################################### # 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 18260 _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' . . . 18260 1 2 '3D CBCA(CO)NH' . . . 18260 1 3 '3D C(CO)NH' . . . 18260 1 4 '3D HNCO' . . . 18260 1 5 '3D HNCA' . . . 18260 1 6 '3D HNCACB' . . . 18260 1 7 '3D HBHA(CO)NH' . . . 18260 1 9 '3D H(CCO)NH' . . . 18260 1 10 '3D 1H-15N NOESY' . . . 18260 1 11 '3D 1H-13C NOESY' . . . 18260 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.500 0.020 . 1 . . . . 1 Met HA . 18260 1 2 . 1 1 1 1 MET HB2 H 1 2.103 0.020 . 1 . . . . 1 Met HB2 . 18260 1 3 . 1 1 1 1 MET HB3 H 1 2.103 0.020 . 1 . . . . 1 Met HB3 . 18260 1 4 . 1 1 1 1 MET HG2 H 1 2.597 0.020 . 1 . . . . 1 Met HG2 . 18260 1 5 . 1 1 1 1 MET HG3 H 1 2.597 0.020 . 1 . . . . 1 Met HG3 . 18260 1 6 . 1 1 1 1 MET HE1 H 1 2.117 0.020 . 1 . . . . 1 Met HE1 . 18260 1 7 . 1 1 1 1 MET HE2 H 1 2.117 0.020 . 1 . . . . 1 Met HE2 . 18260 1 8 . 1 1 1 1 MET HE3 H 1 2.117 0.020 . 1 . . . . 1 Met HE3 . 18260 1 9 . 1 1 1 1 MET C C 13 175.951 0.300 . 1 . . . . 1 Met C . 18260 1 10 . 1 1 1 1 MET CA C 13 55.429 0.300 . 1 . . . . 1 Met CA . 18260 1 11 . 1 1 1 1 MET CB C 13 32.861 0.300 . 1 . . . . 1 Met CB . 18260 1 12 . 1 1 1 1 MET CG C 13 32.484 0.300 . 1 . . . . 1 Met CG . 18260 1 13 . 1 1 1 1 MET CE C 13 17.054 0.300 . 1 . . . . 1 Met CE . 18260 1 14 . 1 1 2 2 ALA H H 1 8.400 0.020 . 1 . . . . 2 Ala H . 18260 1 15 . 1 1 2 2 ALA HA H 1 4.349 0.020 . 1 . . . . 2 Ala HA . 18260 1 16 . 1 1 2 2 ALA HB1 H 1 1.424 0.020 . 1 . . . . 2 Ala HB1 . 18260 1 17 . 1 1 2 2 ALA HB2 H 1 1.424 0.020 . 1 . . . . 2 Ala HB2 . 18260 1 18 . 1 1 2 2 ALA HB3 H 1 1.424 0.020 . 1 . . . . 2 Ala HB3 . 18260 1 19 . 1 1 2 2 ALA C C 13 177.69 0.300 . 1 . . . . 2 Ala C . 18260 1 20 . 1 1 2 2 ALA CA C 13 52.212 0.300 . 1 . . . . 2 Ala CA . 18260 1 21 . 1 1 2 2 ALA CB C 13 19.071 0.300 . 1 . . . . 2 Ala CB . 18260 1 22 . 1 1 2 2 ALA N N 15 126.011 0.100 . 1 . . . . 2 Ala N . 18260 1 23 . 1 1 3 3 ARG H H 1 8.436 0.020 . 1 . . . . 3 Arg H . 18260 1 24 . 1 1 3 3 ARG HA H 1 4.355 0.020 . 1 . . . . 3 Arg HA . 18260 1 25 . 1 1 3 3 ARG HB2 H 1 1.935 0.020 . 1 . . . . 3 Arg HB2 . 18260 1 26 . 1 1 3 3 ARG HB3 H 1 1.935 0.020 . 1 . . . . 3 Arg HB3 . 18260 1 27 . 1 1 3 3 ARG HG2 H 1 1.688 0.020 . 1 . . . . 3 Arg HG2 . 18260 1 28 . 1 1 3 3 ARG HG3 H 1 1.688 0.020 . 1 . . . . 3 Arg HG3 . 18260 1 29 . 1 1 3 3 ARG HD2 H 1 3.261 0.020 . 1 . . . . 3 Arg HD2 . 18260 1 30 . 1 1 3 3 ARG HD3 H 1 3.261 0.020 . 1 . . . . 3 Arg HD3 . 18260 1 31 . 1 1 3 3 ARG C C 13 177.158 0.300 . 1 . . . . 3 Arg C . 18260 1 32 . 1 1 3 3 ARG CA C 13 56.536 0.300 . 1 . . . . 3 Arg CA . 18260 1 33 . 1 1 3 3 ARG CB C 13 30.600 0.300 . 1 . . . . 3 Arg CB . 18260 1 34 . 1 1 3 3 ARG CG C 13 27.059 0.300 . 1 . . . . 3 Arg CG . 18260 1 35 . 1 1 3 3 ARG CD C 13 43.033 0.300 . 1 . . . . 3 Arg CD . 18260 1 36 . 1 1 3 3 ARG N N 15 120.630 0.100 . 1 . . . . 3 Arg N . 18260 1 37 . 1 1 4 4 GLY H H 1 8.540 0.020 . 1 . . . . 4 Gly H . 18260 1 38 . 1 1 4 4 GLY HA2 H 1 3.992 0.020 . 1 . . . . 4 Gly HA2 . 18260 1 39 . 1 1 4 4 GLY HA3 H 1 3.992 0.020 . 1 . . . . 4 Gly HA3 . 18260 1 40 . 1 1 4 4 GLY C C 13 174.332 0.300 . 1 . . . . 4 Gly C . 18260 1 41 . 1 1 4 4 GLY CA C 13 45.369 0.300 . 1 . . . . 4 Gly CA . 18260 1 42 . 1 1 4 4 GLY N N 15 109.607 0.100 . 1 . . . . 4 Gly N . 18260 1 43 . 1 1 5 5 GLN H H 1 8.203 0.020 . 1 . . . . 5 Gln H . 18260 1 44 . 1 1 5 5 GLN HA H 1 4.372 0.020 . 1 . . . . 5 Gln HA . 18260 1 45 . 1 1 5 5 GLN HB2 H 1 2.129 0.020 . 1 . . . . 5 Gln HB2 . 18260 1 46 . 1 1 5 5 GLN HB3 H 1 2.129 0.020 . 1 . . . . 5 Gln HB3 . 18260 1 47 . 1 1 5 5 GLN HG2 H 1 2.397 0.020 . 1 . . . . 5 Gln HG2 . 18260 1 48 . 1 1 5 5 GLN HG3 H 1 2.397 0.020 . 1 . . . . 5 Gln HG3 . 18260 1 49 . 1 1 5 5 GLN HE21 H 1 7.636 0.020 . 2 . . . . 5 Gln HE21 . 18260 1 50 . 1 1 5 5 GLN HE22 H 1 6.877 0.020 . 2 . . . . 5 Gln HE22 . 18260 1 51 . 1 1 5 5 GLN C C 13 176.435 0.300 . 1 . . . . 5 Gln C . 18260 1 52 . 1 1 5 5 GLN CA C 13 56.536 0.300 . 1 . . . . 5 Gln CA . 18260 1 53 . 1 1 5 5 GLN CB C 13 29.244 0.300 . 1 . . . . 5 Gln CB . 18260 1 54 . 1 1 5 5 GLN CG C 13 33.539 0.300 . 1 . . . . 5 Gln CG . 18260 1 55 . 1 1 5 5 GLN CD C 13 180.399 0.300 . 1 . . . . 5 Gln CD . 18260 1 56 . 1 1 5 5 GLN N N 15 120.283 0.100 . 1 . . . . 5 Gln N . 18260 1 57 . 1 1 5 5 GLN NE2 N 15 112.292 0.100 . 1 . . . . 5 Gln NE2 . 18260 1 58 . 1 1 6 6 ARG H H 1 8.450 0.020 . 1 . . . . 6 Arg H . 18260 1 59 . 1 1 6 6 ARG HA H 1 4.320 0.020 . 1 . . . . 6 Arg HA . 18260 1 60 . 1 1 6 6 ARG HB2 H 1 1.799 0.020 . 2 . . . . 6 Arg HB2 . 18260 1 61 . 1 1 6 6 ARG HB3 H 1 1.897 0.020 . 2 . . . . 6 Arg HB3 . 18260 1 62 . 1 1 6 6 ARG HG2 H 1 1.598 0.020 . 1 . . . . 6 Arg HG2 . 18260 1 63 . 1 1 6 6 ARG HG3 H 1 1.598 0.020 . 1 . . . . 6 Arg HG3 . 18260 1 64 . 1 1 6 6 ARG HD2 H 1 2.942 0.020 . 1 . . . . 6 Arg HD2 . 18260 1 65 . 1 1 6 6 ARG HD3 H 1 2.942 0.020 . 1 . . . . 6 Arg HD3 . 18260 1 66 . 1 1 6 6 ARG HE H 1 7.178 0.020 . 1 . . . . 6 Arg HE . 18260 1 67 . 1 1 6 6 ARG C C 13 177.260 0.300 . 1 . . . . 6 Arg C . 18260 1 68 . 1 1 6 6 ARG CA C 13 57.440 0.300 . 1 . . . . 6 Arg CA . 18260 1 69 . 1 1 6 6 ARG CB C 13 30.073 0.300 . 1 . . . . 6 Arg CB . 18260 1 70 . 1 1 6 6 ARG CG C 13 27.360 0.300 . 1 . . . . 6 Arg CG . 18260 1 71 . 1 1 6 6 ARG CD C 13 42.958 0.300 . 1 . . . . 6 Arg CD . 18260 1 72 . 1 1 6 6 ARG CZ C 13 159.321 0.300 . 1 . . . . 6 Arg CZ . 18260 1 73 . 1 1 6 6 ARG N N 15 121.488 0.100 . 1 . . . . 6 Arg N . 18260 1 74 . 1 1 6 6 ARG NE N 15 84.380 00.100 . 1 . . . . 6 Arg NE . 18260 1 75 . 1 1 7 7 LEU H H 1 8.326 0.020 . 1 . . . . 7 Leu H . 18260 1 76 . 1 1 7 7 LEU HA H 1 4.307 0.020 . 1 . . . . 7 Leu HA . 18260 1 77 . 1 1 7 7 LEU HB2 H 1 1.609 0.020 . 1 . . . . 7 Leu HB2 . 18260 1 78 . 1 1 7 7 LEU HB3 H 1 1.609 0.020 . 1 . . . . 7 Leu HB3 . 18260 1 79 . 1 1 7 7 LEU HG H 1 1.418 0.020 . 1 . . . . 7 Leu HG . 18260 1 80 . 1 1 7 7 LEU HD11 H 1 0.860 0.020 . 2 . . . . 7 Leu HD11 . 18260 1 81 . 1 1 7 7 LEU HD12 H 1 0.860 0.020 . 2 . . . . 7 Leu HD12 . 18260 1 82 . 1 1 7 7 LEU HD13 H 1 0.860 0.020 . 2 . . . . 7 Leu HD13 . 18260 1 83 . 1 1 7 7 LEU HD21 H 1 0.860 0.020 . 2 . . . . 7 Leu HD21 . 18260 1 84 . 1 1 7 7 LEU HD22 H 1 0.860 0.020 . 2 . . . . 7 Leu HD22 . 18260 1 85 . 1 1 7 7 LEU HD23 H 1 0.860 0.020 . 2 . . . . 7 Leu HD23 . 18260 1 86 . 1 1 7 7 LEU C C 13 178.270 0.300 . 1 . . . . 7 Leu C . 18260 1 87 . 1 1 7 7 LEU CA C 13 56.708 0.300 . 1 . . . . 7 Leu CA . 18260 1 88 . 1 1 7 7 LEU CB C 13 41.602 0.300 . 1 . . . . 7 Leu CB . 18260 1 89 . 1 1 7 7 LEU CG C 13 24.045 0.300 . 1 . . . . 7 Leu CG . 18260 1 90 . 1 1 7 7 LEU N N 15 123.100 0.100 . 1 . . . . 7 Leu N . 18260 1 91 . 1 1 8 8 GLU H H 1 8.637 0.020 . 1 . . . . 8 Glu H . 18260 1 92 . 1 1 8 8 GLU HA H 1 4.162 0.020 . 1 . . . . 8 Glu HA . 18260 1 93 . 1 1 8 8 GLU HB2 H 1 2.074 0.020 . 1 . . . . 8 Glu HB2 . 18260 1 94 . 1 1 8 8 GLU HB3 H 1 2.074 0.020 . 1 . . . . 8 Glu HB3 . 18260 1 95 . 1 1 8 8 GLU HG2 H 1 2.311 0.020 . 1 . . . . 8 Glu HG2 . 18260 1 96 . 1 1 8 8 GLU HG3 H 1 2.311 0.020 . 1 . . . . 8 Glu HG3 . 18260 1 97 . 1 1 8 8 GLU C C 13 178.334 0.300 . 1 . . . . 8 Glu C . 18260 1 98 . 1 1 8 8 GLU CA C 13 58.431 0.300 . 1 . . . . 8 Glu CA . 18260 1 99 . 1 1 8 8 GLU CB C 13 29.244 0.300 . 1 . . . . 8 Glu CB . 18260 1 100 . 1 1 8 8 GLU CG C 13 36.720 0.300 . 1 . . . . 8 Glu CG . 18260 1 101 . 1 1 8 8 GLU N N 15 120.239 0.100 . 1 . . . . 8 Glu N . 18260 1 102 . 1 1 10 10 SER HA H 1 4.281 0.020 . 1 . . . . 10 Ser HA . 18260 1 103 . 1 1 10 10 SER C C 13 175.738 0.300 . 1 . . . . 10 Ser C . 18260 1 104 . 1 1 10 10 SER CA C 13 60.154 0.300 . 1 . . . . 10 Ser CA . 18260 1 105 . 1 1 10 10 SER CB C 13 63.228 0.300 . 1 . . . . 10 Ser CB . 18260 1 106 . 1 1 11 11 LEU H H 1 8.586 0.020 . 1 . . . . 11 Leu H . 18260 1 107 . 1 1 11 11 LEU HA H 1 4.169 0.020 . 1 . . . . 11 Leu HA . 18260 1 108 . 1 1 11 11 LEU HB2 H 1 1.829 0.020 . 1 . . . . 11 Leu HB2 . 18260 1 109 . 1 1 11 11 LEU HB3 H 1 1.829 0.020 . 1 . . . . 11 Leu HB3 . 18260 1 110 . 1 1 11 11 LEU HG H 1 1.728 0.020 . 1 . . . . 11 Leu HG . 18260 1 111 . 1 1 11 11 LEU HD11 H 1 0.916 0.020 . 2 . . . . 11 Leu HD11 . 18260 1 112 . 1 1 11 11 LEU HD12 H 1 0.916 0.020 . 2 . . . . 11 Leu HD12 . 18260 1 113 . 1 1 11 11 LEU HD13 H 1 0.916 0.020 . 2 . . . . 11 Leu HD13 . 18260 1 114 . 1 1 11 11 LEU HD21 H 1 0.916 0.020 . 2 . . . . 11 Leu HD21 . 18260 1 115 . 1 1 11 11 LEU HD22 H 1 0.916 0.020 . 2 . . . . 11 Leu HD22 . 18260 1 116 . 1 1 11 11 LEU HD23 H 1 0.916 0.020 . 2 . . . . 11 Leu HD23 . 18260 1 117 . 1 1 11 11 LEU C C 13 179.793 0.300 . 1 . . . . 11 Leu C . 18260 1 118 . 1 1 11 11 LEU CA C 13 58.086 0.300 . 1 . . . . 11 Leu CA . 18260 1 119 . 1 1 11 11 LEU CB C 13 41.376 0.300 . 1 . . . . 11 Leu CB . 18260 1 120 . 1 1 11 11 LEU CG C 13 27.022 0.300 . 1 . . . . 11 Leu CG . 18260 1 121 . 1 1 11 11 LEU CD1 C 13 24.435 0.300 . 2 . . . . 11 Leu CD1 . 18260 1 122 . 1 1 11 11 LEU CD2 C 13 24.435 0.300 . 2 . . . . 11 Leu CD2 . 18260 1 123 . 1 1 11 11 LEU N N 15 125.181 0.100 . 1 . . . . 11 Leu N . 18260 1 124 . 1 1 12 12 GLU HA H 1 4.178 0.020 . 1 . . . . 12 Glu HA . 18260 1 125 . 1 1 12 12 GLU HB2 H 1 2.142 0.020 . 1 . . . . 12 Glu HB2 . 18260 1 126 . 1 1 12 12 GLU HB3 H 1 2.142 0.020 . 1 . . . . 12 Glu HB3 . 18260 1 127 . 1 1 12 12 GLU HG2 H 1 2.471 0.020 . 1 . . . . 12 Glu HG2 . 18260 1 128 . 1 1 12 12 GLU HG3 H 1 2.471 0.020 . 1 . . . . 12 Glu HG3 . 18260 1 129 . 1 1 12 12 GLU C C 13 179.843 0.300 . 1 . . . . 12 Glu C . 18260 1 130 . 1 1 12 12 GLU CA C 13 59.938 0.300 . 1 . . . . 12 Glu CA . 18260 1 131 . 1 1 12 12 GLU CB C 13 29.470 0.300 . 1 . . . . 12 Glu CB . 18260 1 132 . 1 1 13 13 TYR H H 1 8.215 0.020 . 1 . . . . 13 Tyr H . 18260 1 133 . 1 1 13 13 TYR HA H 1 4.256 0.020 . 1 . . . . 13 Tyr HA . 18260 1 134 . 1 1 13 13 TYR HB2 H 1 3.066 0.020 . 1 . . . . 13 Tyr HB2 . 18260 1 135 . 1 1 13 13 TYR HB3 H 1 3.066 0.020 . 1 . . . . 13 Tyr HB3 . 18260 1 136 . 1 1 13 13 TYR HD1 H 1 6.700 0.020 . 1 . . . . 13 Tyr HD1 . 18260 1 137 . 1 1 13 13 TYR HD2 H 1 6.700 0.020 . 1 . . . . 13 Tyr HD2 . 18260 1 138 . 1 1 13 13 TYR HE1 H 1 6.490 0.020 . 1 . . . . 13 Tyr HE1 . 18260 1 139 . 1 1 13 13 TYR HE2 H 1 6.490 0.020 . 1 . . . . 13 Tyr HE2 . 18260 1 140 . 1 1 13 13 TYR C C 13 176.210 0.300 . 1 . . . . 13 Tyr C . 18260 1 141 . 1 1 13 13 TYR CA C 13 61.187 0.300 . 1 . . . . 13 Tyr CA . 18260 1 142 . 1 1 13 13 TYR CB C 13 38.738 0.300 . 1 . . . . 13 Tyr CB . 18260 1 143 . 1 1 13 13 TYR N N 15 121.178 0.100 . 1 . . . . 13 Tyr N . 18260 1 144 . 1 1 14 14 GLN H H 1 8.477 0.020 . 1 . . . . 14 Gln H . 18260 1 145 . 1 1 14 14 GLN HA H 1 4.085 0.020 . 1 . . . . 14 Gln HA . 18260 1 146 . 1 1 14 14 GLN HB2 H 1 2.088 0.020 . 1 . . . . 14 Gln HB2 . 18260 1 147 . 1 1 14 14 GLN HB3 H 1 2.088 0.020 . 1 . . . . 14 Gln HB3 . 18260 1 148 . 1 1 14 14 GLN HG2 H 1 2.346 0.020 . 1 . . . . 14 Gln HG2 . 18260 1 149 . 1 1 14 14 GLN HG3 H 1 2.346 0.020 . 1 . . . . 14 Gln HG3 . 18260 1 150 . 1 1 14 14 GLN HE21 H 1 6.871 0.020 . 2 . . . . 14 Gln HE21 . 18260 1 151 . 1 1 14 14 GLN HE22 H 1 7.424 0.020 . 2 . . . . 14 Gln HE22 . 18260 1 152 . 1 1 14 14 GLN C C 13 179.149 0.300 . 1 . . . . 14 Gln C . 18260 1 153 . 1 1 14 14 GLN CA C 13 58.933 0.300 . 1 . . . . 14 Gln CA . 18260 1 154 . 1 1 14 14 GLN CB C 13 27.963 0.300 . 1 . . . . 14 Gln CB . 18260 1 155 . 1 1 14 14 GLN CG C 13 34.142 0.300 . 1 . . . . 14 Gln CG . 18260 1 156 . 1 1 14 14 GLN CD C 13 180.058 0.300 . 1 . . . . 14 Gln CD . 18260 1 157 . 1 1 14 14 GLN N N 15 118.263 0.100 . 1 . . . . 14 Gln N . 18260 1 158 . 1 1 14 14 GLN NE2 N 15 111.024 0.100 . 1 . . . . 14 Gln NE2 . 18260 1 159 . 1 1 15 15 GLN H H 1 8.189 0.020 . 1 . . . . 15 Gln H . 18260 1 160 . 1 1 15 15 GLN HA H 1 4.210 0.020 . 1 . . . . 15 Gln HA . 18260 1 161 . 1 1 15 15 GLN HB2 H 1 2.190 0.020 . 1 . . . . 15 Gln HB2 . 18260 1 162 . 1 1 15 15 GLN HB3 H 1 2.190 0.020 . 1 . . . . 15 Gln HB3 . 18260 1 163 . 1 1 15 15 GLN HG2 H 1 2.475 0.020 . 1 . . . . 15 Gln HG2 . 18260 1 164 . 1 1 15 15 GLN HG3 H 1 2.475 0.020 . 1 . . . . 15 Gln HG3 . 18260 1 165 . 1 1 15 15 GLN HE21 H 1 6.898 0.020 . 2 . . . . 15 Gln HE21 . 18260 1 166 . 1 1 15 15 GLN HE22 H 1 7.419 0.020 . 2 . . . . 15 Gln HE22 . 18260 1 167 . 1 1 15 15 GLN C C 13 177.283 0.300 . 1 . . . . 15 Gln C . 18260 1 168 . 1 1 15 15 GLN CA C 13 58.603 0.300 . 1 . . . . 15 Gln CA . 18260 1 169 . 1 1 15 15 GLN CB C 13 28.490 0.300 . 1 . . . . 15 Gln CB . 18260 1 170 . 1 1 15 15 GLN CG C 13 33.916 0.300 . 1 . . . . 15 Gln CG . 18260 1 171 . 1 1 15 15 GLN CD C 13 179.943 0.300 . 1 . . . . 15 Gln CD . 18260 1 172 . 1 1 15 15 GLN N N 15 119.288 0.100 . 1 . . . . 15 Gln N . 18260 1 173 . 1 1 15 15 GLN NE2 N 15 112.341 0.100 . 1 . . . . 15 Gln NE2 . 18260 1 174 . 1 1 16 16 PHE H H 1 7.497 0.020 . 1 . . . . 16 Phe H . 18260 1 175 . 1 1 16 16 PHE HA H 1 4.361 0.020 . 1 . . . . 16 Phe HA . 18260 1 176 . 1 1 16 16 PHE HB2 H 1 3.214 0.020 . 1 . . . . 16 Phe HB2 . 18260 1 177 . 1 1 16 16 PHE HB3 H 1 3.212 0.020 . 1 . . . . 16 Phe HB3 . 18260 1 178 . 1 1 16 16 PHE HD1 H 1 6.932 0.020 . 3 . . . . 16 Phe HD1 . 18260 1 179 . 1 1 16 16 PHE HD2 H 1 6.932 0.020 . 3 . . . . 16 Phe HD2 . 18260 1 180 . 1 1 16 16 PHE HE1 H 1 7.243 0.020 . 3 . . . . 16 Phe HE1 . 18260 1 181 . 1 1 16 16 PHE HE2 H 1 7.243 0.020 . 3 . . . . 16 Phe HE2 . 18260 1 182 . 1 1 16 16 PHE C C 13 176.189 0.300 . 1 . . . . 16 Phe C . 18260 1 183 . 1 1 16 16 PHE CA C 13 60.972 0.300 . 1 . . . . 16 Phe CA . 18260 1 184 . 1 1 16 16 PHE CB C 13 38.211 0.300 . 1 . . . . 16 Phe CB . 18260 1 185 . 1 1 16 16 PHE CE1 C 13 132.096 0.300 . 1 . . . . 16 Phe CE1 . 18260 1 186 . 1 1 16 16 PHE CE2 C 13 132.096 0.300 . 3 . . . . 16 Phe CE2 . 18260 1 187 . 1 1 16 16 PHE N N 15 121.280 0.100 . 1 . . . . 16 Phe N . 18260 1 188 . 1 1 17 17 VAL H H 1 8.355 0.020 . 1 . . . . 17 Val H . 18260 1 189 . 1 1 17 17 VAL HA H 1 4.230 0.020 . 1 . . . . 17 Val HA . 18260 1 190 . 1 1 17 17 VAL HB H 1 2.258 0.020 . 1 . . . . 17 Val HB . 18260 1 191 . 1 1 17 17 VAL HG11 H 1 0.773 0.020 . 2 . . . . 17 Val HG11 . 18260 1 192 . 1 1 17 17 VAL HG12 H 1 0.773 0.020 . 2 . . . . 17 Val HG12 . 18260 1 193 . 1 1 17 17 VAL HG13 H 1 0.773 0.020 . 2 . . . . 17 Val HG13 . 18260 1 194 . 1 1 17 17 VAL HG21 H 1 0.568 0.020 . 2 . . . . 17 Val HG21 . 18260 1 195 . 1 1 17 17 VAL HG22 H 1 0.568 0.020 . 2 . . . . 17 Val HG22 . 18260 1 196 . 1 1 17 17 VAL HG23 H 1 0.568 0.020 . 2 . . . . 17 Val HG23 . 18260 1 197 . 1 1 17 17 VAL C C 13 177.798 0.300 . 1 . . . . 17 Val C . 18260 1 198 . 1 1 17 17 VAL CA C 13 67.130 0.300 . 1 . . . . 17 Val CA . 18260 1 199 . 1 1 17 17 VAL CB C 13 31.203 0.300 . 1 . . . . 17 Val CB . 18260 1 200 . 1 1 17 17 VAL CG1 C 13 23.367 0.300 . 2 . . . . 17 Val CG1 . 18260 1 201 . 1 1 17 17 VAL CG2 C 13 21.613 0.300 . 2 . . . . 17 Val CG2 . 18260 1 202 . 1 1 17 17 VAL N N 15 119.277 0.100 . 1 . . . . 17 Val N . 18260 1 203 . 1 1 18 18 ALA H H 1 7.808 0.020 . 1 . . . . 18 Ala H . 18260 1 204 . 1 1 18 18 ALA HA H 1 4.077 0.020 . 1 . . . . 18 Ala HA . 18260 1 205 . 1 1 18 18 ALA HB1 H 1 1.442 0.020 . 1 . . . . 18 Ala HB1 . 18260 1 206 . 1 1 18 18 ALA HB2 H 1 1.442 0.020 . 1 . . . . 18 Ala HB2 . 18260 1 207 . 1 1 18 18 ALA HB3 H 1 1.442 0.020 . 1 . . . . 18 Ala HB3 . 18260 1 208 . 1 1 18 18 ALA C C 13 180.736 0.300 . 1 . . . . 18 Ala C . 18260 1 209 . 1 1 18 18 ALA CA C 13 54.900 0.300 . 1 . . . . 18 Ala CA . 18260 1 210 . 1 1 18 18 ALA CB C 13 17.564 0.300 . 1 . . . . 18 Ala CB . 18260 1 211 . 1 1 18 18 ALA N N 15 121.046 0.100 . 1 . . . . 18 Ala N . 18260 1 212 . 1 1 19 19 ASN HA H 1 4.604 0.020 . 1 . . . . 19 Asn HA . 18260 1 213 . 1 1 19 19 ASN HB2 H 1 3.005 0.020 . 2 . . . . 19 Asn HB2 . 18260 1 214 . 1 1 19 19 ASN HB3 H 1 2.773 0.020 . 2 . . . . 19 Asn HB3 . 18260 1 215 . 1 1 19 19 ASN HD21 H 1 7.730 0.020 . 2 . . . . 19 Asn HD21 . 18260 1 216 . 1 1 19 19 ASN HD22 H 1 6.951 0.020 . 2 . . . . 19 Asn HD22 . 18260 1 217 . 1 1 19 19 ASN C C 13 177.883 0.300 . 1 . . . . 19 Asn C . 18260 1 218 . 1 1 19 19 ASN CA C 13 55.890 0.300 . 1 . . . . 19 Asn CA . 18260 1 219 . 1 1 19 19 ASN CB C 13 38.286 0.300 . 1 . . . . 19 Asn CB . 18260 1 220 . 1 1 19 19 ASN CG C 13 176.204 0.300 . 1 . . . . 19 Asn CG . 18260 1 221 . 1 1 19 19 ASN ND2 N 15 112.459 0.100 . 1 . . . . 19 Asn ND2 . 18260 1 222 . 1 1 20 20 VAL H H 1 8.286 0.020 . 1 . . . . 20 Val H . 18260 1 223 . 1 1 20 20 VAL HA H 1 3.351 0.020 . 1 . . . . 20 Val HA . 18260 1 224 . 1 1 20 20 VAL HB H 1 1.984 0.020 . 1 . . . . 20 Val HB . 18260 1 225 . 1 1 20 20 VAL HG11 H 1 0.200 0.020 . 2 . . . . 20 Val HG11 . 18260 1 226 . 1 1 20 20 VAL HG12 H 1 0.200 0.020 . 2 . . . . 20 Val HG12 . 18260 1 227 . 1 1 20 20 VAL HG13 H 1 0.200 0.020 . 2 . . . . 20 Val HG13 . 18260 1 228 . 1 1 20 20 VAL HG21 H 1 0.860 0.020 . 2 . . . . 20 Val HG21 . 18260 1 229 . 1 1 20 20 VAL HG22 H 1 0.860 0.020 . 2 . . . . 20 Val HG22 . 18260 1 230 . 1 1 20 20 VAL HG23 H 1 0.860 0.020 . 2 . . . . 20 Val HG23 . 18260 1 231 . 1 1 20 20 VAL CA C 13 67.087 0.300 . 1 . . . . 20 Val CA . 18260 1 232 . 1 1 20 20 VAL CB C 13 30.977 0.300 . 1 . . . . 20 Val CB . 18260 1 233 . 1 1 20 20 VAL CG1 C 13 22.914 0.300 . 2 . . . . 20 Val CG1 . 18260 1 234 . 1 1 20 20 VAL CG2 C 13 21.387 0.300 . 2 . . . . 20 Val CG2 . 18260 1 235 . 1 1 20 20 VAL N N 15 121.44 0.100 . 1 . . . . 20 Val N . 18260 1 236 . 1 1 21 21 GLU H H 1 8.402 0.020 . 1 . . . . 21 Glu H . 18260 1 237 . 1 1 21 21 GLU HA H 1 4.024 0.020 . 1 . . . . 21 Glu HA . 18260 1 238 . 1 1 21 21 GLU HB2 H 1 2.164 0.020 . 1 . . . . 21 Glu HB2 . 18260 1 239 . 1 1 21 21 GLU HB3 H 1 2.164 0.020 . 1 . . . . 21 Glu HB3 . 18260 1 240 . 1 1 21 21 GLU HG2 H 1 2.552 0.020 . 1 . . . . 21 Glu HG2 . 18260 1 241 . 1 1 21 21 GLU HG3 H 1 2.552 0.020 . 1 . . . . 21 Glu HG3 . 18260 1 242 . 1 1 21 21 GLU CA C 13 59.761 0.300 . 1 . . . . 21 Glu CA . 18260 1 243 . 1 1 21 21 GLU CB C 13 28.943 0.300 . 1 . . . . 21 Glu CB . 18260 1 244 . 1 1 21 21 GLU N N 15 117.778 0.100 . 1 . . . . 21 Glu N . 18260 1 245 . 1 1 22 22 GLU H H 1 8.144 0.020 . 1 . . . . 22 Glu H . 18260 1 246 . 1 1 22 22 GLU HA H 1 4.214 0.020 . 1 . . . . 22 Glu HA . 18260 1 247 . 1 1 22 22 GLU HB2 H 1 2.113 0.020 . 2 . . . . 22 Glu HB2 . 18260 1 248 . 1 1 22 22 GLU HB3 H 1 2.004 0.020 . 2 . . . . 22 Glu HB3 . 18260 1 249 . 1 1 22 22 GLU HG2 H 1 2.746 0.020 . 1 . . . . 22 Glu HG2 . 18260 1 250 . 1 1 22 22 GLU HG3 H 1 2.746 0.020 . 1 . . . . 22 Glu HG3 . 18260 1 251 . 1 1 22 22 GLU C C 13 177.862 0.300 . 1 . . . . 22 Glu C . 18260 1 252 . 1 1 22 22 GLU CA C 13 58.129 0.300 . 1 . . . . 22 Glu CA . 18260 1 253 . 1 1 22 22 GLU CB C 13 29.470 0.300 . 1 . . . . 22 Glu CB . 18260 1 254 . 1 1 22 22 GLU N N 15 120.822 0.100 . 1 . . . . 22 Glu N . 18260 1 255 . 1 1 23 23 GLU H H 1 8.287 0.020 . 1 . . . . 23 Glu H . 18260 1 256 . 1 1 23 23 GLU HA H 1 4.578 0.020 . 1 . . . . 23 Glu HA . 18260 1 257 . 1 1 23 23 GLU HB2 H 1 2.296 0.020 . 2 . . . . 23 Glu HB2 . 18260 1 258 . 1 1 23 23 GLU HB3 H 1 2.090 0.020 . 2 . . . . 23 Glu HB3 . 18260 1 259 . 1 1 23 23 GLU HG2 H 1 2.617 0.020 . 1 . . . . 23 Glu HG2 . 18260 1 260 . 1 1 23 23 GLU HG3 H 1 2.617 0.020 . 1 . . . . 23 Glu HG3 . 18260 1 261 . 1 1 23 23 GLU C C 13 179.321 0.300 . 1 . . . . 23 Glu C . 18260 1 262 . 1 1 23 23 GLU CA C 13 59.517 0.300 . 1 . . . . 23 Glu CA . 18260 1 263 . 1 1 23 23 GLU CB C 13 29.696 0.300 . 1 . . . . 23 Glu CB . 18260 1 264 . 1 1 23 23 GLU CG C 13 36.553 0.300 . 1 . . . . 23 Glu CG . 18260 1 265 . 1 1 23 23 GLU N N 15 119.409 0.100 . 1 . . . . 23 Glu N . 18260 1 266 . 1 1 24 24 GLU H H 1 9.071 0.020 . 1 . . . . 24 Glu H . 18260 1 267 . 1 1 24 24 GLU HA H 1 3.828 0.020 . 1 . . . . 24 Glu HA . 18260 1 268 . 1 1 24 24 GLU HB2 H 1 2.258 0.020 . 2 . . . . 24 Glu HB2 . 18260 1 269 . 1 1 24 24 GLU HB3 H 1 1.987 0.020 . 2 . . . . 24 Glu HB3 . 18260 1 270 . 1 1 24 24 GLU HG2 H 1 2.384 0.020 . 1 . . . . 24 Glu HG2 . 18260 1 271 . 1 1 24 24 GLU HG3 H 1 2.384 0.020 . 1 . . . . 24 Glu HG3 . 18260 1 272 . 1 1 24 24 GLU C C 13 178.227 0.300 . 1 . . . . 24 Glu C . 18260 1 273 . 1 1 24 24 GLU CA C 13 60.886 0.300 . 1 . . . . 24 Glu CA . 18260 1 274 . 1 1 24 24 GLU CB C 13 29.545 0.300 . 1 . . . . 24 Glu CB . 18260 1 275 . 1 1 24 24 GLU CG C 13 38.6663 0.300 . 1 . . . . 24 Glu CG . 18260 1 276 . 1 1 24 24 GLU N N 15 119.418 0.100 . 1 . . . . 24 Glu N . 18260 1 277 . 1 1 25 25 ALA H H 1 8.207 0.020 . 1 . . . . 25 Ala H . 18260 1 278 . 1 1 25 25 ALA HA H 1 4.243 0.020 . 1 . . . . 25 Ala HA . 18260 1 279 . 1 1 25 25 ALA HB1 H 1 1.584 0.020 . 1 . . . . 25 Ala HB1 . 18260 1 280 . 1 1 25 25 ALA HB2 H 1 1.584 0.020 . 1 . . . . 25 Ala HB2 . 18260 1 281 . 1 1 25 25 ALA HB3 H 1 1.584 0.020 . 1 . . . . 25 Ala HB3 . 18260 1 282 . 1 1 25 25 ALA C C 13 180.522 0.300 . 1 . . . . 25 Ala C . 18260 1 283 . 1 1 25 25 ALA CA C 13 55.244 0.300 . 1 . . . . 25 Ala CA . 18260 1 284 . 1 1 25 25 ALA CB C 13 17.564 0.300 . 1 . . . . 25 Ala CB . 18260 1 285 . 1 1 25 25 ALA N N 15 120.107 0.100 . 1 . . . . 25 Ala N . 18260 1 286 . 1 1 26 26 TRP H H 1 7.631 0.020 . 1 . . . . 26 Trp H . 18260 1 287 . 1 1 26 26 TRP HA H 1 4.101 0.020 . 1 . . . . 26 Trp HA . 18260 1 288 . 1 1 26 26 TRP HB2 H 1 3.360 0.020 . 1 . . . . 26 Trp HB2 . 18260 1 289 . 1 1 26 26 TRP HB3 H 1 3.200 0.020 . 1 . . . . 26 Trp HB3 . 18260 1 290 . 1 1 26 26 TRP HD1 H 1 7.248 0.020 . 1 . . . . 26 Trp HD1 . 18260 1 291 . 1 1 26 26 TRP HE1 H 1 10.164 0.020 . 1 . . . . 26 Trp HE1 . 18260 1 292 . 1 1 26 26 TRP HZ2 H 1 6.597 0.020 . 1 . . . . 26 Trp HZ2 . 18260 1 293 . 1 1 26 26 TRP C C 13 177.712 0.300 . 1 . . . . 26 Trp C . 18260 1 294 . 1 1 26 26 TRP CA C 13 62.550 0.300 . 1 . . . . 26 Trp CA . 18260 1 295 . 1 1 26 26 TRP CB C 13 28.114 0.300 . 1 . . . . 26 Trp CB . 18260 1 296 . 1 1 26 26 TRP CD1 C 13 127.365 0.300 . 1 . . . . 26 Trp CD1 . 18260 1 297 . 1 1 26 26 TRP CE2 C 13 158.596 0.300 . 1 . . . . 26 Trp CE2 . 18260 1 298 . 1 1 26 26 TRP CZ2 C 13 103.184 0.300 . 1 . . . . 26 Trp CZ2 . 18260 1 299 . 1 1 26 26 TRP N N 15 120.649 0.100 . 1 . . . . 26 Trp N . 18260 1 300 . 1 1 26 26 TRP NE1 N 15 129.645 0.100 . 1 . . . . 26 Trp NE1 . 18260 1 301 . 1 1 27 27 ILE H H 1 8.574 0.020 . 1 . . . . 27 Ile H . 18260 1 302 . 1 1 27 27 ILE HA H 1 3.263 0.020 . 1 . . . . 27 Ile HA . 18260 1 303 . 1 1 27 27 ILE HB H 1 2.000 0.020 . 1 . . . . 27 Ile HB . 18260 1 304 . 1 1 27 27 ILE HG12 H 1 1.238 0.020 . 1 . . . . 27 Ile HG12 . 18260 1 305 . 1 1 27 27 ILE HG13 H 1 1.238 0.020 . 1 . . . . 27 Ile HG13 . 18260 1 306 . 1 1 27 27 ILE HG21 H 1 0.984 0.020 . 1 . . . . 27 Ile HG21 . 18260 1 307 . 1 1 27 27 ILE HG22 H 1 0.984 0.020 . 1 . . . . 27 Ile HG22 . 18260 1 308 . 1 1 27 27 ILE HG23 H 1 0.984 0.020 . 1 . . . . 27 Ile HG23 . 18260 1 309 . 1 1 27 27 ILE HD11 H 1 0.680 0.020 . 1 . . . . 27 Ile HD11 . 18260 1 310 . 1 1 27 27 ILE HD12 H 1 0.680 0.020 . 1 . . . . 27 Ile HD12 . 18260 1 311 . 1 1 27 27 ILE HD13 H 1 0.680 0.020 . 1 . . . . 27 Ile HD13 . 18260 1 312 . 1 1 27 27 ILE C C 13 177.605 0.300 . 1 . . . . 27 Ile C . 18260 1 313 . 1 1 27 27 ILE CA C 13 65.278 0.300 . 1 . . . . 27 Ile CA . 18260 1 314 . 1 1 27 27 ILE CB C 13 38.286 0.300 . 1 . . . . 27 Ile CB . 18260 1 315 . 1 1 27 27 ILE CG1 C 13 29.093 0.300 . 1 . . . . 27 Ile CG1 . 18260 1 316 . 1 1 27 27 ILE CG2 C 13 18.318 0.300 . 1 . . . . 27 Ile CG2 . 18260 1 317 . 1 1 27 27 ILE CD1 C 13 15.634 0.300 . 1 . . . . 27 Ile CD1 . 18260 1 318 . 1 1 27 27 ILE N N 15 118.334 0.100 . 1 . . . . 27 Ile N . 18260 1 319 . 1 1 28 28 ASN H H 1 8.749 0.020 . 1 . . . . 28 Asn H . 18260 1 320 . 1 1 28 28 ASN HA H 1 4.359 0.020 . 1 . . . . 28 Asn HA . 18260 1 321 . 1 1 28 28 ASN HB2 H 1 2.796 0.020 . 1 . . . . 28 Asn HB2 . 18260 1 322 . 1 1 28 28 ASN HB3 H 1 2.796 0.020 . 1 . . . . 28 Asn HB3 . 18260 1 323 . 1 1 28 28 ASN HD21 H 1 7.545 0.020 . 2 . . . . 28 Asn HD21 . 18260 1 324 . 1 1 28 28 ASN HD22 H 1 6.940 0.020 . 2 . . . . 28 Asn HD22 . 18260 1 325 . 1 1 28 28 ASN C C 13 178.227 0.300 . 1 . . . . 28 Asn C . 18260 1 326 . 1 1 28 28 ASN CA C 13 56.145 0.300 . 1 . . . . 28 Asn CA . 18260 1 327 . 1 1 28 28 ASN CB C 13 37.683 0.300 . 1 . . . . 28 Asn CB . 18260 1 328 . 1 1 28 28 ASN CG C 13 175.781 0.300 . 1 . . . . 28 Asn CG . 18260 1 329 . 1 1 28 28 ASN N N 15 116.961 0.100 . 1 . . . . 28 Asn N . 18260 1 330 . 1 1 28 28 ASN ND2 N 15 111.429 0.100 . 1 . . . . 28 Asn ND2 . 18260 1 331 . 1 1 29 29 GLU H H 1 7.624 0.020 . 1 . . . . 29 Glu H . 18260 1 332 . 1 1 29 29 GLU HA H 1 4.049 0.020 . 1 . . . . 29 Glu HA . 18260 1 333 . 1 1 29 29 GLU HB2 H 1 1.971 0.020 . 1 . . . . 29 Glu HB2 . 18260 1 334 . 1 1 29 29 GLU HB3 H 1 1.971 0.020 . 1 . . . . 29 Glu HB3 . 18260 1 335 . 1 1 29 29 GLU HG2 H 1 2.294 0.020 . 1 . . . . 29 Glu HG2 . 18260 1 336 . 1 1 29 29 GLU HG3 H 1 2.294 0.020 . 1 . . . . 29 Glu HG3 . 18260 1 337 . 1 1 29 29 GLU C C 13 179.361 0.300 . 1 . . . . 29 Glu C . 18260 1 338 . 1 1 29 29 GLU CA C 13 59.033 0.300 . 1 . . . . 29 Glu CA . 18260 1 339 . 1 1 29 29 GLU CB C 13 29.093 0.300 . 1 . . . . 29 Glu CB . 18260 1 340 . 1 1 29 29 GLU CG C 13 35.875 0.300 . 1 . . . . 29 Glu CG . 18260 1 341 . 1 1 29 29 GLU N N 15 119.679 0.100 . 1 . . . . 29 Glu N . 18260 1 342 . 1 1 30 30 LYS H H 1 7.805 0.020 . 1 . . . . 30 Lys H . 18260 1 343 . 1 1 30 30 LYS HA H 1 3.792 0.020 . 1 . . . . 30 Lys HA . 18260 1 344 . 1 1 30 30 LYS HB2 H 1 1.298 0.020 . 1 . . . . 30 Lys HB2 . 18260 1 345 . 1 1 30 30 LYS HB3 H 1 1.298 0.020 . 1 . . . . 30 Lys HB3 . 18260 1 346 . 1 1 30 30 LYS HG2 H 1 1.043 0.020 . 1 . . . . 30 Lys HG2 . 18260 1 347 . 1 1 30 30 LYS HG3 H 1 1.043 0.020 . 1 . . . . 30 Lys HG3 . 18260 1 348 . 1 1 30 30 LYS HD2 H 1 1.624 0.020 . 1 . . . . 30 Lys HD2 . 18260 1 349 . 1 1 30 30 LYS HD3 H 1 1.624 0.020 . 1 . . . . 30 Lys HD3 . 18260 1 350 . 1 1 30 30 LYS HE2 H 1 2.810 0.020 . 2 . . . . 30 Lys HE2 . 18260 1 351 . 1 1 30 30 LYS HE3 H 1 2.305 0.020 . 2 . . . . 30 Lys HE3 . 18260 1 352 . 1 1 30 30 LYS C C 13 178.398 0.300 . 1 . . . . 30 Lys C . 18260 1 353 . 1 1 30 30 LYS CA C 13 56.192 0.300 . 1 . . . . 30 Lys CA . 18260 1 354 . 1 1 30 30 LYS CB C 13 30.299 0.300 . 1 . . . . 30 Lys CB . 18260 1 355 . 1 1 30 30 LYS CE C 13 42.204 0.300 . 1 . . . . 30 Lys CE . 18260 1 356 . 1 1 30 30 LYS N N 15 117.598 0.100 . 1 . . . . 30 Lys N . 18260 1 357 . 1 1 31 31 MET H H 1 8.740 0.020 . 1 . . . . 31 Met H . 18260 1 358 . 1 1 31 31 MET HA H 1 4.011 0.020 . 1 . . . . 31 Met HA . 18260 1 359 . 1 1 31 31 MET HB2 H 1 2.177 0.020 . 2 . . . . 31 Met HB2 . 18260 1 360 . 1 1 31 31 MET HB3 H 1 1.996 0.020 . 2 . . . . 31 Met HB3 . 18260 1 361 . 1 1 31 31 MET HG2 H 1 2.615 0.020 . 1 . . . . 31 Met HG2 . 18260 1 362 . 1 1 31 31 MET HG3 H 1 2.615 0.020 . 1 . . . . 31 Met HG3 . 18260 1 363 . 1 1 31 31 MET HE1 H 1 2.025 0.020 . 1 . . . . 31 Met HE1 . 18260 1 364 . 1 1 31 31 MET HE2 H 1 2.025 0.020 . 1 . . . . 31 Met HE2 . 18260 1 365 . 1 1 31 31 MET HE3 H 1 2.025 0.020 . 1 . . . . 31 Met HE3 . 18260 1 366 . 1 1 31 31 MET C C 13 178.248 0.300 . 1 . . . . 31 Met C . 18260 1 367 . 1 1 31 31 MET CA C 13 57.484 0.300 . 1 . . . . 31 Met CA . 18260 1 368 . 1 1 31 31 MET CB C 13 30.977 0.300 . 1 . . . . 31 Met CB . 18260 1 369 . 1 1 31 31 MET CG C 13 32.635 0.300 . 1 . . . . 31 Met CG . 18260 1 370 . 1 1 31 31 MET CE C 13 16.869 0.300 . 1 . . . . 31 Met CE . 18260 1 371 . 1 1 31 31 MET N N 15 120.255 0.100 . 1 . . . . 31 Met N . 18260 1 372 . 1 1 32 32 THR H H 1 7.165 0.020 . 1 . . . . 32 Thr H . 18260 1 373 . 1 1 32 32 THR HA H 1 3.891 0.020 . 1 . . . . 32 Thr HA . 18260 1 374 . 1 1 32 32 THR HB H 1 4.217 0.020 . 1 . . . . 32 Thr HB . 18260 1 375 . 1 1 32 32 THR HG21 H 1 1.211 0.020 . 1 . . . . 32 Thr HG21 . 18260 1 376 . 1 1 32 32 THR HG22 H 1 1.211 0.020 . 1 . . . . 32 Thr HG22 . 18260 1 377 . 1 1 32 32 THR HG23 H 1 1.211 0.020 . 1 . . . . 32 Thr HG23 . 18260 1 378 . 1 1 32 32 THR C C 13 176.038 0.300 . 1 . . . . 32 Thr C . 18260 1 379 . 1 1 32 32 THR CA C 13 65.639 0.300 . 1 . . . . 32 Thr CA . 18260 1 380 . 1 1 32 32 THR CB C 13 68.427 0.300 . 1 . . . . 32 Thr CB . 18260 1 381 . 1 1 32 32 THR CG2 C 13 21.786 0.300 . 1 . . . . 32 Thr CG2 . 18260 1 382 . 1 1 32 32 THR N N 15 112.333 0.100 . 1 . . . . 32 Thr N . 18260 1 383 . 1 1 33 33 LEU H H 1 7.049 0.020 . 1 . . . . 33 Leu H . 18260 1 384 . 1 1 33 33 LEU HA H 1 4.150 0.020 . 1 . . . . 33 Leu HA . 18260 1 385 . 1 1 33 33 LEU HB2 H 1 1.626 0.020 . 1 . . . . 33 Leu HB2 . 18260 1 386 . 1 1 33 33 LEU HB3 H 1 1.626 0.020 . 1 . . . . 33 Leu HB3 . 18260 1 387 . 1 1 33 33 LEU HD11 H 1 0.566 0.020 . 2 . . . . 33 Leu HD11 . 18260 1 388 . 1 1 33 33 LEU HD12 H 1 0.566 0.020 . 2 . . . . 33 Leu HD12 . 18260 1 389 . 1 1 33 33 LEU HD13 H 1 0.566 0.020 . 2 . . . . 33 Leu HD13 . 18260 1 390 . 1 1 33 33 LEU HD21 H 1 0.773 0.020 . 2 . . . . 33 Leu HD21 . 18260 1 391 . 1 1 33 33 LEU HD22 H 1 0.773 0.020 . 2 . . . . 33 Leu HD22 . 18260 1 392 . 1 1 33 33 LEU HD23 H 1 0.773 0.020 . 2 . . . . 33 Leu HD23 . 18260 1 393 . 1 1 33 33 LEU C C 13 179.793 0.300 . 1 . . . . 33 Leu C . 18260 1 394 . 1 1 33 33 LEU CA C 13 57.527 0.300 . 1 . . . . 33 Leu CA . 18260 1 395 . 1 1 33 33 LEU CB C 13 41.903 0.300 . 1 . . . . 33 Leu CB . 18260 1 396 . 1 1 33 33 LEU CG C 13 26.456 0.300 . 1 . . . . 33 Leu CG . 18260 1 397 . 1 1 33 33 LEU CD1 C 13 24.497 0.300 . 2 . . . . 33 Leu CD1 . 18260 1 398 . 1 1 33 33 LEU CD2 C 13 23.969 0.300 . 2 . . . . 33 Leu CD2 . 18260 1 399 . 1 1 33 33 LEU N N 15 121.450 0.100 . 1 . . . . 33 Leu N . 18260 1 400 . 1 1 34 34 VAL H H 1 8.147 0.020 . 1 . . . . 34 Val H . 18260 1 401 . 1 1 34 34 VAL HA H 1 3.792 0.020 . 1 . . . . 34 Val HA . 18260 1 402 . 1 1 34 34 VAL HB H 1 1.974 0.020 . 1 . . . . 34 Val HB . 18260 1 403 . 1 1 34 34 VAL HG11 H 1 0.554 0.020 . 2 . . . . 34 Val HG11 . 18260 1 404 . 1 1 34 34 VAL HG12 H 1 0.554 0.020 . 2 . . . . 34 Val HG12 . 18260 1 405 . 1 1 34 34 VAL HG13 H 1 0.554 0.020 . 2 . . . . 34 Val HG13 . 18260 1 406 . 1 1 34 34 VAL HG21 H 1 0.554 0.020 . 2 . . . . 34 Val HG21 . 18260 1 407 . 1 1 34 34 VAL HG22 H 1 0.554 0.020 . 2 . . . . 34 Val HG22 . 18260 1 408 . 1 1 34 34 VAL HG23 H 1 0.554 0.020 . 2 . . . . 34 Val HG23 . 18260 1 409 . 1 1 34 34 VAL C C 13 175.781 0.300 . 1 . . . . 34 Val C . 18260 1 410 . 1 1 34 34 VAL CA C 13 64.057 0.300 . 1 . . . . 34 Val CA . 18260 1 411 . 1 1 34 34 VAL CB C 13 31.203 0.300 . 1 . . . . 34 Val CB . 18260 1 412 . 1 1 34 34 VAL CG1 C 13 21.257 0.300 . 2 . . . . 34 Val CG1 . 18260 1 413 . 1 1 34 34 VAL CG2 C 13 20.980 0.300 . 2 . . . . 34 Val CG2 . 18260 1 414 . 1 1 34 34 VAL N N 15 113.928 0.100 . 1 . . . . 34 Val N . 18260 1 415 . 1 1 35 35 ALA H H 1 7.461 0.020 . 1 . . . . 35 Ala H . 18260 1 416 . 1 1 35 35 ALA HA H 1 4.434 0.020 . 1 . . . . 35 Ala HA . 18260 1 417 . 1 1 35 35 ALA HB1 H 1 1.450 0.020 . 1 . . . . 35 Ala HB1 . 18260 1 418 . 1 1 35 35 ALA HB2 H 1 1.450 0.020 . 1 . . . . 35 Ala HB2 . 18260 1 419 . 1 1 35 35 ALA HB3 H 1 1.450 0.020 . 1 . . . . 35 Ala HB3 . 18260 1 420 . 1 1 35 35 ALA C C 13 177.293 0.300 . 1 . . . . 35 Ala C . 18260 1 421 . 1 1 35 35 ALA CA C 13 51.842 0.300 . 1 . . . . 35 Ala CA . 18260 1 422 . 1 1 35 35 ALA CB C 13 18.318 0.300 . 1 . . . . 35 Ala CB . 18260 1 423 . 1 1 35 35 ALA N N 15 120.625 0.100 . 1 . . . . 35 Ala N . 18260 1 424 . 1 1 36 36 SER H H 1 6.934 0.020 . 1 . . . . 36 Ser H . 18260 1 425 . 1 1 36 36 SER HA H 1 4.152 0.020 . 1 . . . . 36 Ser HA . 18260 1 426 . 1 1 36 36 SER HB2 H 1 3.766 0.020 . 2 . . . . 36 Ser HB2 . 18260 1 427 . 1 1 36 36 SER HB3 H 1 3.611 0.020 . 2 . . . . 36 Ser HB3 . 18260 1 428 . 1 1 36 36 SER C C 13 175.095 0.300 . 1 . . . . 36 Ser C . 18260 1 429 . 1 1 36 36 SER CA C 13 58.432 0.300 . 1 . . . . 36 Ser CA . 18260 1 430 . 1 1 36 36 SER CB C 13 63.680 0.300 . 1 . . . . 36 Ser CB . 18260 1 431 . 1 1 36 36 SER N N 15 111.775 0.100 . 1 . . . . 36 Ser N . 18260 1 432 . 1 1 37 37 GLU H H 1 8.487 0.020 . 1 . . . . 37 Glu H . 18260 1 433 . 1 1 37 37 GLU HA H 1 4.281 0.020 . 1 . . . . 37 Glu HA . 18260 1 434 . 1 1 37 37 GLU HB2 H 1 2.193 0.020 . 2 . . . . 37 Glu HB2 . 18260 1 435 . 1 1 37 37 GLU HB3 H 1 1.819 0.020 . 2 . . . . 37 Glu HB3 . 18260 1 436 . 1 1 37 37 GLU HG2 H 1 2.744 0.020 . 1 . . . . 37 Glu HG2 . 18260 1 437 . 1 1 37 37 GLU HG3 H 1 2.744 0.020 . 1 . . . . 37 Glu HG3 . 18260 1 438 . 1 1 37 37 GLU C C 13 174.301 0.300 . 1 . . . . 37 Glu C . 18260 1 439 . 1 1 37 37 GLU CA C 13 55.287 0.300 . 1 . . . . 37 Glu CA . 18260 1 440 . 1 1 37 37 GLU CB C 13 28.792 0.300 . 1 . . . . 37 Glu CB . 18260 1 441 . 1 1 37 37 GLU CG C 13 36.327 0.300 . 1 . . . . 37 Glu CG . 18260 1 442 . 1 1 37 37 GLU N N 15 125.424 0.100 . 1 . . . . 37 Glu N . 18260 1 443 . 1 1 38 38 ASP H H 1 7.606 0.020 . 1 . . . . 38 Asp H . 18260 1 444 . 1 1 38 38 ASP HA H 1 4.499 0.020 . 1 . . . . 38 Asp HA . 18260 1 445 . 1 1 38 38 ASP HB2 H 1 2.644 0.020 . 2 . . . . 38 Asp HB2 . 18260 1 446 . 1 1 38 38 ASP HB3 H 1 2.490 0.020 . 2 . . . . 38 Asp HB3 . 18260 1 447 . 1 1 38 38 ASP C C 13 174.966 0.300 . 1 . . . . 38 Asp C . 18260 1 448 . 1 1 38 38 ASP CA C 13 53.156 0.300 . 1 . . . . 38 Asp CA . 18260 1 449 . 1 1 38 38 ASP CB C 13 40.547 0.300 . 1 . . . . 38 Asp CB . 18260 1 450 . 1 1 38 38 ASP N N 15 119.048 0.100 . 1 . . . . 38 Asp N . 18260 1 451 . 1 1 39 39 TYR H H 1 8.379 0.020 . 1 . . . . 39 Tyr H . 18260 1 452 . 1 1 39 39 TYR HA H 1 4.628 0.020 . 1 . . . . 39 Tyr HA . 18260 1 453 . 1 1 39 39 TYR HB2 H 1 3.327 0.020 . 2 . . . . 39 Tyr HB2 . 18260 1 454 . 1 1 39 39 TYR HB3 H 1 2.799 0.020 . 2 . . . . 39 Tyr HB3 . 18260 1 455 . 1 1 39 39 TYR C C 13 174.966 0.300 . 1 . . . . 39 Tyr C . 18260 1 456 . 1 1 39 39 TYR CA C 13 56.572 0.300 . 1 . . . . 39 Tyr CA . 18260 1 457 . 1 1 39 39 TYR CB C 13 38.437 0.300 . 1 . . . . 39 Tyr CB . 18260 1 458 . 1 1 39 39 TYR N N 15 124.337 0.100 . 1 . . . . 39 Tyr N . 18260 1 459 . 1 1 40 40 GLY H H 1 7.920 0.020 . 1 . . . . 40 Gly H . 18260 1 460 . 1 1 40 40 GLY HA2 H 1 4.059 0.020 . 2 . . . . 40 Gly HA2 . 18260 1 461 . 1 1 40 40 GLY HA3 H 1 3.828 0.020 . 2 . . . . 40 Gly HA3 . 18260 1 462 . 1 1 40 40 GLY C C 13 173.700 0.300 . 1 . . . . 40 Gly C . 18260 1 463 . 1 1 40 40 GLY CA C 13 44.616 0.300 . 1 . . . . 40 Gly CA . 18260 1 464 . 1 1 40 40 GLY N N 15 106.365 0.100 . 1 . . . . 40 Gly N . 18260 1 465 . 1 1 41 41 ASP H H 1 8.319 0.020 . 1 . . . . 41 Asp H . 18260 1 466 . 1 1 41 41 ASP HA H 1 4.757 0.020 . 1 . . . . 41 Asp HA . 18260 1 467 . 1 1 41 41 ASP HB2 H 1 2.838 0.020 . 2 . . . . 41 Asp HB2 . 18260 1 468 . 1 1 41 41 ASP HB3 H 1 2.747 0.020 . 2 . . . . 41 Asp HB3 . 18260 1 469 . 1 1 41 41 ASP C C 13 175.974 0.300 . 1 . . . . 41 Asp C . 18260 1 470 . 1 1 41 41 ASP CA C 13 54.185 0.300 . 1 . . . . 41 Asp CA . 18260 1 471 . 1 1 41 41 ASP CB C 13 40.999 0.300 . 1 . . . . 41 Asp CB . 18260 1 472 . 1 1 41 41 ASP N N 15 117.917 0.100 . 1 . . . . 41 Asp N . 18260 1 473 . 1 1 42 42 THR H H 1 7.738 0.020 . 1 . . . . 42 Thr H . 18260 1 474 . 1 1 42 42 THR HA H 1 4.033 0.020 . 1 . . . . 42 Thr HA . 18260 1 475 . 1 1 42 42 THR HB H 1 4.615 0.020 . 1 . . . . 42 Thr HB . 18260 1 476 . 1 1 42 42 THR HG21 H 1 1.289 0.020 . 1 . . . . 42 Thr HG21 . 18260 1 477 . 1 1 42 42 THR HG22 H 1 1.289 0.020 . 1 . . . . 42 Thr HG22 . 18260 1 478 . 1 1 42 42 THR HG23 H 1 1.289 0.020 . 1 . . . . 42 Thr HG23 . 18260 1 479 . 1 1 42 42 THR C C 13 174.623 0.300 . 1 . . . . 42 Thr C . 18260 1 480 . 1 1 42 42 THR CA C 13 59.353 0.300 . 1 . . . . 42 Thr CA . 18260 1 481 . 1 1 42 42 THR CB C 13 72.421 0.300 . 1 . . . . 42 Thr CB . 18260 1 482 . 1 1 42 42 THR CG2 C 13 21.784 0.300 . 1 . . . . 42 Thr CG2 . 18260 1 483 . 1 1 42 42 THR N N 15 109.890 0.100 . 1 . . . . 42 Thr N . 18260 1 484 . 1 1 43 43 LEU H H 1 8.745 0.020 . 1 . . . . 43 Leu H . 18260 1 485 . 1 1 43 43 LEU HA H 1 4.245 0.020 . 1 . . . . 43 Leu HA . 18260 1 486 . 1 1 43 43 LEU HB2 H 1 1.742 0.020 . 1 . . . . 43 Leu HB2 . 18260 1 487 . 1 1 43 43 LEU HB3 H 1 1.742 0.020 . 1 . . . . 43 Leu HB3 . 18260 1 488 . 1 1 43 43 LEU HD11 H 1 0.954 0.020 . 2 . . . . 43 Leu HD11 . 18260 1 489 . 1 1 43 43 LEU HD12 H 1 0.954 0.020 . 2 . . . . 43 Leu HD12 . 18260 1 490 . 1 1 43 43 LEU HD13 H 1 0.954 0.020 . 2 . . . . 43 Leu HD13 . 18260 1 491 . 1 1 43 43 LEU HD21 H 1 0.954 0.020 . 2 . . . . 43 Leu HD21 . 18260 1 492 . 1 1 43 43 LEU HD22 H 1 0.954 0.020 . 2 . . . . 43 Leu HD22 . 18260 1 493 . 1 1 43 43 LEU HD23 H 1 0.954 0.020 . 2 . . . . 43 Leu HD23 . 18260 1 494 . 1 1 43 43 LEU C C 13 178.931 0.300 . 1 . . . . 43 Leu C . 18260 1 495 . 1 1 43 43 LEU CA C 13 58.086 0.300 . 1 . . . . 43 Leu CA . 18260 1 496 . 1 1 43 43 LEU CB C 13 40.999 0.300 . 1 . . . . 43 Leu CB . 18260 1 497 . 1 1 43 43 LEU CG C 13 26.757 0.300 . 1 . . . . 43 Leu CG . 18260 1 498 . 1 1 43 43 LEU CD1 C 13 24.694 0.300 . 2 . . . . 43 Leu CD1 . 18260 1 499 . 1 1 43 43 LEU CD2 C 13 23.969 0.300 . 2 . . . . 43 Leu CD2 . 18260 1 500 . 1 1 43 43 LEU N N 15 122.584 0.100 . 1 . . . . 43 Leu N . 18260 1 501 . 1 1 44 44 ALA H H 1 8.420 0.020 . 1 . . . . 44 Ala H . 18260 1 502 . 1 1 44 44 ALA HA H 1 4.256 0.020 . 1 . . . . 44 Ala HA . 18260 1 503 . 1 1 44 44 ALA HB1 H 1 1.484 0.020 . 1 . . . . 44 Ala HB1 . 18260 1 504 . 1 1 44 44 ALA HB2 H 1 1.484 0.020 . 1 . . . . 44 Ala HB2 . 18260 1 505 . 1 1 44 44 ALA HB3 H 1 1.484 0.020 . 1 . . . . 44 Ala HB3 . 18260 1 506 . 1 1 44 44 ALA C C 13 180.756 0.300 . 1 . . . . 44 Ala C . 18260 1 507 . 1 1 44 44 ALA CA C 13 54.684 0.300 . 1 . . . . 44 Ala CA . 18260 1 508 . 1 1 44 44 ALA CB C 13 17.886 0.300 . 1 . . . . 44 Ala CB . 18260 1 509 . 1 1 44 44 ALA N N 15 119.826 0.100 . 1 . . . . 44 Ala N . 18260 1 510 . 1 1 45 45 ALA H H 1 8.078 0.020 . 1 . . . . 45 Ala H . 18260 1 511 . 1 1 45 45 ALA HA H 1 4.330 0.020 . 1 . . . . 45 Ala HA . 18260 1 512 . 1 1 45 45 ALA HB1 H 1 1.703 0.020 . 1 . . . . 45 Ala HB1 . 18260 1 513 . 1 1 45 45 ALA HB2 H 1 1.703 0.020 . 1 . . . . 45 Ala HB2 . 18260 1 514 . 1 1 45 45 ALA HB3 H 1 1.703 0.020 . 1 . . . . 45 Ala HB3 . 18260 1 515 . 1 1 45 45 ALA C C 13 180.908 0.300 . 1 . . . . 45 Ala C . 18260 1 516 . 1 1 45 45 ALA CA C 13 54.314 0.300 . 1 . . . . 45 Ala CA . 18260 1 517 . 1 1 45 45 ALA CB C 13 18.996 0.300 . 1 . . . . 45 Ala CB . 18260 1 518 . 1 1 45 45 ALA N N 15 121.692 0.100 . 1 . . . . 45 Ala N . 18260 1 519 . 1 1 46 46 ILE H H 1 8.371 0.020 . 1 . . . . 46 Ile H . 18260 1 520 . 1 1 46 46 ILE HA H 1 3.766 0.020 . 1 . . . . 46 Ile HA . 18260 1 521 . 1 1 46 46 ILE HB H 1 2.064 0.020 . 1 . . . . 46 Ile HB . 18260 1 522 . 1 1 46 46 ILE HG12 H 1 1.676 0.020 . 1 . . . . 46 Ile HG12 . 18260 1 523 . 1 1 46 46 ILE HG13 H 1 1.676 0.020 . 1 . . . . 46 Ile HG13 . 18260 1 524 . 1 1 46 46 ILE HG21 H 1 1.018 0.020 . 1 . . . . 46 Ile HG21 . 18260 1 525 . 1 1 46 46 ILE HG22 H 1 1.018 0.020 . 1 . . . . 46 Ile HG22 . 18260 1 526 . 1 1 46 46 ILE HG23 H 1 1.018 0.020 . 1 . . . . 46 Ile HG23 . 18260 1 527 . 1 1 46 46 ILE HD11 H 1 0.850 0.020 . 1 . . . . 46 Ile HD11 . 18260 1 528 . 1 1 46 46 ILE HD12 H 1 0.850 0.020 . 1 . . . . 46 Ile HD12 . 18260 1 529 . 1 1 46 46 ILE HD13 H 1 0.850 0.020 . 1 . . . . 46 Ile HD13 . 18260 1 530 . 1 1 46 46 ILE C C 13 177.991 0.300 . 1 . . . . 46 Ile C . 18260 1 531 . 1 1 46 46 ILE CA C 13 65.278 0.300 . 1 . . . . 46 Ile CA . 18260 1 532 . 1 1 46 46 ILE CB C 13 38.286 0.300 . 1 . . . . 46 Ile CB . 18260 1 533 . 1 1 46 46 ILE CG1 C 13 29.169 0.300 . 1 . . . . 46 Ile CG1 . 18260 1 534 . 1 1 46 46 ILE CG2 C 13 17.564 0.300 . 1 . . . . 46 Ile CG2 . 18260 1 535 . 1 1 46 46 ILE CD1 C 13 13.646 0.300 . 1 . . . . 46 Ile CD1 . 18260 1 536 . 1 1 46 46 ILE N N 15 120.466 0.100 . 1 . . . . 46 Ile N . 18260 1 537 . 1 1 47 47 GLN H H 1 8.489 0.020 . 1 . . . . 47 Gln H . 18260 1 538 . 1 1 47 47 GLN HA H 1 4.127 0.020 . 1 . . . . 47 Gln HA . 18260 1 539 . 1 1 47 47 GLN HB2 H 1 2.270 0.020 . 2 . . . . 47 Gln HB2 . 18260 1 540 . 1 1 47 47 GLN HB3 H 1 2.129 0.020 . 2 . . . . 47 Gln HB3 . 18260 1 541 . 1 1 47 47 GLN HG2 H 1 2.552 0.020 . 1 . . . . 47 Gln HG2 . 18260 1 542 . 1 1 47 47 GLN HG3 H 1 2.552 0.020 . 1 . . . . 47 Gln HG3 . 18260 1 543 . 1 1 47 47 GLN HE21 H 1 6.952 0.020 . 2 . . . . 47 Gln HE21 . 18260 1 544 . 1 1 47 47 GLN HE22 H 1 7.519 0.020 . 2 . . . . 47 Gln HE22 . 18260 1 545 . 1 1 47 47 GLN C C 13 179.814 0.300 . 1 . . . . 47 Gln C . 18260 1 546 . 1 1 47 47 GLN CA C 13 59.034 0.300 . 1 . . . . 47 Gln CA . 18260 1 547 . 1 1 47 47 GLN CB C 13 27.737 0.300 . 1 . . . . 47 Gln CB . 18260 1 548 . 1 1 47 47 GLN CG C 13 34.142 0.300 . 1 . . . . 47 Gln CG . 18260 1 549 . 1 1 47 47 GLN CD C 13 179.943 0.300 . 1 . . . . 47 Gln CD . 18260 1 550 . 1 1 47 47 GLN N N 15 118.334 0.100 . 1 . . . . 47 Gln N . 18260 1 551 . 1 1 47 47 GLN NE2 N 15 111.765 0.100 . 1 . . . . 47 Gln NE2 . 18260 1 552 . 1 1 48 48 GLY H H 1 8.130 0.020 . 1 . . . . 48 Gly H . 18260 1 553 . 1 1 48 48 GLY HA2 H 1 4.062 0.020 . 1 . . . . 48 Gly HA2 . 18260 1 554 . 1 1 48 48 GLY HA3 H 1 4.062 0.020 . 1 . . . . 48 Gly HA3 . 18260 1 555 . 1 1 48 48 GLY C C 13 176.854 0.300 . 1 . . . . 48 Gly C . 18260 1 556 . 1 1 48 48 GLY CA C 13 46.888 0.300 . 1 . . . . 48 Gly CA . 18260 1 557 . 1 1 48 48 GLY N N 15 106.986 0.100 . 1 . . . . 48 Gly N . 18260 1 558 . 1 1 49 49 LEU H H 1 8.255 0.020 . 1 . . . . 49 Leu H . 18260 1 559 . 1 1 49 49 LEU HA H 1 4.217 0.020 . 1 . . . . 49 Leu HA . 18260 1 560 . 1 1 49 49 LEU HB2 H 1 2.180 0.020 . 2 . . . . 49 Leu HB2 . 18260 1 561 . 1 1 49 49 LEU HB3 H 1 1.420 0.020 . 2 . . . . 49 Leu HB3 . 18260 1 562 . 1 1 49 49 LEU HG H 1 1.882 0.020 . 1 . . . . 49 Leu HG . 18260 1 563 . 1 1 49 49 LEU HD11 H 1 0.799 0.020 . 2 . . . . 49 Leu HD11 . 18260 1 564 . 1 1 49 49 LEU HD12 H 1 0.799 0.020 . 2 . . . . 49 Leu HD12 . 18260 1 565 . 1 1 49 49 LEU HD13 H 1 0.799 0.020 . 2 . . . . 49 Leu HD13 . 18260 1 566 . 1 1 49 49 LEU HD21 H 1 0.799 0.020 . 2 . . . . 49 Leu HD21 . 18260 1 567 . 1 1 49 49 LEU HD22 H 1 0.799 0.020 . 2 . . . . 49 Leu HD22 . 18260 1 568 . 1 1 49 49 LEU HD23 H 1 0.799 0.020 . 2 . . . . 49 Leu HD23 . 18260 1 569 . 1 1 49 49 LEU C C 13 181.208 0.300 . 1 . . . . 49 Leu C . 18260 1 570 . 1 1 49 49 LEU CA C 13 57.527 0.300 . 1 . . . . 49 Leu CA . 18260 1 571 . 1 1 49 49 LEU CB C 13 41.550 0.300 . 1 . . . . 49 Leu CB . 18260 1 572 . 1 1 49 49 LEU CG C 13 25.627 0.300 . 1 . . . . 49 Leu CG . 18260 1 573 . 1 1 49 49 LEU CD1 C 13 22.161 0.300 . 2 . . . . 49 Leu CD1 . 18260 1 574 . 1 1 49 49 LEU CD2 C 13 22.161 0.300 . 2 . . . . 49 Leu CD2 . 18260 1 575 . 1 1 49 49 LEU N N 15 123.512 0.100 . 1 . . . . 49 Leu N . 18260 1 576 . 1 1 50 50 LEU H H 1 8.882 0.020 . 1 . . . . 50 Leu H . 18260 1 577 . 1 1 50 50 LEU HA H 1 4.011 0.020 . 1 . . . . 50 Leu HA . 18260 1 578 . 1 1 50 50 LEU HB2 H 1 2.142 0.020 . 1 . . . . 50 Leu HB2 . 18260 1 579 . 1 1 50 50 LEU HB3 H 1 2.142 0.020 . 1 . . . . 50 Leu HB3 . 18260 1 580 . 1 1 50 50 LEU HG H 1 1.726 0.020 . 1 . . . . 50 Leu HG . 18260 1 581 . 1 1 50 50 LEU HD11 H 1 0.980 0.020 . 2 . . . . 50 Leu HD11 . 18260 1 582 . 1 1 50 50 LEU HD12 H 1 0.980 0.020 . 2 . . . . 50 Leu HD12 . 18260 1 583 . 1 1 50 50 LEU HD13 H 1 0.980 0.020 . 2 . . . . 50 Leu HD13 . 18260 1 584 . 1 1 50 50 LEU HD21 H 1 0.980 0.020 . 2 . . . . 50 Leu HD21 . 18260 1 585 . 1 1 50 50 LEU HD22 H 1 0.980 0.020 . 2 . . . . 50 Leu HD22 . 18260 1 586 . 1 1 50 50 LEU HD23 H 1 0.980 0.020 . 2 . . . . 50 Leu HD23 . 18260 1 587 . 1 1 50 50 LEU C C 13 179.621 0.300 . 1 . . . . 50 Leu C . 18260 1 588 . 1 1 50 50 LEU CA C 13 58.388 0.300 . 1 . . . . 50 Leu CA . 18260 1 589 . 1 1 50 50 LEU CB C 13 41.978 0.300 . 1 . . . . 50 Leu CB . 18260 1 590 . 1 1 50 50 LEU CG C 13 28.457 0.300 . 1 . . . . 50 Leu CG . 18260 1 591 . 1 1 50 50 LEU CD1 C 13 24.396 0.300 . 2 . . . . 50 Leu CD1 . 18260 1 592 . 1 1 50 50 LEU CD2 C 13 25.068 0.300 . 2 . . . . 50 Leu CD2 . 18260 1 593 . 1 1 50 50 LEU N N 15 124.079 0.100 . 1 . . . . 50 Leu N . 18260 1 594 . 1 1 51 51 LYS H H 1 7.941 0.020 . 1 . . . . 51 Lys H . 18260 1 595 . 1 1 51 51 LYS HA H 1 4.346 0.020 . 1 . . . . 51 Lys HA . 18260 1 596 . 1 1 51 51 LYS HB2 H 1 2.064 0.020 . 1 . . . . 51 Lys HB2 . 18260 1 597 . 1 1 51 51 LYS HB3 H 1 2.064 0.020 . 1 . . . . 51 Lys HB3 . 18260 1 598 . 1 1 51 51 LYS HD2 H 1 1.676 0.020 . 1 . . . . 51 Lys HD2 . 18260 1 599 . 1 1 51 51 LYS HD3 H 1 1.676 0.020 . 1 . . . . 51 Lys HD3 . 18260 1 600 . 1 1 51 51 LYS HE2 H 1 3.506 0.020 . 1 . . . . 51 Lys HE2 . 18260 1 601 . 1 1 51 51 LYS HE3 H 1 3.506 0.020 . 1 . . . . 51 Lys HE3 . 18260 1 602 . 1 1 51 51 LYS C C 13 180.415 0.300 . 1 . . . . 51 Lys C . 18260 1 603 . 1 1 51 51 LYS CA C 13 58.467 0.300 . 1 . . . . 51 Lys CA . 18260 1 604 . 1 1 51 51 LYS CB C 13 31.580 0.300 . 1 . . . . 51 Lys CB . 18260 1 605 . 1 1 51 51 LYS CG C 13 24.798 0.300 . 1 . . . . 51 Lys CG . 18260 1 606 . 1 1 51 51 LYS CD C 13 27.827 0.300 . 1 . . . . 51 Lys CD . 18260 1 607 . 1 1 51 51 LYS CE C 13 41.891 0.300 . 1 . . . . 51 Lys CE . 18260 1 608 . 1 1 51 51 LYS N N 15 120.537 0.100 . 1 . . . . 51 Lys N . 18260 1 609 . 1 1 52 52 LYS H H 1 8.059 0.020 . 1 . . . . 52 Lys H . 18260 1 610 . 1 1 52 52 LYS HA H 1 4.294 0.020 . 1 . . . . 52 Lys HA . 18260 1 611 . 1 1 52 52 LYS HB2 H 1 2.051 0.020 . 1 . . . . 52 Lys HB2 . 18260 1 612 . 1 1 52 52 LYS HB3 H 1 2.051 0.020 . 1 . . . . 52 Lys HB3 . 18260 1 613 . 1 1 52 52 LYS HG2 H 1 1.560 0.020 . 1 . . . . 52 Lys HG2 . 18260 1 614 . 1 1 52 52 LYS HG3 H 1 1.560 0.020 . 1 . . . . 52 Lys HG3 . 18260 1 615 . 1 1 52 52 LYS HD2 H 1 1.740 0.020 . 1 . . . . 52 Lys HD2 . 18260 1 616 . 1 1 52 52 LYS HD3 H 1 1.740 0.020 . 1 . . . . 52 Lys HD3 . 18260 1 617 . 1 1 52 52 LYS HE2 H 1 3.458 0.020 . 1 . . . . 52 Lys HE2 . 18260 1 618 . 1 1 52 52 LYS HE3 H 1 3.458 0.020 . 1 . . . . 52 Lys HE3 . 18260 1 619 . 1 1 52 52 LYS C C 13 179.793 0.300 . 1 . . . . 52 Lys C . 18260 1 620 . 1 1 52 52 LYS CA C 13 59.594 0.300 . 1 . . . . 52 Lys CA . 18260 1 621 . 1 1 52 52 LYS CB C 13 32.409 0.300 . 1 . . . . 52 Lys CB . 18260 1 622 . 1 1 52 52 LYS CG C 13 25.778 0.300 . 1 . . . . 52 Lys CG . 18260 1 623 . 1 1 52 52 LYS CD C 13 29.395 0.300 . 1 . . . . 52 Lys CD . 18260 1 624 . 1 1 52 52 LYS CE C 13 41.828 0.300 . 1 . . . . 52 Lys CE . 18260 1 625 . 1 1 52 52 LYS N N 15 120.08 0.100 . 1 . . . . 52 Lys N . 18260 1 626 . 1 1 53 53 HIS H H 1 8.560 0.020 . 1 . . . . 53 His H . 18260 1 627 . 1 1 53 53 HIS HA H 1 4.307 0.020 . 1 . . . . 53 His HA . 18260 1 628 . 1 1 53 53 HIS HB2 H 1 3.160 0.020 . 2 . . . . 53 His HB2 . 18260 1 629 . 1 1 53 53 HIS HB3 H 1 3.482 0.020 . 2 . . . . 53 His HB3 . 18260 1 630 . 1 1 53 53 HIS C C 13 177.143 0.300 . 1 . . . . 53 His C . 18260 1 631 . 1 1 53 53 HIS CA C 13 60.705 0.300 . 1 . . . . 53 His CA . 18260 1 632 . 1 1 53 53 HIS CB C 13 31.055 0.300 . 1 . . . . 53 His CB . 18260 1 633 . 1 1 53 53 HIS N N 15 122.845 0.100 . 1 . . . . 53 His N . 18260 1 634 . 1 1 54 54 GLU H H 1 8.427 0.020 . 1 . . . . 54 Glu H . 18260 1 635 . 1 1 54 54 GLU HA H 1 4.294 0.020 . 1 . . . . 54 Glu HA . 18260 1 636 . 1 1 54 54 GLU HB2 H 1 2.348 0.020 . 1 . . . . 54 Glu HB2 . 18260 1 637 . 1 1 54 54 GLU HB3 H 1 2.348 0.020 . 1 . . . . 54 Glu HB3 . 18260 1 638 . 1 1 54 54 GLU HG2 H 1 2.616 0.020 . 1 . . . . 54 Glu HG2 . 18260 1 639 . 1 1 54 54 GLU HG3 H 1 2.616 0.020 . 1 . . . . 54 Glu HG3 . 18260 1 640 . 1 1 54 54 GLU C C 13 179.192 0.300 . 1 . . . . 54 Glu C . 18260 1 641 . 1 1 54 54 GLU CA C 13 59.637 0.300 . 1 . . . . 54 Glu CA . 18260 1 642 . 1 1 54 54 GLU CB C 13 29.395 0.300 . 1 . . . . 54 Glu CB . 18260 1 643 . 1 1 54 54 GLU CG C 13 36.252 0.300 . 1 . . . . 54 Glu CG . 18260 1 644 . 1 1 54 54 GLU N N 15 119.631 0.100 . 1 . . . . 54 Glu N . 18260 1 645 . 1 1 55 55 ALA H H 1 7.803 0.020 . 1 . . . . 55 Ala H . 18260 1 646 . 1 1 55 55 ALA HA H 1 4.292 0.020 . 1 . . . . 55 Ala HA . 18260 1 647 . 1 1 55 55 ALA HB1 H 1 1.695 0.020 . 1 . . . . 55 Ala HB1 . 18260 1 648 . 1 1 55 55 ALA HB2 H 1 1.695 0.020 . 1 . . . . 55 Ala HB2 . 18260 1 649 . 1 1 55 55 ALA HB3 H 1 1.695 0.020 . 1 . . . . 55 Ala HB3 . 18260 1 650 . 1 1 55 55 ALA C C 13 180.565 0.300 . 1 . . . . 55 Ala C . 18260 1 651 . 1 1 55 55 ALA CA C 13 54.943 0.300 . 1 . . . . 55 Ala CA . 18260 1 652 . 1 1 55 55 ALA CB C 13 17.640 0.300 . 1 . . . . 55 Ala CB . 18260 1 653 . 1 1 55 55 ALA N N 15 121.625 0.100 . 1 . . . . 55 Ala N . 18260 1 654 . 1 1 56 56 PHE H H 1 7.900 0.020 . 1 . . . . 56 Phe H . 18260 1 655 . 1 1 56 56 PHE HA H 1 4.655 0.020 . 1 . . . . 56 Phe HA . 18260 1 656 . 1 1 56 56 PHE HB2 H 1 3.315 0.020 . 1 . . . . 56 Phe HB2 . 18260 1 657 . 1 1 56 56 PHE HB3 H 1 3.315 0.020 . 1 . . . . 56 Phe HB3 . 18260 1 658 . 1 1 56 56 PHE HD1 H 1 6.921 0.020 . 3 . . . . 56 Phe HD1 . 18260 1 659 . 1 1 56 56 PHE HD2 H 1 6.921 0.020 . 3 . . . . 56 Phe HD2 . 18260 1 660 . 1 1 56 56 PHE C C 13 176.489 0.300 . 1 . . . . 56 Phe C . 18260 1 661 . 1 1 56 56 PHE CA C 13 60.584 0.300 . 1 . . . . 56 Phe CA . 18260 1 662 . 1 1 56 56 PHE CB C 13 36.930 0.300 . 1 . . . . 56 Phe CB . 18260 1 663 . 1 1 56 56 PHE CD1 C 13 130.278 0.300 . 3 . . . . 56 Phe CD1 . 18260 1 664 . 1 1 56 56 PHE CD2 C 13 130.278 0.300 . 3 . . . . 56 Phe CD2 . 18260 1 665 . 1 1 56 56 PHE N N 15 120.659 0.100 . 1 . . . . 56 Phe N . 18260 1 666 . 1 1 57 57 GLU H H 1 8.639 0.020 . 1 . . . . 57 Glu H . 18260 1 667 . 1 1 57 57 GLU HA H 1 3.688 0.020 . 1 . . . . 57 Glu HA . 18260 1 668 . 1 1 57 57 GLU HB2 H 1 2.090 0.020 . 2 . . . . 57 Glu HB2 . 18260 1 669 . 1 1 57 57 GLU HB3 H 1 2.322 0.020 . 2 . . . . 57 Glu HB3 . 18260 1 670 . 1 1 57 57 GLU HG2 H 1 2.526 0.020 . 1 . . . . 57 Glu HG2 . 18260 1 671 . 1 1 57 57 GLU HG3 H 1 2.526 0.020 . 1 . . . . 57 Glu HG3 . 18260 1 672 . 1 1 57 57 GLU C C 13 179.943 0.300 . 1 . . . . 57 Glu C . 18260 1 673 . 1 1 57 57 GLU CA C 13 59.891 0.300 . 1 . . . . 57 Glu CA . 18260 1 674 . 1 1 57 57 GLU CB C 13 29.169 0.300 . 1 . . . . 57 Glu CB . 18260 1 675 . 1 1 57 57 GLU CG C 13 36.628 0.300 . 1 . . . . 57 Glu CG . 18260 1 676 . 1 1 57 57 GLU N N 15 121.320 0.100 . 1 . . . . 57 Glu N . 18260 1 677 . 1 1 58 58 THR H H 1 8.027 0.020 . 1 . . . . 58 Thr H . 18260 1 678 . 1 1 58 58 THR HA H 1 4.062 0.020 . 1 . . . . 58 Thr HA . 18260 1 679 . 1 1 58 58 THR HB H 1 4.436 0.020 . 1 . . . . 58 Thr HB . 18260 1 680 . 1 1 58 58 THR HG21 H 1 1.315 0.020 . 1 . . . . 58 Thr HG21 . 18260 1 681 . 1 1 58 58 THR HG22 H 1 1.315 0.020 . 1 . . . . 58 Thr HG22 . 18260 1 682 . 1 1 58 58 THR HG23 H 1 1.315 0.020 . 1 . . . . 58 Thr HG23 . 18260 1 683 . 1 1 58 58 THR C C 13 176.489 0.300 . 1 . . . . 58 Thr C . 18260 1 684 . 1 1 58 58 THR CA C 13 66.544 0.300 . 1 . . . . 58 Thr CA . 18260 1 685 . 1 1 58 58 THR CB C 13 68.578 0.300 . 1 . . . . 58 Thr CB . 18260 1 686 . 1 1 58 58 THR CG2 C 13 21.709 0.300 . 1 . . . . 58 Thr CG2 . 18260 1 687 . 1 1 58 58 THR N N 15 116.434 0.100 . 1 . . . . 58 Thr N . 18260 1 688 . 1 1 59 59 ASP H H 1 7.698 0.020 . 1 . . . . 59 Asp H . 18260 1 689 . 1 1 59 59 ASP HA H 1 4.629 0.020 . 1 . . . . 59 Asp HA . 18260 1 690 . 1 1 59 59 ASP HB2 H 1 3.121 0.020 . 1 . . . . 59 Asp HB2 . 18260 1 691 . 1 1 59 59 ASP HB3 H 1 3.121 0.020 . 1 . . . . 59 Asp HB3 . 18260 1 692 . 1 1 59 59 ASP C C 13 178.656 0.300 . 1 . . . . 59 Asp C . 18260 1 693 . 1 1 59 59 ASP CA C 13 56.823 0.300 . 1 . . . . 59 Asp CA . 18260 1 694 . 1 1 59 59 ASP CB C 13 41.300 0.300 . 1 . . . . 59 Asp CB . 18260 1 695 . 1 1 59 59 ASP N N 15 123.391 0.100 . 1 . . . . 59 Asp N . 18260 1 696 . 1 1 60 60 PHE H H 1 9.537 0.020 . 1 . . . . 60 Phe H . 18260 1 697 . 1 1 60 60 PHE HA H 1 4.836 0.020 . 1 . . . . 60 Phe HA . 18260 1 698 . 1 1 60 60 PHE HB2 H 1 3.237 0.020 . 2 . . . . 60 Phe HB2 . 18260 1 699 . 1 1 60 60 PHE HB3 H 1 2.722 0.020 . 2 . . . . 60 Phe HB3 . 18260 1 700 . 1 1 60 60 PHE C C 13 178.004 0.300 . 1 . . . . 60 Phe C . 18260 1 701 . 1 1 60 60 PHE CA C 13 56.536 0.300 . 1 . . . . 60 Phe CA . 18260 1 702 . 1 1 60 60 PHE CB C 13 37.156 0.300 . 1 . . . . 60 Phe CB . 18260 1 703 . 1 1 60 60 PHE N N 15 121.007 0.100 . 1 . . . . 60 Phe N . 18260 1 704 . 1 1 61 61 THR H H 1 8.222 0.020 . 1 . . . . 61 Thr H . 18260 1 705 . 1 1 61 61 THR HA H 1 3.585 0.020 . 1 . . . . 61 Thr HA . 18260 1 706 . 1 1 61 61 THR HB H 1 4.423 0.020 . 1 . . . . 61 Thr HB . 18260 1 707 . 1 1 61 61 THR HG21 H 1 1.224 0.020 . 1 . . . . 61 Thr HG21 . 18260 1 708 . 1 1 61 61 THR HG22 H 1 1.224 0.020 . 1 . . . . 61 Thr HG22 . 18260 1 709 . 1 1 61 61 THR HG23 H 1 1.224 0.020 . 1 . . . . 61 Thr HG23 . 18260 1 710 . 1 1 61 61 THR C C 13 175.695 0.300 . 1 . . . . 61 Thr C . 18260 1 711 . 1 1 61 61 THR CA C 13 67.523 0.300 . 1 . . . . 61 Thr CA . 18260 1 712 . 1 1 61 61 THR CB C 13 68.379 0.300 . 1 . . . . 61 Thr CB . 18260 1 713 . 1 1 61 61 THR CG2 C 13 21.784 0.300 . 1 . . . . 61 Thr CG2 . 18260 1 714 . 1 1 61 61 THR N N 15 116.559 0.100 . 1 . . . . 61 Thr N . 18260 1 715 . 1 1 62 62 VAL H H 1 7.028 0.020 . 1 . . . . 62 Val H . 18260 1 716 . 1 1 62 62 VAL HA H 1 3.814 0.020 . 1 . . . . 62 Val HA . 18260 1 717 . 1 1 62 62 VAL HB H 1 2.280 0.020 . 1 . . . . 62 Val HB . 18260 1 718 . 1 1 62 62 VAL HG11 H 1 1.070 0.020 . 2 . . . . 62 Val HG11 . 18260 1 719 . 1 1 62 62 VAL HG12 H 1 1.070 0.020 . 2 . . . . 62 Val HG12 . 18260 1 720 . 1 1 62 62 VAL HG13 H 1 1.070 0.020 . 2 . . . . 62 Val HG13 . 18260 1 721 . 1 1 62 62 VAL HG21 H 1 0.644 0.020 . 2 . . . . 62 Val HG21 . 18260 1 722 . 1 1 62 62 VAL HG22 H 1 0.644 0.020 . 2 . . . . 62 Val HG22 . 18260 1 723 . 1 1 62 62 VAL HG23 H 1 0.644 0.020 . 2 . . . . 62 Val HG23 . 18260 1 724 . 1 1 62 62 VAL C C 13 179.750 0.300 . 1 . . . . 62 Val C . 18260 1 725 . 1 1 62 62 VAL CA C 13 66.091 0.300 . 1 . . . . 62 Val CA . 18260 1 726 . 1 1 62 62 VAL CB C 13 30.977 0.300 . 1 . . . . 62 Val CB . 18260 1 727 . 1 1 62 62 VAL CG1 C 13 20.428 0.300 . 2 . . . . 62 Val CG1 . 18260 1 728 . 1 1 62 62 VAL CG2 C 13 22.010 0.300 . 2 . . . . 62 Val CG2 . 18260 1 729 . 1 1 62 62 VAL N N 15 120.528 0.100 . 1 . . . . 62 Val N . 18260 1 730 . 1 1 63 63 HIS H H 1 7.851 0.020 . 1 . . . . 63 His H . 18260 1 731 . 1 1 63 63 HIS HA H 1 3.804 0.020 . 1 . . . . 63 His HA . 18260 1 732 . 1 1 63 63 HIS HB2 H 1 2.902 0.020 . 2 . . . . 63 His HB2 . 18260 1 733 . 1 1 63 63 HIS HB3 H 1 2.541 0.020 . 2 . . . . 63 His HB3 . 18260 1 734 . 1 1 63 63 HIS HD2 H 1 7.120 0.020 . 1 . . . . 63 His HD2 . 18260 1 735 . 1 1 63 63 HIS C C 13 176.661 0.300 . 1 . . . . 63 His C . 18260 1 736 . 1 1 63 63 HIS CA C 13 60.277 0.300 . 1 . . . . 63 His CA . 18260 1 737 . 1 1 63 63 HIS CB C 13 27.360 0.300 . 1 . . . . 63 His CB . 18260 1 738 . 1 1 63 63 HIS CD2 C 13 117.967 0.300 . 1 . . . . 63 His CD2 . 18260 1 739 . 1 1 63 63 HIS N N 15 118.587 0.100 . 1 . . . . 63 His N . 18260 1 740 . 1 1 64 64 LYS H H 1 9.097 0.020 . 1 . . . . 64 Lys H . 18260 1 741 . 1 1 64 64 LYS HA H 1 3.843 0.020 . 1 . . . . 64 Lys HA . 18260 1 742 . 1 1 64 64 LYS HB2 H 1 1.768 0.020 . 1 . . . . 64 Lys HB2 . 18260 1 743 . 1 1 64 64 LYS HB3 H 1 1.768 0.020 . 1 . . . . 64 Lys HB3 . 18260 1 744 . 1 1 64 64 LYS HG2 H 1 1.096 0.020 . 1 . . . . 64 Lys HG2 . 18260 1 745 . 1 1 64 64 LYS HG3 H 1 1.096 0.020 . 1 . . . . 64 Lys HG3 . 18260 1 746 . 1 1 64 64 LYS HD2 H 1 1.199 0.020 . 1 . . . . 64 Lys HD2 . 18260 1 747 . 1 1 64 64 LYS HD3 H 1 1.199 0.020 . 1 . . . . 64 Lys HD3 . 18260 1 748 . 1 1 64 64 LYS HE2 H 1 2.751 0.020 . 1 . . . . 64 Lys HE2 . 18260 1 749 . 1 1 64 64 LYS HE3 H 1 3.554 0.020 . 1 . . . . 64 Lys HE3 . 18260 1 750 . 1 1 64 64 LYS C C 13 179.321 0.300 . 1 . . . . 64 Lys C . 18260 1 751 . 1 1 64 64 LYS CA C 13 60.920 0.300 . 1 . . . . 64 Lys CA . 18260 1 752 . 1 1 64 64 LYS CB C 13 31.881 0.300 . 1 . . . . 64 Lys CB . 18260 1 753 . 1 1 64 64 LYS CG C 13 26.381 0.300 . 1 . . . . 64 Lys CG . 18260 1 754 . 1 1 64 64 LYS CD C 13 29.258 0.300 . 1 . . . . 64 Lys CD . 18260 1 755 . 1 1 64 64 LYS CE C 13 40.396 0.300 . 1 . . . . 64 Lys CE . 18260 1 756 . 1 1 64 64 LYS N N 15 122.184 0.100 . 1 . . . . 64 Lys N . 18260 1 757 . 1 1 65 65 ASP H H 1 7.408 0.020 . 1 . . . . 65 Asp H . 18260 1 758 . 1 1 65 65 ASP HA H 1 4.537 0.020 . 1 . . . . 65 Asp HA . 18260 1 759 . 1 1 65 65 ASP HB2 H 1 2.812 0.020 . 1 . . . . 65 Asp HB2 . 18260 1 760 . 1 1 65 65 ASP HB3 H 1 2.812 0.020 . 1 . . . . 65 Asp HB3 . 18260 1 761 . 1 1 65 65 ASP C C 13 178.506 0.300 . 1 . . . . 65 Asp C . 18260 1 762 . 1 1 65 65 ASP CA C 13 57.231 0.300 . 1 . . . . 65 Asp CA . 18260 1 763 . 1 1 65 65 ASP CB C 13 39.492 0.300 . 1 . . . . 65 Asp CB . 18260 1 764 . 1 1 65 65 ASP N N 15 119.752 0.100 . 1 . . . . 65 Asp N . 18260 1 765 . 1 1 66 66 ARG H H 1 7.750 0.020 . 1 . . . . 66 Arg H . 18260 1 766 . 1 1 66 66 ARG HA H 1 4.033 0.020 . 1 . . . . 66 Arg HA . 18260 1 767 . 1 1 66 66 ARG HB3 H 1 1.871 0.020 . 1 . . . . 66 Arg HB3 . 18260 1 768 . 1 1 66 66 ARG HG2 H 1 1.585 0.020 . 1 . . . . 66 Arg HG2 . 18260 1 769 . 1 1 66 66 ARG HG3 H 1 1.585 0.020 . 1 . . . . 66 Arg HG3 . 18260 1 770 . 1 1 66 66 ARG HD2 H 1 3.346 0.020 . 1 . . . . 66 Arg HD2 . 18260 1 771 . 1 1 66 66 ARG HD3 H 1 3.346 0.020 . 1 . . . . 66 Arg HD3 . 18260 1 772 . 1 1 66 66 ARG C C 13 179.471 0.300 . 1 . . . . 66 Arg C . 18260 1 773 . 1 1 66 66 ARG CA C 13 59.292 0.300 . 1 . . . . 66 Arg CA . 18260 1 774 . 1 1 66 66 ARG CB C 13 29.093 0.300 . 1 . . . . 66 Arg CB . 18260 1 775 . 1 1 66 66 ARG CG C 13 27.662 0.300 . 1 . . . . 66 Arg CG . 18260 1 776 . 1 1 66 66 ARG CD C 13 42.883 0.300 . 1 . . . . 66 Arg CD . 18260 1 777 . 1 1 66 66 ARG N N 15 120.995 0.100 . 1 . . . . 66 Arg N . 18260 1 778 . 1 1 67 67 VAL H H 1 9.009 0.020 . 1 . . . . 67 Val H . 18260 1 779 . 1 1 67 67 VAL HA H 1 3.857 0.020 . 1 . . . . 67 Val HA . 18260 1 780 . 1 1 67 67 VAL HB H 1 2.370 0.020 . 1 . . . . 67 Val HB . 18260 1 781 . 1 1 67 67 VAL HG11 H 1 1.224 0.020 . 2 . . . . 67 Val HG11 . 18260 1 782 . 1 1 67 67 VAL HG12 H 1 1.224 0.020 . 2 . . . . 67 Val HG12 . 18260 1 783 . 1 1 67 67 VAL HG13 H 1 1.224 0.020 . 2 . . . . 67 Val HG13 . 18260 1 784 . 1 1 67 67 VAL HG21 H 1 1.018 0.020 . 2 . . . . 67 Val HG21 . 18260 1 785 . 1 1 67 67 VAL HG22 H 1 1.018 0.020 . 2 . . . . 67 Val HG22 . 18260 1 786 . 1 1 67 67 VAL HG23 H 1 1.018 0.020 . 2 . . . . 67 Val HG23 . 18260 1 787 . 1 1 67 67 VAL C C 13 178.141 0.300 . 1 . . . . 67 Val C . 18260 1 788 . 1 1 67 67 VAL CA C 13 67.673 0.300 . 1 . . . . 67 Val CA . 18260 1 789 . 1 1 67 67 VAL CB C 13 30.977 0.300 . 1 . . . . 67 Val CB . 18260 1 790 . 1 1 67 67 VAL CG1 C 13 23.969 0.300 . 2 . . . . 67 Val CG1 . 18260 1 791 . 1 1 67 67 VAL CG2 C 13 21.106 0.300 . 2 . . . . 67 Val CG2 . 18260 1 792 . 1 1 67 67 VAL N N 15 120.648 0.100 . 1 . . . . 67 Val N . 18260 1 793 . 1 1 68 68 ASN H H 1 8.074 0.020 . 1 . . . . 68 Asn H . 18260 1 794 . 1 1 68 68 ASN HA H 1 4.565 0.020 . 1 . . . . 68 Asn HA . 18260 1 795 . 1 1 68 68 ASN HB2 H 1 2.967 0.020 . 2 . . . . 68 Asn HB2 . 18260 1 796 . 1 1 68 68 ASN HB3 H 1 3.160 0.020 . 2 . . . . 68 Asn HB3 . 18260 1 797 . 1 1 68 68 ASN HD21 H 1 6.816 0.020 . 2 . . . . 68 Asn HD21 . 18260 1 798 . 1 1 68 68 ASN HD22 H 1 7.914 0.020 . 2 . . . . 68 Asn HD22 . 18260 1 799 . 1 1 68 68 ASN C C 13 178.527 0.300 . 1 . . . . 68 Asn C . 18260 1 800 . 1 1 68 68 ASN CA C 13 56.493 0.300 . 1 . . . . 68 Asn CA . 18260 1 801 . 1 1 68 68 ASN CB C 13 36.930 0.300 . 1 . . . . 68 Asn CB . 18260 1 802 . 1 1 68 68 ASN CG C 13 175.91 0.300 . 1 . . . . 68 Asn CG . 18260 1 803 . 1 1 68 68 ASN N N 15 119.704 0.100 . 1 . . . . 68 Asn N . 18260 1 804 . 1 1 68 68 ASN ND2 N 15 112.588 0.100 . 1 . . . . 68 Asn ND2 . 18260 1 805 . 1 1 69 69 ASP H H 1 8.127 0.020 . 1 . . . . 69 Asp H . 18260 1 806 . 1 1 69 69 ASP HA H 1 4.578 0.020 . 1 . . . . 69 Asp HA . 18260 1 807 . 1 1 69 69 ASP HB2 H 1 3.018 0.020 . 2 . . . . 69 Asp HB2 . 18260 1 808 . 1 1 69 69 ASP HB3 H 1 2.838 0.020 . 2 . . . . 69 Asp HB3 . 18260 1 809 . 1 1 69 69 ASP C C 13 178.806 0.300 . 1 . . . . 69 Asp C . 18260 1 810 . 1 1 69 69 ASP CA C 13 57.742 0.300 . 1 . . . . 69 Asp CA . 18260 1 811 . 1 1 69 69 ASP CB C 13 40.170 0.300 . 1 . . . . 69 Asp CB . 18260 1 812 . 1 1 69 69 ASP N N 15 123.366 0.100 . 1 . . . . 69 Asp N . 18260 1 813 . 1 1 70 70 VAL H H 1 8.773 0.020 . 1 . . . . 70 Val H . 18260 1 814 . 1 1 70 70 VAL HA H 1 4.114 0.020 . 1 . . . . 70 Val HA . 18260 1 815 . 1 1 70 70 VAL HB H 1 2.335 0.020 . 1 . . . . 70 Val HB . 18260 1 816 . 1 1 70 70 VAL HG11 H 1 1.057 0.020 . 2 . . . . 70 Val HG11 . 18260 1 817 . 1 1 70 70 VAL HG12 H 1 1.057 0.020 . 2 . . . . 70 Val HG12 . 18260 1 818 . 1 1 70 70 VAL HG13 H 1 1.057 0.020 . 2 . . . . 70 Val HG13 . 18260 1 819 . 1 1 70 70 VAL HG21 H 1 0.941 0.020 . 2 . . . . 70 Val HG21 . 18260 1 820 . 1 1 70 70 VAL HG22 H 1 0.941 0.020 . 2 . . . . 70 Val HG22 . 18260 1 821 . 1 1 70 70 VAL HG23 H 1 0.941 0.020 . 2 . . . . 70 Val HG23 . 18260 1 822 . 1 1 70 70 VAL C C 13 179.278 0.300 . 1 . . . . 70 Val C . 18260 1 823 . 1 1 70 70 VAL CA C 13 66.139 0.300 . 1 . . . . 70 Val CA . 18260 1 824 . 1 1 70 70 VAL CB C 13 31.881 0.300 . 1 . . . . 70 Val CB . 18260 1 825 . 1 1 70 70 VAL CG1 C 13 24.045 0.300 . 2 . . . . 70 Val CG1 . 18260 1 826 . 1 1 70 70 VAL CG2 C 13 22.839 0.300 . 2 . . . . 70 Val CG2 . 18260 1 827 . 1 1 70 70 VAL N N 15 123.275 0.100 . 1 . . . . 70 Val N . 18260 1 828 . 1 1 71 71 CYS H H 1 8.735 0.020 . 1 . . . . 71 Cys H . 18260 1 829 . 1 1 71 71 CYS HA H 1 4.537 0.020 . 1 . . . . 71 Cys HA . 18260 1 830 . 1 1 71 71 CYS HB2 H 1 3.145 0.020 . 1 . . . . 71 Cys HB2 . 18260 1 831 . 1 1 71 71 CYS HB3 H 1 3.145 0.020 . 1 . . . . 71 Cys HB3 . 18260 1 832 . 1 1 71 71 CYS C C 13 179.471 0.300 . 1 . . . . 71 Cys C . 18260 1 833 . 1 1 71 71 CYS CA C 13 64.718 0.300 . 1 . . . . 71 Cys CA . 18260 1 834 . 1 1 71 71 CYS CB C 13 26.230 0.300 . 1 . . . . 71 Cys CB . 18260 1 835 . 1 1 71 71 CYS N N 15 118.195 0.100 . 1 . . . . 71 Cys N . 18260 1 836 . 1 1 72 72 ALA H H 1 8.278 0.020 . 1 . . . . 72 Ala H . 18260 1 837 . 1 1 72 72 ALA HA H 1 4.230 0.020 . 1 . . . . 72 Ala HA . 18260 1 838 . 1 1 72 72 ALA HB1 H 1 1.626 0.020 . 1 . . . . 72 Ala HB1 . 18260 1 839 . 1 1 72 72 ALA HB2 H 1 1.626 0.020 . 1 . . . . 72 Ala HB2 . 18260 1 840 . 1 1 72 72 ALA HB3 H 1 1.626 0.020 . 1 . . . . 72 Ala HB3 . 18260 1 841 . 1 1 72 72 ALA C C 13 180.779 0.300 . 1 . . . . 72 Ala C . 18260 1 842 . 1 1 72 72 ALA CA C 13 55.287 0.300 . 1 . . . . 72 Ala CA . 18260 1 843 . 1 1 72 72 ALA CB C 13 17.263 0.300 . 1 . . . . 72 Ala CB . 18260 1 844 . 1 1 72 72 ALA N N 15 123.612 0.100 . 1 . . . . 72 Ala N . 18260 1 845 . 1 1 73 73 ASN H H 1 8.124 0.020 . 1 . . . . 73 Asn H . 18260 1 846 . 1 1 73 73 ASN HA H 1 4.668 0.020 . 1 . . . . 73 Asn HA . 18260 1 847 . 1 1 73 73 ASN HB2 H 1 3.305 0.020 . 1 . . . . 73 Asn HB2 . 18260 1 848 . 1 1 73 73 ASN HB3 H 1 3.305 0.020 . 1 . . . . 73 Asn HB3 . 18260 1 849 . 1 1 73 73 ASN HD21 H 1 7.870 0.020 . 2 . . . . 73 Asn HD21 . 18260 1 850 . 1 1 73 73 ASN HD22 H 1 7.021 0.020 . 2 . . . . 73 Asn HD22 . 18260 1 851 . 1 1 73 73 ASN C C 13 177.948 0.300 . 1 . . . . 73 Asn C . 18260 1 852 . 1 1 73 73 ASN CA C 13 56.159 0.300 . 1 . . . . 73 Asn CA . 18260 1 853 . 1 1 73 73 ASN CB C 13 38.572 0.300 . 1 . . . . 73 Asn CB . 18260 1 854 . 1 1 73 73 ASN CG C 13 175.867 0.300 . 1 . . . . 73 Asn CG . 18260 1 855 . 1 1 73 73 ASN N N 15 118.259 0.100 . 1 . . . . 73 Asn N . 18260 1 856 . 1 1 73 73 ASN ND2 N 15 111.270 0.100 . 1 . . . . 73 Asn ND2 . 18260 1 857 . 1 1 74 74 GLY H H 1 8.738 0.020 . 1 . . . . 74 Gly H . 18260 1 858 . 1 1 74 74 GLY HA2 H 1 3.869 0.020 . 1 . . . . 74 Gly HA2 . 18260 1 859 . 1 1 74 74 GLY HA3 H 1 3.869 0.020 . 1 . . . . 74 Gly HA3 . 18260 1 860 . 1 1 74 74 GLY C C 13 175.181 0.300 . 1 . . . . 74 Gly C . 18260 1 861 . 1 1 74 74 GLY CA C 13 48.526 0.300 . 1 . . . . 74 Gly CA . 18260 1 862 . 1 1 74 74 GLY N N 15 108.762 0.100 . 1 . . . . 74 Gly N . 18260 1 863 . 1 1 75 75 GLU H H 1 8.489 0.020 . 1 . . . . 75 Glu H . 18260 1 864 . 1 1 75 75 GLU HA H 1 3.970 0.020 . 1 . . . . 75 Glu HA . 18260 1 865 . 1 1 75 75 GLU HB2 H 1 2.217 0.020 . 1 . . . . 75 Glu HB2 . 18260 1 866 . 1 1 75 75 GLU HB3 H 1 2.217 0.020 . 1 . . . . 75 Glu HB3 . 18260 1 867 . 1 1 75 75 GLU HG2 H 1 2.539 0.020 . 2 . . . . 75 Glu HG2 . 18260 1 868 . 1 1 75 75 GLU HG3 H 1 2.539 0.020 . 2 . . . . 75 Glu HG3 . 18260 1 869 . 1 1 75 75 GLU C C 13 179.664 0.300 . 1 . . . . 75 Glu C . 18260 1 870 . 1 1 75 75 GLU CA C 13 59.680 0.300 . 1 . . . . 75 Glu CA . 18260 1 871 . 1 1 75 75 GLU CB C 13 28.867 0.300 . 1 . . . . 75 Glu CB . 18260 1 872 . 1 1 75 75 GLU CG C 13 36.252 0.300 . 1 . . . . 75 Glu CG . 18260 1 873 . 1 1 75 75 GLU N N 15 120.131 0.100 . 1 . . . . 75 Glu N . 18260 1 874 . 1 1 76 76 ASP H H 1 7.961 0.020 . 1 . . . . 76 Asp H . 18260 1 875 . 1 1 76 76 ASP HA H 1 4.488 0.020 . 1 . . . . 76 Asp HA . 18260 1 876 . 1 1 76 76 ASP HB2 H 1 2.902 0.020 . 1 . . . . 76 Asp HB2 . 18260 1 877 . 1 1 76 76 ASP HB3 H 1 2.902 0.020 . 1 . . . . 76 Asp HB3 . 18260 1 878 . 1 1 76 76 ASP C C 13 178.527 0.300 . 1 . . . . 76 Asp C . 18260 1 879 . 1 1 76 76 ASP CA C 13 57.613 0.300 . 1 . . . . 76 Asp CA . 18260 1 880 . 1 1 76 76 ASP CB C 13 40.773 0.300 . 1 . . . . 76 Asp CB . 18260 1 881 . 1 1 76 76 ASP N N 15 121.076 0.100 . 1 . . . . 76 Asp N . 18260 1 882 . 1 1 77 77 LEU H H 1 8.146 0.020 . 1 . . . . 77 Leu H . 18260 1 883 . 1 1 77 77 LEU HA H 1 3.959 0.020 . 1 . . . . 77 Leu HA . 18260 1 884 . 1 1 77 77 LEU HB2 H 1 2.129 0.020 . 1 . . . . 77 Leu HB2 . 18260 1 885 . 1 1 77 77 LEU HB3 H 1 2.129 0.020 . 1 . . . . 77 Leu HB3 . 18260 1 886 . 1 1 77 77 LEU HD11 H 1 1.010 0.020 . 2 . . . . 77 Leu HD11 . 18260 1 887 . 1 1 77 77 LEU HD12 H 1 1.010 0.020 . 2 . . . . 77 Leu HD12 . 18260 1 888 . 1 1 77 77 LEU HD13 H 1 1.010 0.020 . 2 . . . . 77 Leu HD13 . 18260 1 889 . 1 1 77 77 LEU HD21 H 1 1.010 0.020 . 2 . . . . 77 Leu HD21 . 18260 1 890 . 1 1 77 77 LEU HD22 H 1 1.010 0.020 . 2 . . . . 77 Leu HD22 . 18260 1 891 . 1 1 77 77 LEU HD23 H 1 1.010 0.020 . 2 . . . . 77 Leu HD23 . 18260 1 892 . 1 1 77 77 LEU C C 13 179.943 0.300 . 1 . . . . 77 Leu C . 18260 1 893 . 1 1 77 77 LEU CA C 13 58.086 0.300 . 1 . . . . 77 Leu CA . 18260 1 894 . 1 1 77 77 LEU CB C 13 41.376 0.300 . 1 . . . . 77 Leu CB . 18260 1 895 . 1 1 77 77 LEU CG C 13 26.079 0.300 . 1 . . . . 77 Leu CG . 18260 1 896 . 1 1 77 77 LEU CD1 C 13 25.326 0.300 . 2 . . . . 77 Leu CD1 . 18260 1 897 . 1 1 77 77 LEU CD2 C 13 23.442 0.300 . 2 . . . . 77 Leu CD2 . 18260 1 898 . 1 1 77 77 LEU N N 15 119.165 0.100 . 1 . . . . 77 Leu N . 18260 1 899 . 1 1 78 78 ILE H H 1 7.981 0.020 . 1 . . . . 78 Ile H . 18260 1 900 . 1 1 78 78 ILE HA H 1 3.582 0.020 . 1 . . . . 78 Ile HA . 18260 1 901 . 1 1 78 78 ILE HB H 1 1.855 0.020 . 1 . . . . 78 Ile HB . 18260 1 902 . 1 1 78 78 ILE HG21 H 1 0.862 0.020 . 1 . . . . 78 Ile HG21 . 18260 1 903 . 1 1 78 78 ILE HG22 H 1 0.862 0.020 . 1 . . . . 78 Ile HG22 . 18260 1 904 . 1 1 78 78 ILE HG23 H 1 0.862 0.020 . 1 . . . . 78 Ile HG23 . 18260 1 905 . 1 1 78 78 ILE HD11 H 1 0.656 0.020 . 1 . . . . 78 Ile HD11 . 18260 1 906 . 1 1 78 78 ILE HD12 H 1 0.656 0.020 . 1 . . . . 78 Ile HD12 . 18260 1 907 . 1 1 78 78 ILE HD13 H 1 0.656 0.020 . 1 . . . . 78 Ile HD13 . 18260 1 908 . 1 1 78 78 ILE CA C 13 65.795 0.300 . 1 . . . . 78 Ile CA . 18260 1 909 . 1 1 78 78 ILE CB C 13 37.759 0.300 . 1 . . . . 78 Ile CB . 18260 1 910 . 1 1 78 78 ILE CG1 C 13 29.470 0.300 . 1 . . . . 78 Ile CG1 . 18260 1 911 . 1 1 78 78 ILE CG2 C 13 17.112 0.300 . 1 . . . . 78 Ile CG2 . 18260 1 912 . 1 1 78 78 ILE CD1 C 13 14.174 0.300 . 1 . . . . 78 Ile CD1 . 18260 1 913 . 1 1 78 78 ILE N N 15 119.419 0.100 . 1 . . . . 78 Ile N . 18260 1 914 . 1 1 79 79 LYS HA H 1 4.127 0.020 . 1 . . . . 79 Lys HA . 18260 1 915 . 1 1 79 79 LYS HB2 H 1 2.077 0.020 . 1 . . . . 79 Lys HB2 . 18260 1 916 . 1 1 79 79 LYS HB3 H 1 2.077 0.020 . 1 . . . . 79 Lys HB3 . 18260 1 917 . 1 1 79 79 LYS HG2 H 1 1.521 0.020 . 1 . . . . 79 Lys HG2 . 18260 1 918 . 1 1 79 79 LYS HG3 H 1 1.521 0.020 . 1 . . . . 79 Lys HG3 . 18260 1 919 . 1 1 79 79 LYS HD2 H 1 1.701 0.020 . 1 . . . . 79 Lys HD2 . 18260 1 920 . 1 1 79 79 LYS HD3 H 1 1.701 0.020 . 1 . . . . 79 Lys HD3 . 18260 1 921 . 1 1 79 79 LYS HE2 H 1 3.055 0.020 . 1 . . . . 79 Lys HE2 . 18260 1 922 . 1 1 79 79 LYS HE3 H 1 3.055 0.020 . 1 . . . . 79 Lys HE3 . 18260 1 923 . 1 1 79 79 LYS C C 13 178.227 0.300 . 1 . . . . 79 Lys C . 18260 1 924 . 1 1 79 79 LYS CA C 13 59.292 0.300 . 1 . . . . 79 Lys CA . 18260 1 925 . 1 1 79 79 LYS CB C 13 32.032 0.300 . 1 . . . . 79 Lys CB . 18260 1 926 . 1 1 79 79 LYS CG C 13 25.326 0.300 . 1 . . . . 79 Lys CG . 18260 1 927 . 1 1 79 79 LYS CD C 13 29.395 0.300 . 1 . . . . 79 Lys CD . 18260 1 928 . 1 1 79 79 LYS CE C 13 41.838 0.300 . 1 . . . . 79 Lys CE . 18260 1 929 . 1 1 80 80 LYS H H 1 7.625 0.020 . 1 . . . . 80 Lys H . 18260 1 930 . 1 1 80 80 LYS HA H 1 4.346 0.020 . 1 . . . . 80 Lys HA . 18260 1 931 . 1 1 80 80 LYS HB2 H 1 1.986 0.020 . 1 . . . . 80 Lys HB2 . 18260 1 932 . 1 1 80 80 LYS HB3 H 1 1.986 0.020 . 1 . . . . 80 Lys HB3 . 18260 1 933 . 1 1 80 80 LYS HG2 H 1 1.611 0.020 . 1 . . . . 80 Lys HG2 . 18260 1 934 . 1 1 80 80 LYS HG3 H 1 1.611 0.020 . 1 . . . . 80 Lys HG3 . 18260 1 935 . 1 1 80 80 LYS HD2 H 1 1.714 0.020 . 1 . . . . 80 Lys HD2 . 18260 1 936 . 1 1 80 80 LYS HD3 H 1 1.714 0.020 . 1 . . . . 80 Lys HD3 . 18260 1 937 . 1 1 80 80 LYS C C 13 176.360 0.300 . 1 . . . . 80 Lys C . 18260 1 938 . 1 1 80 80 LYS CA C 13 57.017 0.300 . 1 . . . . 80 Lys CA . 18260 1 939 . 1 1 80 80 LYS CB C 13 32.258 0.300 . 1 . . . . 80 Lys CB . 18260 1 940 . 1 1 80 80 LYS CG C 13 25.326 0.300 . 1 . . . . 80 Lys CG . 18260 1 941 . 1 1 80 80 LYS CD C 13 29.093 0.300 . 1 . . . . 80 Lys CD . 18260 1 942 . 1 1 80 80 LYS CE C 13 41.602 0.300 . 1 . . . . 80 Lys CE . 18260 1 943 . 1 1 80 80 LYS N N 15 116.717 0.100 . 1 . . . . 80 Lys N . 18260 1 944 . 1 1 81 81 ASN H H 1 8.119 0.020 . 1 . . . . 81 Asn H . 18260 1 945 . 1 1 81 81 ASN HA H 1 4.484 0.020 . 1 . . . . 81 Asn HA . 18260 1 946 . 1 1 81 81 ASN CA C 13 53.413 0.300 . 1 . . . . 81 Asn CA . 18260 1 947 . 1 1 81 81 ASN CB C 13 38.065 0.300 . 1 . . . . 81 Asn CB . 18260 1 948 . 1 1 81 81 ASN N N 15 116.080 0.100 . 1 . . . . 81 Asn N . 18260 1 949 . 1 1 84 84 HIS HA H 1 4.668 0.020 . 1 . . . . 84 His HA . 18260 1 950 . 1 1 84 84 HIS HB2 H 1 2.552 0.020 . 2 . . . . 84 His HB2 . 18260 1 951 . 1 1 84 84 HIS HB3 H 1 2.552 0.020 . 2 . . . . 84 His HB3 . 18260 1 952 . 1 1 84 84 HIS C C 13 175.223 0.300 . 1 . . . . 84 His C . 18260 1 953 . 1 1 84 84 HIS CA C 13 55.994 0.300 . 1 . . . . 84 His CA . 18260 1 954 . 1 1 84 84 HIS CB C 13 28.585 0.300 . 1 . . . . 84 His CB . 18260 1 955 . 1 1 85 85 VAL H H 1 7.532 0.020 . 1 . . . . 85 Val H . 18260 1 956 . 1 1 85 85 VAL HA H 1 3.621 0.020 . 1 . . . . 85 Val HA . 18260 1 957 . 1 1 85 85 VAL HB H 1 2.241 0.020 . 1 . . . . 85 Val HB . 18260 1 958 . 1 1 85 85 VAL HG11 H 1 1.096 0.020 . 2 . . . . 85 Val HG11 . 18260 1 959 . 1 1 85 85 VAL HG12 H 1 1.096 0.020 . 2 . . . . 85 Val HG12 . 18260 1 960 . 1 1 85 85 VAL HG13 H 1 1.096 0.020 . 2 . . . . 85 Val HG13 . 18260 1 961 . 1 1 85 85 VAL HG21 H 1 1.096 0.020 . 2 . . . . 85 Val HG21 . 18260 1 962 . 1 1 85 85 VAL HG22 H 1 1.096 0.020 . 2 . . . . 85 Val HG22 . 18260 1 963 . 1 1 85 85 VAL HG23 H 1 1.096 0.020 . 2 . . . . 85 Val HG23 . 18260 1 964 . 1 1 85 85 VAL C C 13 176.768 0.300 . 1 . . . . 85 Val C . 18260 1 965 . 1 1 85 85 VAL CA C 13 66.871 0.300 . 1 . . . . 85 Val CA . 18260 1 966 . 1 1 85 85 VAL CB C 13 31.429 0.300 . 1 . . . . 85 Val CB . 18260 1 967 . 1 1 85 85 VAL CG1 C 13 22.161 0.300 . 2 . . . . 85 Val CG1 . 18260 1 968 . 1 1 85 85 VAL CG2 C 13 22.161 0.300 . 2 . . . . 85 Val CG2 . 18260 1 969 . 1 1 85 85 VAL N N 15 119.024 0.100 . 1 . . . . 85 Val N . 18260 1 970 . 1 1 86 86 GLU H H 1 9.036 0.020 . 1 . . . . 86 Glu H . 18260 1 971 . 1 1 86 86 GLU HA H 1 4.110 0.020 . 1 . . . . 86 Glu HA . 18260 1 972 . 1 1 86 86 GLU HB2 H 1 2.062 0.020 . 1 . . . . 86 Glu HB2 . 18260 1 973 . 1 1 86 86 GLU HB3 H 1 2.062 0.020 . 1 . . . . 86 Glu HB3 . 18260 1 974 . 1 1 86 86 GLU HG2 H 1 2.372 0.020 . 1 . . . . 86 Glu HG2 . 18260 1 975 . 1 1 86 86 GLU HG3 H 1 2.372 0.020 . 1 . . . . 86 Glu HG3 . 18260 1 976 . 1 1 86 86 GLU C C 13 179.106 0.300 . 1 . . . . 86 Glu C . 18260 1 977 . 1 1 86 86 GLU CA C 13 60.369 0.300 . 1 . . . . 86 Glu CA . 18260 1 978 . 1 1 86 86 GLU CB C 13 28.716 0.300 . 1 . . . . 86 Glu CB . 18260 1 979 . 1 1 86 86 GLU CG C 13 36.327 0.300 . 1 . . . . 86 Glu CG . 18260 1 980 . 1 1 86 86 GLU N N 15 122.464 0.100 . 1 . . . . 86 Glu N . 18260 1 981 . 1 1 87 87 ASN H H 1 8.117 0.020 . 1 . . . . 87 Asn H . 18260 1 982 . 1 1 87 87 ASN HA H 1 4.771 0.020 . 1 . . . . 87 Asn HA . 18260 1 983 . 1 1 87 87 ASN HB2 H 1 3.108 0.020 . 2 . . . . 87 Asn HB2 . 18260 1 984 . 1 1 87 87 ASN HB3 H 1 3.044 0.020 . 2 . . . . 87 Asn HB3 . 18260 1 985 . 1 1 87 87 ASN C C 13 177.905 0.300 . 1 . . . . 87 Asn C . 18260 1 986 . 1 1 87 87 ASN CA C 13 56.062 0.300 . 1 . . . . 87 Asn CA . 18260 1 987 . 1 1 87 87 ASN CB C 13 38.814 0.300 . 1 . . . . 87 Asn CB . 18260 1 988 . 1 1 87 87 ASN N N 15 118.403 0.100 . 1 . . . . 87 Asn N . 18260 1 989 . 1 1 88 88 ILE H H 1 8.579 0.020 . 1 . . . . 88 Ile H . 18260 1 990 . 1 1 88 88 ILE HA H 1 3.895 0.020 . 1 . . . . 88 Ile HA . 18260 1 991 . 1 1 88 88 ILE HB H 1 1.714 0.020 . 1 . . . . 88 Ile HB . 18260 1 992 . 1 1 88 88 ILE HG12 H 1 1.654 0.020 . 1 . . . . 88 Ile HG12 . 18260 1 993 . 1 1 88 88 ILE HG13 H 1 1.654 0.020 . 1 . . . . 88 Ile HG13 . 18260 1 994 . 1 1 88 88 ILE HG21 H 1 0.709 0.020 . 1 . . . . 88 Ile HG21 . 18260 1 995 . 1 1 88 88 ILE HG22 H 1 0.709 0.020 . 1 . . . . 88 Ile HG22 . 18260 1 996 . 1 1 88 88 ILE HG23 H 1 0.709 0.020 . 1 . . . . 88 Ile HG23 . 18260 1 997 . 1 1 88 88 ILE HD11 H 1 0.631 0.020 . 1 . . . . 88 Ile HD11 . 18260 1 998 . 1 1 88 88 ILE HD12 H 1 0.631 0.020 . 1 . . . . 88 Ile HD12 . 18260 1 999 . 1 1 88 88 ILE HD13 H 1 0.631 0.020 . 1 . . . . 88 Ile HD13 . 18260 1 1000 . 1 1 88 88 ILE C C 13 178.076 0.300 . 1 . . . . 88 Ile C . 18260 1 1001 . 1 1 88 88 ILE CA C 13 66.047 0.300 . 1 . . . . 88 Ile CA . 18260 1 1002 . 1 1 88 88 ILE CB C 13 38.135 0.300 . 1 . . . . 88 Ile CB . 18260 1 1003 . 1 1 88 88 ILE CG1 C 13 29.470 0.300 . 1 . . . . 88 Ile CG1 . 18260 1 1004 . 1 1 88 88 ILE CG2 C 13 17.188 0.300 . 1 . . . . 88 Ile CG2 . 18260 1 1005 . 1 1 88 88 ILE CD1 C 13 14.174 0.300 . 1 . . . . 88 Ile CD1 . 18260 1 1006 . 1 1 88 88 ILE N N 15 120.249 0.100 . 1 . . . . 88 Ile N . 18260 1 1007 . 1 1 89 89 THR H H 1 8.455 0.020 . 1 . . . . 89 Thr H . 18260 1 1008 . 1 1 89 89 THR HA H 1 3.959 0.020 . 1 . . . . 89 Thr HA . 18260 1 1009 . 1 1 89 89 THR HB H 1 4.359 0.020 . 1 . . . . 89 Thr HB . 18260 1 1010 . 1 1 89 89 THR HG21 H 1 1.328 0.020 . 1 . . . . 89 Thr HG21 . 18260 1 1011 . 1 1 89 89 THR HG22 H 1 1.328 0.020 . 1 . . . . 89 Thr HG22 . 18260 1 1012 . 1 1 89 89 THR HG23 H 1 1.328 0.020 . 1 . . . . 89 Thr HG23 . 18260 1 1013 . 1 1 89 89 THR C C 13 176.661 0.300 . 1 . . . . 89 Thr C . 18260 1 1014 . 1 1 89 89 THR CA C 13 67.431 0.300 . 1 . . . . 89 Thr CA . 18260 1 1015 . 1 1 89 89 THR CB C 13 68.578 0.300 . 1 . . . . 89 Thr CB . 18260 1 1016 . 1 1 89 89 THR CG2 C 13 21.106 0.300 . 1 . . . . 89 Thr CG2 . 18260 1 1017 . 1 1 89 89 THR N N 15 115.112 0.100 . 1 . . . . 89 Thr N . 18260 1 1018 . 1 1 90 90 ALA H H 1 7.975 0.020 . 1 . . . . 90 Ala H . 18260 1 1019 . 1 1 90 90 ALA HA H 1 4.124 0.020 . 1 . . . . 90 Ala HA . 18260 1 1020 . 1 1 90 90 ALA HB1 H 1 1.729 0.020 . 1 . . . . 90 Ala HB1 . 18260 1 1021 . 1 1 90 90 ALA HB2 H 1 1.729 0.020 . 1 . . . . 90 Ala HB2 . 18260 1 1022 . 1 1 90 90 ALA HB3 H 1 1.729 0.020 . 1 . . . . 90 Ala HB3 . 18260 1 1023 . 1 1 90 90 ALA C C 13 181.659 0.300 . 1 . . . . 90 Ala C . 18260 1 1024 . 1 1 90 90 ALA CA C 13 55.316 0.300 . 1 . . . . 90 Ala CA . 18260 1 1025 . 1 1 90 90 ALA CB C 13 18.092 0.300 . 1 . . . . 90 Ala CB . 18260 1 1026 . 1 1 90 90 ALA N N 15 123.221 0.100 . 1 . . . . 90 Ala N . 18260 1 1027 . 1 1 91 91 LYS H H 1 8.546 0.020 . 1 . . . . 91 Lys H . 18260 1 1028 . 1 1 91 91 LYS HA H 1 4.271 0.020 . 1 . . . . 91 Lys HA . 18260 1 1029 . 1 1 91 91 LYS HB2 H 1 1.922 0.020 . 1 . . . . 91 Lys HB2 . 18260 1 1030 . 1 1 91 91 LYS HB3 H 1 1.922 0.020 . 1 . . . . 91 Lys HB3 . 18260 1 1031 . 1 1 91 91 LYS HG2 H 1 1.732 0.020 . 1 . . . . 91 Lys HG2 . 18260 1 1032 . 1 1 91 91 LYS HG3 H 1 1.732 0.020 . 1 . . . . 91 Lys HG3 . 18260 1 1033 . 1 1 91 91 LYS HD2 H 1 1.916 0.020 . 1 . . . . 91 Lys HD2 . 18260 1 1034 . 1 1 91 91 LYS HD3 H 1 1.916 0.020 . 1 . . . . 91 Lys HD3 . 18260 1 1035 . 1 1 91 91 LYS HE2 H 1 2.449 0.020 . 1 . . . . 91 Lys HE2 . 18260 1 1036 . 1 1 91 91 LYS HE3 H 1 2.449 0.020 . 1 . . . . 91 Lys HE3 . 18260 1 1037 . 1 1 91 91 LYS C C 13 180.329 0.300 . 1 . . . . 91 Lys C . 18260 1 1038 . 1 1 91 91 LYS CA C 13 58.775 0.300 . 1 . . . . 91 Lys CA . 18260 1 1039 . 1 1 91 91 LYS CB C 13 32.866 0.300 . 1 . . . . 91 Lys CB . 18260 1 1040 . 1 1 91 91 LYS CG C 13 24.271 0.300 . 1 . . . . 91 Lys CG . 18260 1 1041 . 1 1 91 91 LYS CD C 13 31.052 0.300 . 1 . . . . 91 Lys CD . 18260 1 1042 . 1 1 91 91 LYS CE C 13 41.903 0.300 . 1 . . . . 91 Lys CE . 18260 1 1043 . 1 1 91 91 LYS N N 15 118.539 0.100 . 1 . . . . 91 Lys N . 18260 1 1044 . 1 1 92 92 MET H H 1 8.586 0.020 . 1 . . . . 92 Met H . 18260 1 1045 . 1 1 92 92 MET HA H 1 4.260 0.020 . 1 . . . . 92 Met HA . 18260 1 1046 . 1 1 92 92 MET HB2 H 1 2.517 0.020 . 1 . . . . 92 Met HB2 . 18260 1 1047 . 1 1 92 92 MET HB3 H 1 2.517 0.020 . 1 . . . . 92 Met HB3 . 18260 1 1048 . 1 1 92 92 MET HG2 H 1 2.600 0.020 . 1 . . . . 92 Met HG2 . 18260 1 1049 . 1 1 92 92 MET HG3 H 1 2.600 0.020 . 1 . . . . 92 Met HG3 . 18260 1 1050 . 1 1 92 92 MET HE1 H 1 2.145 0.020 . 1 . . . . 92 Met HE1 . 18260 1 1051 . 1 1 92 92 MET HE2 H 1 2.145 0.020 . 1 . . . . 92 Met HE2 . 18260 1 1052 . 1 1 92 92 MET HE3 H 1 2.145 0.020 . 1 . . . . 92 Met HE3 . 18260 1 1053 . 1 1 92 92 MET C C 13 177.755 0.300 . 1 . . . . 92 Met C . 18260 1 1054 . 1 1 92 92 MET CA C 13 60.541 0.300 . 1 . . . . 92 Met CA . 18260 1 1055 . 1 1 92 92 MET CB C 13 33.916 0.300 . 1 . . . . 92 Met CB . 18260 1 1056 . 1 1 92 92 MET CG C 13 31.630 0.300 . 1 . . . . 92 Met CG . 18260 1 1057 . 1 1 92 92 MET CE C 13 16.229 0.300 . 1 . . . . 92 Met CE . 18260 1 1058 . 1 1 92 92 MET N N 15 118.612 0.100 . 1 . . . . 92 Met N . 18260 1 1059 . 1 1 93 93 LYS H H 1 8.581 0.020 . 1 . . . . 93 Lys H . 18260 1 1060 . 1 1 93 93 LYS HA H 1 4.088 0.020 . 1 . . . . 93 Lys HA . 18260 1 1061 . 1 1 93 93 LYS HB2 H 1 2.051 0.020 . 1 . . . . 93 Lys HB2 . 18260 1 1062 . 1 1 93 93 LYS HB3 H 1 2.051 0.020 . 1 . . . . 93 Lys HB3 . 18260 1 1063 . 1 1 93 93 LYS HG2 H 1 1.669 0.020 . 1 . . . . 93 Lys HG2 . 18260 1 1064 . 1 1 93 93 LYS HG3 H 1 1.669 0.020 . 1 . . . . 93 Lys HG3 . 18260 1 1065 . 1 1 93 93 LYS HD2 H 1 1.701 0.020 . 1 . . . . 93 Lys HD2 . 18260 1 1066 . 1 1 93 93 LYS HD3 H 1 1.701 0.020 . 1 . . . . 93 Lys HD3 . 18260 1 1067 . 1 1 93 93 LYS HE2 H 1 3.016 0.020 . 1 . . . . 93 Lys HE2 . 18260 1 1068 . 1 1 93 93 LYS HE3 H 1 3.016 0.020 . 1 . . . . 93 Lys HE3 . 18260 1 1069 . 1 1 93 93 LYS C C 13 180.887 0.300 . 1 . . . . 93 Lys C . 18260 1 1070 . 1 1 93 93 LYS CA C 13 59.848 0.300 . 1 . . . . 93 Lys CA . 18260 1 1071 . 1 1 93 93 LYS CB C 13 32.333 0.300 . 1 . . . . 93 Lys CB . 18260 1 1072 . 1 1 93 93 LYS CG C 13 25.100 0.300 . 1 . . . . 93 Lys CG . 18260 1 1073 . 1 1 93 93 LYS CD C 13 29.395 0.300 . 1 . . . . 93 Lys CD . 18260 1 1074 . 1 1 93 93 LYS CE C 13 41.828 0.300 . 1 . . . . 93 Lys CE . 18260 1 1075 . 1 1 93 93 LYS N N 15 117.761 0.100 . 1 . . . . 93 Lys N . 18260 1 1076 . 1 1 94 94 GLY H H 1 8.398 0.020 . 1 . . . . 94 Gly H . 18260 1 1077 . 1 1 94 94 GLY HA2 H 1 4.140 0.020 . 2 . . . . 94 Gly HA2 . 18260 1 1078 . 1 1 94 94 GLY HA3 H 1 3.998 0.020 . 2 . . . . 94 Gly HA3 . 18260 1 1079 . 1 1 94 94 GLY C C 13 176.189 0.300 . 1 . . . . 94 Gly C . 18260 1 1080 . 1 1 94 94 GLY CA C 13 46.847 0.300 . 1 . . . . 94 Gly CA . 18260 1 1081 . 1 1 94 94 GLY N N 15 106.774 0.100 . 1 . . . . 94 Gly N . 18260 1 1082 . 1 1 95 95 LEU H H 1 7.964 0.020 . 1 . . . . 95 Leu H . 18260 1 1083 . 1 1 95 95 LEU HA H 1 4.320 0.020 . 1 . . . . 95 Leu HA . 18260 1 1084 . 1 1 95 95 LEU HB2 H 1 2.013 0.020 . 1 . . . . 95 Leu HB2 . 18260 1 1085 . 1 1 95 95 LEU HB3 H 1 2.013 0.020 . 1 . . . . 95 Leu HB3 . 18260 1 1086 . 1 1 95 95 LEU HG H 1 1.735 0.020 . 1 . . . . 95 Leu HG . 18260 1 1087 . 1 1 95 95 LEU HD11 H 1 1.083 0.020 . 2 . . . . 95 Leu HD11 . 18260 1 1088 . 1 1 95 95 LEU HD12 H 1 1.083 0.020 . 2 . . . . 95 Leu HD12 . 18260 1 1089 . 1 1 95 95 LEU HD13 H 1 1.083 0.020 . 2 . . . . 95 Leu HD13 . 18260 1 1090 . 1 1 95 95 LEU HD21 H 1 0.889 0.020 . 2 . . . . 95 Leu HD21 . 18260 1 1091 . 1 1 95 95 LEU HD22 H 1 0.889 0.020 . 2 . . . . 95 Leu HD22 . 18260 1 1092 . 1 1 95 95 LEU HD23 H 1 0.889 0.020 . 2 . . . . 95 Leu HD23 . 18260 1 1093 . 1 1 95 95 LEU C C 13 178.248 0.300 . 1 . . . . 95 Leu C . 18260 1 1094 . 1 1 95 95 LEU CA C 13 58.027 0.300 . 1 . . . . 95 Leu CA . 18260 1 1095 . 1 1 95 95 LEU CB C 13 41.903 0.300 . 1 . . . . 95 Leu CB . 18260 1 1096 . 1 1 95 95 LEU CG C 13 26.757 0.300 . 1 . . . . 95 Leu CG . 18260 1 1097 . 1 1 95 95 LEU CD1 C 13 22.764 0.300 . 2 . . . . 95 Leu CD1 . 18260 1 1098 . 1 1 95 95 LEU CD2 C 13 23.261 0.300 . 2 . . . . 95 Leu CD2 . 18260 1 1099 . 1 1 95 95 LEU N N 15 124.264 0.100 . 1 . . . . 95 Leu N . 18260 1 1100 . 1 1 96 96 LYS H H 1 8.376 0.020 . 1 . . . . 96 Lys H . 18260 1 1101 . 1 1 96 96 LYS HA H 1 4.024 0.020 . 1 . . . . 96 Lys HA . 18260 1 1102 . 1 1 96 96 LYS HB2 H 1 1.987 0.020 . 1 . . . . 96 Lys HB2 . 18260 1 1103 . 1 1 96 96 LYS HB3 H 1 1.987 0.020 . 1 . . . . 96 Lys HB3 . 18260 1 1104 . 1 1 96 96 LYS HG2 H 1 1.495 0.020 . 1 . . . . 96 Lys HG2 . 18260 1 1105 . 1 1 96 96 LYS HG3 H 1 1.495 0.020 . 1 . . . . 96 Lys HG3 . 18260 1 1106 . 1 1 96 96 LYS HD2 H 1 1.766 0.020 . 1 . . . . 96 Lys HD2 . 18260 1 1107 . 1 1 96 96 LYS HD3 H 1 1.766 0.020 . 1 . . . . 96 Lys HD3 . 18260 1 1108 . 1 1 96 96 LYS C C 13 180.694 0.300 . 1 . . . . 96 Lys C . 18260 1 1109 . 1 1 96 96 LYS CA C 13 60.289 0.300 . 1 . . . . 96 Lys CA . 18260 1 1110 . 1 1 96 96 LYS CB C 13 32.183 0.300 . 1 . . . . 96 Lys CB . 18260 1 1111 . 1 1 96 96 LYS CG C 13 25.702 0.300 . 1 . . . . 96 Lys CG . 18260 1 1112 . 1 1 96 96 LYS CD C 13 29.847 0.300 . 1 . . . . 96 Lys CD . 18260 1 1113 . 1 1 96 96 LYS CE C 13 42.129 0.300 . 1 . . . . 96 Lys CE . 18260 1 1114 . 1 1 96 96 LYS N N 15 117.239 0.100 . 1 . . . . 96 Lys N . 18260 1 1115 . 1 1 97 97 GLY H H 1 8.241 0.020 . 1 . . . . 97 Gly H . 18260 1 1116 . 1 1 97 97 GLY HA2 H 1 4.062 0.020 . 1 . . . . 97 Gly HA2 . 18260 1 1117 . 1 1 97 97 GLY HA3 H 1 4.062 0.020 . 1 . . . . 97 Gly HA3 . 18260 1 1118 . 1 1 97 97 GLY C C 13 175.717 0.300 . 1 . . . . 97 Gly C . 18260 1 1119 . 1 1 97 97 GLY CA C 13 47.171 0.300 . 1 . . . . 97 Gly CA . 18260 1 1120 . 1 1 97 97 GLY N N 15 107.677 0.100 . 1 . . . . 97 Gly N . 18260 1 1121 . 1 1 98 98 LYS H H 1 7.996 0.020 . 1 . . . . 98 Lys H . 18260 1 1122 . 1 1 98 98 LYS HA H 1 4.359 0.020 . 1 . . . . 98 Lys HA . 18260 1 1123 . 1 1 98 98 LYS HB2 H 1 1.971 0.020 . 1 . . . . 98 Lys HB2 . 18260 1 1124 . 1 1 98 98 LYS HB3 H 1 1.971 0.020 . 1 . . . . 98 Lys HB3 . 18260 1 1125 . 1 1 98 98 LYS HG2 H 1 1.623 0.020 . 1 . . . . 98 Lys HG2 . 18260 1 1126 . 1 1 98 98 LYS HG3 H 1 1.623 0.020 . 1 . . . . 98 Lys HG3 . 18260 1 1127 . 1 1 98 98 LYS HD2 H 1 1.790 0.020 . 1 . . . . 98 Lys HD2 . 18260 1 1128 . 1 1 98 98 LYS HD3 H 1 1.790 0.020 . 1 . . . . 98 Lys HD3 . 18260 1 1129 . 1 1 98 98 LYS C C 13 179.921 0.300 . 1 . . . . 98 Lys C . 18260 1 1130 . 1 1 98 98 LYS CA C 13 59.551 0.300 . 1 . . . . 98 Lys CA . 18260 1 1131 . 1 1 98 98 LYS CB C 13 32.333 0.300 . 1 . . . . 98 Lys CB . 18260 1 1132 . 1 1 98 98 LYS CG C 13 25.702 0.300 . 1 . . . . 98 Lys CG . 18260 1 1133 . 1 1 98 98 LYS CD C 13 28.867 0.300 . 1 . . . . 98 Lys CD . 18260 1 1134 . 1 1 98 98 LYS CE C 13 41.903 0.300 . 1 . . . . 98 Lys CE . 18260 1 1135 . 1 1 98 98 LYS N N 15 122.105 0.100 . 1 . . . . 98 Lys N . 18260 1 1136 . 1 1 99 99 VAL H H 1 8.312 0.020 . 1 . . . . 99 Val H . 18260 1 1137 . 1 1 99 99 VAL HA H 1 3.882 0.020 . 1 . . . . 99 Val HA . 18260 1 1138 . 1 1 99 99 VAL HB H 1 2.528 0.020 . 1 . . . . 99 Val HB . 18260 1 1139 . 1 1 99 99 VAL HG11 H 1 1.186 0.020 . 2 . . . . 99 Val HG11 . 18260 1 1140 . 1 1 99 99 VAL HG12 H 1 1.186 0.020 . 2 . . . . 99 Val HG12 . 18260 1 1141 . 1 1 99 99 VAL HG13 H 1 1.186 0.020 . 2 . . . . 99 Val HG13 . 18260 1 1142 . 1 1 99 99 VAL HG21 H 1 1.366 0.020 . 2 . . . . 99 Val HG21 . 18260 1 1143 . 1 1 99 99 VAL HG22 H 1 1.366 0.020 . 2 . . . . 99 Val HG22 . 18260 1 1144 . 1 1 99 99 VAL HG23 H 1 1.366 0.020 . 2 . . . . 99 Val HG23 . 18260 1 1145 . 1 1 99 99 VAL C C 13 177.903 0.300 . 1 . . . . 99 Val C . 18260 1 1146 . 1 1 99 99 VAL CA C 13 67.826 0.300 . 1 . . . . 99 Val CA . 18260 1 1147 . 1 1 99 99 VAL CB C 13 31.505 0.300 . 1 . . . . 99 Val CB . 18260 1 1148 . 1 1 99 99 VAL CG1 C 13 21.784 0.300 . 2 . . . . 99 Val CG1 . 18260 1 1149 . 1 1 99 99 VAL CG2 C 13 24.723 0.300 . 2 . . . . 99 Val CG2 . 18260 1 1150 . 1 1 99 99 VAL N N 15 120.080 0.100 . 1 . . . . 99 Val N . 18260 1 1151 . 1 1 100 100 SER H H 1 7.977 0.020 . 1 . . . . 100 Ser H . 18260 1 1152 . 1 1 100 100 SER HA H 1 4.578 0.020 . 1 . . . . 100 Ser HA . 18260 1 1153 . 1 1 100 100 SER HB2 H 1 4.204 0.020 . 1 . . . . 100 Ser HB2 . 18260 1 1154 . 1 1 100 100 SER HB3 H 1 4.204 0.020 . 1 . . . . 100 Ser HB3 . 18260 1 1155 . 1 1 100 100 SER C C 13 177.583 0.300 . 1 . . . . 100 Ser C . 18260 1 1156 . 1 1 100 100 SER CA C 13 61.661 0.300 . 1 . . . . 100 Ser CA . 18260 1 1157 . 1 1 100 100 SER CB C 13 62.474 0.300 . 1 . . . . 100 Ser CB . 18260 1 1158 . 1 1 100 100 SER N N 15 114.664 0.100 . 1 . . . . 100 Ser N . 18260 1 1159 . 1 1 101 101 ASP H H 1 8.532 0.020 . 1 . . . . 101 Asp H . 18260 1 1160 . 1 1 101 101 ASP HA H 1 4.563 0.020 . 1 . . . . 101 Asp HA . 18260 1 1161 . 1 1 101 101 ASP HB2 H 1 2.976 0.020 . 2 . . . . 101 Asp HB2 . 18260 1 1162 . 1 1 101 101 ASP HB3 H 1 2.615 0.020 . 2 . . . . 101 Asp HB3 . 18260 1 1163 . 1 1 101 101 ASP C C 13 176.316 0.300 . 1 . . . . 101 Asp C . 18260 1 1164 . 1 1 101 101 ASP CA C 13 57.457 0.300 . 1 . . . . 101 Asp CA . 18260 1 1165 . 1 1 101 101 ASP CB C 13 39.869 0.300 . 1 . . . . 101 Asp CB . 18260 1 1166 . 1 1 101 101 ASP N N 15 121.731 0.100 . 1 . . . . 101 Asp N . 18260 1 1167 . 1 1 102 102 LEU H H 1 8.289 0.020 . 1 . . . . 102 Leu H . 18260 1 1168 . 1 1 102 102 LEU HA H 1 4.513 0.020 . 1 . . . . 102 Leu HA . 18260 1 1169 . 1 1 102 102 LEU HB2 H 1 2.322 0.020 . 2 . . . . 102 Leu HB2 . 18260 1 1170 . 1 1 102 102 LEU HB3 H 1 1.523 0.020 . 2 . . . . 102 Leu HB3 . 18260 1 1171 . 1 1 102 102 LEU HG H 1 1.392 0.020 . 1 . . . . 102 Leu HG . 18260 1 1172 . 1 1 102 102 LEU HD11 H 1 0.709 0.020 . 2 . . . . 102 Leu HD11 . 18260 1 1173 . 1 1 102 102 LEU HD12 H 1 0.709 0.020 . 2 . . . . 102 Leu HD12 . 18260 1 1174 . 1 1 102 102 LEU HD13 H 1 0.709 0.020 . 2 . . . . 102 Leu HD13 . 18260 1 1175 . 1 1 102 102 LEU HD21 H 1 0.709 0.020 . 2 . . . . 102 Leu HD21 . 18260 1 1176 . 1 1 102 102 LEU HD22 H 1 0.709 0.020 . 2 . . . . 102 Leu HD22 . 18260 1 1177 . 1 1 102 102 LEU HD23 H 1 0.709 0.020 . 2 . . . . 102 Leu HD23 . 18260 1 1178 . 1 1 102 102 LEU C C 13 177.905 0.300 . 1 . . . . 102 Leu C . 18260 1 1179 . 1 1 102 102 LEU CA C 13 57.828 0.300 . 1 . . . . 102 Leu CA . 18260 1 1180 . 1 1 102 102 LEU CB C 13 40.170 0.300 . 1 . . . . 102 Leu CB . 18260 1 1181 . 1 1 102 102 LEU CG C 13 27.436 0.300 . 1 . . . . 102 Leu CG . 18260 1 1182 . 1 1 102 102 LEU CD1 C 13 22.764 0.300 . 2 . . . . 102 Leu CD1 . 18260 1 1183 . 1 1 102 102 LEU CD2 C 13 22.764 0.300 . 2 . . . . 102 Leu CD2 . 18260 1 1184 . 1 1 102 102 LEU N N 15 123.769 0.100 . 1 . . . . 102 Leu N . 18260 1 1185 . 1 1 103 103 GLU H H 1 9.157 0.020 . 1 . . . . 103 Glu H . 18260 1 1186 . 1 1 103 103 GLU HA H 1 4.410 0.020 . 1 . . . . 103 Glu HA . 18260 1 1187 . 1 1 103 103 GLU HB2 H 1 2.297 0.020 . 1 . . . . 103 Glu HB2 . 18260 1 1188 . 1 1 103 103 GLU HB3 H 1 2.297 0.020 . 1 . . . . 103 Glu HB3 . 18260 1 1189 . 1 1 103 103 GLU HG2 H 1 2.691 0.020 . 1 . . . . 103 Glu HG2 . 18260 1 1190 . 1 1 103 103 GLU HG3 H 1 2.691 0.020 . 1 . . . . 103 Glu HG3 . 18260 1 1191 . 1 1 103 103 GLU C C 13 180.307 0.300 . 1 . . . . 103 Glu C . 18260 1 1192 . 1 1 103 103 GLU CA C 13 60.627 0.300 . 1 . . . . 103 Glu CA . 18260 1 1193 . 1 1 103 103 GLU CB C 13 29.847 0.300 . 1 . . . . 103 Glu CB . 18260 1 1194 . 1 1 103 103 GLU CG C 13 37.081 0.300 . 1 . . . . 103 Glu CG . 18260 1 1195 . 1 1 103 103 GLU N N 15 120.969 0.100 . 1 . . . . 103 Glu N . 18260 1 1196 . 1 1 104 104 LYS H H 1 8.222 0.020 . 1 . . . . 104 Lys H . 18260 1 1197 . 1 1 104 104 LYS HA H 1 4.268 0.020 . 1 . . . . 104 Lys HA . 18260 1 1198 . 1 1 104 104 LYS HB2 H 1 2.051 0.020 . 1 . . . . 104 Lys HB2 . 18260 1 1199 . 1 1 104 104 LYS HB3 H 1 2.051 0.020 . 1 . . . . 104 Lys HB3 . 18260 1 1200 . 1 1 104 104 LYS HG2 H 1 1.521 0.020 . 1 . . . . 104 Lys HG2 . 18260 1 1201 . 1 1 104 104 LYS HG3 H 1 1.521 0.020 . 1 . . . . 104 Lys HG3 . 18260 1 1202 . 1 1 104 104 LYS HD2 H 1 1.766 0.020 . 1 . . . . 104 Lys HD2 . 18260 1 1203 . 1 1 104 104 LYS HD3 H 1 1.766 0.020 . 1 . . . . 104 Lys HD3 . 18260 1 1204 . 1 1 104 104 LYS C C 13 179.256 0.300 . 1 . . . . 104 Lys C . 18260 1 1205 . 1 1 104 104 LYS CA C 13 59.723 0.300 . 1 . . . . 104 Lys CA . 18260 1 1206 . 1 1 104 104 LYS CB C 13 32.333 0.300 . 1 . . . . 104 Lys CB . 18260 1 1207 . 1 1 104 104 LYS CG C 13 24.798 0.300 . 1 . . . . 104 Lys CG . 18260 1 1208 . 1 1 104 104 LYS CD C 13 29.771 0.300 . 1 . . . . 104 Lys CD . 18260 1 1209 . 1 1 104 104 LYS CE C 13 41.978 0.300 . 1 . . . . 104 Lys CE . 18260 1 1210 . 1 1 104 104 LYS N N 15 119.694 0.100 . 1 . . . . 104 Lys N . 18260 1 1211 . 1 1 105 105 ALA H H 1 8.134 0.020 . 1 . . . . 105 Ala H . 18260 1 1212 . 1 1 105 105 ALA HA H 1 4.294 0.020 . 1 . . . . 105 Ala HA . 18260 1 1213 . 1 1 105 105 ALA HB1 H 1 1.536 0.020 . 1 . . . . 105 Ala HB1 . 18260 1 1214 . 1 1 105 105 ALA HB2 H 1 1.536 0.020 . 1 . . . . 105 Ala HB2 . 18260 1 1215 . 1 1 105 105 ALA HB3 H 1 1.536 0.020 . 1 . . . . 105 Ala HB3 . 18260 1 1216 . 1 1 105 105 ALA C C 13 181.015 0.300 . 1 . . . . 105 Ala C . 18260 1 1217 . 1 1 105 105 ALA CA C 13 54.886 0.300 . 1 . . . . 105 Ala CA . 18260 1 1218 . 1 1 105 105 ALA CB C 13 18.318 0.300 . 1 . . . . 105 Ala CB . 18260 1 1219 . 1 1 105 105 ALA N N 15 122.614 0.100 . 1 . . . . 105 Ala N . 18260 1 1220 . 1 1 106 106 ALA H H 1 9.434 0.020 . 1 . . . . 106 Ala H . 18260 1 1221 . 1 1 106 106 ALA HA H 1 4.101 0.020 . 1 . . . . 106 Ala HA . 18260 1 1222 . 1 1 106 106 ALA HB1 H 1 1.961 0.020 . 1 . . . . 106 Ala HB1 . 18260 1 1223 . 1 1 106 106 ALA HB2 H 1 1.961 0.020 . 1 . . . . 106 Ala HB2 . 18260 1 1224 . 1 1 106 106 ALA HB3 H 1 1.961 0.020 . 1 . . . . 106 Ala HB3 . 18260 1 1225 . 1 1 106 106 ALA C C 13 178.699 0.300 . 1 . . . . 106 Ala C . 18260 1 1226 . 1 1 106 106 ALA CA C 13 55.589 0.300 . 1 . . . . 106 Ala CA . 18260 1 1227 . 1 1 106 106 ALA CB C 13 18.845 0.300 . 1 . . . . 106 Ala CB . 18260 1 1228 . 1 1 106 106 ALA N N 15 122.165 0.100 . 1 . . . . 106 Ala N . 18260 1 1229 . 1 1 107 107 ALA H H 1 8.108 0.020 . 1 . . . . 107 Ala H . 18260 1 1230 . 1 1 107 107 ALA HA H 1 4.346 0.020 . 1 . . . . 107 Ala HA . 18260 1 1231 . 1 1 107 107 ALA HB1 H 1 1.716 0.020 . 1 . . . . 107 Ala HB1 . 18260 1 1232 . 1 1 107 107 ALA HB2 H 1 1.716 0.020 . 1 . . . . 107 Ala HB2 . 18260 1 1233 . 1 1 107 107 ALA HB3 H 1 1.716 0.020 . 1 . . . . 107 Ala HB3 . 18260 1 1234 . 1 1 107 107 ALA C C 13 181.311 0.300 . 1 . . . . 107 Ala C . 18260 1 1235 . 1 1 107 107 ALA CA C 13 54.788 0.300 . 1 . . . . 107 Ala CA . 18260 1 1236 . 1 1 107 107 ALA CB C 13 17.710 0.300 . 1 . . . . 107 Ala CB . 18260 1 1237 . 1 1 107 107 ALA N N 15 119.978 0.100 . 1 . . . . 107 Ala N . 18260 1 1238 . 1 1 108 108 GLN H H 1 7.858 0.020 . 1 . . . . 108 Gln H . 18260 1 1239 . 1 1 108 108 GLN HA H 1 4.136 0.020 . 1 . . . . 108 Gln HA . 18260 1 1240 . 1 1 108 108 GLN HB2 H 1 2.180 0.020 . 1 . . . . 108 Gln HB2 . 18260 1 1241 . 1 1 108 108 GLN HB3 H 1 2.180 0.020 . 1 . . . . 108 Gln HB3 . 18260 1 1242 . 1 1 108 108 GLN HG2 H 1 2.501 0.020 . 1 . . . . 108 Gln HG2 . 18260 1 1243 . 1 1 108 108 GLN HG3 H 1 2.501 0.020 . 1 . . . . 108 Gln HG3 . 18260 1 1244 . 1 1 108 108 GLN HE21 H 1 6.915 0.020 . 2 . . . . 108 Gln HE21 . 18260 1 1245 . 1 1 108 108 GLN HE22 H 1 7.470 0.020 . 2 . . . . 108 Gln HE22 . 18260 1 1246 . 1 1 108 108 GLN C C 13 177.798 0.300 . 1 . . . . 108 Gln C . 18260 1 1247 . 1 1 108 108 GLN CA C 13 58.646 0.300 . 1 . . . . 108 Gln CA . 18260 1 1248 . 1 1 108 108 GLN CB C 13 28.264 0.300 . 1 . . . . 108 Gln CB . 18260 1 1249 . 1 1 108 108 GLN CG C 13 33.690 0.300 . 1 . . . . 108 Gln CG . 18260 1 1250 . 1 1 108 108 GLN CD C 13 180.056 0.300 . 1 . . . . 108 Gln CD . 18260 1 1251 . 1 1 108 108 GLN N N 15 118.927 0.100 . 1 . . . . 108 Gln N . 18260 1 1252 . 1 1 108 108 GLN NE2 N 15 111.388 0.100 . 1 . . . . 108 Gln NE2 . 18260 1 1253 . 1 1 109 109 ARG H H 1 7.813 0.020 . 1 . . . . 109 Arg H . 18260 1 1254 . 1 1 109 109 ARG HA H 1 4.268 0.020 . 1 . . . . 109 Arg HA . 18260 1 1255 . 1 1 109 109 ARG HB2 H 1 2.283 0.020 . 2 . . . . 109 Arg HB2 . 18260 1 1256 . 1 1 109 109 ARG HB3 H 1 2.025 0.020 . 2 . . . . 109 Arg HB3 . 18260 1 1257 . 1 1 109 109 ARG HG2 H 1 1.663 0.020 . 2 . . . . 109 Arg HG2 . 18260 1 1258 . 1 1 109 109 ARG HG3 H 1 1.456 0.020 . 2 . . . . 109 Arg HG3 . 18260 1 1259 . 1 1 109 109 ARG HD2 H 1 3.449 0.020 . 1 . . . . 109 Arg HD2 . 18260 1 1260 . 1 1 109 109 ARG HD3 H 1 3.449 0.020 . 1 . . . . 109 Arg HD3 . 18260 1 1261 . 1 1 109 109 ARG HE H 1 7.783 0.020 . 1 . . . . 109 Arg HE . 18260 1 1262 . 1 1 109 109 ARG C C 13 177.347 0.300 . 1 . . . . 109 Arg C . 18260 1 1263 . 1 1 109 109 ARG CA C 13 58.732 0.300 . 1 . . . . 109 Arg CA . 18260 1 1264 . 1 1 109 109 ARG CB C 13 29.093 0.300 . 1 . . . . 109 Arg CB . 18260 1 1265 . 1 1 109 109 ARG CG C 13 27.134 0.300 . 1 . . . . 109 Arg CG . 18260 1 1266 . 1 1 109 109 ARG CD C 13 43.033 0.300 . 1 . . . . 109 Arg CD . 18260 1 1267 . 1 1 109 109 ARG CZ C 13 159.256 0.300 . 1 . . . . 109 Arg CZ . 18260 1 1268 . 1 1 109 109 ARG N N 15 120.668 0.100 . 1 . . . . 109 Arg N . 18260 1 1269 . 1 1 109 109 ARG NE N 15 85.466 00.100 . 1 . . . . 109 Arg NE . 18260 1 1270 . 1 1 110 110 LYS H H 1 8.292 0.020 . 1 . . . . 110 Lys H . 18260 1 1271 . 1 1 110 110 LYS HA H 1 3.495 0.020 . 1 . . . . 110 Lys HA . 18260 1 1272 . 1 1 110 110 LYS HB2 H 1 1.957 0.020 . 1 . . . . 110 Lys HB2 . 18260 1 1273 . 1 1 110 110 LYS HB3 H 1 1.957 0.020 . 1 . . . . 110 Lys HB3 . 18260 1 1274 . 1 1 110 110 LYS HG2 H 1 1.562 0.020 . 1 . . . . 110 Lys HG2 . 18260 1 1275 . 1 1 110 110 LYS HG3 H 1 1.562 0.020 . 1 . . . . 110 Lys HG3 . 18260 1 1276 . 1 1 110 110 LYS HD2 H 1 1.622 0.020 . 1 . . . . 110 Lys HD2 . 18260 1 1277 . 1 1 110 110 LYS HD3 H 1 1.622 0.020 . 1 . . . . 110 Lys HD3 . 18260 1 1278 . 1 1 110 110 LYS HE2 H 1 3.115 0.020 . 1 . . . . 110 Lys HE2 . 18260 1 1279 . 1 1 110 110 LYS HE3 H 1 3.115 0.020 . 1 . . . . 110 Lys HE3 . 18260 1 1280 . 1 1 110 110 LYS C C 13 177.412 0.300 . 1 . . . . 110 Lys C . 18260 1 1281 . 1 1 110 110 LYS CA C 13 58.857 0.300 . 1 . . . . 110 Lys CA . 18260 1 1282 . 1 1 110 110 LYS CB C 13 31.957 0.300 . 1 . . . . 110 Lys CB . 18260 1 1283 . 1 1 110 110 LYS CG C 13 24.421 0.300 . 1 . . . . 110 Lys CG . 18260 1 1284 . 1 1 110 110 LYS CD C 13 29.421 0.300 . 1 . . . . 110 Lys CD . 18260 1 1285 . 1 1 110 110 LYS CE C 13 42.204 0.300 . 1 . . . . 110 Lys CE . 18260 1 1286 . 1 1 110 110 LYS N N 15 118.871 0.100 . 1 . . . . 110 Lys N . 18260 1 1287 . 1 1 111 111 ALA H H 1 7.792 0.020 . 1 . . . . 111 Ala H . 18260 1 1288 . 1 1 111 111 ALA HA H 1 4.230 0.020 . 1 . . . . 111 Ala HA . 18260 1 1289 . 1 1 111 111 ALA HB1 H 1 1.523 0.020 . 1 . . . . 111 Ala HB1 . 18260 1 1290 . 1 1 111 111 ALA HB2 H 1 1.523 0.020 . 1 . . . . 111 Ala HB2 . 18260 1 1291 . 1 1 111 111 ALA HB3 H 1 1.523 0.020 . 1 . . . . 111 Ala HB3 . 18260 1 1292 . 1 1 111 111 ALA C C 13 180.608 0.300 . 1 . . . . 111 Ala C . 18260 1 1293 . 1 1 111 111 ALA CA C 13 54.900 0.300 . 1 . . . . 111 Ala CA . 18260 1 1294 . 1 1 111 111 ALA CB C 13 17.489 0.300 . 1 . . . . 111 Ala CB . 18260 1 1295 . 1 1 111 111 ALA N N 15 118.486 0.100 . 1 . . . . 111 Ala N . 18260 1 1296 . 1 1 112 112 LYS H H 1 7.583 0.020 . 1 . . . . 112 Lys H . 18260 1 1297 . 1 1 112 112 LYS HA H 1 3.969 0.020 . 1 . . . . 112 Lys HA . 18260 1 1298 . 1 1 112 112 LYS HB2 H 1 1.751 0.020 . 1 . . . . 112 Lys HB2 . 18260 1 1299 . 1 1 112 112 LYS HB3 H 1 1.751 0.020 . 1 . . . . 112 Lys HB3 . 18260 1 1300 . 1 1 112 112 LYS HG2 H 1 1.209 0.020 . 1 . . . . 112 Lys HG2 . 18260 1 1301 . 1 1 112 112 LYS HG3 H 1 1.209 0.020 . 1 . . . . 112 Lys HG3 . 18260 1 1302 . 1 1 112 112 LYS HD2 H 1 1.454 0.020 . 1 . . . . 112 Lys HD2 . 18260 1 1303 . 1 1 112 112 LYS HD3 H 1 1.454 0.020 . 1 . . . . 112 Lys HD3 . 18260 1 1304 . 1 1 112 112 LYS C C 13 179.471 0.300 . 1 . . . . 112 Lys C . 18260 1 1305 . 1 1 112 112 LYS CA C 13 58.000 0.300 . 1 . . . . 112 Lys CA . 18260 1 1306 . 1 1 112 112 LYS CB C 13 31.278 0.300 . 1 . . . . 112 Lys CB . 18260 1 1307 . 1 1 112 112 LYS CG C 13 24.195 0.300 . 1 . . . . 112 Lys CG . 18260 1 1308 . 1 1 112 112 LYS CD C 13 27.812 0.300 . 1 . . . . 112 Lys CD . 18260 1 1309 . 1 1 112 112 LYS CE C 13 41.828 0.300 . 1 . . . . 112 Lys CE . 18260 1 1310 . 1 1 112 112 LYS N N 15 117.818 0.100 . 1 . . . . 112 Lys N . 18260 1 1311 . 1 1 113 113 LEU H H 1 8.152 0.020 . 1 . . . . 113 Leu H . 18260 1 1312 . 1 1 113 113 LEU HA H 1 4.204 0.020 . 1 . . . . 113 Leu HA . 18260 1 1313 . 1 1 113 113 LEU HB2 H 1 1.368 0.020 . 2 . . . . 113 Leu HB2 . 18260 1 1314 . 1 1 113 113 LEU HB3 H 1 2.051 0.020 . 2 . . . . 113 Leu HB3 . 18260 1 1315 . 1 1 113 113 LEU HD11 H 1 1.018 0.020 . 2 . . . . 113 Leu HD11 . 18260 1 1316 . 1 1 113 113 LEU HD12 H 1 1.018 0.020 . 2 . . . . 113 Leu HD12 . 18260 1 1317 . 1 1 113 113 LEU HD13 H 1 1.018 0.020 . 2 . . . . 113 Leu HD13 . 18260 1 1318 . 1 1 113 113 LEU HD21 H 1 1.018 0.020 . 2 . . . . 113 Leu HD21 . 18260 1 1319 . 1 1 113 113 LEU HD22 H 1 1.018 0.020 . 2 . . . . 113 Leu HD22 . 18260 1 1320 . 1 1 113 113 LEU HD23 H 1 1.018 0.020 . 2 . . . . 113 Leu HD23 . 18260 1 1321 . 1 1 113 113 LEU C C 13 178.849 0.300 . 1 . . . . 113 Leu C . 18260 1 1322 . 1 1 113 113 LEU CA C 13 57.656 0.300 . 1 . . . . 113 Leu CA . 18260 1 1323 . 1 1 113 113 LEU CB C 13 41.752 0.300 . 1 . . . . 113 Leu CB . 18260 1 1324 . 1 1 113 113 LEU CG C 13 26.079 0.300 . 1 . . . . 113 Leu CG . 18260 1 1325 . 1 1 113 113 LEU CD1 C 13 23.743 0.300 . 2 . . . . 113 Leu CD1 . 18260 1 1326 . 1 1 113 113 LEU CD2 C 13 22.387 0.300 . 2 . . . . 113 Leu CD2 . 18260 1 1327 . 1 1 113 113 LEU N N 15 120.385 0.100 . 1 . . . . 113 Leu N . 18260 1 1328 . 1 1 114 114 ASP H H 1 8.413 0.020 . 1 . . . . 114 Asp H . 18260 1 1329 . 1 1 114 114 ASP HA H 1 4.410 0.020 . 1 . . . . 114 Asp HA . 18260 1 1330 . 1 1 114 114 ASP HB2 H 1 2.722 0.020 . 1 . . . . 114 Asp HB2 . 18260 1 1331 . 1 1 114 114 ASP HB3 H 1 2.722 0.020 . 1 . . . . 114 Asp HB3 . 18260 1 1332 . 1 1 114 114 ASP C C 13 178.956 0.300 . 1 . . . . 114 Asp C . 18260 1 1333 . 1 1 114 114 ASP CA C 13 56.373 0.300 . 1 . . . . 114 Asp CA . 18260 1 1334 . 1 1 114 114 ASP CB C 13 40.321 0.300 . 1 . . . . 114 Asp CB . 18260 1 1335 . 1 1 114 114 ASP N N 15 118.664 0.100 . 1 . . . . 114 Asp N . 18260 1 1336 . 1 1 115 115 GLU H H 1 7.925 0.020 . 1 . . . . 115 Glu H . 18260 1 1337 . 1 1 115 115 GLU HA H 1 4.124 0.020 . 1 . . . . 115 Glu HA . 18260 1 1338 . 1 1 115 115 GLU HB2 H 1 2.129 0.020 . 1 . . . . 115 Glu HB2 . 18260 1 1339 . 1 1 115 115 GLU HB3 H 1 2.129 0.020 . 1 . . . . 115 Glu HB3 . 18260 1 1340 . 1 1 115 115 GLU HG2 H 1 2.461 0.020 . 1 . . . . 115 Glu HG2 . 18260 1 1341 . 1 1 115 115 GLU HG3 H 1 2.461 0.020 . 1 . . . . 115 Glu HG3 . 18260 1 1342 . 1 1 115 115 GLU C C 13 177.456 0.300 . 1 . . . . 115 Glu C . 18260 1 1343 . 1 1 115 115 GLU CA C 13 58.346 0.300 . 1 . . . . 115 Glu CA . 18260 1 1344 . 1 1 115 115 GLU CB C 13 29.696 0.300 . 1 . . . . 115 Glu CB . 18260 1 1345 . 1 1 115 115 GLU CG C 13 36.101 0.300 . 1 . . . . 115 Glu CG . 18260 1 1346 . 1 1 115 115 GLU N N 15 119.989 0.100 . 1 . . . . 115 Glu N . 18260 1 1347 . 1 1 116 116 ASN H H 1 7.853 0.020 . 1 . . . . 116 Asn H . 18260 1 1348 . 1 1 116 116 ASN HA H 1 4.834 0.020 . 1 . . . . 116 Asn HA . 18260 1 1349 . 1 1 116 116 ASN HB2 H 1 2.941 0.020 . 2 . . . . 116 Asn HB2 . 18260 1 1350 . 1 1 116 116 ASN HB3 H 1 2.806 0.020 . 2 . . . . 116 Asn HB3 . 18260 1 1351 . 1 1 116 116 ASN HD21 H 1 7.368 0.020 . 2 . . . . 116 Asn HD21 . 18260 1 1352 . 1 1 116 116 ASN HD22 H 1 6.952 0.020 . 2 . . . . 116 Asn HD22 . 18260 1 1353 . 1 1 116 116 ASN C C 13 174.794 0.300 . 1 . . . . 116 Asn C . 18260 1 1354 . 1 1 116 116 ASN CA C 13 53.714 0.300 . 1 . . . . 116 Asn CA . 18260 1 1355 . 1 1 116 116 ASN CB C 13 39.040 0.300 . 1 . . . . 116 Asn CB . 18260 1 1356 . 1 1 116 116 ASN CG C 13 176.811 0.300 . 1 . . . . 116 Asn CG . 18260 1 1357 . 1 1 116 116 ASN N N 15 116.559 0.100 . 1 . . . . 116 Asn N . 18260 1 1358 . 1 1 116 116 ASN ND2 N 15 112.365 0.100 . 1 . . . . 116 Asn ND2 . 18260 1 1359 . 1 1 117 117 SER H H 1 7.778 0.020 . 1 . . . . 117 Ser H . 18260 1 1360 . 1 1 117 117 SER HA H 1 4.473 0.020 . 1 . . . . 117 Ser HA . 18260 1 1361 . 1 1 117 117 SER HB2 H 1 4.020 0.020 . 1 . . . . 117 Ser HB2 . 18260 1 1362 . 1 1 117 117 SER HB3 H 1 4.020 0.020 . 1 . . . . 117 Ser HB3 . 18260 1 1363 . 1 1 117 117 SER C C 13 172.928 0.300 . 1 . . . . 117 Ser C . 18260 1 1364 . 1 1 117 117 SER CA C 13 58.405 0.300 . 1 . . . . 117 Ser CA . 18260 1 1365 . 1 1 117 117 SER CB C 13 64.057 0.300 . 1 . . . . 117 Ser CB . 18260 1 1366 . 1 1 117 117 SER N N 15 114.523 0.100 . 1 . . . . 117 Ser N . 18260 1 1367 . 1 1 118 118 ALA H H 1 7.610 0.020 . 1 . . . . 118 Ala H . 18260 1 1368 . 1 1 118 118 ALA HA H 1 4.150 0.020 . 1 . . . . 118 Ala HA . 18260 1 1369 . 1 1 118 118 ALA HB1 H 1 1.372 0.020 . 1 . . . . 118 Ala HB1 . 18260 1 1370 . 1 1 118 118 ALA HB2 H 1 1.372 0.020 . 1 . . . . 118 Ala HB2 . 18260 1 1371 . 1 1 118 118 ALA HB3 H 1 1.372 0.020 . 1 . . . . 118 Ala HB3 . 18260 1 1372 . 1 1 118 118 ALA C C 13 182.431 0.300 . 1 . . . . 118 Ala C . 18260 1 1373 . 1 1 118 118 ALA CA C 13 53.799 0.300 . 1 . . . . 118 Ala CA . 18260 1 1374 . 1 1 118 118 ALA CB C 13 20.051 0.300 . 1 . . . . 118 Ala CB . 18260 1 1375 . 1 1 118 118 ALA N N 15 130.609 0.100 . 1 . . . . 118 Ala N . 18260 1 stop_ save_