33 Arg CB . 15850 1 395 . 1 1 34 34 ASN H H 1 8.913 0.02 . 1 . . . . . 34 Asn H . 15850 1 396 . 1 1 34 34 ASN HA H 1 5.479 0.02 . 1 . . . . . 34 Asn HA . 15850 1 397 . 1 1 34 34 ASN HB2 H 1 2.370 0.02 . 2 . . . . . 34 Asn HB2 . 15850 1 398 . 1 1 34 34 ASN HB3 H 1 2.477 0.02 . 2 . . . . . 34 Asn HB3 . 15850 1 399 . 1 1 34 34 ASN HD21 H 1 7.124 0.02 . 1 . . . . . 34 Asn HD21 . 15850 1 400 . 1 1 34 34 ASN HD22 H 1 6.822 0.02 . 1 . . . . . 34 Asn HD22 . 15850 1 401 . 1 1 34 34 ASN C C 13 173.950 0.3 . 1 . . . . . 34 Asn C . 15850 1 402 . 1 1 34 34 ASN CA C 13 51.390 0.3 . 1 . . . . . 34 Asn CA . 15850 1 403 . 1 1 34 34 ASN CB C 13 42.078 0.3 . 1 . . . . . 34 Asn CB . 15850 1 404 . 1 1 34 34 ASN CG C 13 175.501 0.3 . 1 . . . . . 34 Asn CG . 15850 1 405 . 1 1 34 34 ASN N N 15 124.021 0.3 . 1 . . . . . 34 Asn N . 15850 1 406 . 1 1 34 34 ASN ND2 N 15 112.116 0.3 . 1 . . . . . 34 Asn ND2 . 15850 1 407 . 1 1 35 35 TYR H H 1 8.574 0.02 . 1 . . . . . 35 Tyr H . 15850 1 408 . 1 1 35 35 TYR HA H 1 4.677 0.02 . 1 . . . . . 35 Tyr HA . 15850 1 409 . 1 1 35 35 TYR HB2 H 1 2.534 0.02 . 2 . . . . . 35 Tyr HB2 . 15850 1 410 . 1 1 35 35 TYR HB3 H 1 2.322 0.02 . 2 . . . . . 35 Tyr HB3 . 15850 1 411 . 1 1 35 35 TYR HE1 H 1 6.550 0.02 . 3 . . . . . 35 Tyr HE1 . 15850 1 412 . 1 1 35 35 TYR HE2 H 1 6.550 0.02 . 3 . . . . . 35 Tyr HE2 . 15850 1 413 . 1 1 35 35 TYR C C 13 174.635 0.3 . 1 . . . . . 35 Tyr C . 15850 1 414 . 1 1 35 35 TYR CA C 13 57.645 0.3 . 1 . . . . . 35 Tyr CA . 15850 1 415 . 1 1 35 35 TYR CB C 13 42.330 0.3 . 1 . . . . . 35 Tyr CB . 15850 1 416 . 1 1 35 35 TYR CE1 C 13 117.111 0.3 . 3 . . . . . 35 Tyr CE1 . 15850 1 417 . 1 1 35 35 TYR CE2 C 13 117.111 0.3 . 3 . . . . . 35 Tyr CE2 . 15850 1 418 . 1 1 35 35 TYR N N 15 119.292 0.3 . 1 . . . . . 35 Tyr N . 15850 1 419 . 1 1 36 36 THR H H 1 8.496 0.02 . 1 . . . . . 36 Thr H . 15850 1 420 . 1 1 36 36 THR HA H 1 5.570 0.02 . 1 . . . . . 36 Thr HA . 15850 1 421 . 1 1 36 36 THR HB H 1 3.914 0.02 . 1 . . . . . 36 Thr HB . 15850 1 422 . 1 1 36 36 THR HG21 H 1 1.115 0.02 . 1 . . . . . 36 Thr HG2 . 15850 1 423 . 1 1 36 36 THR HG22 H 1 1.115 0.02 . 1 . . . . . 36 Thr HG2 . 15850 1 424 . 1 1 36 36 THR HG23 H 1 1.115 0.02 . 1 . . . . . 36 Thr HG2 . 15850 1 425 . 1 1 36 36 THR C C 13 174.682 0.3 . 1 . . . . . 36 Thr C . 15850 1 426 . 1 1 36 36 THR CA C 13 61.964 0.3 . 1 . . . . . 36 Thr CA . 15850 1 427 . 1 1 36 36 THR CB C 13 70.835 0.3 . 1 . . . . . 36 Thr CB . 15850 1 428 . 1 1 36 36 THR CG2 C 13 21.423 0.3 . 1 . . . . . 36 Thr CG2 . 15850 1 429 . 1 1 36 36 THR N N 15 117.929 0.3 . 1 . . . . . 36 Thr N . 15850 1 430 . 1 1 37 37 LEU H H 1 9.015 0.02 . 1 . . . . . 37 Leu H . 15850 1 431 . 1 1 37 37 LEU HA H 1 5.213 0.02 . 1 . . . . . 37 Leu HA . 15850 1 432 . 1 1 37 37 LEU HB2 H 1 1.806 0.02 . 2 . . . . . 37 Leu HB2 . 15850 1 433 . 1 1 37 37 LEU HB3 H 1 2.029 0.02 . 2 . . . . . 37 Leu HB3 . 15850 1 434 . 1 1 37 37 LEU HD11 H 1 1.471 0.02 . 1 . . . . . 37 Leu HD1 . 15850 1 435 . 1 1 37 37 LEU HD12 H 1 1.471 0.02 . 1 . . . . . 37 Leu HD1 . 15850 1 436 . 1 1 37 37 LEU HD13 H 1 1.471 0.02 . 1 . . . . . 37 Leu HD1 . 15850 1 437 . 1 1 37 37 LEU HD21 H 1 1.439 0.02 . 1 . . . . . 37 Leu HD2 . 15850 1 438 . 1 1 37 37 LEU HD22 H 1 1.439 0.02 . 1 . . . . . 37 Leu HD2 . 15850 1 439 . 1 1 37 37 LEU HD23 H 1 1.439 0.02 . 1 . . . . . 37 Leu HD2 . 15850 1 440 . 1 1 37 37 LEU HG H 1 1.945 0.02 . 1 . . . . . 37 Leu HG . 15850 1 441 . 1 1 37 37 LEU CA C 13 52.077 0.3 . 1 . . . . . 37 Leu CA . 15850 1 442 . 1 1 37 37 LEU CB C 13 47.001 0.3 . 1 . . . . . 37 Leu CB . 15850 1 443 . 1 1 37 37 LEU CD1 C 13 27.961 0.3 . 1 . . . . . 37 Leu CD1 . 15850 1 444 . 1 1 37 37 LEU CD2 C 13 24.063 0.3 . 1 . . . . . 37 Leu CD2 . 15850 1 445 . 1 1 37 37 LEU CG C 13 28.124 0.3 . 1 . . . . . 37 Leu CG . 15850 1 446 . 1 1 37 37 LEU N N 15 129.005 0.3 . 1 . . . . . 37 Leu N . 15850 1 447 . 1 1 38 38 PRO HA H 1 4.895 0.02 . 1 . . . . . 38 Pro HA . 15850 1 448 . 1 1 38 38 PRO HB2 H 1 2.291 0.02 . 2 . . . . . 38 Pro HB2 . 15850 1 449 . 1 1 38 38 PRO HB3 H 1 1.870 0.02 . 2 . . . . . 38 Pro HB3 . 15850 1 450 . 1 1 38 38 PRO HD2 H 1 3.999 0.02 . 2 . . . . . 38 Pro HD2 . 15850 1 451 . 1 1 38 38 PRO HD3 H 1 3.934 0.02 . 2 . . . . . 38 Pro HD3 . 15850 1 452 . 1 1 38 38 PRO HG2 H 1 2.409 0.02 . 2 . . . . . 38 Pro HG2 . 15850 1 453 . 1 1 38 38 PRO HG3 H 1 2.287 0.02 . 2 . . . . . 38 Pro HG3 . 15850 1 454 . 1 1 38 38 PRO C C 13 175.147 0.3 . 1 . . . . . 38 Pro C . 15850 1 455 . 1 1 38 38 PRO CA C 13 62.412 0.3 . 1 . . . . . 38 Pro CA . 15850 1 456 . 1 1 38 38 PRO CB C 13 33.001 0.3 . 1 . . . . . 38 Pro CB . 15850 1 457 . 1 1 38 38 PRO CD C 13 50.644 0.3 . 1 . . . . . 38 Pro CD . 15850 1 458 . 1 1 38 38 PRO CG C 13 27.609 0.3 . 1 . . . . . 38 Pro CG . 15850 1 459 . 1 1 39 39 ALA H H 1 8.723 0.02 . 1 . . . . . 39 Ala H . 15850 1 460 . 1 1 39 39 ALA HA H 1 5.214 0.02 . 1 . . . . . 39 Ala HA . 15850 1 461 . 1 1 39 39 ALA HB1 H 1 1.258 0.02 . 1 . . . . . 39 Ala HB . 15850 1 462 . 1 1 39 39 ALA HB2 H 1 1.258 0.02 . 1 . . . . . 39 Ala HB . 15850 1 463 . 1 1 39 39 ALA HB3 H 1 1.258 0.02 . 1 . . . . . 39 Ala HB . 15850 1 464 . 1 1 39 39 ALA C C 13 174.605 0.3 . 1 . . . . . 39 Ala C . 15850 1 465 . 1 1 39 39 ALA CA C 13 50.361 0.3 . 1 . . . . . 39 Ala CA . 15850 1 466 . 1 1 39 39 ALA CB C 13 24.878 0.3 . 1 . . . . . 39 Ala CB . 15850 1 467 . 1 1 39 39 ALA N N 15 123.010 0.3 . 1 . . . . . 39 Ala N . 15850 1 468 . 1 1 40 40 TYR H H 1 9.255 0.02 . 1 . . . . . 40 Tyr H . 15850 1 469 . 1 1 40 40 TYR HA H 1 6.035 0.02 . 1 . . . . . 40 Tyr HA . 15850 1 470 . 1 1 40 40 TYR HB2 H 1 3.099 0.02 . 2 . . . . . 40 Tyr HB2 . 15850 1 471 . 1 1 40 40 TYR HB3 H 1 2.806 0.02 . 2 . . . . . 40 Tyr HB3 . 15850 1 472 . 1 1 40 40 TYR HD1 H 1 7.074 0.02 . 3 . . . . . 40 Tyr HD1 . 15850 1 473 . 1 1 40 40 TYR HD2 H 1 7.068 0.02 . 3 . . . . . 40 Tyr HD2 . 15850 1 474 . 1 1 40 40 TYR HE1 H 1 6.809 0.02 . 3 . . . . . 40 Tyr HE1 . 15850 1 475 . 1 1 40 40 TYR HE2 H 1 6.809 0.02 . 3 . . . . . 40 Tyr HE2 . 15850 1 476 . 1 1 40 40 TYR C C 13 176.948 0.3 . 1 . . . . . 40 Tyr C . 15850 1 477 . 1 1 40 40 TYR CA C 13 56.428 0.3 . 1 . . . . . 40 Tyr CA . 15850 1 478 . 1 1 40 40 TYR CB C 13 44.330 0.3 . 1 . . . . . 40 Tyr CB . 15850 1 479 . 1 1 40 40 TYR CD1 C 13 133.366 0.3 . 3 . . . . . 40 Tyr CD1 . 15850 1 480 . 1 1 40 40 TYR CD2 C 13 133.366 0.3 . 3 . . . . . 40 Tyr CD2 . 15850 1 481 . 1 1 40 40 TYR CE1 C 13 117.592 0.3 . 3 . . . . . 40 Tyr CE1 . 15850 1 482 . 1 1 40 40 TYR CE2 C 13 117.592 0.3 . 3 . . . . . 40 Tyr CE2 . 15850 1 483 . 1 1 40 40 TYR N N 15 115.489 0.3 . 1 . . . . . 40 Tyr N . 15850 1 484 . 1 1 41 41 ASP H H 1 8.792 0.02 . 1 . . . . . 41 Asp H . 15850 1 485 . 1 1 41 41 ASP HA H 1 5.046 0.02 . 1 . . . . . 41 Asp HA . 15850 1 486 . 1 1 41 41 ASP HB2 H 1 3.225 0.02 . 2 . . . . . 41 Asp HB2 . 15850 1 487 . 1 1 41 41 ASP HB3 H 1 2.385 0.02 . 2 . . . . . 41 Asp HB3 . 15850 1 488 . 1 1 41 41 ASP C C 13 177.665 0.3 . 1 . . . . . 41 Asp C . 15850 1 489 . 1 1 41 41 ASP CA C 13 52.241 0.3 . 1 . . . . . 41 Asp CA . 15850 1 490 . 1 1 41 41 ASP CB C 13 41.049 0.3 . 1 . . . . . 41 Asp CB . 15850 1 491 . 1 1 41 41 ASP N N 15 122.934 0.3 . 1 . . . . . 41 Asp N . 15850 1 492 . 1 1 42 42 GLU H H 1 8.833 0.02 . 1 . . . . . 42 Glu H . 15850 1 493 . 1 1 42 42 GLU HA H 1 3.965 0.02 . 1 . . . . . 42 Glu HA . 15850 1 494 . 1 1 42 42 GLU HB2 H 1 2.269 0.02 . 2 . . . . . 42 Glu HB2 . 15850 1 495 . 1 1 42 42 GLU HB3 H 1 2.215 0.02 . 2 . . . . . 42 Glu HB3 . 15850 1 496 . 1 1 42 42 GLU HG2 H 1 2.322 0.02 . 2 . . . . . 42 Glu HG2 . 15850 1 497 . 1 1 42 42 GLU HG3 H 1 2.425 0.02 . 2 . . . . . 42 Glu HG3 . 15850 1 498 . 1 1 42 42 GLU C C 13 178.471 0.3 . 1 . . . . . 42 Glu C . 15850 1 499 . 1 1 42 42 GLU CA C 13 58.939 0.3 . 1 . . . . . 42 Glu CA . 15850 1 500 . 1 1 42 42 GLU CB C 13 29.591 0.3 . 1 . . . . . 42 Glu CB . 15850 1 501 . 1 1 42 42 GLU CG C 13 36.135 0.3 . 1 . . . . . 42 Glu CG . 15850 1 502 . 1 1 42 42 GLU N N 15 113.929 0.3 . 1 . . . . . 42 Glu N . 15850 1 503 . 1 1 43 43 ASP H H 1 8.162 0.02 . 1 . . . . . 43 Asp H . 15850 1 504 . 1 1 43 43 ASP HA H 1 4.944 0.02 . 1 . . . . . 43 Asp HA . 15850 1 505 . 1 1 43 43 ASP HB2 H 1 2.983 0.02 . 2 . . . . . 43 Asp HB2 . 15850 1 506 . 1 1 43 43 ASP HB3 H 1 2.861 0.02 . 2 . . . . . 43 Asp HB3 . 15850 1 507 . 1 1 43 43 ASP C C 13 176.926 0.3 . 1 . . . . . 43 Asp C . 15850 1 508 . 1 1 43 43 ASP CA C 13 54.483 0.3 . 1 . . . . . 43 Asp CA . 15850 1 509 . 1 1 43 43 ASP CB C 13 42.174 0.3 . 1 . . . . . 43 Asp CB . 15850 1 510 . 1 1 43 43 ASP N N 15 117.252 0.3 . 1 . . . . . 43 Asp N . 15850 1 511 . 1 1 44 44 GLY H H 1 8.751 0.02 . 1 . . . . . 44 Gly H . 15850 1 512 . 1 1 44 44 GLY HA2 H 1 4.257 0.02 . 2 . . . . . 44 Gly HA2 . 15850 1 513 . 1 1 44 44 GLY HA3 H 1 3.481 0.02 . 2 . . . . . 44 Gly HA3 . 15850 1 514 . 1 1 44 44 GLY C C 13 173.424 0.3 . 1 . . . . . 44 Gly C . 15850 1 515 . 1 1 44 44 GLY CA C 13 45.834 0.3 . 1 . . . . . 44 Gly CA . 15850 1 516 . 1 1 44 44 GLY N N 15 109.652 0.3 . 1 . . . . . 44 Gly N . 15850 1 517 . 1 1 45 45 VAL H H 1 8.728 0.02 . 1 . . . . . 45 Val H . 15850 1 518 . 1 1 45 45 VAL HA H 1 3.959 0.02 . 1 . . . . . 45 Val HA . 15850 1 519 . 1 1 45 45 VAL HB H 1 2.420 0.02 . 1 . . . . . 45 Val HB . 15850 1 520 . 1 1 45 45 VAL HG11 H 1 1.099 0.02 . 1 . . . . . 45 Val HG1 . 15850 1 521 . 1 1 45 45 VAL HG12 H 1 1.099 0.02 . 1 . . . . . 45 Val HG1 . 15850 1 522 . 1 1 45 45 VAL HG13 H 1 1.099 0.02 . 1 . . . . . 45 Val HG1 . 15850 1 523 . 1 1 45 45 VAL HG21 H 1 1.108 0.02 . 1 . . . . . 45 Val HG2 . 15850 1 524 . 1 1 45 45 VAL HG22 H 1 1.108 0.02 . 1 . . . . . 45 Val HG2 . 15850 1 525 . 1 1 45 45 VAL HG23 H 1 1.108 0.02 . 1 . . . . . 45 Val HG2 . 15850 1 526 . 1 1 45 45 VAL C C 13 175.480 0.3 . 1 . . . . . 45 Val C . 15850 1 527 . 1 1 45 45 VAL CA C 13 64.584 0.3 . 1 . . . . . 45 Val CA . 15850 1 528 . 1 1 45 45 VAL CB C 13 31.175 0.3 . 1 . . . . . 45 Val CB . 15850 1 529 . 1 1 45 45 VAL CG1 C 13 21.746 0.3 . 1 . . . . . 45 Val CG1 . 15850 1 530 . 1 1 45 45 VAL CG2 C 13 22.573 0.3 . 1 . . . . . 45 Val CG2 . 15850 1 531 . 1 1 45 45 VAL N N 15 125.503 0.3 . 1 . . . . . 45 Val N . 15850 1 532 . 1 1 46 46 LYS H H 1 8.304 0.02 . 1 . . . . . 46 Lys H . 15850 1 533 . 1 1 46 46 LYS HA H 1 4.951 0.02 . 1 . . . . . 46 Lys HA . 15850 1 534 . 1 1 46 46 LYS HB2 H 1 1.888 0.02 . 2 . . . . . 46 Lys HB2 . 15850 1 535 . 1 1 46 46 LYS HB3 H 1 1.860 0.02 . 2 . . . . . 46 Lys HB3 . 15850 1 536 . 1 1 46 46 LYS HD2 H 1 1.778 0.02 . 2 . . . . . 46 Lys HD2 . 15850 1 537 . 1 1 46 46 LYS HD3 H 1 1.778 0.02 . 2 . . . . . 46 Lys HD3 . 15850 1 538 . 1 1 46 46 LYS HE2 H 1 3.080 0.02 . 2 . . . . . 46 Lys HE2 . 15850 1 539 . 1 1 46 46 LYS HE3 H 1 3.080 0.02 . 2 . . . . . 46 Lys HE3 . 15850 1 540 . 1 1 46 46 LYS HG2 H 1 1.167 0.02 . 2 . . . . . 46 Lys HG2 . 15850 1 541 . 1 1 46 46 LYS HG3 H 1 1.077 0.02 . 2 . . . . . 46 Lys HG3 . 15850 1 542 . 1 1 46 46 LYS C C 13 176.879 0.3 . 1 . . . . . 46 Lys C . 15850 1 543 . 1 1 46 46 LYS CA C 13 55.704 0.3 . 1 . . . . . 46 Lys CA . 15850 1 544 . 1 1 46 46 LYS CB C 13 34.985 0.3 . 1 . . . . . 46 Lys CB . 15850 1 545 . 1 1 46 46 LYS CD C 13 29.981 0.3 . 1 . . . . . 46 Lys CD . 15850 1 546 . 1 1 46 46 LYS CE C 13 41.815 0.3 . 1 . . . . . 46 Lys CE . 15850 1 547 . 1 1 46 46 LYS CG C 13 24.370 0.3 . 1 . . . . . 46 Lys CG . 15850 1 548 . 1 1 46 46 LYS N N 15 128.801 0.3 . 1 . . . . . 46 Lys N . 15850 1 549 . 1 1 47 47 LYS H H 1 9.090 0.02 . 1 . . . . . 47 Lys H . 15850 1 550 . 1 1 47 47 LYS HA H 1 4.728 0.02 . 1 . . . . . 47 Lys HA . 15850 1 551 . 1 1 47 47 LYS HB2 H 1 1.454 0.02 . 2 . . . . . 47 Lys HB2 . 15850 1 552 . 1 1 47 47 LYS HB3 H 1 1.113 0.02 . 2 . . . . . 47 Lys HB3 . 15850 1 553 . 1 1 47 47 LYS HE2 H 1 2.820 0.02 . 2 . . . . . 47 Lys HE2 . 15850 1 554 . 1 1 47 47 LYS HE3 H 1 2.820 0.02 . 2 . . . . . 47 Lys HE3 . 15850 1 555 . 1 1 47 47 LYS HG2 H 1 1.402 0.02 . 2 . . . . . 47 Lys HG2 . 15850 1 556 . 1 1 47 47 LYS HG3 H 1 1.402 0.02 . 2 . . . . . 47 Lys HG3 . 15850 1 557 . 1 1 47 47 LYS C C 13 174.450 0.3 . 1 . . . . . 47 Lys C . 15850 1 558 . 1 1 47 47 LYS CA C 13 54.850 0.3 . 1 . . . . . 47 Lys CA . 15850 1 559 . 1 1 47 47 LYS CB C 13 37.293 0.3 . 1 . . . . . 47 Lys CB . 15850 1 560 . 1 1 47 47 LYS CE C 13 42.980 0.3 . 1 . . . . . 47 Lys CE . 15850 1 561 . 1 1 47 47 LYS CG C 13 27.001 0.3 . 1 . . . . . 47 Lys CG . 15850 1 562 . 1 1 47 47 LYS N N 15 126.008 0.3 . 1 . . . . . 47 Lys N . 15850 1 563 . 1 1 48 48 GLN H H 1 8.185 0.02 . 1 . . . . . 48 Gln H . 15850 1 564 . 1 1 48 48 GLN HA H 1 4.619 0.02 . 1 . . . . . 48 Gln HA . 15850 1 565 . 1 1 48 48 GLN HB2 H 1 2.030 0.02 . 2 . . . . . 48 Gln HB2 . 15850 1 566 . 1 1 48 48 GLN HB3 H 1 2.030 0.02 . 2 . . . . . 48 Gln HB3 . 15850 1 567 . 1 1 48 48 GLN HE21 H 1 7.439 0.02 . 1 . . . . . 48 Gln HE21 . 15850 1 568 . 1 1 48 48 GLN HE22 H 1 6.815 0.02 . 1 . . . . . 48 Gln HE22 . 15850 1 569 . 1 1 48 48 GLN HG2 H 1 2.221 0.02 . 2 . . . . . 48 Gln HG2 . 15850 1 570 . 1 1 48 48 GLN HG3 H 1 2.049 0.02 . 2 . . . . . 48 Gln HG3 . 15850 1 571 . 1 1 48 48 GLN C C 13 174.748 0.3 . 1 . . . . . 48 Gln C . 15850 1 572 . 1 1 48 48 GLN CA C 13 55.509 0.3 . 1 . . . . . 48 Gln CA . 15850 1 573 . 1 1 48 48 GLN CB C 13 31.229 0.3 . 1 . . . . . 48 Gln CB . 15850 1 574 . 1 1 48 48 GLN CD C 13 180.044 0.3 . 1 . . . . . 48 Gln CD . 15850 1 575 . 1 1 48 48 GLN CG C 13 34.341 0.3 . 1 . . . . . 48 Gln CG . 15850 1 576 . 1 1 48 48 GLN N N 15 120.556 0.3 . 1 . . . . . 48 Gln N . 15850 1 577 . 1 1 48 48 GLN NE2 N 15 110.697 0.3 . 1 . . . . . 48 Gln NE2 . 15850 1 578 . 1 1 49 49 ILE H H 1 8.757 0.02 . 1 . . . . . 49 Ile H . 15850 1 579 . 1 1 49 49 ILE HA H 1 4.596 0.02 . 1 . . . . . 49 Ile HA . 15850 1 580 . 1 1 49 49 ILE HB H 1 1.524 0.02 . 1 . . . . . 49 Ile HB . 15850 1 581 . 1 1 49 49 ILE HD11 H 1 0.200 0.02 . 1 . . . . . 49 Ile HD1 . 15850 1 582 . 1 1 49 49 ILE HD12 H 1 0.200 0.02 . 1 . . . . . 49 Ile HD1 . 15850 1 583 . 1 1 49 49 ILE HD13 H 1 0.200 0.02 . 1 . . . . . 49 Ile HD1 . 15850 1 584 . 1 1 49 49 ILE HG12 H 1 1.270 0.02 . 2 . . . . . 49 Ile HG12 . 15850 1 585 . 1 1 49 49 ILE HG21 H 1 0.597 0.02 . 1 . . . . . 49 Ile HG2 . 15850 1 586 . 1 1 49 49 ILE HG22 H 1 0.597 0.02 . 1 . . . . . 49 Ile HG2 . 15850 1 587 . 1 1 49 49 ILE HG23 H 1 0.597 0.02 . 1 . . . . . 49 Ile HG2 . 15850 1 588 . 1 1 49 49 ILE C C 13 174.399 0.3 . 1 . . . . . 49 Ile C . 15850 1 589 . 1 1 49 49 ILE CA C 13 61.595 0.3 . 1 . . . . . 49 Ile CA . 15850 1 590 . 1 1 49 49 ILE CB C 13 39.980 0.3 . 1 . . . . . 49 Ile CB . 15850 1 591 . 1 1 49 49 ILE CD1 C 13 14.058 0.3 . 1 . . . . . 49 Ile CD1 . 15850 1 592 . 1 1 49 49 ILE CG1 C 13 26.839 0.3 . 1 . . . . . 49 Ile CG1 . 15850 1 593 . 1 1 49 49 ILE CG2 C 13 17.766 0.3 . 1 . . . . . 49 Ile CG2 . 15850 1 594 . 1 1 49 49 ILE N N 15 126.705 0.3 . 1 . . . . . 49 Ile N . 15850 1 595 . 1 1 50 50 THR HA H 1 5.906 0.02 . 1 . . . . . 50 Thr HA . 15850 1 596 . 1 1 50 50 THR HB H 1 4.001 0.02 . 1 . . . . . 50 Thr HB . 15850 1 597 . 1 1 50 50 THR HG21 H 1 1.165 0.02 . 1 . . . . . 50 Thr HG2 . 15850 1 598 . 1 1 50 50 THR HG22 H 1 1.165 0.02 . 1 . . . . . 50 Thr HG2 . 15850 1 599 . 1 1 50 50 THR HG23 H 1 1.165 0.02 . 1 . . . . . 50 Thr HG2 . 15850 1 600 . 1 1 50 50 THR CA C 13 61.193 0.3 . 1 . . . . . 50 Thr CA . 15850 1 601 . 1 1 50 50 THR CB C 13 70.673 0.3 . 1 . . . . . 50 Thr CB . 15850 1 602 . 1 1 50 50 THR CG2 C 13 21.198 0.3 . 1 . . . . . 50 Thr CG2 . 15850 1 603 . 1 1 51 51 PHE HD1 H 1 6.860 0.02 . 3 . . . . . 51 Phe HD1 . 15850 1 604 . 1 1 51 51 PHE HD2 H 1 6.860 0.02 . 3 . . . . . 51 Phe HD2 . 15850 1 605 . 1 1 51 51 PHE HE1 H 1 6.541 0.02 . 3 . . . . . 51 Phe HE1 . 15850 1 606 . 1 1 51 51 PHE HE2 H 1 6.541 0.02 . 3 . . . . . 51 Phe HE2 . 15850 1 607 . 1 1 51 51 PHE HZ H 1 6.267 0.02 . 1 . . . . . 51 Phe HZ . 15850 1 608 . 1 1 51 51 PHE CD1 C 13 131.272 0.3 . 3 . . . . . 51 Phe CD1 . 15850 1 609 . 1 1 51 51 PHE CD2 C 13 131.272 0.3 . 3 . . . . . 51 Phe CD2 . 15850 1 610 . 1 1 51 51 PHE CE1 C 13 130.561 0.3 . 3 . . . . . 51 Phe CE1 . 15850 1 611 . 1 1 51 51 PHE CE2 C 13 130.561 0.3 . 3 . . . . . 51 Phe CE2 . 15850 1 612 . 1 1 51 51 PHE CZ C 13 129.107 0.3 . 1 . . . . . 51 Phe CZ . 15850 1 613 . 1 1 52 52 ARG HA H 1 4.947 0.02 . 1 . . . . . 52 Arg HA . 15850 1 614 . 1 1 52 52 ARG HB2 H 1 1.832 0.02 . 2 . . . . . 52 Arg HB2 . 15850 1 615 . 1 1 52 52 ARG HB3 H 1 1.838 0.02 . 2 . . . . . 52 Arg HB3 . 15850 1 616 . 1 1 52 52 ARG HD2 H 1 3.230 0.02 . 2 . . . . . 52 Arg HD2 . 15850 1 617 . 1 1 52 52 ARG HD3 H 1 3.230 0.02 . 2 . . . . . 52 Arg HD3 . 15850 1 618 . 1 1 52 52 ARG HG2 H 1 1.733 0.02 . 2 . . . . . 52 Arg HG2 . 15850 1 619 . 1 1 52 52 ARG HG3 H 1 1.666 0.02 . 2 . . . . . 52 Arg HG3 . 15850 1 620 . 1 1 52 52 ARG C C 13 176.633 0.3 . 1 . . . . . 52 Arg C . 15850 1 621 . 1 1 52 52 ARG CA C 13 54.313 0.3 . 1 . . . . . 52 Arg CA . 15850 1 622 . 1 1 52 52 ARG CB C 13 32.061 0.3 . 1 . . . . . 52 Arg CB . 15850 1 623 . 1 1 52 52 ARG CD C 13 43.872 0.3 . 1 . . . . . 52 Arg CD . 15850 1 624 . 1 1 52 52 ARG CG C 13 26.875 0.3 . 1 . . . . . 52 Arg CG . 15850 1 625 . 1 1 53 53 SER H H 1 8.840 0.02 . 1 . . . . . 53 Ser H . 15850 1 626 . 1 1 53 53 SER HA H 1 4.788 0.02 . 1 . . . . . 53 Ser HA . 15850 1 627 . 1 1 53 53 SER HB2 H 1 4.232 0.02 . 2 . . . . . 53 Ser HB2 . 15850 1 628 . 1 1 53 53 SER HB3 H 1 4.047 0.02 . 2 . . . . . 53 Ser HB3 . 15850 1 629 . 1 1 53 53 SER C C 13 177.244 0.3 . 1 . . . . . 53 Ser C . 15850 1 630 . 1 1 53 53 SER CA C 13 57.871 0.3 . 1 . . . . . 53 Ser CA . 15850 1 631 . 1 1 53 53 SER CB C 13 64.398 0.3 . 1 . . . . . 53 Ser CB . 15850 1 632 . 1 1 53 53 SER N N 15 118.250 0.3 . 1 . . . . . 53 Ser N . 15850 1 633 . 1 1 54 54 THR HA H 1 4.633 0.02 . 1 . . . . . 54 Thr HA . 15850 1 634 . 1 1 54 54 THR HB H 1 4.645 0.02 . 1 . . . . . 54 Thr HB . 15850 1 635 . 1 1 54 54 THR HG21 H 1 1.387 0.02 . 1 . . . . . 54 Thr HG2 . 15850 1 636 . 1 1 54 54 THR HG22 H 1 1.387 0.02 . 1 . . . . . 54 Thr HG2 . 15850 1 637 . 1 1 54 54 THR HG23 H 1 1.387 0.02 . 1 . . . . . 54 Thr HG2 . 15850 1 638 . 1 1 54 54 THR CA C 13 61.278 0.3 . 1 . . . . . 54 Thr CA . 15850 1 639 . 1 1 54 54 THR CB C 13 69.323 0.3 . 1 . . . . . 54 Thr CB . 15850 1 640 . 1 1 54 54 THR CG2 C 13 21.813 0.3 . 1 . . . . . 54 Thr CG2 . 15850 1 641 . 1 1 56 56 LYS HA H 1 4.283 0.02 . 1 . . . . . 56 Lys HA . 15850 1 642 . 1 1 56 56 LYS HB2 H 1 1.990 0.02 . 2 . . . . . 56 Lys HB2 . 15850 1 643 . 1 1 56 56 LYS HB3 H 1 1.991 0.02 . 2 . . . . . 56 Lys HB3 . 15850 1 644 . 1 1 56 56 LYS CA C 13 58.835 0.3 . 1 . . . . . 56 Lys CA . 15850 1 645 . 1 1 56 56 LYS CB C 13 33.432 0.3 . 1 . . . . . 56 Lys CB . 15850 1 646 . 1 1 60 60 HIS HB2 H 1 3.303 0.02 . 2 . . . . . 60 His HB2 . 15850 1 647 . 1 1 60 60 HIS HB3 H 1 3.182 0.02 . 2 . . . . . 60 His HB3 . 15850 1 648 . 1 1 60 60 HIS C C 13 173.971 0.3 . 1 . . . . . 60 His C . 15850 1 649 . 1 1 60 60 HIS CB C 13 30.441 0.3 . 1 . . . . . 60 His CB . 15850 1 650 . 1 1 61 61 LYS H H 1 8.823 0.02 . 1 . . . . . 61 Lys H . 15850 1 651 . 1 1 61 61 LYS HA H 1 4.378 0.02 . 1 . . . . . 61 Lys HA . 15850 1 652 . 1 1 61 61 LYS C C 13 176.422 0.3 . 1 . . . . . 61 Lys C . 15850 1 653 . 1 1 61 61 LYS CA C 13 57.412 0.3 . 1 . . . . . 61 Lys CA . 15850 1 654 . 1 1 61 61 LYS N N 15 121.166 0.3 . 1 . . . . . 61 Lys N . 15850 1 655 . 1 1 62 62 LEU H H 1 8.064 0.02 . 1 . . . . . 62 Leu H . 15850 1 656 . 1 1 62 62 LEU HA H 1 4.359 0.02 . 1 . . . . . 62 Leu HA . 15850 1 657 . 1 1 62 62 LEU HB2 H 1 1.396 0.02 . 2 . . . . . 62 Leu HB2 . 15850 1 658 . 1 1 62 62 LEU HB3 H 1 1.396 0.02 . 2 . . . . . 62 Leu HB3 . 15850 1 659 . 1 1 62 62 LEU HD11 H 1 0.782 0.02 . 1 . . . . . 62 Leu HD1 . 15850 1 660 . 1 1 62 62 LEU HD12 H 1 0.782 0.02 . 1 . . . . . 62 Leu HD1 . 15850 1 661 . 1 1 62 62 LEU HD13 H 1 0.782 0.02 . 1 . . . . . 62 Leu HD1 . 15850 1 662 . 1 1 62 62 LEU HD21 H 1 1.031 0.02 . 1 . . . . . 62 Leu HD2 . 15850 1 663 . 1 1 62 62 LEU HD22 H 1 1.031 0.02 . 1 . . . . . 62 Leu HD2 . 15850 1 664 . 1 1 62 62 LEU HD23 H 1 1.031 0.02 . 1 . . . . . 62 Leu HD2 . 15850 1 665 . 1 1 62 62 LEU HG H 1 1.775 0.02 . 1 . . . . . 62 Leu HG . 15850 1 666 . 1 1 62 62 LEU C C 13 176.643 0.3 . 1 . . . . . 62 Leu C . 15850 1 667 . 1 1 62 62 LEU CA C 13 54.211 0.3 . 1 . . . . . 62 Leu CA . 15850 1 668 . 1 1 62 62 LEU CB C 13 43.063 0.3 . 1 . . . . . 62 Leu CB . 15850 1 669 . 1 1 62 62 LEU CD1 C 13 26.236 0.3 . 1 . . . . . 62 Leu CD1 . 15850 1 670 . 1 1 62 62 LEU CD2 C 13 24.079 0.3 . 1 . . . . . 62 Leu CD2 . 15850 1 671 . 1 1 62 62 LEU CG C 13 27.992 0.3 . 1 . . . . . 62 Leu CG . 15850 1 672 . 1 1 62 62 LEU N N 15 124.757 0.3 . 1 . . . . . 62 Leu N . 15850 1 673 . 1 1 63 63 ASN H H 1 8.887 0.02 . 1 . . . . . 63 Asn H . 15850 1 674 . 1 1 63 63 ASN HA H 1 4.523 0.02 . 1 . . . . . 63 Asn HA . 15850 1 675 . 1 1 63 63 ASN HB2 H 1 3.137 0.02 . 2 . . . . . 63 Asn HB2 . 15850 1 676 . 1 1 63 63 ASN HB3 H 1 2.758 0.02 . 2 . . . . . 63 Asn HB3 . 15850 1 677 . 1 1 63 63 ASN HD21 H 1 7.020 0.02 . 1 . . . . . 63 Asn HD21 . 15850 1 678 . 1 1 63 63 ASN HD22 H 1 7.645 0.02 . 1 . . . . . 63 Asn HD22 . 15850 1 679 . 1 1 63 63 ASN C C 13 174.734 0.3 . 1 . . . . . 63 Asn C . 15850 1 680 . 1 1 63 63 ASN CA C 13 53.544 0.3 . 1 . . . . . 63 Asn CA . 15850 1 681 . 1 1 63 63 ASN CB C 13 38.300 0.3 . 1 . . . . . 63 Asn CB . 15850 1 682 . 1 1 63 63 ASN CG C 13 177.766 0.3 . 1 . . . . . 63 Asn CG . 15850 1 683 . 1 1 63 63 ASN N N 15 121.187 0.3 . 1 . . . . . 63 Asn N . 15850 1 684 . 1 1 63 63 ASN ND2 N 15 112.317 0.3 . 1 . . . . . 63 Asn ND2 . 15850 1 685 . 1 1 64 64 LYS H H 1 8.293 0.02 . 1 . . . . . 64 Lys H . 15850 1 686 . 1 1 64 64 LYS HA H 1 3.566 0.02 . 1 . . . . . 64 Lys HA . 15850 1 687 . 1 1 64 64 LYS HB2 H 1 1.360 0.02 . 2 . . . . . 64 Lys HB2 . 15850 1 688 . 1 1 64 64 LYS HB3 H 1 1.642 0.02 . 2 . . . . . 64 Lys HB3 . 15850 1 689 . 1 1 64 64 LYS HE2 H 1 2.955 0.02 . 2 . . . . . 64 Lys HE2 . 15850 1 690 . 1 1 64 64 LYS HE3 H 1 2.955 0.02 . 2 . . . . . 64 Lys HE3 . 15850 1 691 . 1 1 64 64 LYS HG2 H 1 1.099 0.02 . 2 . . . . . 64 Lys HG2 . 15850 1 692 . 1 1 64 64 LYS C C 13 177.154 0.3 . 1 . . . . . 64 Lys C . 15850 1 693 . 1 1 64 64 LYS CA C 13 58.808 0.3 . 1 . . . . . 64 Lys CA . 15850 1 694 . 1 1 64 64 LYS CB C 13 32.197 0.3 . 1 . . . . . 64 Lys CB . 15850 1 695 . 1 1 64 64 LYS CE C 13 41.970 0.3 . 1 . . . . . 64 Lys CE . 15850 1 696 . 1 1 64 64 LYS CG C 13 25.551 0.3 . 1 . . . . . 64 Lys CG . 15850 1 697 . 1 1 64 64 LYS N N 15 122.027 0.3 . 1 . . . . . 64 Lys N . 15850 1 698 . 1 1 65 65 TYR H H 1 8.351 0.02 . 1 . . . . . 65 Tyr H . 15850 1 699 . 1 1 65 65 TYR HA H 1 3.973 0.02 . 1 . . . . . 65 Tyr HA . 15850 1 700 . 1 1 65 65 TYR HB2 H 1 3.386 0.02 . 2 . . . . . 65 Tyr HB2 . 15850 1 701 . 1 1 65 65 TYR HB3 H 1 3.196 0.02 . 2 . . . . . 65 Tyr HB3 . 15850 1 702 . 1 1 65 65 TYR HE1 H 1 6.955 0.02 . 3 . . . . . 65 Tyr HE1 . 15850 1 703 . 1 1 65 65 TYR HE2 H 1 6.955 0.02 . 3 . . . . . 65 Tyr HE2 . 15850 1 704 . 1 1 65 65 TYR C C 13 174.702 0.3 . 1 . . . . . 65 Tyr C . 15850 1 705 . 1 1 65 65 TYR CA C 13 59.810 0.3 . 1 . . . . . 65 Tyr CA . 15850 1 706 . 1 1 65 65 TYR CB C 13 35.495 0.3 . 1 . . . . . 65 Tyr CB . 15850 1 707 . 1 1 65 65 TYR CE1 C 13 118.173 0.3 . 3 . . . . . 65 Tyr CE1 . 15850 1 708 . 1 1 65 65 TYR CE2 C 13 118.173 0.3 . 3 . . . . . 65 Tyr CE2 . 15850 1 709 . 1 1 65 65 TYR N N 15 116.044 0.3 . 1 . . . . . 65 Tyr N . 15850 1 710 . 1 1 66 66 ALA H H 1 7.611 0.02 . 1 . . . . . 66 Ala H . 15850 1 711 . 1 1 66 66 ALA HA H 1 4.232 0.02 . 1 . . . . . 66 Ala HA . 15850 1 712 . 1 1 66 66 ALA HB1 H 1 1.422 0.02 . 1 . . . . . 66 Ala HB . 15850 1 713 . 1 1 66 66 ALA HB2 H 1 1.422 0.02 . 1 . . . . . 66 Ala HB . 15850 1 714 . 1 1 66 66 ALA HB3 H 1 1.422 0.02 . 1 . . . . . 66 Ala HB . 15850 1 715 . 1 1 66 66 ALA C C 13 175.636 0.3 . 1 . . . . . 66 Ala C . 15850 1 716 . 1 1 66 66 ALA CA C 13 52.576 0.3 . 1 . . . . . 66 Ala CA . 15850 1 717 . 1 1 66 66 ALA CB C 13 19.783 0.3 . 1 . . . . . 66 Ala CB . 15850 1 718 . 1 1 66 66 ALA N N 15 123.082 0.3 . 1 . . . . . 66 Ala N . 15850 1 719 . 1 1 67 67 PHE H H 1 8.778 0.02 . 1 . . . . . 67 Phe H . 15850 1 720 . 1 1 67 67 PHE HA H 1 5.437 0.02 . 1 . . . . . 67 Phe HA . 15850 1 721 . 1 1 67 67 PHE HB2 H 1 2.757 0.02 . 2 . . . . . 67 Phe HB2 . 15850 1 722 . 1 1 67 67 PHE HB3 H 1 3.018 0.02 . 2 . . . . . 67 Phe HB3 . 15850 1 723 . 1 1 67 67 PHE HD1 H 1 6.980 0.02 . 3 . . . . . 67 Phe HD1 . 15850 1 724 . 1 1 67 67 PHE C C 13 174.991 0.3 . 1 . . . . . 67 Phe C . 15850 1 725 . 1 1 67 67 PHE CA C 13 57.123 0.3 . 1 . . . . . 67 Phe CA . 15850 1 726 . 1 1 67 67 PHE CB C 13 41.913 0.3 . 1 . . . . . 67 Phe CB . 15850 1 727 . 1 1 67 67 PHE CD1 C 13 131.557 0.3 . 3 . . . . . 67 Phe CD1 . 15850 1 728 . 1 1 67 67 PHE N N 15 117.690 0.3 . 1 . . . . . 67 Phe N . 15850 1 729 . 1 1 68 68 LEU H H 1 9.292 0.02 . 1 . . . . . 68 Leu H . 15850 1 730 . 1 1 68 68 LEU HA H 1 5.414 0.02 . 1 . . . . . 68 Leu HA . 15850 1 731 . 1 1 68 68 LEU HB2 H 1 1.365 0.02 . 2 . . . . . 68 Leu HB2 . 15850 1 732 . 1 1 68 68 LEU HB3 H 1 1.365 0.02 . 2 . . . . . 68 Leu HB3 . 15850 1 733 . 1 1 68 68 LEU HD11 H 1 0.358 0.02 . 1 . . . . . 68 Leu HD1 . 15850 1 734 . 1 1 68 68 LEU HD12 H 1 0.358 0.02 . 1 . . . . . 68 Leu HD1 . 15850 1 735 . 1 1 68 68 LEU HD13 H 1 0.358 0.02 . 1 . . . . . 68 Leu HD1 . 15850 1 736 . 1 1 68 68 LEU HD21 H 1 0.644 0.02 . 1 . . . . . 68 Leu HD2 . 15850 1 737 . 1 1 68 68 LEU HD22 H 1 0.644 0.02 . 1 . . . . . 68 Leu HD2 . 15850 1 738 . 1 1 68 68 LEU HD23 H 1 0.644 0.02 . 1 . . . . . 68 Leu HD2 . 15850 1 739 . 1 1 68 68 LEU HG H 1 1.354 0.02 . 1 . . . . . 68 Leu HG . 15850 1 740 . 1 1 68 68 LEU C C 13 175.773 0.3 . 1 . . . . . 68 Leu C . 15850 1 741 . 1 1 68 68 LEU CA C 13 53.127 0.3 . 1 . . . . . 68 Leu CA . 15850 1 742 . 1 1 68 68 LEU CB C 13 47.212 0.3 . 1 . . . . . 68 Leu CB . 15850 1 743 . 1 1 68 68 LEU CD1 C 13 26.42 0.3 . 1 . . . . . 68 Leu CD1 . 15850 1 744 . 1 1 68 68 LEU CD2 C 13 24.19 0.3 . 1 . . . . . 68 Leu CD2 . 15850 1 745 . 1 1 68 68 LEU CG C 13 27.66 0.3 . 1 . . . . . 68 Leu CG . 15850 1 746 . 1 1 68 68 LEU N N 15 119.654 0.3 . 1 . . . . . 68 Leu N . 15850 1 747 . 1 1 69 69 ARG H H 1 8.967 0.02 . 1 . . . . . 69 Arg H . 15850 1 748 . 1 1 69 69 ARG HA H 1 4.958 0.02 . 1 . . . . . 69 Arg HA . 15850 1 749 . 1 1 69 69 ARG HB2 H 1 1.839 0.02 . 2 . . . . . 69 Arg HB2 . 15850 1 750 . 1 1 69 69 ARG HB3 H 1 1.484 0.02 . 2 . . . . . 69 Arg HB3 . 15850 1 751 . 1 1 69 69 ARG HD2 H 1 3.264 0.02 . 2 . . . . . 69 Arg HD2 . 15850 1 752 . 1 1 69 69 ARG HD3 H 1 3.116 0.02 . 2 . . . . . 69 Arg HD3 . 15850 1 753 . 1 1 69 69 ARG HG2 H 1 0.926 0.02 . 2 . . . . . 69 Arg HG2 . 15850 1 754 . 1 1 69 69 ARG HG3 H 1 0.926 0.02 . 2 . . . . . 69 Arg HG3 . 15850 1 755 . 1 1 69 69 ARG C C 13 174.614 0.3 . 1 . . . . . 69 Arg C . 15850 1 756 . 1 1 69 69 ARG CA C 13 54.282 0.3 . 1 . . . . . 69 Arg CA . 15850 1 757 . 1 1 69 69 ARG CB C 13 33.832 0.3 . 1 . . . . . 69 Arg CB . 15850 1 758 . 1 1 69 69 ARG CD C 13 44.333 0.3 . 1 . . . . . 69 Arg CD . 15850 1 759 . 1 1 69 69 ARG CG C 13 27.343 0.3 . 1 . . . . . 69 Arg CG . 15850 1 760 . 1 1 69 69 ARG N N 15 121.139 0.3 . 1 . . . . . 69 Arg N . 15850 1 761 . 1 1 70 70 LEU H H 1 9.354 0.02 . 1 . . . . . 70 Leu H . 15850 1 762 . 1 1 70 70 LEU HA H 1 4.980 0.02 . 1 . . . . . 70 Leu HA . 15850 1 763 . 1 1 70 70 LEU HB2 H 1 1.528 0.02 . 2 . . . . . 70 Leu HB2 . 15850 1 764 . 1 1 70 70 LEU HB3 H 1 1.266 0.02 . 2 . . . . . 70 Leu HB3 . 15850 1 765 . 1 1 70 70 LEU HD11 H 1 0.645 0.02 . 1 . . . . . 70 Leu HD1 . 15850 1 766 . 1 1 70 70 LEU HD12 H 1 0.645 0.02 . 1 . . . . . 70 Leu HD1 . 15850 1 767 . 1 1 70 70 LEU HD13 H 1 0.645 0.02 . 1 . . . . . 70 Leu HD1 . 15850 1 768 . 1 1 70 70 LEU HD21 H 1 0.220 0.02 . 1 . . . . . 70 Leu HD2 . 15850 1 769 . 1 1 70 70 LEU HD22 H 1 0.220 0.02 . 1 . . . . . 70 Leu HD2 . 15850 1 770 . 1 1 70 70 LEU HD23 H 1 0.220 0.02 . 1 . . . . . 70 Leu HD2 . 15850 1 771 . 1 1 70 70 LEU HG H 1 1.259 0.02 . 1 . . . . . 70 Leu HG . 15850 1 772 . 1 1 70 70 LEU C C 13 174.056 0.3 . 1 . . . . . 70 Leu C . 15850 1 773 . 1 1 70 70 LEU CA C 13 54.865 0.3 . 1 . . . . . 70 Leu CA . 15850 1 774 . 1 1 70 70 LEU CB C 13 44.662 0.3 . 1 . . . . . 70 Leu CB . 15850 1 775 . 1 1 70 70 LEU CD1 C 13 27.37 0.3 . 1 . . . . . 70 Leu CD1 . 15850 1 776 . 1 1 70 70 LEU CD2 C 13 26.70 0.3 . 1 . . . . . 70 Leu CD2 . 15850 1 777 . 1 1 70 70 LEU CG C 13 28.55 0.3 . 1 . . . . . 70 Leu CG . 15850 1 778 . 1 1 70 70 LEU N N 15 125.126 0.3 . 1 . . . . . 70 Leu N . 15850 1 779 . 1 1 71 71 TYR H H 1 8.562 0.02 . 1 . . . . . 71 Tyr H . 15850 1 780 . 1 1 71 71 TYR HA H 1 5.124 0.02 . 1 . . . . . 71 Tyr HA . 15850 1 781 . 1 1 71 71 TYR HB2 H 1 2.949 0.02 . 2 . . . . . 71 Tyr HB2 . 15850 1 782 . 1 1 71 71 TYR HB3 H 1 3.038 0.02 . 2 . . . . . 71 Tyr HB3 . 15850 1 783 . 1 1 71 71 TYR HD1 H 1 7.087 0.02 . 3 . . . . . 71 Tyr HD1 . 15850 1 784 . 1 1 71 71 TYR HD2 H 1 7.087 0.02 . 3 . . . . . 71 Tyr HD2 . 15850 1 785 . 1 1 71 71 TYR C C 13 176.047 0.3 . 1 . . . . . 71 Tyr C . 15850 1 786 . 1 1 71 71 TYR CA C 13 57.414 0.3 . 1 . . . . . 71 Tyr CA . 15850 1 787 . 1 1 71 71 TYR CB C 13 39.009 0.3 . 1 . . . . . 71 Tyr CB . 15850 1 788 . 1 1 71 71 TYR CD1 C 13 133.835 0.3 . 3 . . . . . 71 Tyr CD1 . 15850 1 789 . 1 1 71 71 TYR CD2 C 13 133.835 0.3 . 3 . . . . . 71 Tyr CD2 . 15850 1 790 . 1 1 71 71 TYR N N 15 120.603 0.3 . 1 . . . . . 71 Tyr N . 15850 1 791 . 1 1 72 72 VAL HA H 1 5.206 0.02 . 1 . . . . . 72 Val HA . 15850 1 792 . 1 1 72 72 VAL HB H 1 2.193 0.02 . 1 . . . . . 72 Val HB . 15850 1 793 . 1 1 72 72 VAL HG11 H 1 0.996 0.02 . 2 . . . . . 72 Val HG1 . 15850 1 794 . 1 1 72 72 VAL HG12 H 1 0.996 0.02 . 2 . . . . . 72 Val HG1 . 15850 1 795 . 1 1 72 72 VAL HG13 H 1 0.996 0.02 . 2 . . . . . 72 Val HG1 . 15850 1 796 . 1 1 72 72 VAL HG21 H 1 0.996 0.02 . 2 . . . . . 72 Val HG2 . 15850 1 797 . 1 1 72 72 VAL HG22 H 1 0.996 0.02 . 2 . . . . . 72 Val HG2 . 15850 1 798 . 1 1 72 72 VAL HG23 H 1 0.996 0.02 . 2 . . . . . 72 Val HG2 . 15850 1 799 . 1 1 72 72 VAL C C 13 174.513 0.3 . 1 . . . . . 72 Val C . 15850 1 800 . 1 1 72 72 VAL CA C 13 60.441 0.3 . 1 . . . . . 72 Val CA . 15850 1 801 . 1 1 72 72 VAL CB C 13 36.815 0.3 . 1 . . . . . 72 Val CB . 15850 1 802 . 1 1 72 72 VAL CG1 C 13 22.006 0.3 . 2 . . . . . 72 Val CG1 . 15850 1 803 . 1 1 72 72 VAL CG2 C 13 22.170 0.3 . 2 . . . . . 72 Val CG2 . 15850 1 804 . 1 1 73 73 ASP H H 1 8.837 0.02 . 1 . . . . . 73 Asp H . 15850 1 805 . 1 1 73 73 ASP HA H 1 5.256 0.02 . 1 . . . . . 73 Asp HA . 15850 1 806 . 1 1 73 73 ASP HB2 H 1 2.858 0.02 . 2 . . . . . 73 Asp HB2 . 15850 1 807 . 1 1 73 73 ASP HB3 H 1 2.521 0.02 . 2 . . . . . 73 Asp HB3 . 15850 1 808 . 1 1 73 73 ASP C C 13 175.142 0.3 . 1 . . . . . 73 Asp C . 15850 1 809 . 1 1 73 73 ASP CA C 13 53.526 0.3 . 1 . . . . . 73 Asp CA . 15850 1 810 . 1 1 73 73 ASP CB C 13 43.280 0.3 . 1 . . . . . 73 Asp CB . 15850 1 811 . 1 1 73 73 ASP N N 15 124.564 0.3 . 1 . . . . . 73 Asp N . 15850 1 812 . 1 1 74 74 GLN H H 1 9.258 0.02 . 1 . . . . . 74 Gln H . 15850 1 813 . 1 1 74 74 GLN HG2 H 1 1.735 0.02 . 2 . . . . . 74 Gln HG2 . 15850 1 814 . 1 1 74 74 GLN HG3 H 1 1.735 0.02 . 2 . . . . . 74 Gln HG3 . 15850 1 815 . 1 1 74 74 GLN C C 13 176.423 0.3 . 1 . . . . . 74 Gln C . 15850 1 816 . 1 1 74 74 GLN CG C 13 33.050 0.3 . 1 . . . . . 74 Gln CG . 15850 1 817 . 1 1 74 74 GLN N N 15 122.712 0.3 . 1 . . . . . 74 Gln N . 15850 1 818 . 1 1 75 75 ASP H H 1 9.178 0.02 . 1 . . . . . 75 Asp H . 15850 1 819 . 1 1 75 75 ASP HA H 1 4.574 0.02 . 1 . . . . . 75 Asp HA . 15850 1 820 . 1 1 75 75 ASP HB2 H 1 2.768 0.02 . 2 . . . . . 75 Asp HB2 . 15850 1 821 . 1 1 75 75 ASP HB3 H 1 2.768 0.02 . 2 . . . . . 75 Asp HB3 . 15850 1 822 . 1 1 75 75 ASP CA C 13 56.984 0.3 . 1 . . . . . 75 Asp CA . 15850 1 823 . 1 1 75 75 ASP CB C 13 41.147 0.3 . 1 . . . . . 75 Asp CB . 15850 1 824 . 1 1 75 75 ASP N N 15 125.711 0.3 . 1 . . . . . 75 Asp N . 15850 1 825 . 1 1 76 76 ASP H H 1 8.558 0.02 . 1 . . . . . 76 Asp H . 15850 1 826 . 1 1 76 76 ASP HA H 1 4.854 0.02 . 1 . . . . . 76 Asp HA . 15850 1 827 . 1 1 76 76 ASP HB2 H 1 2.906 0.02 . 2 . . . . . 76 Asp HB2 . 15850 1 828 . 1 1 76 76 ASP HB3 H 1 2.686 0.02 . 2 . . . . . 76 Asp HB3 . 15850 1 829 . 1 1 76 76 ASP C C 13 176.264 0.3 . 1 . . . . . 76 Asp C . 15850 1 830 . 1 1 76 76 ASP CA C 13 52.718 0.3 . 1 . . . . . 76 Asp CA . 15850 1 831 . 1 1 76 76 ASP CB C 13 41.495 0.3 . 1 . . . . . 76 Asp CB . 15850 1 832 . 1 1 76 76 ASP N N 15 118.004 0.3 . 1 . . . . . 76 Asp N . 15850 1 833 . 1 1 77 77 ASN H H 1 8.762 0.02 . 1 . . . . . 77 Asn H . 15850 1 834 . 1 1 77 77 ASN HA H 1 4.476 0.02 . 1 . . . . . 77 Asn HA . 15850 1 835 . 1 1 77 77 ASN HB2 H 1 3.111 0.02 . 2 . . . . . 77 Asn HB2 . 15850 1 836 . 1 1 77 77 ASN HB3 H 1 2.940 0.02 . 2 . . . . . 77 Asn HB3 . 15850 1 837 . 1 1 77 77 ASN HD21 H 1 7.059 0.02 . 1 . . . . . 77 Asn HD21 . 15850 1 838 . 1 1 77 77 ASN HD22 H 1 7.775 0.02 . 1 . . . . . 77 Asn HD22 . 15850 1 839 . 1 1 77 77 ASN C C 13 175.717 0.3 . 1 . . . . . 77 Asn C . 15850 1 840 . 1 1 77 77 ASN CA C 13 54.029 0.3 . 1 . . . . . 77 Asn CA . 15850 1 841 . 1 1 77 77 ASN CB C 13 38.093 0.3 . 1 . . . . . 77 Asn CB . 15850 1 842 . 1 1 77 77 ASN CG C 13 176.962 0.3 . 1 . . . . . 77 Asn CG . 15850 1 843 . 1 1 77 77 ASN N N 15 122.010 0.3 . 1 . . . . . 77 Asn N . 15850 1 844 . 1 1 77 77 ASN ND2 N 15 112.160 0.3 . 1 . . . . . 77 Asn ND2 . 15850 1 845 . 1 1 78 78 SER H H 1 8.652 0.02 . 1 . . . . . 78 Ser H . 15850 1 846 . 1 1 78 78 SER HA H 1 4.454 0.02 . 1 . . . . . 78 Ser HA . 15850 1 847 . 1 1 78 78 SER HB2 H 1 4.077 0.02 . 2 . . . . . 78 Ser HB2 . 15850 1 848 . 1 1 78 78 SER HB3 H 1 4.094 0.02 . 2 . . . . . 78 Ser HB3 . 15850 1 849 . 1 1 78 78 SER C C 13 175.454 0.3 . 1 . . . . . 78 Ser C . 15850 1 850 . 1 1 78 78 SER CA C 13 59.928 0.3 . 1 . . . . . 78 Ser CA . 15850 1 851 . 1 1 78 78 SER CB C 13 63.779 0.3 . 1 . . . . . 78 Ser CB . 15850 1 852 . 1 1 78 78 SER N N 15 115.171 0.3 . 1 . . . . . 78 Ser N . 15850 1 853 . 1 1 79 79 LYS H H 1 7.585 0.02 . 1 . . . . . 79 Lys H . 15850 1 854 . 1 1 79 79 LYS C C 13 177.576 0.3 . 1 . . . . . 79 Lys C . 15850 1 855 . 1 1 79 79 LYS N N 15 122.422 0.3 . 1 . . . . . 79 Lys N . 15850 1 856 . 1 1 81 81 GLU HB2 H 1 1.840 0.02 . 2 . . . . . 81 Glu HB2 . 15850 1 857 . 1 1 81 81 GLU CB C 13 31.800 0.3 . 1 . . . . . 81 Glu CB . 15850 1 858 . 1 1 82 82 ILE HA H 1 4.249 0.02 . 1 . . . . . 82 Ile HA . 15850 1 859 . 1 1 82 82 ILE HB H 1 1.707 0.02 . 1 . . . . . 82 Ile HB . 15850 1 860 . 1 1 82 82 ILE HD11 H 1 0.263 0.02 . 1 . . . . . 82 Ile HD1 . 15850 1 861 . 1 1 82 82 ILE HD12 H 1 0.263 0.02 . 1 . . . . . 82 Ile HD1 . 15850 1 862 . 1 1 82 82 ILE HD13 H 1 0.263 0.02 . 1 . . . . . 82 Ile HD1 . 15850 1 863 . 1 1 82 82 ILE HG12 H 1 1.321 0.02 . 2 . . . . . 82 Ile HG12 . 15850 1 864 . 1 1 82 82 ILE HG13 H 1 0.815 0.02 . 2 . . . . . 82 Ile HG13 . 15850 1 865 . 1 1 82 82 ILE HG21 H 1 1.001 0.02 . 1 . . . . . 82 Ile HG2 . 15850 1 866 . 1 1 82 82 ILE HG22 H 1 1.001 0.02 . 1 . . . . . 82 Ile HG2 . 15850 1 867 . 1 1 82 82 ILE HG23 H 1 1.001 0.02 . 1 . . . . . 82 Ile HG2 . 15850 1 868 . 1 1 82 82 ILE C C 13 175.406 0.3 . 1 . . . . . 82 Ile C . 15850 1 869 . 1 1 82 82 ILE CA C 13 61.339 0.3 . 1 . . . . . 82 Ile CA . 15850 1 870 . 1 1 82 82 ILE CB C 13 39.772 0.3 . 1 . . . . . 82 Ile CB . 15850 1 871 . 1 1 82 82 ILE CD1 C 13 13.689 0.3 . 1 . . . . . 82 Ile CD1 . 15850 1 872 . 1 1 82 82 ILE CG1 C 13 29.020 0.3 . 1 . . . . . 82 Ile CG1 . 15850 1 873 . 1 1 82 82 ILE CG2 C 13 18.562 0.3 . 1 . . . . . 82 Ile CG2 . 15850 1 874 . 1 1 83 83 SER HA H 1 4.810 0.02 . 1 . . . . . 83 Ser HA . 15850 1 875 . 1 1 83 83 SER HB2 H 1 4.233 0.02 . 2 . . . . . 83 Ser HB2 . 15850 1 876 . 1 1 83 83 SER HB3 H 1 4.051 0.02 . 2 . . . . . 83 Ser HB3 . 15850 1 877 . 1 1 83 83 SER CA C 13 57.751 0.3 . 1 . . . . . 83 Ser CA . 15850 1 878 . 1 1 83 83 SER CB C 13 65.802 0.3 . 1 . . . . . 83 Ser CB . 15850 1 879 . 1 1 84 84 SER H H 1 8.642 0.02 . 1 . . . . . 84 Ser H . 15850 1 880 . 1 1 84 84 SER HA H 1 4.763 0.02 . 1 . . . . . 84 Ser HA . 15850 1 881 . 1 1 84 84 SER HB2 H 1 4.025 0.02 . 2 . . . . . 84 Ser HB2 . 15850 1 882 . 1 1 84 84 SER HB3 H 1 3.770 0.02 . 2 . . . . . 84 Ser HB3 . 15850 1 883 . 1 1 84 84 SER CA C 13 61.837 0.3 . 1 . . . . . 84 Ser CA . 15850 1 884 . 1 1 84 84 SER CB C 13 63.129 0.3 . 1 . . . . . 84 Ser CB . 15850 1 885 . 1 1 84 84 SER N N 15 115.955 0.3 . 1 . . . . . 84 Ser N . 15850 1 886 . 1 1 85 85 ILE H H 1 7.654 0.02 . 1 . . . . . 85 Ile H . 15850 1 887 . 1 1 85 85 ILE HA H 1 4.393 0.02 . 1 . . . . . 85 Ile HA . 15850 1 888 . 1 1 85 85 ILE HB H 1 2.055 0.02 . 1 . . . . . 85 Ile HB . 15850 1 889 . 1 1 85 85 ILE HD11 H 1 1.006 0.02 . 1 . . . . . 85 Ile HD1 . 15850 1 890 . 1 1 85 85 ILE HD12 H 1 1.006 0.02 . 1 . . . . . 85 Ile HD1 . 15850 1 891 . 1 1 85 85 ILE HD13 H 1 1.006 0.02 . 1 . . . . . 85 Ile HD1 . 15850 1 892 . 1 1 85 85 ILE HG12 H 1 1.550 0.02 . 2 . . . . . 85 Ile HG12 . 15850 1 893 . 1 1 85 85 ILE HG13 H 1 1.387 0.02 . 2 . . . . . 85 Ile HG13 . 15850 1 894 . 1 1 85 85 ILE HG21 H 1 1.063 0.02 . 1 . . . . . 85 Ile HG2 . 15850 1 895 . 1 1 85 85 ILE HG22 H 1 1.063 0.02 . 1 . . . . . 85 Ile HG2 . 15850 1 896 . 1 1 85 85 ILE HG23 H 1 1.063 0.02 . 1 . . . . . 85 Ile HG2 . 15850 1 897 . 1 1 85 85 ILE CA C 13 62.388 0.3 . 1 . . . . . 85 Ile CA . 15850 1 898 . 1 1 85 85 ILE CB C 13 38.525 0.3 . 1 . . . . . 85 Ile CB . 15850 1 899 . 1 1 85 85 ILE CD1 C 13 13.956 0.3 . 1 . . . . . 85 Ile CD1 . 15850 1 900 . 1 1 85 85 ILE CG1 C 13 27.932 0.3 . 1 . . . . . 85 Ile CG1 . 15850 1 901 . 1 1 85 85 ILE CG2 C 13 18.108 0.3 . 1 . . . . . 85 Ile CG2 . 15850 1 902 . 1 1 85 85 ILE N N 15 117.106 0.3 . 1 . . . . . 85 Ile N . 15850 1 903 . 1 1 87 87 VAL HA H 1 4.131 0.02 . 1 . . . . . 87 Val HA . 15850 1 904 . 1 1 87 87 VAL HB H 1 2.544 0.02 . 1 . . . . . 87 Val HB . 15850 1 905 . 1 1 87 87 VAL HG11 H 1 1.018 0.02 . 1 . . . . . 87 Val HG1 . 15850 1 906 . 1 1 87 87 VAL HG12 H 1 1.018 0.02 . 1 . . . . . 87 Val HG1 . 15850 1 907 . 1 1 87 87 VAL HG13 H 1 1.018 0.02 . 1 . . . . . 87 Val HG1 . 15850 1 908 . 1 1 87 87 VAL HG21 H 1 1.018 0.02 . 1 . . . . . 87 Val HG2 . 15850 1 909 . 1 1 87 87 VAL HG22 H 1 1.018 0.02 . 1 . . . . . 87 Val HG2 . 15850 1 910 . 1 1 87 87 VAL HG23 H 1 1.018 0.02 . 1 . . . . . 87 Val HG2 . 15850 1 911 . 1 1 87 87 VAL C C 13 175.561 0.3 . 1 . . . . . 87 Val C . 15850 1 912 . 1 1 87 87 VAL CA C 13 63.254 0.3 . 1 . . . . . 87 Val CA . 15850 1 913 . 1 1 87 87 VAL CB C 13 31.541 0.3 . 1 . . . . . 87 Val CB . 15850 1 914 . 1 1 87 87 VAL CG1 C 13 22.156 0.3 . 1 . . . . . 87 Val CG1 . 15850 1 915 . 1 1 87 87 VAL CG2 C 13 22.161 0.3 . 1 . . . . . 87 Val CG2 . 15850 1 916 . 1 1 88 88 LYS H H 1 9.367 0.02 . 1 . . . . . 88 Lys H . 15850 1 917 . 1 1 88 88 LYS HA H 1 4.425 0.02 . 1 . . . . . 88 Lys HA . 15850 1 918 . 1 1 88 88 LYS HB2 H 1 1.828 0.02 . 2 . . . . . 88 Lys HB2 . 15850 1 919 . 1 1 88 88 LYS HB3 H 1 1.972 0.02 . 2 . . . . . 88 Lys HB3 . 15850 1 920 . 1 1 88 88 LYS HG2 H 1 1.675 0.02 . 2 . . . . . 88 Lys HG2 . 15850 1 921 . 1 1 88 88 LYS HG3 H 1 1.589 0.02 . 2 . . . . . 88 Lys HG3 . 15850 1 922 . 1 1 88 88 LYS C C 13 177.797 0.3 . 1 . . . . . 88 Lys C . 15850 1 923 . 1 1 88 88 LYS CA C 13 55.596 0.3 . 1 . . . . . 88 Lys CA . 15850 1 924 . 1 1 88 88 LYS CB C 13 32.110 0.3 . 1 . . . . . 88 Lys CB . 15850 1 925 . 1 1 88 88 LYS CG C 13 24.059 0.3 . 1 . . . . . 88 Lys CG . 15850 1 926 . 1 1 88 88 LYS N N 15 127.381 0.3 . 1 . . . . . 88 Lys N . 15850 1 927 . 1 1 89 89 SER H H 1 8.096 0.02 . 1 . . . . . 89 Ser H . 15850 1 928 . 1 1 89 89 SER HA H 1 4.727 0.02 . 1 . . . . . 89 Ser HA . 15850 1 929 . 1 1 89 89 SER HB2 H 1 3.995 0.02 . 2 . . . . . 89 Ser HB2 . 15850 1 930 . 1 1 89 89 SER HB3 H 1 3.995 0.02 . 2 . . . . . 89 Ser HB3 . 15850 1 931 . 1 1 89 89 SER C C 13 172.013 0.3 . 1 . . . . . 89 Ser C . 15850 1 932 . 1 1 89 89 SER CA C 13 58.160 0.3 . 1 . . . . . 89 Ser CA . 15850 1 933 . 1 1 89 89 SER CB C 13 64.346 0.3 . 1 . . . . . 89 Ser CB . 15850 1 934 . 1 1 89 89 SER N N 15 109.772 0.3 . 1 . . . . . 89 Ser N . 15850 1 935 . 1 1 90 90 TYR H H 1 8.069 0.02 . 1 . . . . . 90 Tyr H . 15850 1 936 . 1 1 90 90 TYR HA H 1 5.829 0.02 . 1 . . . . . 90 Tyr HA . 15850 1 937 . 1 1 90 90 TYR HB2 H 1 2.876 0.02 . 2 . . . . . 90 Tyr HB2 . 15850 1 938 . 1 1 90 90 TYR HB3 H 1 2.876 0.02 . 2 . . . . . 90 Tyr HB3 . 15850 1 939 . 1 1 90 90 TYR HD1 H 1 6.846 0.02 . 3 . . . . . 90 Tyr HD1 . 15850 1 940 . 1 1 90 90 TYR HD2 H 1 6.838 0.02 . 3 . . . . . 90 Tyr HD2 . 15850 1 941 . 1 1 90 90 TYR HE1 H 1 7.183 0.02 . 3 . . . . . 90 Tyr HE1 . 15850 1 942 . 1 1 90 90 TYR HE2 H 1 7.183 0.02 . 3 . . . . . 90 Tyr HE2 . 15850 1 943 . 1 1 90 90 TYR C C 13 173.415 0.3 . 1 . . . . . 90 Tyr C . 15850 1 944 . 1 1 90 90 TYR CA C 13 56.692 0.3 . 1 . . . . . 90 Tyr CA . 15850 1 945 . 1 1 90 90 TYR CB C 13 41.973 0.3 . 1 . . . . . 90 Tyr CB . 15850 1 946 . 1 1 90 90 TYR CD1 C 13 133.560 0.3 . 3 . . . . . 90 Tyr CD1 . 15850 1 947 . 1 1 90 90 TYR CD2 C 13 133.570 0.3 . 3 . . . . . 90 Tyr CD2 . 15850 1 948 . 1 1 90 90 TYR CE1 C 13 118.642 0.3 . 3 . . . . . 90 Tyr CE1 . 15850 1 949 . 1 1 90 90 TYR CE2 C 13 118.642 0.3 . 3 . . . . . 90 Tyr CE2 . 15850 1 950 . 1 1 90 90 TYR N N 15 114.869 0.3 . 1 . . . . . 90 Tyr N . 15850 1 951 . 1 1 91 91 GLU H H 1 9.388 0.02 . 1 . . . . . 91 Glu H . 15850 1 952 . 1 1 91 91 GLU HA H 1 4.879 0.02 . 1 . . . . . 91 Glu HA . 15850 1 953 . 1 1 91 91 GLU HB2 H 1 2.290 0.02 . 2 . . . . . 91 Glu HB2 . 15850 1 954 . 1 1 91 91 GLU HB3 H 1 2.149 0.02 . 2 . . . . . 91 Glu HB3 . 15850 1 955 . 1 1 91 91 GLU HG2 H 1 2.380 0.02 . 2 . . . . . 91 Glu HG2 . 15850 1 956 . 1 1 91 91 GLU HG3 H 1 2.502 0.02 . 2 . . . . . 91 Glu HG3 . 15850 1 957 . 1 1 91 91 GLU C C 13 174.385 0.3 . 1 . . . . . 91 Glu C . 15850 1 958 . 1 1 91 91 GLU CA C 13 54.348 0.3 . 1 . . . . . 91 Glu CA . 15850 1 959 . 1 1 91 91 GLU CB C 13 33.170 0.3 . 1 . . . . . 91 Glu CB . 15850 1 960 . 1 1 91 91 GLU CG C 13 35.559 0.3 . 1 . . . . . 91 Glu CG . 15850 1 961 . 1 1 91 91 GLU N N 15 117.854 0.3 . 1 . . . . . 91 Glu N . 15850 1 962 . 1 1 92 92 GLU H H 1 8.997 0.02 . 1 . . . . . 92 Glu H . 15850 1 963 . 1 1 92 92 GLU HA H 1 5.106 0.02 . 1 . . . . . 92 Glu HA . 15850 1 964 . 1 1 92 92 GLU HB2 H 1 2.215 0.02 . 2 . . . . . 92 Glu HB2 . 15850 1 965 . 1 1 92 92 GLU HB3 H 1 2.067 0.02 . 2 . . . . . 92 Glu HB3 . 15850 1 966 . 1 1 92 92 GLU HG2 H 1 2.696 0.02 . 2 . . . . . 92 Glu HG2 . 15850 1 967 . 1 1 92 92 GLU HG3 H 1 2.410 0.02 . 2 . . . . . 92 Glu HG3 . 15850 1 968 . 1 1 92 92 GLU C C 13 176.670 0.3 . 1 . . . . . 92 Glu C . 15850 1 969 . 1 1 92 92 GLU CA C 13 57.010 0.3 . 1 . . . . . 92 Glu CA . 15850 1 970 . 1 1 92 92 GLU CB C 13 30.136 0.3 . 1 . . . . . 92 Glu CB . 15850 1 971 . 1 1 92 92 GLU CG C 13 37.272 0.3 . 1 . . . . . 92 Glu CG . 15850 1 972 . 1 1 92 92 GLU N N 15 124.075 0.3 . 1 . . . . . 92 Glu N . 15850 1 973 . 1 1 93 93 ILE H H 1 8.676 0.02 . 1 . . . . . 93 Ile H . 15850 1 974 . 1 1 93 93 ILE HA H 1 4.999 0.02 . 1 . . . . . 93 Ile HA . 15850 1 975 . 1 1 93 93 ILE HB H 1 2.448 0.02 . 1 . . . . . 93 Ile HB . 15850 1 976 . 1 1 93 93 ILE HD11 H 1 1.015 0.02 . 1 . . . . . 93 Ile HD1 . 15850 1 977 . 1 1 93 93 ILE HD12 H 1 1.015 0.02 . 1 . . . . . 93 Ile HD1 . 15850 1 978 . 1 1 93 93 ILE HD13 H 1 1.015 0.02 . 1 . . . . . 93 Ile HD1 . 15850 1 979 . 1 1 93 93 ILE HG12 H 1 0.993 0.02 . 2 . . . . . 93 Ile HG12 . 15850 1 980 . 1 1 93 93 ILE HG13 H 1 1.406 0.02 . 2 . . . . . 93 Ile HG13 . 15850 1 981 . 1 1 93 93 ILE HG21 H 1 1.010 0.02 . 1 . . . . . 93 Ile HG2 . 15850 1 982 . 1 1 93 93 ILE HG22 H 1 1.010 0.02 . 1 . . . . . 93 Ile HG2 . 15850 1 983 . 1 1 93 93 ILE HG23 H 1 1.010 0.02 . 1 . . . . . 93 Ile HG2 . 15850 1 984 . 1 1 93 93 ILE C C 13 174.255 0.3 . 1 . . . . . 93 Ile C . 15850 1 985 . 1 1 93 93 ILE CA C 13 59.716 0.3 . 1 . . . . . 93 Ile CA . 15850 1 986 . 1 1 93 93 ILE CB C 13 41.554 0.3 . 1 . . . . . 93 Ile CB . 15850 1 987 . 1 1 93 93 ILE CD1 C 13 14.631 0.3 . 1 . . . . . 93 Ile CD1 . 15850 1 988 . 1 1 93 93 ILE CG1 C 13 25.983 0.3 . 1 . . . . . 93 Ile CG1 . 15850 1 989 . 1 1 93 93 ILE CG2 C 13 18.361 0.3 . 1 . . . . . 93 Ile CG2 . 15850 1 990 . 1 1 93 93 ILE N N 15 120.045 0.3 . 1 . . . . . 93 Ile N . 15850 1 991 . 1 1 94 94 GLN H H 1 8.988 0.02 . 1 . . . . . 94 Gln H . 15850 1 992 . 1 1 94 94 GLN HA H 1 4.869 0.02 . 1 . . . . . 94 Gln HA . 15850 1 993 . 1 1 94 94 GLN HB2 H 1 2.008 0.02 . 2 . . . . . 94 Gln HB2 . 15850 1 994 . 1 1 94 94 GLN HB3 H 1 2.533 0.02 . 2 . . . . . 94 Gln HB3 . 15850 1 995 . 1 1 94 94 GLN HE21 H 1 7.843 0.02 . 1 . . . . . 94 Gln HE21 . 15850 1 996 . 1 1 94 94 GLN HE22 H 1 7.070 0.02 . 1 . . . . . 94 Gln HE22 . 15850 1 997 . 1 1 94 94 GLN HG2 H 1 2.590 0.02 . 2 . . . . . 94 Gln HG2 . 15850 1 998 . 1 1 94 94 GLN HG3 H 1 2.572 0.02 . 2 . . . . . 94 Gln HG3 . 15850 1 999 . 1 1 94 94 GLN C C 13 177.374 0.3 . 1 . . . . . 94 Gln C . 15850 1 1000 . 1 1 94 94 GLN CA C 13 53.743 0.3 . 1 . . . . . 94 Gln CA . 15850 1 1001 . 1 1 94 94 GLN CB C 13 30.700 0.3 . 1 . . . . . 94 Gln CB . 15850 1 1002 . 1 1 94 94 GLN CD C 13 180.690 0.3 . 1 . . . . . 94 Gln CD . 15850 1 1003 . 1 1 94 94 GLN CG C 13 34.092 0.3 . 1 . . . . . 94 Gln CG . 15850 1 1004 . 1 1 94 94 GLN N N 15 117.992 0.3 . 1 . . . . . 94 Gln N . 15850 1 1005 . 1 1 94 94 GLN NE2 N 15 114.224 0.3 . 1 . . . . . 94 Gln NE2 . 15850 1 1006 . 1 1 95 95 LYS H H 1 9.010 0.02 . 1 . . . . . 95 Lys H . 15850 1 1007 . 1 1 95 95 LYS HA H 1 3.245 0.02 . 1 . . . . . 95 Lys HA . 15850 1 1008 . 1 1 95 95 LYS HB2 H 1 1.851 0.02 . 2 . . . . . 95 Lys HB2 . 15850 1 1009 . 1 1 95 95 LYS HB3 H 1 1.836 0.02 . 2 . . . . . 95 Lys HB3 . 15850 1 1010 . 1 1 95 95 LYS HD2 H 1 1.815 0.02 . 2 . . . . . 95 Lys HD2 . 15850 1 1011 . 1 1 95 95 LYS HD3 H 1 1.815 0.02 . 2 . . . . . 95 Lys HD3 . 15850 1 1012 . 1 1 95 95 LYS HE2 H 1 3.066 0.02 . 2 . . . . . 95 Lys HE2 . 15850 1 1013 . 1 1 95 95 LYS HE3 H 1 3.066 0.02 . 2 . . . . . 95 Lys HE3 . 15850 1 1014 . 1 1 95 95 LYS HG2 H 1 1.180 0.02 . 2 . . . . . 95 Lys HG2 . 15850 1 1015 . 1 1 95 95 LYS HG3 H 1 1.356 0.02 . 2 . . . . . 95 Lys HG3 . 15850 1 1016 . 1 1 95 95 LYS C C 13 175.814 0.3 . 1 . . . . . 95 Lys C . 15850 1 1017 . 1 1 95 95 LYS CA C 13 59.730 0.3 . 1 . . . . . 95 Lys CA . 15850 1 1018 . 1 1 95 95 LYS CB C 13 32.231 0.3 . 1 . . . . . 95 Lys CB . 15850 1 1019 . 1 1 95 95 LYS CD C 13 29.709 0.3 . 1 . . . . . 95 Lys CD . 15850 1 1020 . 1 1 95 95 LYS CE C 13 42.100 0.3 . 1 . . . . . 95 Lys CE . 15850 1 1021 . 1 1 95 95 LYS CG C 13 25.002 0.3 . 1 . . . . . 95 Lys CG . 15850 1 1022 . 1 1 95 95 LYS N N 15 122.622 0.3 . 1 . . . . . 95 Lys N . 15850 1 1023 . 1 1 96 96 ALA H H 1 8.136 0.02 . 1 . . . . . 96 Ala H . 15850 1 1024 . 1 1 96 96 ALA HA H 1 4.082 0.02 . 1 . . . . . 96 Ala HA . 15850 1 1025 . 1 1 96 96 ALA HB1 H 1 1.437 0.02 . 1 . . . . . 96 Ala HB . 15850 1 1026 . 1 1 96 96 ALA HB2 H 1 1.437 0.02 . 1 . . . . . 96 Ala HB . 15850 1 1027 . 1 1 96 96 ALA HB3 H 1 1.437 0.02 . 1 . . . . . 96 Ala HB . 15850 1 1028 . 1 1 96 96 ALA C C 13 177.959 0.3 . 1 . . . . . 96 Ala C . 15850 1 1029 . 1 1 96 96 ALA CA C 13 54.039 0.3 . 1 . . . . . 96 Ala CA . 15850 1 1030 . 1 1 96 96 ALA CB C 13 18.965 0.3 . 1 . . . . . 96 Ala CB . 15850 1 1031 . 1 1 96 96 ALA N N 15 117.133 0.3 . 1 . . . . . 96 Ala N . 15850 1 1032 . 1 1 97 97 ASP H H 1 7.761 0.02 . 1 . . . . . 97 Asp H . 15850 1 1033 . 1 1 97 97 ASP HA H 1 4.655 0.02 . 1 . . . . . 97 Asp HA . 15850 1 1034 . 1 1 97 97 ASP HB2 H 1 2.955 0.02 . 2 . . . . . 97 Asp HB2 . 15850 1 1035 . 1 1 97 97 ASP HB3 H 1 2.955 0.02 . 2 . . . . . 97 Asp HB3 . 15850 1 1036 . 1 1 97 97 ASP C C 13 176.159 0.3 . 1 . . . . . 97 Asp C . 15850 1 1037 . 1 1 97 97 ASP CA C 13 54.868 0.3 . 1 . . . . . 97 Asp CA . 15850 1 1038 . 1 1 97 97 ASP CB C 13 42.331 0.3 . 1 . . . . . 97 Asp CB . 15850 1 1039 . 1 1 97 97 ASP N N 15 115.016 0.3 . 1 . . . . . 97 Asp N . 15850 1 1040 . 1 1 98 98 LEU H H 1 7.346 0.02 . 1 . . . . . 98 Leu H . 15850 1 1041 . 1 1 98 98 LEU HA H 1 3.899 0.02 . 1 . . . . . 98 Leu HA . 15850 1 1042 . 1 1 98 98 LEU HB2 H 1 0.772 0.02 . 2 . . . . . 98 Leu HB2 . 15850 1 1043 . 1 1 98 98 LEU HB3 H 1 1.659 0.02 . 2 . . . . . 98 Leu HB3 . 15850 1 1044 . 1 1 98 98 LEU HD11 H 1 0.292 0.02 . 1 . . . . . 98 Leu HD1 . 15850 1 1045 . 1 1 98 98 LEU HD12 H 1 0.292 0.02 . 1 . . . . . 98 Leu HD1 . 15850 1 1046 . 1 1 98 98 LEU HD13 H 1 0.292 0.02 . 1 . . . . . 98 Leu HD1 . 15850 1 1047 . 1 1 98 98 LEU HD21 H 1 0.635 0.02 . 1 . . . . . 98 Leu HD2 . 15850 1 1048 . 1 1 98 98 LEU HD22 H 1 0.635 0.02 . 1 . . . . . 98 Leu HD2 . 15850 1 1049 . 1 1 98 98 LEU HD23 H 1 0.635 0.02 . 1 . . . . . 98 Leu HD2 . 15850 1 1050 . 1 1 98 98 LEU HG H 1 1.509 0.02 . 1 . . . . . 98 Leu HG . 15850 1 1051 . 1 1 98 98 LEU CA C 13 52.814 0.3 . 1 . . . . . 98 Leu CA . 15850 1 1052 . 1 1 98 98 LEU CB C 13 42.307 0.3 . 1 . . . . . 98 Leu CB . 15850 1 1053 . 1 1 98 98 LEU CD1 C 13 26.01 0.3 . 1 . . . . . 98 Leu CD1 . 15850 1 1054 . 1 1 98 98 LEU CD2 C 13 23.66 0.3 . 1 . . . . . 98 Leu CD2 . 15850 1 1055 . 1 1 98 98 LEU CG C 13 26.150 0.3 . 1 . . . . . 98 Leu CG . 15850 1 1056 . 1 1 98 98 LEU N N 15 120.047 0.3 . 1 . . . . . 98 Leu N . 15850 1 1057 . 1 1 99 99 PRO HA H 1 4.487 0.02 . 1 . . . . . 99 Pro HA . 15850 1 1058 . 1 1 99 99 PRO HB2 H 1 1.765 0.02 . 2 . . . . . 99 Pro HB2 . 15850 1 1059 . 1 1 99 99 PRO HB3 H 1 2.591 0.02 . 2 . . . . . 99 Pro HB3 . 15850 1 1060 . 1 1 99 99 PRO HD2 H 1 2.257 0.02 . 2 . . . . . 99 Pro HD2 . 15850 1 1061 . 1 1 99 99 PRO HD3 H 1 3.294 0.02 . 2 . . . . . 99 Pro HD3 . 15850 1 1062 . 1 1 99 99 PRO HG2 H 1 1.637 0.02 . 2 . . . . . 99 Pro HG2 . 15850 1 1063 . 1 1 99 99 PRO HG3 H 1 2.017 0.02 . 2 . . . . . 99 Pro HG3 . 15850 1 1064 . 1 1 99 99 PRO C C 13 177.368 0.3 . 1 . . . . . 99 Pro C . 15850 1 1065 . 1 1 99 99 PRO CA C 13 62.493 0.3 . 1 . . . . . 99 Pro CA . 15850 1 1066 . 1 1 99 99 PRO CB C 13 32.279 0.3 . 1 . . . . . 99 Pro CB . 15850 1 1067 . 1 1 99 99 PRO CD C 13 49.637 0.3 . 1 . . . . . 99 Pro CD . 15850 1 1068 . 1 1 99 99 PRO CG C 13 28.294 0.3 . 1 . . . . . 99 Pro CG . 15850 1 1069 . 1 1 100 100 GLU H H 1 8.930 0.02 . 1 . . . . . 100 Glu H . 15850 1 1070 . 1 1 100 100 GLU HA H 1 3.818 0.02 . 1 . . . . . 100 Glu HA . 15850 1 1071 . 1 1 100 100 GLU HB2 H 1 2.082 0.02 . 2 . . . . . 100 Glu HB2 . 15850 1 1072 . 1 1 100 100 GLU HB3 H 1 2.155 0.02 . 2 . . . . . 100 Glu HB3 . 15850 1 1073 . 1 1 100 100 GLU HG2 H 1 2.391 0.02 . 2 . . . . . 100 Glu HG2 . 15850 1 1074 . 1 1 100 100 GLU HG3 H 1 2.391 0.02 . 2 . . . . . 100 Glu HG3 . 15850 1 1075 . 1 1 100 100 GLU C C 13 178.504 0.3 . 1 . . . . . 100 Glu C . 15850 1 1076 . 1 1 100 100 GLU CA C 13 60.634 0.3 . 1 . . . . . 100 Glu CA . 15850 1 1077 . 1 1 100 100 GLU CB C 13 29.940 0.3 . 1 . . . . . 100 Glu CB . 15850 1 1078 . 1 1 100 100 GLU CG C 13 35.970 0.3 . 1 . . . . . 100 Glu CG . 15850 1 1079 . 1 1 100 100 GLU N N 15 124.659 0.3 . 1 . . . . . 100 Glu N . 15850 1 1080 . 1 1 101 101 LYS H H 1 8.922 0.02 . 1 . . . . . 101 Lys H . 15850 1 1081 . 1 1 101 101 LYS HA H 1 4.154 0.02 . 1 . . . . . 101 Lys HA . 15850 1 1082 . 1 1 101 101 LYS HB2 H 1 1.804 0.02 . 2 . . . . . 101 Lys HB2 . 15850 1 1083 . 1 1 101 101 LYS HB3 H 1 1.785 0.02 . 2 . . . . . 101 Lys HB3 . 15850 1 1084 . 1 1 101 101 LYS HD2 H 1 1.870 0.02 . 2 . . . . . 101 Lys HD2 . 15850 1 1085 . 1 1 101 101 LYS HD3 H 1 1.870 0.02 . 2 . . . . . 101 Lys HD3 . 15850 1 1086 . 1 1 101 101 LYS HE2 H 1 3.110 0.02 . 2 . . . . . 101 Lys HE2 . 15850 1 1087 . 1 1 101 101 LYS HE3 H 1 3.110 0.02 . 2 . . . . . 101 Lys HE3 . 15850 1 1088 . 1 1 101 101 LYS HG2 H 1 1.507 0.02 . 2 . . . . . 101 Lys HG2 . 15850 1 1089 . 1 1 101 101 LYS HG3 H 1 1.667 0.02 . 2 . . . . . 101 Lys HG3 . 15850 1 1090 . 1 1 101 101 LYS C C 13 177.293 0.3 . 1 . . . . . 101 Lys C . 15850 1 1091 . 1 1 101 101 LYS CA C 13 58.645 0.3 . 1 . . . . . 101 Lys CA . 15850 1 1092 . 1 1 101 101 LYS CB C 13 32.417 0.3 . 1 . . . . . 101 Lys CB . 15850 1 1093 . 1 1 101 101 LYS CD C 13 29.300 0.3 . 1 . . . . . 101 Lys CD . 15850 1 1094 . 1 1 101 101 LYS CE C 13 42.080 0.3 . 1 . . . . . 101 Lys CE . 15850 1 1095 . 1 1 101 101 LYS CG C 13 26.144 0.3 . 1 . . . . . 101 Lys CG . 15850 1 1096 . 1 1 101 101 LYS N N 15 114.802 0.3 . 1 . . . . . 101 Lys N . 15850 1 1097 . 1 1 102 102 VAL H H 1 7.277 0.02 . 1 . . . . . 102 Val H . 15850 1 1098 . 1 1 102 102 VAL HA H 1 3.695 0.02 . 1 . . . . . 102 Val HA . 15850 1 1099 . 1 1 102 102 VAL HB H 1 1.816 0.02 . 1 . . . . . 102 Val HB . 15850 1 1100 . 1 1 102 102 VAL HG11 H 1 0.836 0.02 . 1 . . . . . 102 Val HG1 . 15850 1 1101 . 1 1 102 102 VAL HG12 H 1 0.836 0.02 . 1 . . . . . 102 Val HG1 . 15850 1 1102 . 1 1 102 102 VAL HG13 H 1 0.836 0.02 . 1 . . . . . 102 Val HG1 . 15850 1 1103 . 1 1 102 102 VAL HG21 H 1 0.800 0.02 . 1 . . . . . 102 Val HG2 . 15850 1 1104 . 1 1 102 102 VAL HG22 H 1 0.800 0.02 . 1 . . . . . 102 Val HG2 . 15850 1 1105 . 1 1 102 102 VAL HG23 H 1 0.800 0.02 . 1 . . . . . 102 Val HG2 . 15850 1 1106 . 1 1 102 102 VAL C C 13 176.669 0.3 . 1 . . . . . 102 Val C . 15850 1 1107 . 1 1 102 102 VAL CA C 13 63.136 0.3 . 1 . . . . . 102 Val CA . 15850 1 1108 . 1 1 102 102 VAL CB C 13 32.239 0.3 . 1 . . . . . 102 Val CB . 15850 1 1109 . 1 1 102 102 VAL CG1 C 13 23.231 0.3 . 1 . . . . . 102 Val CG1 . 15850 1 1110 . 1 1 102 102 VAL CG2 C 13 23.145 0.3 . 1 . . . . . 102 Val CG2 . 15850 1 1111 . 1 1 102 102 VAL N N 15 114.257 0.3 . 1 . . . . . 102 Val N . 15850 1 1112 . 1 1 103 103 LYS H H 1 7.715 0.02 . 1 . . . . . 103 Lys H . 15850 1 1113 . 1 1 103 103 LYS HA H 1 3.706 0.02 . 1 . . . . . 103 Lys HA . 15850 1 1114 . 1 1 103 103 LYS HB2 H 1 1.796 0.02 . 2 . . . . . 103 Lys HB2 . 15850 1 1115 . 1 1 103 103 LYS HB3 H 1 1.795 0.02 . 2 . . . . . 103 Lys HB3 . 15850 1 1116 . 1 1 103 103 LYS HD2 H 1 1.684 0.02 . 2 . . . . . 103 Lys HD2 . 15850 1 1117 . 1 1 103 103 LYS HD3 H 1 1.749 0.02 . 2 . . . . . 103 Lys HD3 . 15850 1 1118 . 1 1 103 103 LYS HE2 H 1 2.986 0.02 . 2 . . . . . 103 Lys HE2 . 15850 1 1119 . 1 1 103 103 LYS HE3 H 1 2.986 0.02 . 2 . . . . . 103 Lys HE3 . 15850 1 1120 . 1 1 103 103 LYS HG2 H 1 1.311 0.02 . 2 . . . . . 103 Lys HG2 . 15850 1 1121 . 1 1 103 103 LYS HG3 H 1 1.428 0.02 . 2 . . . . . 103 Lys HG3 . 15850 1 1122 . 1 1 103 103 LYS C C 13 178.288 0.3 . 1 . . . . . 103 Lys C . 15850 1 1123 . 1 1 103 103 LYS CA C 13 60.816 0.3 . 1 . . . . . 103 Lys CA . 15850 1 1124 . 1 1 103 103 LYS CB C 13 32.558 0.3 . 1 . . . . . 103 Lys CB . 15850 1 1125 . 1 1 103 103 LYS CD C 13 29.510 0.3 . 1 . . . . . 103 Lys CD . 15850 1 1126 . 1 1 103 103 LYS CE C 13 42.280 0.3 . 1 . . . . . 103 Lys CE . 15850 1 1127 . 1 1 103 103 LYS CG C 13 25.729 0.3 . 1 . . . . . 103 Lys CG . 15850 1 1128 . 1 1 103 103 LYS N N 15 119.842 0.3 . 1 . . . . . 103 Lys N . 15850 1 1129 . 1 1 104 104 ASP H H 1 7.946 0.02 . 1 . . . . . 104 Asp H . 15850 1 1130 . 1 1 104 104 ASP HA H 1 4.540 0.02 . 1 . . . . . 104 Asp HA . 15850 1 1131 . 1 1 104 104 ASP HB2 H 1 2.675 0.02 . 2 . . . . . 104 Asp HB2 . 15850 1 1132 . 1 1 104 104 ASP HB3 H 1 2.675 0.02 . 2 . . . . . 104 Asp HB3 . 15850 1 1133 . 1 1 104 104 ASP C C 13 177.618 0.3 . 1 . . . . . 104 Asp C . 15850 1 1134 . 1 1 104 104 ASP CA C 13 55.782 0.3 . 1 . . . . . 104 Asp CA . 15850 1 1135 . 1 1 104 104 ASP CB C 13 40.704 0.3 . 1 . . . . . 104 Asp CB . 15850 1 1136 . 1 1 104 104 ASP N N 15 115.582 0.3 . 1 . . . . . 104 Asp N . 15850 1 1137 . 1 1 105 105 LYS H H 1 7.461 0.02 . 1 . . . . . 105 Lys H . 15850 1 1138 . 1 1 105 105 LYS HA H 1 3.983 0.02 . 1 . . . . . 105 Lys HA . 15850 1 1139 . 1 1 105 105 LYS HB2 H 1 0.985 0.02 . 2 . . . . . 105 Lys HB2 . 15850 1 1140 . 1 1 105 105 LYS HB3 H 1 0.876 0.02 . 2 . . . . . 105 Lys HB3 . 15850 1 1141 . 1 1 105 105 LYS HD2 H 1 1.171 0.02 . 2 . . . . . 105 Lys HD2 . 15850 1 1142 . 1 1 105 105 LYS HD3 H 1 1.322 0.02 . 2 . . . . . 105 Lys HD3 . 15850 1 1143 . 1 1 105 105 LYS HE2 H 1 2.910 0.02 . 2 . . . . . 105 Lys HE2 . 15850 1 1144 . 1 1 105 105 LYS HE3 H 1 3.030 0.02 . 2 . . . . . 105 Lys HE3 . 15850 1 1145 . 1 1 105 105 LYS HG2 H 1 0.419 0.02 . 2 . . . . . 105 Lys HG2 . 15850 1 1146 . 1 1 105 105 LYS HG3 H 1 1.174 0.02 . 2 . . . . . 105 Lys HG3 . 15850 1 1147 . 1 1 105 105 LYS C C 13 177.401 0.3 . 1 . . . . . 105 Lys C . 15850 1 1148 . 1 1 105 105 LYS CA C 13 55.715 0.3 . 1 . . . . . 105 Lys CA . 15850 1 1149 . 1 1 105 105 LYS CB C 13 30.925 0.3 . 1 . . . . . 105 Lys CB . 15850 1 1150 . 1 1 105 105 LYS CD C 13 27.438 0.3 . 1 . . . . . 105 Lys CD . 15850 1 1151 . 1 1 105 105 LYS CE C 13 42.233 0.3 . 1 . . . . . 105 Lys CE . 15850 1 1152 . 1 1 105 105 LYS CG C 13 24.077 0.3 . 1 . . . . . 105 Lys CG . 15850 1 1153 . 1 1 105 105 LYS N N 15 116.672 0.3 . 1 . . . . . 105 Lys N . 15850 1 1154 . 1 1 106 106 PHE H H 1 7.369 0.02 . 1 . . . . . 106 Phe H . 15850 1 1155 . 1 1 106 106 PHE HA H 1 5.123 0.02 . 1 . . . . . 106 Phe HA . 15850 1 1156 . 1 1 106 106 PHE HB2 H 1 3.687 0.02 . 2 . . . . . 106 Phe HB2 . 15850 1 1157 . 1 1 106 106 PHE HB3 H 1 2.854 0.02 . 2 . . . . . 106 Phe HB3 . 15850 1 1158 . 1 1 106 106 PHE HD1 H 1 7.386 0.02 . 3 . . . . . 106 Phe HD1 . 15850 1 1159 . 1 1 106 106 PHE HD2 H 1 7.386 0.02 . 3 . . . . . 106 Phe HD2 . 15850 1 1160 . 1 1 106 106 PHE HE1 H 1 7.506 0.02 . 3 . . . . . 106 Phe HE1 . 15850 1 1161 . 1 1 106 106 PHE HE2 H 1 7.506 0.02 . 3 . . . . . 106 Phe HE2 . 15850 1 1162 . 1 1 106 106 PHE HZ H 1 7.534 0.02 . 1 . . . . . 106 Phe HZ . 15850 1 1163 . 1 1 106 106 PHE C C 13 175.400 0.3 . 1 . . . . . 106 Phe C . 15850 1 1164 . 1 1 106 106 PHE CA C 13 56.260 0.3 . 1 . . . . . 106 Phe CA . 15850 1 1165 . 1 1 106 106 PHE CB C 13 40.189 0.3 . 1 . . . . . 106 Phe CB . 15850 1 1166 . 1 1 106 106 PHE CD1 C 13 131.832 0.3 . 3 . . . . . 106 Phe CD1 . 15850 1 1167 . 1 1 106 106 PHE CD2 C 13 131.832 0.3 . 3 . . . . . 106 Phe CD2 . 15850 1 1168 . 1 1 106 106 PHE CE1 C 13 131.522 0.3 . 3 . . . . . 106 Phe CE1 . 15850 1 1169 . 1 1 106 106 PHE CE2 C 13 131.522 0.3 . 3 . . . . . 106 Phe CE2 . 15850 1 1170 . 1 1 106 106 PHE CZ C 13 129.151 0.3 . 1 . . . . . 106 Phe CZ . 15850 1 1171 . 1 1 106 106 PHE N N 15 116.305 0.3 . 1 . . . . . 106 Phe N . 15850 1 1172 . 1 1 107 107 THR H H 1 8.026 0.02 . 1 . . . . . 107 Thr H . 15850 1 1173 . 1 1 107 107 THR HA H 1 4.520 0.02 . 1 . . . . . 107 Thr HA . 15850 1 1174 . 1 1 107 107 THR HB H 1 4.287 0.02 . 1 . . . . . 107 Thr HB . 15850 1 1175 . 1 1 107 107 THR HG21 H 1 1.304 0.02 . 1 . . . . . 107 Thr HG2 . 15850 1 1176 . 1 1 107 107 THR HG22 H 1 1.304 0.02 . 1 . . . . . 107 Thr HG2 . 15850 1 1177 . 1 1 107 107 THR HG23 H 1 1.304 0.02 . 1 . . . . . 107 Thr HG2 . 15850 1 1178 . 1 1 107 107 THR C C 13 174.160 0.3 . 1 . . . . . 107 Thr C . 15850 1 1179 . 1 1 107 107 THR CA C 13 62.338 0.3 . 1 . . . . . 107 Thr CA . 15850 1 1180 . 1 1 107 107 THR CB C 13 70.033 0.3 . 1 . . . . . 107 Thr CB . 15850 1 1181 . 1 1 107 107 THR CG2 C 13 21.766 0.3 . 1 . . . . . 107 Thr CG2 . 15850 1 1182 . 1 1 107 107 THR N N 15 115.523 0.3 . 1 . . . . . 107 Thr N . 15850 1 1183 . 1 1 108 108 ILE H H 1 8.461 0.02 . 1 . . . . . 108 Ile H . 15850 1 1184 . 1 1 108 108 ILE HA H 1 4.321 0.02 . 1 . . . . . 108 Ile HA . 15850 1 1185 . 1 1 108 108 ILE HB H 1 1.968 0.02 . 1 . . . . . 108 Ile HB . 15850 1 1186 . 1 1 108 108 ILE HD11 H 1 0.953 0.02 . 1 . . . . . 108 Ile HD1 . 15850 1 1187 . 1 1 108 108 ILE HD12 H 1 0.953 0.02 . 1 . . . . . 108 Ile HD1 . 15850 1 1188 . 1 1 108 108 ILE HD13 H 1 0.953 0.02 . 1 . . . . . 108 Ile HD1 . 15850 1 1189 . 1 1 108 108 ILE HG12 H 1 1.601 0.02 . 2 . . . . . 108 Ile HG12 . 15850 1 1190 . 1 1 108 108 ILE HG13 H 1 1.328 0.02 . 2 . . . . . 108 Ile HG13 . 15850 1 1191 . 1 1 108 108 ILE HG21 H 1 0.984 0.02 . 1 . . . . . 108 Ile HG2 . 15850 1 1192 . 1 1 108 108 ILE HG22 H 1 0.984 0.02 . 1 . . . . . 108 Ile HG2 . 15850 1 1193 . 1 1 108 108 ILE HG23 H 1 0.984 0.02 . 1 . . . . . 108 Ile HG2 . 15850 1 1194 . 1 1 108 108 ILE C C 13 175.757 0.3 . 1 . . . . . 108 Ile C . 15850 1 1195 . 1 1 108 108 ILE CA C 13 61.097 0.3 . 1 . . . . . 108 Ile CA . 15850 1 1196 . 1 1 108 108 ILE CB C 13 38.810 0.3 . 1 . . . . . 108 Ile CB . 15850 1 1197 . 1 1 108 108 ILE CD1 C 13 13.082 0.3 . 1 . . . . . 108 Ile CD1 . 15850 1 1198 . 1 1 108 108 ILE CG1 C 13 27.410 0.3 . 1 . . . . . 108 Ile CG1 . 15850 1 1199 . 1 1 108 108 ILE CG2 C 13 17.628 0.3 . 1 . . . . . 108 Ile CG2 . 15850 1 1200 . 1 1 108 108 ILE N N 15 125.267 0.3 . 1 . . . . . 108 Ile N . 15850 1 1201 . 1 1 109 109 LYS H H 1 8.508 0.02 . 1 . . . . . 109 Lys H . 15850 1 1202 . 1 1 109 109 LYS HA H 1 4.432 0.02 . 1 . . . . . 109 Lys HA . 15850 1 1203 . 1 1 109 109 LYS HB2 H 1 1.780 0.02 . 2 . . . . . 109 Lys HB2 . 15850 1 1204 . 1 1 109 109 LYS HB3 H 1 1.870 0.02 . 2 . . . . . 109 Lys HB3 . 15850 1 1205 . 1 1 109 109 LYS HD2 H 1 1.818 0.02 . 2 . . . . . 109 Lys HD2 . 15850 1 1206 . 1 1 109 109 LYS HD3 H 1 1.818 0.02 . 2 . . . . . 109 Lys HD3 . 15850 1 1207 . 1 1 109 109 LYS C C 13 176.006 0.3 . 1 . . . . . 109 Lys C . 15850 1 1208 . 1 1 109 109 LYS CA C 13 55.964 0.3 . 1 . . . . . 109 Lys CA . 15850 1 1209 . 1 1 109 109 LYS CB C 13 33.200 0.3 . 1 . . . . . 109 Lys CB . 15850 1 1210 . 1 1 109 109 LYS CD C 13 28.961 0.3 . 1 . . . . . 109 Lys CD . 15850 1 1211 . 1 1 109 109 LYS N N 15 126.763 0.3 . 1 . . . . . 109 Lys N . 15850 1 stop_ save_