################################### # 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 27017 _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 . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 27017 1 2 '3D HNCACB' . . . 27017 1 3 '3D CBCA(CO)NH' . . . 27017 1 4 '3D HNCO' . . . 27017 1 5 '3D C(CO)NH' . . . 27017 1 6 '3D HBHA(CO)NH' . . . 27017 1 7 '3D 1H-15N NOESY' . . . 27017 1 8 '2D 1H-13C HMQC' . . . 27017 1 9 '3D 1H-13C NOESY' . . . 27017 1 10 '3D HCACO' . . . 27017 1 11 '3D HCCH-TOCSY' . . . 27017 1 12 '2D 1H-13C CT-HSQC aromatic' . . . 27017 1 13 '2D (HB)CB(CGCD)HD' . . . 27017 1 14 '2D (HB)CB(CGCDCE)HE' . . . 27017 1 15 '2D 1H-1H gCOSY' . . . 27017 1 16 '2D 1H-1H TOCSY' . . . 27017 1 17 '2D 1H-1H NOESY' . . . 27017 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $Analysis . . 27017 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 ALA HA H 1 4.107 0.002 . 1 . . . . 1 ALA HA . 27017 1 2 . 1 1 1 1 ALA HB1 H 1 1.528 0.001 . 1 . . . . 1 ALA HB1 . 27017 1 3 . 1 1 1 1 ALA HB2 H 1 1.528 0.001 . 1 . . . . 1 ALA HB2 . 27017 1 4 . 1 1 1 1 ALA HB3 H 1 1.528 0.001 . 1 . . . . 1 ALA HB3 . 27017 1 5 . 1 1 1 1 ALA C C 13 173.607 0.000 . 1 . . . . 1 ALA C . 27017 1 6 . 1 1 1 1 ALA CA C 13 51.711 0.125 . 1 . . . . 1 ALA CA . 27017 1 7 . 1 1 1 1 ALA CB C 13 19.138 0.112 . 1 . . . . 1 ALA CB . 27017 1 8 . 1 1 2 2 GLU HA H 1 4.337 0.004 . 1 . . . . 2 GLU HA . 27017 1 9 . 1 1 2 2 GLU HB2 H 1 1.906 0.002 . 2 . . . . 2 GLU HB2 . 27017 1 10 . 1 1 2 2 GLU HB3 H 1 2.061 0.002 . 2 . . . . 2 GLU HB3 . 27017 1 11 . 1 1 2 2 GLU HG2 H 1 2.286 0.001 . 1 . . . . 2 GLU HG2 . 27017 1 12 . 1 1 2 2 GLU HG3 H 1 2.286 0.001 . 1 . . . . 2 GLU HG3 . 27017 1 13 . 1 1 2 2 GLU C C 13 176.029 0.023 . 1 . . . . 2 GLU C . 27017 1 14 . 1 1 2 2 GLU CA C 13 56.411 0.087 . 1 . . . . 2 GLU CA . 27017 1 15 . 1 1 2 2 GLU CB C 13 30.256 0.087 . 1 . . . . 2 GLU CB . 27017 1 16 . 1 1 2 2 GLU CG C 13 36.187 0.030 . 1 . . . . 2 GLU CG . 27017 1 17 . 1 1 3 3 GLN H H 1 8.505 0.006 . 1 . . . . 3 GLN H . 27017 1 18 . 1 1 3 3 GLN HA H 1 4.385 0.002 . 1 . . . . 3 GLN HA . 27017 1 19 . 1 1 3 3 GLN HB2 H 1 1.989 0.003 . 2 . . . . 3 GLN HB2 . 27017 1 20 . 1 1 3 3 GLN HB3 H 1 2.093 0.004 . 2 . . . . 3 GLN HB3 . 27017 1 21 . 1 1 3 3 GLN HG2 H 1 2.368 0.001 . 1 . . . . 3 GLN HG2 . 27017 1 22 . 1 1 3 3 GLN HG3 H 1 2.368 0.001 . 1 . . . . 3 GLN HG3 . 27017 1 23 . 1 1 3 3 GLN HE21 H 1 7.550 0.002 . 1 . . . . 3 GLN HE21 . 27017 1 24 . 1 1 3 3 GLN HE22 H 1 6.848 0.002 . 1 . . . . 3 GLN HE22 . 27017 1 25 . 1 1 3 3 GLN C C 13 175.557 0.017 . 1 . . . . 3 GLN C . 27017 1 26 . 1 1 3 3 GLN CA C 13 55.455 0.054 . 1 . . . . 3 GLN CA . 27017 1 27 . 1 1 3 3 GLN CB C 13 29.660 0.079 . 1 . . . . 3 GLN CB . 27017 1 28 . 1 1 3 3 GLN CG C 13 33.686 0.058 . 1 . . . . 3 GLN CG . 27017 1 29 . 1 1 3 3 GLN CD C 13 180.590 0.015 . 1 . . . . 3 GLN CD . 27017 1 30 . 1 1 3 3 GLN N N 15 121.695 0.026 . 1 . . . . 3 GLN N . 27017 1 31 . 1 1 3 3 GLN NE2 N 15 112.640 0.062 . 1 . . . . 3 GLN NE2 . 27017 1 32 . 1 1 4 4 LEU H H 1 8.298 0.006 . 1 . . . . 4 LEU H . 27017 1 33 . 1 1 4 4 LEU HA H 1 4.713 0.006 . 1 . . . . 4 LEU HA . 27017 1 34 . 1 1 4 4 LEU HB2 H 1 1.549 0.010 . 2 . . . . 4 LEU HB2 . 27017 1 35 . 1 1 4 4 LEU HB3 H 1 1.716 0.007 . 2 . . . . 4 LEU HB3 . 27017 1 36 . 1 1 4 4 LEU HD11 H 1 0.923 0.002 . 2 . . . . 4 LEU HD11 . 27017 1 37 . 1 1 4 4 LEU HD12 H 1 0.923 0.002 . 2 . . . . 4 LEU HD12 . 27017 1 38 . 1 1 4 4 LEU HD13 H 1 0.923 0.002 . 2 . . . . 4 LEU HD13 . 27017 1 39 . 1 1 4 4 LEU HD21 H 1 0.876 0.003 . 2 . . . . 4 LEU HD21 . 27017 1 40 . 1 1 4 4 LEU HD22 H 1 0.876 0.003 . 2 . . . . 4 LEU HD22 . 27017 1 41 . 1 1 4 4 LEU HD23 H 1 0.876 0.003 . 2 . . . . 4 LEU HD23 . 27017 1 42 . 1 1 4 4 LEU C C 13 177.746 0.013 . 1 . . . . 4 LEU C . 27017 1 43 . 1 1 4 4 LEU CA C 13 54.357 0.068 . 1 . . . . 4 LEU CA . 27017 1 44 . 1 1 4 4 LEU CB C 13 43.769 0.034 . 1 . . . . 4 LEU CB . 27017 1 45 . 1 1 4 4 LEU CD1 C 13 23.478 0.023 . 2 . . . . 4 LEU CD1 . 27017 1 46 . 1 1 4 4 LEU CD2 C 13 26.756 0.051 . 2 . . . . 4 LEU CD2 . 27017 1 47 . 1 1 4 4 LEU N N 15 124.086 0.031 . 1 . . . . 4 LEU N . 27017 1 48 . 1 1 5 5 THR H H 1 8.834 0.004 . 1 . . . . 5 THR H . 27017 1 49 . 1 1 5 5 THR HA H 1 4.484 0.004 . 1 . . . . 5 THR HA . 27017 1 50 . 1 1 5 5 THR HB H 1 4.821 0.004 . 1 . . . . 5 THR HB . 27017 1 51 . 1 1 5 5 THR HG21 H 1 1.370 0.004 . 1 . . . . 5 THR HG21 . 27017 1 52 . 1 1 5 5 THR HG22 H 1 1.370 0.004 . 1 . . . . 5 THR HG22 . 27017 1 53 . 1 1 5 5 THR HG23 H 1 1.370 0.004 . 1 . . . . 5 THR HG23 . 27017 1 54 . 1 1 5 5 THR C C 13 175.304 0.049 . 1 . . . . 5 THR C . 27017 1 55 . 1 1 5 5 THR CA C 13 60.533 0.069 . 1 . . . . 5 THR CA . 27017 1 56 . 1 1 5 5 THR CB C 13 71.239 0.057 . 1 . . . . 5 THR CB . 27017 1 57 . 1 1 5 5 THR CG2 C 13 21.652 0.050 . 1 . . . . 5 THR CG2 . 27017 1 58 . 1 1 5 5 THR N N 15 113.234 0.043 . 1 . . . . 5 THR N . 27017 1 59 . 1 1 6 6 GLU H H 1 9.032 0.002 . 1 . . . . 6 GLU H . 27017 1 60 . 1 1 6 6 GLU HA H 1 4.011 0.003 . 1 . . . . 6 GLU HA . 27017 1 61 . 1 1 6 6 GLU HB2 H 1 2.081 0.005 . 2 . . . . 6 GLU HB2 . 27017 1 62 . 1 1 6 6 GLU HB3 H 1 2.082 0.003 . 2 . . . . 6 GLU HB3 . 27017 1 63 . 1 1 6 6 GLU HG2 H 1 2.434 0.004 . 2 . . . . 6 GLU HG2 . 27017 1 64 . 1 1 6 6 GLU HG3 H 1 2.371 0.001 . 2 . . . . 6 GLU HG3 . 27017 1 65 . 1 1 6 6 GLU C C 13 179.516 0.056 . 1 . . . . 6 GLU C . 27017 1 66 . 1 1 6 6 GLU CA C 13 60.066 0.101 . 1 . . . . 6 GLU CA . 27017 1 67 . 1 1 6 6 GLU CB C 13 29.285 0.043 . 1 . . . . 6 GLU CB . 27017 1 68 . 1 1 6 6 GLU CG C 13 36.594 0.011 . 1 . . . . 6 GLU CG . 27017 1 69 . 1 1 6 6 GLU N N 15 120.408 0.038 . 1 . . . . 6 GLU N . 27017 1 70 . 1 1 7 7 GLU H H 1 8.689 0.002 . 1 . . . . 7 GLU H . 27017 1 71 . 1 1 7 7 GLU HA H 1 4.101 0.002 . 1 . . . . 7 GLU HA . 27017 1 72 . 1 1 7 7 GLU HB2 H 1 1.957 0.005 . 2 . . . . 7 GLU HB2 . 27017 1 73 . 1 1 7 7 GLU HB3 H 1 2.079 0.004 . 2 . . . . 7 GLU HB3 . 27017 1 74 . 1 1 7 7 GLU HG2 H 1 2.299 0.004 . 2 . . . . 7 GLU HG2 . 27017 1 75 . 1 1 7 7 GLU HG3 H 1 2.367 0.002 . 2 . . . . 7 GLU HG3 . 27017 1 76 . 1 1 7 7 GLU C C 13 178.628 0.053 . 1 . . . . 7 GLU C . 27017 1 77 . 1 1 7 7 GLU CA C 13 60.032 0.043 . 1 . . . . 7 GLU CA . 27017 1 78 . 1 1 7 7 GLU CB C 13 29.147 0.072 . 1 . . . . 7 GLU CB . 27017 1 79 . 1 1 7 7 GLU CG C 13 36.738 0.004 . 1 . . . . 7 GLU CG . 27017 1 80 . 1 1 7 7 GLU N N 15 120.030 0.014 . 1 . . . . 7 GLU N . 27017 1 81 . 1 1 8 8 GLN H H 1 7.789 0.003 . 1 . . . . 8 GLN H . 27017 1 82 . 1 1 8 8 GLN HA H 1 4.067 0.012 . 1 . . . . 8 GLN HA . 27017 1 83 . 1 1 8 8 GLN HB2 H 1 1.896 0.014 . 1 . . . . 8 GLN HB2 . 27017 1 84 . 1 1 8 8 GLN HG2 H 1 2.428 0.016 . 1 . . . . 8 GLN HG2 . 27017 1 85 . 1 1 8 8 GLN HE21 H 1 7.690 0.009 . 1 . . . . 8 GLN HE21 . 27017 1 86 . 1 1 8 8 GLN HE22 H 1 6.788 0.008 . 1 . . . . 8 GLN HE22 . 27017 1 87 . 1 1 8 8 GLN C C 13 179.556 0.011 . 1 . . . . 8 GLN C . 27017 1 88 . 1 1 8 8 GLN CA C 13 58.750 0.068 . 1 . . . . 8 GLN CA . 27017 1 89 . 1 1 8 8 GLN CB C 13 29.787 0.151 . 1 . . . . 8 GLN CB . 27017 1 90 . 1 1 8 8 GLN CG C 13 35.123 0.068 . 1 . . . . 8 GLN CG . 27017 1 91 . 1 1 8 8 GLN CD C 13 180.045 0.003 . 1 . . . . 8 GLN CD . 27017 1 92 . 1 1 8 8 GLN N N 15 119.054 0.080 . 1 . . . . 8 GLN N . 27017 1 93 . 1 1 8 8 GLN NE2 N 15 111.570 0.070 . 1 . . . . 8 GLN NE2 . 27017 1 94 . 1 1 9 9 ILE H H 1 8.509 0.003 . 1 . . . . 9 ILE H . 27017 1 95 . 1 1 9 9 ILE HA H 1 3.851 0.006 . 1 . . . . 9 ILE HA . 27017 1 96 . 1 1 9 9 ILE HB H 1 2.054 0.005 . 1 . . . . 9 ILE HB . 27017 1 97 . 1 1 9 9 ILE HG12 H 1 1.123 0.004 . 2 . . . . 9 ILE HG12 . 27017 1 98 . 1 1 9 9 ILE HG13 H 1 1.872 0.008 . 2 . . . . 9 ILE HG13 . 27017 1 99 . 1 1 9 9 ILE HG21 H 1 1.163 0.002 . 1 . . . . 9 ILE HG21 . 27017 1 100 . 1 1 9 9 ILE HG22 H 1 1.163 0.002 . 1 . . . . 9 ILE HG22 . 27017 1 101 . 1 1 9 9 ILE HG23 H 1 1.163 0.002 . 1 . . . . 9 ILE HG23 . 27017 1 102 . 1 1 9 9 ILE HD11 H 1 0.873 0.003 . 1 . . . . 9 ILE HD11 . 27017 1 103 . 1 1 9 9 ILE HD12 H 1 0.873 0.003 . 1 . . . . 9 ILE HD12 . 27017 1 104 . 1 1 9 9 ILE HD13 H 1 0.873 0.003 . 1 . . . . 9 ILE HD13 . 27017 1 105 . 1 1 9 9 ILE C C 13 178.040 0.013 . 1 . . . . 9 ILE C . 27017 1 106 . 1 1 9 9 ILE CA C 13 66.318 0.099 . 1 . . . . 9 ILE CA . 27017 1 107 . 1 1 9 9 ILE CB C 13 37.731 0.118 . 1 . . . . 9 ILE CB . 27017 1 108 . 1 1 9 9 ILE CG1 C 13 30.266 0.045 . 1 . . . . 9 ILE CG1 . 27017 1 109 . 1 1 9 9 ILE CG2 C 13 17.502 0.154 . 1 . . . . 9 ILE CG2 . 27017 1 110 . 1 1 9 9 ILE CD1 C 13 12.825 0.023 . 1 . . . . 9 ILE CD1 . 27017 1 111 . 1 1 9 9 ILE N N 15 120.238 0.052 . 1 . . . . 9 ILE N . 27017 1 112 . 1 1 10 10 ALA H H 1 8.044 0.003 . 1 . . . . 10 ALA H . 27017 1 113 . 1 1 10 10 ALA HA H 1 4.170 0.004 . 1 . . . . 10 ALA HA . 27017 1 114 . 1 1 10 10 ALA HB1 H 1 1.603 0.001 . 1 . . . . 10 ALA HB1 . 27017 1 115 . 1 1 10 10 ALA HB2 H 1 1.603 0.001 . 1 . . . . 10 ALA HB2 . 27017 1 116 . 1 1 10 10 ALA HB3 H 1 1.603 0.001 . 1 . . . . 10 ALA HB3 . 27017 1 117 . 1 1 10 10 ALA C C 13 181.209 0.000 . 1 . . . . 10 ALA C . 27017 1 118 . 1 1 10 10 ALA CA C 13 55.536 0.090 . 1 . . . . 10 ALA CA . 27017 1 119 . 1 1 10 10 ALA CB C 13 17.881 0.065 . 1 . . . . 10 ALA CB . 27017 1 120 . 1 1 10 10 ALA N N 15 121.962 0.027 . 1 . . . . 10 ALA N . 27017 1 121 . 1 1 11 11 GLU H H 1 7.955 0.003 . 1 . . . . 11 GLU H . 27017 1 122 . 1 1 11 11 GLU HA H 1 4.029 0.007 . 1 . . . . 11 GLU HA . 27017 1 123 . 1 1 11 11 GLU HB2 H 1 1.520 0.011 . 1 . . . . 11 GLU HB2 . 27017 1 124 . 1 1 11 11 GLU HG2 H 1 2.648 0.009 . 1 . . . . 11 GLU HG2 . 27017 1 125 . 1 1 11 11 GLU C C 13 180.034 0.041 . 1 . . . . 11 GLU C . 27017 1 126 . 1 1 11 11 GLU CA C 13 59.129 0.091 . 1 . . . . 11 GLU CA . 27017 1 127 . 1 1 11 11 GLU CB C 13 29.266 0.114 . 1 . . . . 11 GLU CB . 27017 1 128 . 1 1 11 11 GLU CG C 13 36.094 0.041 . 1 . . . . 11 GLU CG . 27017 1 129 . 1 1 11 11 GLU N N 15 118.344 0.042 . 1 . . . . 11 GLU N . 27017 1 130 . 1 1 12 12 PHE H H 1 8.499 0.003 . 1 . . . . 12 PHE H . 27017 1 131 . 1 1 12 12 PHE HA H 1 4.817 0.004 . 1 . . . . 12 PHE HA . 27017 1 132 . 1 1 12 12 PHE HB2 H 1 3.534 0.021 . 2 . . . . 12 PHE HB2 . 27017 1 133 . 1 1 12 12 PHE HB3 H 1 3.465 0.005 . 2 . . . . 12 PHE HB3 . 27017 1 134 . 1 1 12 12 PHE HD1 H 1 7.221 0.006 . 1 . . . . 12 PHE HD1 . 27017 1 135 . 1 1 12 12 PHE HD2 H 1 7.221 0.006 . 1 . . . . 12 PHE HD2 . 27017 1 136 . 1 1 12 12 PHE HE1 H 1 7.067 0.006 . 1 . . . . 12 PHE HE1 . 27017 1 137 . 1 1 12 12 PHE HE2 H 1 7.067 0.006 . 1 . . . . 12 PHE HE2 . 27017 1 138 . 1 1 12 12 PHE HZ H 1 7.027 0.016 . 1 . . . . 12 PHE HZ . 27017 1 139 . 1 1 12 12 PHE C C 13 179.023 0.004 . 1 . . . . 12 PHE C . 27017 1 140 . 1 1 12 12 PHE CA C 13 61.594 0.045 . 1 . . . . 12 PHE CA . 27017 1 141 . 1 1 12 12 PHE CB C 13 39.293 0.056 . 1 . . . . 12 PHE CB . 27017 1 142 . 1 1 12 12 PHE CD1 C 13 130.623 0.008 . 1 . . . . 12 PHE CD1 . 27017 1 143 . 1 1 12 12 PHE CD2 C 13 130.623 0.008 . 1 . . . . 12 PHE CD2 . 27017 1 144 . 1 1 12 12 PHE CE1 C 13 131.498 0.002 . 1 . . . . 12 PHE CE1 . 27017 1 145 . 1 1 12 12 PHE CE2 C 13 131.498 0.002 . 1 . . . . 12 PHE CE2 . 27017 1 146 . 1 1 12 12 PHE CZ C 13 131.911 0.017 . 1 . . . . 12 PHE CZ . 27017 1 147 . 1 1 12 12 PHE N N 15 118.531 0.052 . 1 . . . . 12 PHE N . 27017 1 148 . 1 1 13 13 LYS H H 1 9.091 0.002 . 1 . . . . 13 LYS H . 27017 1 149 . 1 1 13 13 LYS HA H 1 3.987 0.006 . 1 . . . . 13 LYS HA . 27017 1 150 . 1 1 13 13 LYS HB2 H 1 1.935 0.002 . 2 . . . . 13 LYS HB2 . 27017 1 151 . 1 1 13 13 LYS HB3 H 1 1.935 0.002 . 2 . . . . 13 LYS HB3 . 27017 1 152 . 1 1 13 13 LYS HG2 H 1 0.971 0.005 . 2 . . . . 13 LYS HG2 . 27017 1 153 . 1 1 13 13 LYS HG3 H 1 1.193 0.003 . 2 . . . . 13 LYS HG3 . 27017 1 154 . 1 1 13 13 LYS HD2 H 1 1.197 0.005 . 2 . . . . 13 LYS HD2 . 27017 1 155 . 1 1 13 13 LYS HD3 H 1 1.344 0.003 . 2 . . . . 13 LYS HD3 . 27017 1 156 . 1 1 13 13 LYS HE2 H 1 2.541 0.004 . 1 . . . . 13 LYS HE2 . 27017 1 157 . 1 1 13 13 LYS HE3 H 1 2.541 0.004 . 1 . . . . 13 LYS HE3 . 27017 1 158 . 1 1 13 13 LYS C C 13 179.348 0.023 . 1 . . . . 13 LYS C . 27017 1 159 . 1 1 13 13 LYS CA C 13 60.262 0.108 . 1 . . . . 13 LYS CA . 27017 1 160 . 1 1 13 13 LYS CB C 13 31.705 0.067 . 1 . . . . 13 LYS CB . 27017 1 161 . 1 1 13 13 LYS CG C 13 25.574 0.077 . 1 . . . . 13 LYS CG . 27017 1 162 . 1 1 13 13 LYS CD C 13 28.606 0.052 . 1 . . . . 13 LYS CD . 27017 1 163 . 1 1 13 13 LYS CE C 13 41.543 0.024 . 1 . . . . 13 LYS CE . 27017 1 164 . 1 1 13 13 LYS N N 15 123.907 0.019 . 1 . . . . 13 LYS N . 27017 1 165 . 1 1 14 14 GLU H H 1 7.883 0.003 . 1 . . . . 14 GLU H . 27017 1 166 . 1 1 14 14 GLU HA H 1 4.254 0.004 . 1 . . . . 14 GLU HA . 27017 1 167 . 1 1 14 14 GLU HB2 H 1 2.198 0.006 . 2 . . . . 14 GLU HB2 . 27017 1 168 . 1 1 14 14 GLU HB3 H 1 2.219 0.002 . 2 . . . . 14 GLU HB3 . 27017 1 169 . 1 1 14 14 GLU HG2 H 1 2.382 0.020 . 2 . . . . 14 GLU HG2 . 27017 1 170 . 1 1 14 14 GLU HG3 H 1 2.457 0.006 . 2 . . . . 14 GLU HG3 . 27017 1 171 . 1 1 14 14 GLU C C 13 179.152 0.008 . 1 . . . . 14 GLU C . 27017 1 172 . 1 1 14 14 GLU CA C 13 59.527 0.065 . 1 . . . . 14 GLU CA . 27017 1 173 . 1 1 14 14 GLU CB C 13 29.746 0.115 . 1 . . . . 14 GLU CB . 27017 1 174 . 1 1 14 14 GLU CG C 13 36.448 0.042 . 1 . . . . 14 GLU CG . 27017 1 175 . 1 1 14 14 GLU N N 15 118.741 0.044 . 1 . . . . 14 GLU N . 27017 1 176 . 1 1 15 15 ALA H H 1 7.654 0.004 . 1 . . . . 15 ALA H . 27017 1 177 . 1 1 15 15 ALA HA H 1 4.277 0.001 . 1 . . . . 15 ALA HA . 27017 1 178 . 1 1 15 15 ALA HB1 H 1 1.911 0.003 . 1 . . . . 15 ALA HB1 . 27017 1 179 . 1 1 15 15 ALA HB2 H 1 1.911 0.003 . 1 . . . . 15 ALA HB2 . 27017 1 180 . 1 1 15 15 ALA HB3 H 1 1.911 0.003 . 1 . . . . 15 ALA HB3 . 27017 1 181 . 1 1 15 15 ALA C C 13 177.590 0.028 . 1 . . . . 15 ALA C . 27017 1 182 . 1 1 15 15 ALA CA C 13 55.233 0.057 . 1 . . . . 15 ALA CA . 27017 1 183 . 1 1 15 15 ALA CB C 13 17.587 0.108 . 1 . . . . 15 ALA CB . 27017 1 184 . 1 1 15 15 ALA N N 15 121.369 0.037 . 1 . . . . 15 ALA N . 27017 1 185 . 1 1 16 16 PHE H H 1 8.591 0.003 . 1 . . . . 16 PHE H . 27017 1 186 . 1 1 16 16 PHE HA H 1 3.380 0.006 . 1 . . . . 16 PHE HA . 27017 1 187 . 1 1 16 16 PHE HB2 H 1 2.920 0.010 . 2 . . . . 16 PHE HB2 . 27017 1 188 . 1 1 16 16 PHE HB3 H 1 3.279 0.009 . 2 . . . . 16 PHE HB3 . 27017 1 189 . 1 1 16 16 PHE HD1 H 1 6.732 0.005 . 1 . . . . 16 PHE HD1 . 27017 1 190 . 1 1 16 16 PHE HD2 H 1 6.732 0.005 . 1 . . . . 16 PHE HD2 . 27017 1 191 . 1 1 16 16 PHE HE1 H 1 6.679 0.015 . 1 . . . . 16 PHE HE1 . 27017 1 192 . 1 1 16 16 PHE HE2 H 1 6.679 0.015 . 1 . . . . 16 PHE HE2 . 27017 1 193 . 1 1 16 16 PHE HZ H 1 7.197 0.004 . 1 . . . . 16 PHE HZ . 27017 1 194 . 1 1 16 16 PHE C C 13 177.383 0.001 . 1 . . . . 16 PHE C . 27017 1 195 . 1 1 16 16 PHE CA C 13 61.447 0.060 . 1 . . . . 16 PHE CA . 27017 1 196 . 1 1 16 16 PHE CB C 13 39.942 0.116 . 1 . . . . 16 PHE CB . 27017 1 197 . 1 1 16 16 PHE CD1 C 13 131.855 0.027 . 1 . . . . 16 PHE CD1 . 27017 1 198 . 1 1 16 16 PHE CD2 C 13 131.855 0.027 . 1 . . . . 16 PHE CD2 . 27017 1 199 . 1 1 16 16 PHE CE1 C 13 131.910 0.011 . 1 . . . . 16 PHE CE1 . 27017 1 200 . 1 1 16 16 PHE CE2 C 13 131.910 0.011 . 1 . . . . 16 PHE CE2 . 27017 1 201 . 1 1 16 16 PHE N N 15 119.149 0.018 . 1 . . . . 16 PHE N . 27017 1 202 . 1 1 17 17 ALA H H 1 8.040 0.004 . 1 . . . . 17 ALA H . 27017 1 203 . 1 1 17 17 ALA HA H 1 3.934 0.003 . 1 . . . . 17 ALA HA . 27017 1 204 . 1 1 17 17 ALA HB1 H 1 1.559 0.005 . 1 . . . . 17 ALA HB1 . 27017 1 205 . 1 1 17 17 ALA HB2 H 1 1.559 0.005 . 1 . . . . 17 ALA HB2 . 27017 1 206 . 1 1 17 17 ALA HB3 H 1 1.559 0.005 . 1 . . . . 17 ALA HB3 . 27017 1 207 . 1 1 17 17 ALA C C 13 177.606 0.009 . 1 . . . . 17 ALA C . 27017 1 208 . 1 1 17 17 ALA CA C 13 54.337 0.084 . 1 . . . . 17 ALA CA . 27017 1 209 . 1 1 17 17 ALA CB C 13 18.462 0.079 . 1 . . . . 17 ALA CB . 27017 1 210 . 1 1 17 17 ALA N N 15 120.150 0.069 . 1 . . . . 17 ALA N . 27017 1 211 . 1 1 18 18 LEU H H 1 7.065 0.003 . 1 . . . . 18 LEU H . 27017 1 212 . 1 1 18 18 LEU HA H 1 3.927 0.005 . 1 . . . . 18 LEU HA . 27017 1 213 . 1 1 18 18 LEU HB2 H 1 1.293 0.018 . 2 . . . . 18 LEU HB2 . 27017 1 214 . 1 1 18 18 LEU HB3 H 1 1.858 0.009 . 2 . . . . 18 LEU HB3 . 27017 1 215 . 1 1 18 18 LEU HD11 H 1 0.637 0.010 . 2 . . . . 18 LEU HD11 . 27017 1 216 . 1 1 18 18 LEU HD12 H 1 0.637 0.010 . 2 . . . . 18 LEU HD12 . 27017 1 217 . 1 1 18 18 LEU HD13 H 1 0.637 0.010 . 2 . . . . 18 LEU HD13 . 27017 1 218 . 1 1 18 18 LEU HD21 H 1 0.658 0.003 . 2 . . . . 18 LEU HD21 . 27017 1 219 . 1 1 18 18 LEU HD22 H 1 0.658 0.003 . 2 . . . . 18 LEU HD22 . 27017 1 220 . 1 1 18 18 LEU HD23 H 1 0.658 0.003 . 2 . . . . 18 LEU HD23 . 27017 1 221 . 1 1 18 18 LEU C C 13 175.823 0.016 . 1 . . . . 18 LEU C . 27017 1 222 . 1 1 18 18 LEU CA C 13 57.340 0.041 . 1 . . . . 18 LEU CA . 27017 1 223 . 1 1 18 18 LEU CB C 13 41.718 0.058 . 1 . . . . 18 LEU CB . 27017 1 224 . 1 1 18 18 LEU CD1 C 13 23.144 0.015 . 2 . . . . 18 LEU CD1 . 27017 1 225 . 1 1 18 18 LEU CD2 C 13 26.019 0.072 . 2 . . . . 18 LEU CD2 . 27017 1 226 . 1 1 18 18 LEU N N 15 117.318 0.033 . 1 . . . . 18 LEU N . 27017 1 227 . 1 1 19 19 PHE H H 1 6.879 0.008 . 1 . . . . 19 PHE H . 27017 1 228 . 1 1 19 19 PHE HA H 1 4.178 0.008 . 1 . . . . 19 PHE HA . 27017 1 229 . 1 1 19 19 PHE HB2 H 1 2.599 0.009 . 2 . . . . 19 PHE HB2 . 27017 1 230 . 1 1 19 19 PHE HB3 H 1 2.727 0.007 . 2 . . . . 19 PHE HB3 . 27017 1 231 . 1 1 19 19 PHE HD1 H 1 7.231 0.010 . 1 . . . . 19 PHE HD1 . 27017 1 232 . 1 1 19 19 PHE HD2 H 1 7.231 0.010 . 1 . . . . 19 PHE HD2 . 27017 1 233 . 1 1 19 19 PHE HE1 H 1 7.215 0.010 . 1 . . . . 19 PHE HE1 . 27017 1 234 . 1 1 19 19 PHE HE2 H 1 7.215 0.010 . 1 . . . . 19 PHE HE2 . 27017 1 235 . 1 1 19 19 PHE HZ H 1 7.058 0.001 . 1 . . . . 19 PHE HZ . 27017 1 236 . 1 1 19 19 PHE C C 13 176.091 0.054 . 1 . . . . 19 PHE C . 27017 1 237 . 1 1 19 19 PHE CA C 13 58.637 0.071 . 1 . . . . 19 PHE CA . 27017 1 238 . 1 1 19 19 PHE CB C 13 41.699 0.066 . 1 . . . . 19 PHE CB . 27017 1 239 . 1 1 19 19 PHE CD1 C 13 132.358 0.026 . 1 . . . . 19 PHE CD1 . 27017 1 240 . 1 1 19 19 PHE CD2 C 13 132.358 0.026 . 1 . . . . 19 PHE CD2 . 27017 1 241 . 1 1 19 19 PHE CE1 C 13 130.823 0.038 . 1 . . . . 19 PHE CE1 . 27017 1 242 . 1 1 19 19 PHE CE2 C 13 130.823 0.038 . 1 . . . . 19 PHE CE2 . 27017 1 243 . 1 1 19 19 PHE CZ C 13 129.057 0.003 . 1 . . . . 19 PHE CZ . 27017 1 244 . 1 1 19 19 PHE N N 15 112.582 0.044 . 1 . . . . 19 PHE N . 27017 1 245 . 1 1 20 20 ASP H H 1 7.663 0.004 . 1 . . . . 20 ASP H . 27017 1 246 . 1 1 20 20 ASP HA H 1 4.568 0.006 . 1 . . . . 20 ASP HA . 27017 1 247 . 1 1 20 20 ASP HB2 H 1 1.411 0.008 . 2 . . . . 20 ASP HB2 . 27017 1 248 . 1 1 20 20 ASP HB3 H 1 2.200 0.009 . 2 . . . . 20 ASP HB3 . 27017 1 249 . 1 1 20 20 ASP C C 13 176.925 0.031 . 1 . . . . 20 ASP C . 27017 1 250 . 1 1 20 20 ASP CA C 13 52.221 0.023 . 1 . . . . 20 ASP CA . 27017 1 251 . 1 1 20 20 ASP CB C 13 39.435 0.043 . 1 . . . . 20 ASP CB . 27017 1 252 . 1 1 20 20 ASP N N 15 116.629 0.032 . 1 . . . . 20 ASP N . 27017 1 253 . 1 1 21 21 LYS H H 1 7.606 0.003 . 1 . . . . 21 LYS H . 27017 1 254 . 1 1 21 21 LYS HA H 1 3.941 0.007 . 1 . . . . 21 LYS HA . 27017 1 255 . 1 1 21 21 LYS HB2 H 1 1.884 0.006 . 2 . . . . 21 LYS HB2 . 27017 1 256 . 1 1 21 21 LYS HB3 H 1 1.822 0.004 . 2 . . . . 21 LYS HB3 . 27017 1 257 . 1 1 21 21 LYS HG2 H 1 1.465 0.005 . 2 . . . . 21 LYS HG2 . 27017 1 258 . 1 1 21 21 LYS HG3 H 1 1.543 0.007 . 2 . . . . 21 LYS HG3 . 27017 1 259 . 1 1 21 21 LYS HD2 H 1 1.662 0.007 . 1 . . . . 21 LYS HD2 . 27017 1 260 . 1 1 21 21 LYS HD3 H 1 1.662 0.007 . 1 . . . . 21 LYS HD3 . 27017 1 261 . 1 1 21 21 LYS HE2 H 1 2.994 0.003 . 1 . . . . 21 LYS HE2 . 27017 1 262 . 1 1 21 21 LYS HE3 H 1 2.994 0.003 . 1 . . . . 21 LYS HE3 . 27017 1 263 . 1 1 21 21 LYS C C 13 178.209 0.001 . 1 . . . . 21 LYS C . 27017 1 264 . 1 1 21 21 LYS CA C 13 58.320 0.053 . 1 . . . . 21 LYS CA . 27017 1 265 . 1 1 21 21 LYS CB C 13 32.638 0.076 . 1 . . . . 21 LYS CB . 27017 1 266 . 1 1 21 21 LYS CG C 13 24.332 0.041 . 1 . . . . 21 LYS CG . 27017 1 267 . 1 1 21 21 LYS CD C 13 28.277 0.049 . 1 . . . . 21 LYS CD . 27017 1 268 . 1 1 21 21 LYS CE C 13 42.290 0.014 . 1 . . . . 21 LYS CE . 27017 1 269 . 1 1 21 21 LYS N N 15 123.535 0.029 . 1 . . . . 21 LYS N . 27017 1 270 . 1 1 22 22 ASP H H 1 8.096 0.004 . 1 . . . . 22 ASP H . 27017 1 271 . 1 1 22 22 ASP HA H 1 4.605 0.008 . 1 . . . . 22 ASP HA . 27017 1 272 . 1 1 22 22 ASP HB2 H 1 2.649 0.011 . 2 . . . . 22 ASP HB2 . 27017 1 273 . 1 1 22 22 ASP HB3 H 1 3.078 0.009 . 2 . . . . 22 ASP HB3 . 27017 1 274 . 1 1 22 22 ASP C C 13 177.718 0.031 . 1 . . . . 22 ASP C . 27017 1 275 . 1 1 22 22 ASP CA C 13 52.839 0.060 . 1 . . . . 22 ASP CA . 27017 1 276 . 1 1 22 22 ASP CB C 13 39.670 0.043 . 1 . . . . 22 ASP CB . 27017 1 277 . 1 1 22 22 ASP N N 15 113.925 0.015 . 1 . . . . 22 ASP N . 27017 1 278 . 1 1 23 23 GLY H H 1 7.639 0.005 . 1 . . . . 23 GLY H . 27017 1 279 . 1 1 23 23 GLY HA2 H 1 3.853 0.028 . 2 . . . . 23 GLY HA2 . 27017 1 280 . 1 1 23 23 GLY HA3 H 1 3.920 0.017 . 2 . . . . 23 GLY HA3 . 27017 1 281 . 1 1 23 23 GLY C C 13 175.228 0.000 . 1 . . . . 23 GLY C . 27017 1 282 . 1 1 23 23 GLY CA C 13 47.282 0.033 . 1 . . . . 23 GLY CA . 27017 1 283 . 1 1 23 23 GLY N N 15 109.384 0.056 . 1 . . . . 23 GLY N . 27017 1 284 . 1 1 24 24 ASP H H 1 8.484 0.004 . 1 . . . . 24 ASP H . 27017 1 285 . 1 1 24 24 ASP HA H 1 4.528 0.010 . 1 . . . . 24 ASP HA . 27017 1 286 . 1 1 24 24 ASP HB2 H 1 2.475 0.013 . 2 . . . . 24 ASP HB2 . 27017 1 287 . 1 1 24 24 ASP HB3 H 1 3.070 0.007 . 2 . . . . 24 ASP HB3 . 27017 1 288 . 1 1 24 24 ASP C C 13 177.345 0.006 . 1 . . . . 24 ASP C . 27017 1 289 . 1 1 24 24 ASP CA C 13 53.722 0.028 . 1 . . . . 24 ASP CA . 27017 1 290 . 1 1 24 24 ASP CB C 13 40.457 0.039 . 1 . . . . 24 ASP CB . 27017 1 291 . 1 1 24 24 ASP N N 15 121.104 0.027 . 1 . . . . 24 ASP N . 27017 1 292 . 1 1 25 25 GLY H H 1 10.525 0.003 . 1 . . . . 25 GLY H . 27017 1 293 . 1 1 25 25 GLY HA2 H 1 3.757 0.004 . 2 . . . . 25 GLY HA2 . 27017 1 294 . 1 1 25 25 GLY HA3 H 1 4.431 0.007 . 2 . . . . 25 GLY HA3 . 27017 1 295 . 1 1 25 25 GLY C C 13 173.832 0.000 . 1 . . . . 25 GLY C . 27017 1 296 . 1 1 25 25 GLY CA C 13 45.335 0.079 . 1 . . . . 25 GLY CA . 27017 1 297 . 1 1 25 25 GLY N N 15 112.823 0.022 . 1 . . . . 25 GLY N . 27017 1 298 . 1 1 26 26 THR H H 1 8.212 0.003 . 1 . . . . 26 THR H . 27017 1 299 . 1 1 26 26 THR HA H 1 5.436 0.030 . 1 . . . . 26 THR HA . 27017 1 300 . 1 1 26 26 THR HB H 1 3.867 0.004 . 1 . . . . 26 THR HB . 27017 1 301 . 1 1 26 26 THR HG21 H 1 1.069 0.003 . 1 . . . . 26 THR HG21 . 27017 1 302 . 1 1 26 26 THR HG22 H 1 1.069 0.003 . 1 . . . . 26 THR HG22 . 27017 1 303 . 1 1 26 26 THR HG23 H 1 1.069 0.003 . 1 . . . . 26 THR HG23 . 27017 1 304 . 1 1 26 26 THR C C 13 173.266 0.000 . 1 . . . . 26 THR C . 27017 1 305 . 1 1 26 26 THR CA C 13 59.612 0.053 . 1 . . . . 26 THR CA . 27017 1 306 . 1 1 26 26 THR CB C 13 72.868 0.112 . 1 . . . . 26 THR CB . 27017 1 307 . 1 1 26 26 THR CG2 C 13 22.064 0.063 . 1 . . . . 26 THR CG2 . 27017 1 308 . 1 1 26 26 THR N N 15 112.109 0.040 . 1 . . . . 26 THR N . 27017 1 309 . 1 1 27 27 ILE H H 1 9.895 0.005 . 1 . . . . 27 ILE H . 27017 1 310 . 1 1 27 27 ILE HA H 1 4.761 0.011 . 1 . . . . 27 ILE HA . 27017 1 311 . 1 1 27 27 ILE HB H 1 1.783 0.007 . 1 . . . . 27 ILE HB . 27017 1 312 . 1 1 27 27 ILE HG12 H 1 1.355 0.009 . 1 . . . . 27 ILE HG12 . 27017 1 313 . 1 1 27 27 ILE HG21 H 1 0.911 0.010 . 1 . . . . 27 ILE HG21 . 27017 1 314 . 1 1 27 27 ILE HG22 H 1 0.911 0.010 . 1 . . . . 27 ILE HG22 . 27017 1 315 . 1 1 27 27 ILE HG23 H 1 0.911 0.010 . 1 . . . . 27 ILE HG23 . 27017 1 316 . 1 1 27 27 ILE HD11 H 1 0.303 0.004 . 1 . . . . 27 ILE HD11 . 27017 1 317 . 1 1 27 27 ILE HD12 H 1 0.303 0.004 . 1 . . . . 27 ILE HD12 . 27017 1 318 . 1 1 27 27 ILE HD13 H 1 0.303 0.004 . 1 . . . . 27 ILE HD13 . 27017 1 319 . 1 1 27 27 ILE C C 13 176.029 0.034 . 1 . . . . 27 ILE C . 27017 1 320 . 1 1 27 27 ILE CA C 13 61.110 0.062 . 1 . . . . 27 ILE CA . 27017 1 321 . 1 1 27 27 ILE CB C 13 39.809 0.071 . 1 . . . . 27 ILE CB . 27017 1 322 . 1 1 27 27 ILE CG1 C 13 26.257 0.064 . 1 . . . . 27 ILE CG1 . 27017 1 323 . 1 1 27 27 ILE CG2 C 13 17.400 0.101 . 1 . . . . 27 ILE CG2 . 27017 1 324 . 1 1 27 27 ILE CD1 C 13 14.719 0.109 . 1 . . . . 27 ILE CD1 . 27017 1 325 . 1 1 27 27 ILE N N 15 126.735 0.036 . 1 . . . . 27 ILE N . 27017 1 326 . 1 1 28 28 THR H H 1 8.415 0.005 . 1 . . . . 28 THR H . 27017 1 327 . 1 1 28 28 THR HA H 1 4.907 0.005 . 1 . . . . 28 THR HA . 27017 1 328 . 1 1 28 28 THR HB H 1 4.831 0.008 . 1 . . . . 28 THR HB . 27017 1 329 . 1 1 28 28 THR HG21 H 1 1.297 0.003 . 1 . . . . 28 THR HG21 . 27017 1 330 . 1 1 28 28 THR HG22 H 1 1.297 0.003 . 1 . . . . 28 THR HG22 . 27017 1 331 . 1 1 28 28 THR HG23 H 1 1.297 0.003 . 1 . . . . 28 THR HG23 . 27017 1 332 . 1 1 28 28 THR C C 13 176.771 0.026 . 1 . . . . 28 THR C . 27017 1 333 . 1 1 28 28 THR CA C 13 59.471 0.033 . 1 . . . . 28 THR CA . 27017 1 334 . 1 1 28 28 THR CB C 13 72.530 0.031 . 1 . . . . 28 THR CB . 27017 1 335 . 1 1 28 28 THR CG2 C 13 21.674 0.029 . 1 . . . . 28 THR CG2 . 27017 1 336 . 1 1 28 28 THR N N 15 116.405 0.043 . 1 . . . . 28 THR N . 27017 1 337 . 1 1 29 29 THR H H 1 9.207 0.003 . 1 . . . . 29 THR H . 27017 1 338 . 1 1 29 29 THR HA H 1 3.785 0.003 . 1 . . . . 29 THR HA . 27017 1 339 . 1 1 29 29 THR HB H 1 4.234 0.006 . 1 . . . . 29 THR HB . 27017 1 340 . 1 1 29 29 THR HG21 H 1 1.312 0.001 . 1 . . . . 29 THR HG21 . 27017 1 341 . 1 1 29 29 THR HG22 H 1 1.312 0.001 . 1 . . . . 29 THR HG22 . 27017 1 342 . 1 1 29 29 THR HG23 H 1 1.312 0.001 . 1 . . . . 29 THR HG23 . 27017 1 343 . 1 1 29 29 THR C C 13 177.359 0.046 . 1 . . . . 29 THR C . 27017 1 344 . 1 1 29 29 THR CA C 13 66.213 0.078 . 1 . . . . 29 THR CA . 27017 1 345 . 1 1 29 29 THR CB C 13 67.725 0.108 . 1 . . . . 29 THR CB . 27017 1 346 . 1 1 29 29 THR CG2 C 13 23.410 0.078 . 1 . . . . 29 THR CG2 . 27017 1 347 . 1 1 29 29 THR N N 15 112.315 0.018 . 1 . . . . 29 THR N . 27017 1 348 . 1 1 30 30 LYS H H 1 7.570 0.005 . 1 . . . . 30 LYS H . 27017 1 349 . 1 1 30 30 LYS HA H 1 4.143 0.005 . 1 . . . . 30 LYS HA . 27017 1 350 . 1 1 30 30 LYS HB2 H 1 1.826 0.017 . 2 . . . . 30 LYS HB2 . 27017 1 351 . 1 1 30 30 LYS HB3 H 1 1.875 0.015 . 2 . . . . 30 LYS HB3 . 27017 1 352 . 1 1 30 30 LYS HG2 H 1 1.421 0.003 . 2 . . . . 30 LYS HG2 . 27017 1 353 . 1 1 30 30 LYS HG3 H 1 1.509 0.010 . 2 . . . . 30 LYS HG3 . 27017 1 354 . 1 1 30 30 LYS HD2 H 1 1.690 0.006 . 2 . . . . 30 LYS HD2 . 27017 1 355 . 1 1 30 30 LYS HD3 H 1 1.691 0.005 . 2 . . . . 30 LYS HD3 . 27017 1 356 . 1 1 30 30 LYS HE2 H 1 2.993 0.004 . 1 . . . . 30 LYS HE2 . 27017 1 357 . 1 1 30 30 LYS HE3 H 1 2.993 0.004 . 1 . . . . 30 LYS HE3 . 27017 1 358 . 1 1 30 30 LYS C C 13 179.921 0.023 . 1 . . . . 30 LYS C . 27017 1 359 . 1 1 30 30 LYS CA C 13 59.202 0.060 . 1 . . . . 30 LYS CA . 27017 1 360 . 1 1 30 30 LYS CB C 13 32.517 0.085 . 1 . . . . 30 LYS CB . 27017 1 361 . 1 1 30 30 LYS CG C 13 24.863 0.054 . 1 . . . . 30 LYS CG . 27017 1 362 . 1 1 30 30 LYS CD C 13 29.059 0.089 . 1 . . . . 30 LYS CD . 27017 1 363 . 1 1 30 30 LYS CE C 13 41.905 0.052 . 1 . . . . 30 LYS CE . 27017 1 364 . 1 1 30 30 LYS N N 15 121.213 0.015 . 1 . . . . 30 LYS N . 27017 1 365 . 1 1 31 31 GLU H H 1 7.702 0.003 . 1 . . . . 31 GLU H . 27017 1 366 . 1 1 31 31 GLU HA H 1 4.014 0.009 . 1 . . . . 31 GLU HA . 27017 1 367 . 1 1 31 31 GLU HB2 H 1 2.085 0.005 . 2 . . . . 31 GLU HB2 . 27017 1 368 . 1 1 31 31 GLU HB3 H 1 2.086 0.005 . 2 . . . . 31 GLU HB3 . 27017 1 369 . 1 1 31 31 GLU HG2 H 1 2.316 0.007 . 2 . . . . 31 GLU HG2 . 27017 1 370 . 1 1 31 31 GLU HG3 H 1 2.489 0.008 . 2 . . . . 31 GLU HG3 . 27017 1 371 . 1 1 31 31 GLU C C 13 178.976 0.045 . 1 . . . . 31 GLU C . 27017 1 372 . 1 1 31 31 GLU CA C 13 59.570 0.070 . 1 . . . . 31 GLU CA . 27017 1 373 . 1 1 31 31 GLU CB C 13 29.497 0.040 . 1 . . . . 31 GLU CB . 27017 1 374 . 1 1 31 31 GLU CG C 13 38.413 0.122 . 1 . . . . 31 GLU CG . 27017 1 375 . 1 1 31 31 GLU N N 15 122.103 0.013 . 1 . . . . 31 GLU N . 27017 1 376 . 1 1 32 32 LEU H H 1 8.665 0.012 . 1 . . . . 32 LEU H . 27017 1 377 . 1 1 32 32 LEU HA H 1 4.176 0.012 . 1 . . . . 32 LEU HA . 27017 1 378 . 1 1 32 32 LEU HB2 H 1 1.424 0.005 . 2 . . . . 32 LEU HB2 . 27017 1 379 . 1 1 32 32 LEU HB3 H 1 1.927 0.011 . 2 . . . . 32 LEU HB3 . 27017 1 380 . 1 1 32 32 LEU HD11 H 1 0.932 0.007 . 2 . . . . 32 LEU HD11 . 27017 1 381 . 1 1 32 32 LEU HD12 H 1 0.932 0.007 . 2 . . . . 32 LEU HD12 . 27017 1 382 . 1 1 32 32 LEU HD13 H 1 0.932 0.007 . 2 . . . . 32 LEU HD13 . 27017 1 383 . 1 1 32 32 LEU HD21 H 1 0.974 0.006 . 2 . . . . 32 LEU HD21 . 27017 1 384 . 1 1 32 32 LEU HD22 H 1 0.974 0.006 . 2 . . . . 32 LEU HD22 . 27017 1 385 . 1 1 32 32 LEU HD23 H 1 0.974 0.006 . 2 . . . . 32 LEU HD23 . 27017 1 386 . 1 1 32 32 LEU C C 13 178.993 0.031 . 1 . . . . 32 LEU C . 27017 1 387 . 1 1 32 32 LEU CA C 13 58.280 0.054 . 1 . . . . 32 LEU CA . 27017 1 388 . 1 1 32 32 LEU CB C 13 42.535 0.033 . 1 . . . . 32 LEU CB . 27017 1 389 . 1 1 32 32 LEU CD1 C 13 26.495 0.066 . 2 . . . . 32 LEU CD1 . 27017 1 390 . 1 1 32 32 LEU CD2 C 13 23.637 0.040 . 2 . . . . 32 LEU CD2 . 27017 1 391 . 1 1 32 32 LEU N N 15 120.033 0.017 . 1 . . . . 32 LEU N . 27017 1 392 . 1 1 33 33 GLY H H 1 8.810 0.004 . 1 . . . . 33 GLY H . 27017 1 393 . 1 1 33 33 GLY HA2 H 1 3.509 0.004 . 2 . . . . 33 GLY HA2 . 27017 1 394 . 1 1 33 33 GLY HA3 H 1 3.948 0.006 . 2 . . . . 33 GLY HA3 . 27017 1 395 . 1 1 33 33 GLY C C 13 174.803 0.000 . 1 . . . . 33 GLY C . 27017 1 396 . 1 1 33 33 GLY CA C 13 48.576 0.056 . 1 . . . . 33 GLY CA . 27017 1 397 . 1 1 33 33 GLY N N 15 105.976 0.041 . 1 . . . . 33 GLY N . 27017 1 398 . 1 1 34 34 THR H H 1 8.059 0.002 . 1 . . . . 34 THR H . 27017 1 399 . 1 1 34 34 THR HA H 1 3.948 0.005 . 1 . . . . 34 THR HA . 27017 1 400 . 1 1 34 34 THR HB H 1 4.430 0.007 . 1 . . . . 34 THR HB . 27017 1 401 . 1 1 34 34 THR HG21 H 1 1.287 0.003 . 1 . . . . 34 THR HG21 . 27017 1 402 . 1 1 34 34 THR HG22 H 1 1.287 0.003 . 1 . . . . 34 THR HG22 . 27017 1 403 . 1 1 34 34 THR HG23 H 1 1.287 0.003 . 1 . . . . 34 THR HG23 . 27017 1 404 . 1 1 34 34 THR C C 13 177.206 0.041 . 1 . . . . 34 THR C . 27017 1 405 . 1 1 34 34 THR CA C 13 67.160 0.080 . 1 . . . . 34 THR CA . 27017 1 406 . 1 1 34 34 THR CB C 13 68.672 0.127 . 1 . . . . 34 THR CB . 27017 1 407 . 1 1 34 34 THR CG2 C 13 21.184 0.107 . 1 . . . . 34 THR CG2 . 27017 1 408 . 1 1 34 34 THR N N 15 118.712 0.018 . 1 . . . . 34 THR N . 27017 1 409 . 1 1 35 35 VAL H H 1 7.686 0.004 . 1 . . . . 35 VAL H . 27017 1 410 . 1 1 35 35 VAL HA H 1 3.676 0.003 . 1 . . . . 35 VAL HA . 27017 1 411 . 1 1 35 35 VAL HB H 1 2.094 0.007 . 1 . . . . 35 VAL HB . 27017 1 412 . 1 1 35 35 VAL HG11 H 1 0.586 0.001 . 2 . . . . 35 VAL HG11 . 27017 1 413 . 1 1 35 35 VAL HG12 H 1 0.586 0.001 . 2 . . . . 35 VAL HG12 . 27017 1 414 . 1 1 35 35 VAL HG13 H 1 0.586 0.001 . 2 . . . . 35 VAL HG13 . 27017 1 415 . 1 1 35 35 VAL HG21 H 1 0.919 0.004 . 2 . . . . 35 VAL HG21 . 27017 1 416 . 1 1 35 35 VAL HG22 H 1 0.919 0.004 . 2 . . . . 35 VAL HG22 . 27017 1 417 . 1 1 35 35 VAL HG23 H 1 0.919 0.004 . 2 . . . . 35 VAL HG23 . 27017 1 418 . 1 1 35 35 VAL C C 13 179.118 0.011 . 1 . . . . 35 VAL C . 27017 1 419 . 1 1 35 35 VAL CA C 13 66.492 0.095 . 1 . . . . 35 VAL CA . 27017 1 420 . 1 1 35 35 VAL CB C 13 31.997 0.083 . 1 . . . . 35 VAL CB . 27017 1 421 . 1 1 35 35 VAL CG1 C 13 20.356 0.075 . 2 . . . . 35 VAL CG1 . 27017 1 422 . 1 1 35 35 VAL CG2 C 13 23.337 0.046 . 2 . . . . 35 VAL CG2 . 27017 1 423 . 1 1 35 35 VAL N N 15 121.545 0.065 . 1 . . . . 35 VAL N . 27017 1 424 . 1 1 36 36 MET H H 1 8.458 0.006 . 1 . . . . 36 MET H . 27017 1 425 . 1 1 36 36 MET HA H 1 4.133 0.017 . 1 . . . . 36 MET HA . 27017 1 426 . 1 1 36 36 MET HB2 H 1 1.847 0.006 . 1 . . . . 36 MET HB2 . 27017 1 427 . 1 1 36 36 MET HG2 H 1 2.414 0.003 . 2 . . . . 36 MET HG2 . 27017 1 428 . 1 1 36 36 MET HG3 H 1 2.523 0.006 . 2 . . . . 36 MET HG3 . 27017 1 429 . 1 1 36 36 MET HE1 H 1 1.728 0.000 . 1 . . . . 36 MET HE1 . 27017 1 430 . 1 1 36 36 MET HE2 H 1 1.728 0.000 . 1 . . . . 36 MET HE2 . 27017 1 431 . 1 1 36 36 MET HE3 H 1 1.728 0.000 . 1 . . . . 36 MET HE3 . 27017 1 432 . 1 1 36 36 MET C C 13 179.247 0.000 . 1 . . . . 36 MET C . 27017 1 433 . 1 1 36 36 MET CA C 13 58.216 0.044 . 1 . . . . 36 MET CA . 27017 1 434 . 1 1 36 36 MET CB C 13 30.285 0.026 . 1 . . . . 36 MET CB . 27017 1 435 . 1 1 36 36 MET CG C 13 31.912 0.108 . 1 . . . . 36 MET CG . 27017 1 436 . 1 1 36 36 MET CE C 13 16.677 0.000 . 1 . . . . 36 MET CE . 27017 1 437 . 1 1 36 36 MET N N 15 117.205 0.051 . 1 . . . . 36 MET N . 27017 1 438 . 1 1 37 37 ARG H H 1 8.771 0.005 . 1 . . . . 37 ARG H . 27017 1 439 . 1 1 37 37 ARG HA H 1 4.810 0.008 . 1 . . . . 37 ARG HA . 27017 1 440 . 1 1 37 37 ARG HB2 H 1 1.872 0.011 . 2 . . . . 37 ARG HB2 . 27017 1 441 . 1 1 37 37 ARG HB3 H 1 1.915 0.003 . 2 . . . . 37 ARG HB3 . 27017 1 442 . 1 1 37 37 ARG HG2 H 1 1.840 0.031 . 1 . . . . 37 ARG HG2 . 27017 1 443 . 1 1 37 37 ARG HD2 H 1 3.233 0.002 . 1 . . . . 37 ARG HD2 . 27017 1 444 . 1 1 37 37 ARG HE H 1 7.431 0.002 . 1 . . . . 37 ARG HE . 27017 1 445 . 1 1 37 37 ARG C C 13 181.676 0.025 . 1 . . . . 37 ARG C . 27017 1 446 . 1 1 37 37 ARG CA C 13 59.155 0.065 . 1 . . . . 37 ARG CA . 27017 1 447 . 1 1 37 37 ARG CB C 13 30.134 0.161 . 1 . . . . 37 ARG CB . 27017 1 448 . 1 1 37 37 ARG CG C 13 29.640 0.075 . 1 . . . . 37 ARG CG . 27017 1 449 . 1 1 37 37 ARG CD C 13 43.425 0.115 . 1 . . . . 37 ARG CD . 27017 1 450 . 1 1 37 37 ARG N N 15 118.753 0.052 . 1 . . . . 37 ARG N . 27017 1 451 . 1 1 37 37 ARG NE N 15 85.303 0.011 . 1 . . . . 37 ARG NE . 27017 1 452 . 1 1 38 38 SER H H 1 7.949 0.003 . 1 . . . . 38 SER H . 27017 1 453 . 1 1 38 38 SER HA H 1 4.382 0.010 . 1 . . . . 38 SER HA . 27017 1 454 . 1 1 38 38 SER HB2 H 1 4.056 0.007 . 2 . . . . 38 SER HB2 . 27017 1 455 . 1 1 38 38 SER HB3 H 1 4.054 0.007 . 2 . . . . 38 SER HB3 . 27017 1 456 . 1 1 38 38 SER C C 13 174.827 0.044 . 1 . . . . 38 SER C . 27017 1 457 . 1 1 38 38 SER CA C 13 61.747 0.022 . 1 . . . . 38 SER CA . 27017 1 458 . 1 1 38 38 SER CB C 13 62.515 0.050 . 1 . . . . 38 SER CB . 27017 1 459 . 1 1 38 38 SER N N 15 119.151 0.048 . 1 . . . . 38 SER N . 27017 1 460 . 1 1 39 39 LEU H H 1 7.246 0.004 . 1 . . . . 39 LEU H . 27017 1 461 . 1 1 39 39 LEU HA H 1 4.437 0.006 . 1 . . . . 39 LEU HA . 27017 1 462 . 1 1 39 39 LEU HB2 H 1 1.807 0.013 . 2 . . . . 39 LEU HB2 . 27017 1 463 . 1 1 39 39 LEU HB3 H 1 1.855 0.018 . 2 . . . . 39 LEU HB3 . 27017 1 464 . 1 1 39 39 LEU HG H 1 1.909 0.013 . 1 . . . . 39 LEU HG . 27017 1 465 . 1 1 39 39 LEU HD11 H 1 0.847 0.003 . 2 . . . . 39 LEU HD11 . 27017 1 466 . 1 1 39 39 LEU HD12 H 1 0.847 0.003 . 2 . . . . 39 LEU HD12 . 27017 1 467 . 1 1 39 39 LEU HD13 H 1 0.847 0.003 . 2 . . . . 39 LEU HD13 . 27017 1 468 . 1 1 39 39 LEU HD21 H 1 0.748 0.004 . 2 . . . . 39 LEU HD21 . 27017 1 469 . 1 1 39 39 LEU HD22 H 1 0.748 0.004 . 2 . . . . 39 LEU HD22 . 27017 1 470 . 1 1 39 39 LEU HD23 H 1 0.748 0.004 . 2 . . . . 39 LEU HD23 . 27017 1 471 . 1 1 39 39 LEU C C 13 177.159 0.036 . 1 . . . . 39 LEU C . 27017 1 472 . 1 1 39 39 LEU CA C 13 54.234 0.054 . 1 . . . . 39 LEU CA . 27017 1 473 . 1 1 39 39 LEU CB C 13 41.429 0.056 . 1 . . . . 39 LEU CB . 27017 1 474 . 1 1 39 39 LEU CG C 13 26.335 0.190 . 1 . . . . 39 LEU CG . 27017 1 475 . 1 1 39 39 LEU CD1 C 13 26.515 0.042 . 2 . . . . 39 LEU CD1 . 27017 1 476 . 1 1 39 39 LEU CD2 C 13 22.447 0.094 . 2 . . . . 39 LEU CD2 . 27017 1 477 . 1 1 39 39 LEU N N 15 119.935 0.050 . 1 . . . . 39 LEU N . 27017 1 478 . 1 1 40 40 GLY H H 1 7.846 0.004 . 1 . . . . 40 GLY H . 27017 1 479 . 1 1 40 40 GLY HA2 H 1 3.810 0.004 . 2 . . . . 40 GLY HA2 . 27017 1 480 . 1 1 40 40 GLY HA3 H 1 4.282 0.004 . 2 . . . . 40 GLY HA3 . 27017 1 481 . 1 1 40 40 GLY C C 13 174.187 0.000 . 1 . . . . 40 GLY C . 27017 1 482 . 1 1 40 40 GLY CA C 13 45.496 0.035 . 1 . . . . 40 GLY CA . 27017 1 483 . 1 1 40 40 GLY N N 15 106.701 0.014 . 1 . . . . 40 GLY N . 27017 1 484 . 1 1 41 41 GLN H H 1 7.833 0.002 . 1 . . . . 41 GLN H . 27017 1 485 . 1 1 41 41 GLN HA H 1 4.573 0.007 . 1 . . . . 41 GLN HA . 27017 1 486 . 1 1 41 41 GLN HB2 H 1 1.552 0.008 . 2 . . . . 41 GLN HB2 . 27017 1 487 . 1 1 41 41 GLN HB3 H 1 1.891 0.010 . 2 . . . . 41 GLN HB3 . 27017 1 488 . 1 1 41 41 GLN HG2 H 1 2.102 0.005 . 2 . . . . 41 GLN HG2 . 27017 1 489 . 1 1 41 41 GLN HG3 H 1 2.224 0.003 . 2 . . . . 41 GLN HG3 . 27017 1 490 . 1 1 41 41 GLN HE21 H 1 6.527 0.004 . 1 . . . . 41 GLN HE21 . 27017 1 491 . 1 1 41 41 GLN HE22 H 1 7.353 0.003 . 1 . . . . 41 GLN HE22 . 27017 1 492 . 1 1 41 41 GLN C C 13 174.422 0.019 . 1 . . . . 41 GLN C . 27017 1 493 . 1 1 41 41 GLN CA C 13 54.354 0.059 . 1 . . . . 41 GLN CA . 27017 1 494 . 1 1 41 41 GLN CB C 13 30.226 0.077 . 1 . . . . 41 GLN CB . 27017 1 495 . 1 1 41 41 GLN CG C 13 33.407 0.030 . 1 . . . . 41 GLN CG . 27017 1 496 . 1 1 41 41 GLN CD C 13 177.779 0.011 . 1 . . . . 41 GLN CD . 27017 1 497 . 1 1 41 41 GLN N N 15 118.518 0.011 . 1 . . . . 41 GLN N . 27017 1 498 . 1 1 41 41 GLN NE2 N 15 110.689 0.081 . 1 . . . . 41 GLN NE2 . 27017 1 499 . 1 1 42 42 ASN H H 1 8.600 0.006 . 1 . . . . 42 ASN H . 27017 1 500 . 1 1 42 42 ASN HA H 1 5.250 0.002 . 1 . . . . 42 ASN HA . 27017 1 501 . 1 1 42 42 ASN HB2 H 1 2.636 0.004 . 2 . . . . 42 ASN HB2 . 27017 1 502 . 1 1 42 42 ASN HB3 H 1 2.792 0.004 . 2 . . . . 42 ASN HB3 . 27017 1 503 . 1 1 42 42 ASN HD21 H 1 7.523 0.002 . 1 . . . . 42 ASN HD21 . 27017 1 504 . 1 1 42 42 ASN HD22 H 1 6.816 0.004 . 1 . . . . 42 ASN HD22 . 27017 1 505 . 1 1 42 42 ASN C C 13 172.323 0.000 . 1 . . . . 42 ASN C . 27017 1 506 . 1 1 42 42 ASN CA C 13 51.190 0.078 . 1 . . . . 42 ASN CA . 27017 1 507 . 1 1 42 42 ASN CB C 13 39.133 0.076 . 1 . . . . 42 ASN CB . 27017 1 508 . 1 1 42 42 ASN CG C 13 178.303 0.005 . 1 . . . . 42 ASN CG . 27017 1 509 . 1 1 42 42 ASN N N 15 116.528 0.028 . 1 . . . . 42 ASN N . 27017 1 510 . 1 1 42 42 ASN ND2 N 15 112.090 0.080 . 1 . . . . 42 ASN ND2 . 27017 1 511 . 1 1 43 43 PRO HA H 1 4.874 0.004 . 1 . . . . 43 PRO HA . 27017 1 512 . 1 1 43 43 PRO HB2 H 1 1.848 0.015 . 2 . . . . 43 PRO HB2 . 27017 1 513 . 1 1 43 43 PRO HB3 H 1 1.710 0.012 . 2 . . . . 43 PRO HB3 . 27017 1 514 . 1 1 43 43 PRO HG2 H 1 1.325 0.011 . 2 . . . . 43 PRO HG2 . 27017 1 515 . 1 1 43 43 PRO HG3 H 1 1.713 0.009 . 2 . . . . 43 PRO HG3 . 27017 1 516 . 1 1 43 43 PRO HD2 H 1 2.928 0.011 . 2 . . . . 43 PRO HD2 . 27017 1 517 . 1 1 43 43 PRO HD3 H 1 3.463 0.010 . 2 . . . . 43 PRO HD3 . 27017 1 518 . 1 1 43 43 PRO C C 13 177.566 0.007 . 1 . . . . 43 PRO C . 27017 1 519 . 1 1 43 43 PRO CA C 13 62.255 0.079 . 1 . . . . 43 PRO CA . 27017 1 520 . 1 1 43 43 PRO CB C 13 31.833 0.083 . 1 . . . . 43 PRO CB . 27017 1 521 . 1 1 43 43 PRO CG C 13 27.426 0.077 . 1 . . . . 43 PRO CG . 27017 1 522 . 1 1 43 43 PRO CD C 13 49.602 0.101 . 1 . . . . 43 PRO CD . 27017 1 523 . 1 1 44 44 THR H H 1 9.496 0.005 . 1 . . . . 44 THR H . 27017 1 524 . 1 1 44 44 THR HA H 1 4.457 0.013 . 1 . . . . 44 THR HA . 27017 1 525 . 1 1 44 44 THR HB H 1 4.757 0.008 . 1 . . . . 44 THR HB . 27017 1 526 . 1 1 44 44 THR HG21 H 1 1.349 0.013 . 1 . . . . 44 THR HG21 . 27017 1 527 . 1 1 44 44 THR HG22 H 1 1.349 0.013 . 1 . . . . 44 THR HG22 . 27017 1 528 . 1 1 44 44 THR HG23 H 1 1.349 0.013 . 1 . . . . 44 THR HG23 . 27017 1 529 . 1 1 44 44 THR C C 13 175.193 0.115 . 1 . . . . 44 THR C . 27017 1 530 . 1 1 44 44 THR CA C 13 60.527 0.052 . 1 . . . . 44 THR CA . 27017 1 531 . 1 1 44 44 THR CB C 13 70.995 0.098 . 1 . . . . 44 THR CB . 27017 1 532 . 1 1 44 44 THR CG2 C 13 21.609 0.010 . 1 . . . . 44 THR CG2 . 27017 1 533 . 1 1 44 44 THR N N 15 114.734 0.047 . 1 . . . . 44 THR N . 27017 1 534 . 1 1 45 45 GLU H H 1 8.776 0.002 . 1 . . . . 45 GLU H . 27017 1 535 . 1 1 45 45 GLU HA H 1 4.028 0.003 . 1 . . . . 45 GLU HA . 27017 1 536 . 1 1 45 45 GLU HB2 H 1 2.074 0.006 . 1 . . . . 45 GLU HB2 . 27017 1 537 . 1 1 45 45 GLU HG2 H 1 2.375 0.004 . 1 . . . . 45 GLU HG2 . 27017 1 538 . 1 1 45 45 GLU C C 13 178.922 0.011 . 1 . . . . 45 GLU C . 27017 1 539 . 1 1 45 45 GLU CA C 13 60.019 0.053 . 1 . . . . 45 GLU CA . 27017 1 540 . 1 1 45 45 GLU CB C 13 28.863 0.062 . 1 . . . . 45 GLU CB . 27017 1 541 . 1 1 45 45 GLU CG C 13 36.051 0.041 . 1 . . . . 45 GLU CG . 27017 1 542 . 1 1 45 45 GLU N N 15 120.223 0.027 . 1 . . . . 45 GLU N . 27017 1 543 . 1 1 46 46 ALA H H 1 8.250 0.003 . 1 . . . . 46 ALA H . 27017 1 544 . 1 1 46 46 ALA HA H 1 4.131 0.004 . 1 . . . . 46 ALA HA . 27017 1 545 . 1 1 46 46 ALA HB1 H 1 1.433 0.003 . 1 . . . . 46 ALA HB1 . 27017 1 546 . 1 1 46 46 ALA HB2 H 1 1.433 0.003 . 1 . . . . 46 ALA HB2 . 27017 1 547 . 1 1 46 46 ALA HB3 H 1 1.433 0.003 . 1 . . . . 46 ALA HB3 . 27017 1 548 . 1 1 46 46 ALA C C 13 180.387 0.018 . 1 . . . . 46 ALA C . 27017 1 549 . 1 1 46 46 ALA CA C 13 55.048 0.070 . 1 . . . . 46 ALA CA . 27017 1 550 . 1 1 46 46 ALA CB C 13 18.282 0.086 . 1 . . . . 46 ALA CB . 27017 1 551 . 1 1 46 46 ALA N N 15 121.039 0.046 . 1 . . . . 46 ALA N . 27017 1 552 . 1 1 47 47 GLU H H 1 7.735 0.003 . 1 . . . . 47 GLU H . 27017 1 553 . 1 1 47 47 GLU HA H 1 4.115 0.003 . 1 . . . . 47 GLU HA . 27017 1 554 . 1 1 47 47 GLU HB2 H 1 2.196 0.004 . 1 . . . . 47 GLU HB2 . 27017 1 555 . 1 1 47 47 GLU HG2 H 1 2.386 0.003 . 1 . . . . 47 GLU HG2 . 27017 1 556 . 1 1 47 47 GLU C C 13 179.392 0.035 . 1 . . . . 47 GLU C . 27017 1 557 . 1 1 47 47 GLU CA C 13 59.032 0.066 . 1 . . . . 47 GLU CA . 27017 1 558 . 1 1 47 47 GLU CB C 13 29.537 0.122 . 1 . . . . 47 GLU CB . 27017 1 559 . 1 1 47 47 GLU CG C 13 37.400 0.000 . 1 . . . . 47 GLU CG . 27017 1 560 . 1 1 47 47 GLU N N 15 118.725 0.018 . 1 . . . . 47 GLU N . 27017 1 561 . 1 1 48 48 LEU H H 1 8.341 0.003 . 1 . . . . 48 LEU H . 27017 1 562 . 1 1 48 48 LEU HA H 1 4.114 0.007 . 1 . . . . 48 LEU HA . 27017 1 563 . 1 1 48 48 LEU HB2 H 1 1.179 0.009 . 2 . . . . 48 LEU HB2 . 27017 1 564 . 1 1 48 48 LEU HB3 H 1 2.143 0.010 . 2 . . . . 48 LEU HB3 . 27017 1 565 . 1 1 48 48 LEU HG H 1 1.734 0.005 . 1 . . . . 48 LEU HG . 27017 1 566 . 1 1 48 48 LEU HD11 H 1 0.790 0.004 . 2 . . . . 48 LEU HD11 . 27017 1 567 . 1 1 48 48 LEU HD12 H 1 0.790 0.004 . 2 . . . . 48 LEU HD12 . 27017 1 568 . 1 1 48 48 LEU HD13 H 1 0.790 0.004 . 2 . . . . 48 LEU HD13 . 27017 1 569 . 1 1 48 48 LEU HD21 H 1 0.863 0.005 . 2 . . . . 48 LEU HD21 . 27017 1 570 . 1 1 48 48 LEU HD22 H 1 0.863 0.005 . 2 . . . . 48 LEU HD22 . 27017 1 571 . 1 1 48 48 LEU HD23 H 1 0.863 0.005 . 2 . . . . 48 LEU HD23 . 27017 1 572 . 1 1 48 48 LEU C C 13 178.931 0.021 . 1 . . . . 48 LEU C . 27017 1 573 . 1 1 48 48 LEU CA C 13 58.105 0.028 . 1 . . . . 48 LEU CA . 27017 1 574 . 1 1 48 48 LEU CB C 13 42.682 0.067 . 1 . . . . 48 LEU CB . 27017 1 575 . 1 1 48 48 LEU CD1 C 13 23.308 0.082 . 2 . . . . 48 LEU CD1 . 27017 1 576 . 1 1 48 48 LEU CD2 C 13 26.095 0.070 . 2 . . . . 48 LEU CD2 . 27017 1 577 . 1 1 48 48 LEU N N 15 119.180 0.020 . 1 . . . . 48 LEU N . 27017 1 578 . 1 1 49 49 GLN H H 1 8.009 0.004 . 1 . . . . 49 GLN H . 27017 1 579 . 1 1 49 49 GLN HA H 1 3.844 0.003 . 1 . . . . 49 GLN HA . 27017 1 580 . 1 1 49 49 GLN HB2 H 1 2.225 0.003 . 1 . . . . 49 GLN HB2 . 27017 1 581 . 1 1 49 49 GLN HG2 H 1 2.451 0.005 . 2 . . . . 49 GLN HG2 . 27017 1 582 . 1 1 49 49 GLN HG3 H 1 2.465 0.012 . 2 . . . . 49 GLN HG3 . 27017 1 583 . 1 1 49 49 GLN HE21 H 1 7.510 0.002 . 1 . . . . 49 GLN HE21 . 27017 1 584 . 1 1 49 49 GLN HE22 H 1 6.838 0.002 . 1 . . . . 49 GLN HE22 . 27017 1 585 . 1 1 49 49 GLN C C 13 178.400 0.011 . 1 . . . . 49 GLN C . 27017 1 586 . 1 1 49 49 GLN CA C 13 58.630 0.075 . 1 . . . . 49 GLN CA . 27017 1 587 . 1 1 49 49 GLN CB C 13 28.332 0.037 . 1 . . . . 49 GLN CB . 27017 1 588 . 1 1 49 49 GLN CG C 13 34.230 0.067 . 1 . . . . 49 GLN CG . 27017 1 589 . 1 1 49 49 GLN CD C 13 180.213 0.012 . 1 . . . . 49 GLN CD . 27017 1 590 . 1 1 49 49 GLN N N 15 118.104 0.020 . 1 . . . . 49 GLN N . 27017 1 591 . 1 1 49 49 GLN NE2 N 15 112.926 0.063 . 1 . . . . 49 GLN NE2 . 27017 1 592 . 1 1 50 50 ASP H H 1 8.119 0.004 . 1 . . . . 50 ASP H . 27017 1 593 . 1 1 50 50 ASP HA H 1 4.494 0.006 . 1 . . . . 50 ASP HA . 27017 1 594 . 1 1 50 50 ASP HB2 H 1 2.650 0.008 . 2 . . . . 50 ASP HB2 . 27017 1 595 . 1 1 50 50 ASP HB3 H 1 2.929 0.014 . 2 . . . . 50 ASP HB3 . 27017 1 596 . 1 1 50 50 ASP C C 13 179.269 0.032 . 1 . . . . 50 ASP C . 27017 1 597 . 1 1 50 50 ASP CA C 13 57.603 0.084 . 1 . . . . 50 ASP CA . 27017 1 598 . 1 1 50 50 ASP CB C 13 40.463 0.036 . 1 . . . . 50 ASP CB . 27017 1 599 . 1 1 50 50 ASP N N 15 121.031 0.066 . 1 . . . . 50 ASP N . 27017 1 600 . 1 1 51 51 MET H H 1 8.454 0.002 . 1 . . . . 51 MET H . 27017 1 601 . 1 1 51 51 MET HA H 1 3.809 0.009 . 1 . . . . 51 MET HA . 27017 1 602 . 1 1 51 51 MET HB2 H 1 1.990 0.003 . 2 . . . . 51 MET HB2 . 27017 1 603 . 1 1 51 51 MET HB3 H 1 2.234 0.018 . 2 . . . . 51 MET HB3 . 27017 1 604 . 1 1 51 51 MET HG2 H 1 2.289 0.009 . 2 . . . . 51 MET HG2 . 27017 1 605 . 1 1 51 51 MET HG3 H 1 2.817 0.011 . 2 . . . . 51 MET HG3 . 27017 1 606 . 1 1 51 51 MET HE1 H 1 2.047 0.000 . 1 . . . . 51 MET HE1 . 27017 1 607 . 1 1 51 51 MET HE2 H 1 2.047 0.000 . 1 . . . . 51 MET HE2 . 27017 1 608 . 1 1 51 51 MET HE3 H 1 2.047 0.000 . 1 . . . . 51 MET HE3 . 27017 1 609 . 1 1 51 51 MET C C 13 177.942 0.023 . 1 . . . . 51 MET C . 27017 1 610 . 1 1 51 51 MET CA C 13 59.935 0.062 . 1 . . . . 51 MET CA . 27017 1 611 . 1 1 51 51 MET CB C 13 34.064 0.035 . 1 . . . . 51 MET CB . 27017 1 612 . 1 1 51 51 MET CG C 13 32.555 0.068 . 1 . . . . 51 MET CG . 27017 1 613 . 1 1 51 51 MET CE C 13 17.563 0.000 . 1 . . . . 51 MET CE . 27017 1 614 . 1 1 51 51 MET N N 15 121.208 0.067 . 1 . . . . 51 MET N . 27017 1 615 . 1 1 52 52 ILE H H 1 7.882 0.006 . 1 . . . . 52 ILE H . 27017 1 616 . 1 1 52 52 ILE HA H 1 3.494 0.008 . 1 . . . . 52 ILE HA . 27017 1 617 . 1 1 52 52 ILE HB H 1 2.060 0.007 . 1 . . . . 52 ILE HB . 27017 1 618 . 1 1 52 52 ILE HG12 H 1 1.212 0.006 . 2 . . . . 52 ILE HG12 . 27017 1 619 . 1 1 52 52 ILE HG13 H 1 1.673 0.009 . 2 . . . . 52 ILE HG13 . 27017 1 620 . 1 1 52 52 ILE HG21 H 1 0.737 0.011 . 1 . . . . 52 ILE HG21 . 27017 1 621 . 1 1 52 52 ILE HG22 H 1 0.737 0.011 . 1 . . . . 52 ILE HG22 . 27017 1 622 . 1 1 52 52 ILE HG23 H 1 0.737 0.011 . 1 . . . . 52 ILE HG23 . 27017 1 623 . 1 1 52 52 ILE HD11 H 1 0.693 0.026 . 1 . . . . 52 ILE HD11 . 27017 1 624 . 1 1 52 52 ILE HD12 H 1 0.693 0.026 . 1 . . . . 52 ILE HD12 . 27017 1 625 . 1 1 52 52 ILE HD13 H 1 0.693 0.026 . 1 . . . . 52 ILE HD13 . 27017 1 626 . 1 1 52 52 ILE C C 13 178.447 0.007 . 1 . . . . 52 ILE C . 27017 1 627 . 1 1 52 52 ILE CA C 13 64.698 0.089 . 1 . . . . 52 ILE CA . 27017 1 628 . 1 1 52 52 ILE CB C 13 36.593 0.086 . 1 . . . . 52 ILE CB . 27017 1 629 . 1 1 52 52 ILE CG1 C 13 29.386 0.089 . 1 . . . . 52 ILE CG1 . 27017 1 630 . 1 1 52 52 ILE CG2 C 13 16.478 0.052 . 1 . . . . 52 ILE CG2 . 27017 1 631 . 1 1 52 52 ILE CD1 C 13 11.957 0.047 . 1 . . . . 52 ILE CD1 . 27017 1 632 . 1 1 52 52 ILE N N 15 117.544 0.051 . 1 . . . . 52 ILE N . 27017 1 633 . 1 1 53 53 ASN H H 1 8.541 0.003 . 1 . . . . 53 ASN H . 27017 1 634 . 1 1 53 53 ASN HA H 1 4.455 0.005 . 1 . . . . 53 ASN HA . 27017 1 635 . 1 1 53 53 ASN HB2 H 1 2.944 0.009 . 2 . . . . 53 ASN HB2 . 27017 1 636 . 1 1 53 53 ASN HB3 H 1 3.040 0.007 . 2 . . . . 53 ASN HB3 . 27017 1 637 . 1 1 53 53 ASN HD21 H 1 6.950 0.002 . 1 . . . . 53 ASN HD21 . 27017 1 638 . 1 1 53 53 ASN HD22 H 1 7.900 0.001 . 1 . . . . 53 ASN HD22 . 27017 1 639 . 1 1 53 53 ASN C C 13 176.672 0.025 . 1 . . . . 53 ASN C . 27017 1 640 . 1 1 53 53 ASN CA C 13 55.922 0.073 . 1 . . . . 53 ASN CA . 27017 1 641 . 1 1 53 53 ASN CB C 13 38.180 0.131 . 1 . . . . 53 ASN CB . 27017 1 642 . 1 1 53 53 ASN CG C 13 176.421 0.045 . 1 . . . . 53 ASN CG . 27017 1 643 . 1 1 53 53 ASN N N 15 117.915 0.039 . 1 . . . . 53 ASN N . 27017 1 644 . 1 1 53 53 ASN ND2 N 15 112.402 0.019 . 1 . . . . 53 ASN ND2 . 27017 1 645 . 1 1 54 54 GLU H H 1 7.447 0.003 . 1 . . . . 54 GLU H . 27017 1 646 . 1 1 54 54 GLU HA H 1 4.113 0.005 . 1 . . . . 54 GLU HA . 27017 1 647 . 1 1 54 54 GLU HB2 H 1 2.186 0.009 . 2 . . . . 54 GLU HB2 . 27017 1 648 . 1 1 54 54 GLU HB3 H 1 2.188 0.009 . 2 . . . . 54 GLU HB3 . 27017 1 649 . 1 1 54 54 GLU HG2 H 1 2.330 0.004 . 2 . . . . 54 GLU HG2 . 27017 1 650 . 1 1 54 54 GLU HG3 H 1 2.412 0.002 . 2 . . . . 54 GLU HG3 . 27017 1 651 . 1 1 54 54 GLU C C 13 176.866 0.022 . 1 . . . . 54 GLU C . 27017 1 652 . 1 1 54 54 GLU CA C 13 58.221 0.061 . 1 . . . . 54 GLU CA . 27017 1 653 . 1 1 54 54 GLU CB C 13 29.549 0.047 . 1 . . . . 54 GLU CB . 27017 1 654 . 1 1 54 54 GLU CG C 13 35.417 0.023 . 1 . . . . 54 GLU CG . 27017 1 655 . 1 1 54 54 GLU N N 15 116.988 0.051 . 1 . . . . 54 GLU N . 27017 1 656 . 1 1 55 55 VAL H H 1 7.308 0.003 . 1 . . . . 55 VAL H . 27017 1 657 . 1 1 55 55 VAL HA H 1 4.143 0.004 . 1 . . . . 55 VAL HA . 27017 1 658 . 1 1 55 55 VAL HB H 1 2.083 0.006 . 1 . . . . 55 VAL HB . 27017 1 659 . 1 1 55 55 VAL HG11 H 1 0.943 0.004 . 2 . . . . 55 VAL HG11 . 27017 1 660 . 1 1 55 55 VAL HG12 H 1 0.943 0.004 . 2 . . . . 55 VAL HG12 . 27017 1 661 . 1 1 55 55 VAL HG13 H 1 0.943 0.004 . 2 . . . . 55 VAL HG13 . 27017 1 662 . 1 1 55 55 VAL HG21 H 1 0.992 0.006 . 2 . . . . 55 VAL HG21 . 27017 1 663 . 1 1 55 55 VAL HG22 H 1 0.992 0.006 . 2 . . . . 55 VAL HG22 . 27017 1 664 . 1 1 55 55 VAL HG23 H 1 0.992 0.006 . 2 . . . . 55 VAL HG23 . 27017 1 665 . 1 1 55 55 VAL C C 13 175.532 0.001 . 1 . . . . 55 VAL C . 27017 1 666 . 1 1 55 55 VAL CA C 13 61.593 0.038 . 1 . . . . 55 VAL CA . 27017 1 667 . 1 1 55 55 VAL CB C 13 33.280 0.038 . 1 . . . . 55 VAL CB . 27017 1 668 . 1 1 55 55 VAL CG1 C 13 21.225 0.041 . 2 . . . . 55 VAL CG1 . 27017 1 669 . 1 1 55 55 VAL CG2 C 13 23.564 0.069 . 2 . . . . 55 VAL CG2 . 27017 1 670 . 1 1 55 55 VAL N N 15 114.101 0.051 . 1 . . . . 55 VAL N . 27017 1 671 . 1 1 56 56 ASP H H 1 7.983 0.003 . 1 . . . . 56 ASP H . 27017 1 672 . 1 1 56 56 ASP HA H 1 4.428 0.004 . 1 . . . . 56 ASP HA . 27017 1 673 . 1 1 56 56 ASP HB2 H 1 2.482 0.002 . 2 . . . . 56 ASP HB2 . 27017 1 674 . 1 1 56 56 ASP HB3 H 1 2.739 0.016 . 2 . . . . 56 ASP HB3 . 27017 1 675 . 1 1 56 56 ASP C C 13 175.599 0.004 . 1 . . . . 56 ASP C . 27017 1 676 . 1 1 56 56 ASP CA C 13 54.008 0.027 . 1 . . . . 56 ASP CA . 27017 1 677 . 1 1 56 56 ASP CB C 13 41.307 0.067 . 1 . . . . 56 ASP CB . 27017 1 678 . 1 1 56 56 ASP N N 15 120.664 0.039 . 1 . . . . 56 ASP N . 27017 1 679 . 1 1 57 57 ALA H H 1 8.148 0.003 . 1 . . . . 57 ALA H . 27017 1 680 . 1 1 57 57 ALA HA H 1 4.326 0.002 . 1 . . . . 57 ALA HA . 27017 1 681 . 1 1 57 57 ALA HB1 H 1 1.545 0.001 . 1 . . . . 57 ALA HB1 . 27017 1 682 . 1 1 57 57 ALA HB2 H 1 1.545 0.001 . 1 . . . . 57 ALA HB2 . 27017 1 683 . 1 1 57 57 ALA HB3 H 1 1.545 0.001 . 1 . . . . 57 ALA HB3 . 27017 1 684 . 1 1 57 57 ALA C C 13 178.617 0.022 . 1 . . . . 57 ALA C . 27017 1 685 . 1 1 57 57 ALA CA C 13 53.971 0.071 . 1 . . . . 57 ALA CA . 27017 1 686 . 1 1 57 57 ALA CB C 13 20.060 0.105 . 1 . . . . 57 ALA CB . 27017 1 687 . 1 1 57 57 ALA N N 15 130.891 0.011 . 1 . . . . 57 ALA N . 27017 1 688 . 1 1 58 58 ASP H H 1 8.261 0.004 . 1 . . . . 58 ASP H . 27017 1 689 . 1 1 58 58 ASP HA H 1 4.662 0.009 . 1 . . . . 58 ASP HA . 27017 1 690 . 1 1 58 58 ASP HB2 H 1 2.694 0.007 . 2 . . . . 58 ASP HB2 . 27017 1 691 . 1 1 58 58 ASP HB3 H 1 3.059 0.004 . 2 . . . . 58 ASP HB3 . 27017 1 692 . 1 1 58 58 ASP C C 13 177.889 0.019 . 1 . . . . 58 ASP C . 27017 1 693 . 1 1 58 58 ASP CA C 13 52.786 0.060 . 1 . . . . 58 ASP CA . 27017 1 694 . 1 1 58 58 ASP CB C 13 39.966 0.068 . 1 . . . . 58 ASP CB . 27017 1 695 . 1 1 58 58 ASP N N 15 114.621 0.013 . 1 . . . . 58 ASP N . 27017 1 696 . 1 1 59 59 GLY H H 1 7.641 0.002 . 1 . . . . 59 GLY H . 27017 1 697 . 1 1 59 59 GLY HA2 H 1 3.796 0.001 . 2 . . . . 59 GLY HA2 . 27017 1 698 . 1 1 59 59 GLY HA3 H 1 3.946 0.002 . 2 . . . . 59 GLY HA3 . 27017 1 699 . 1 1 59 59 GLY C C 13 175.053 0.000 . 1 . . . . 59 GLY C . 27017 1 700 . 1 1 59 59 GLY CA C 13 47.242 0.054 . 1 . . . . 59 GLY CA . 27017 1 701 . 1 1 59 59 GLY N N 15 108.921 0.032 . 1 . . . . 59 GLY N . 27017 1 702 . 1 1 60 60 ASN H H 1 8.195 0.001 . 1 . . . . 60 ASN H . 27017 1 703 . 1 1 60 60 ASN HA H 1 4.643 0.007 . 1 . . . . 60 ASN HA . 27017 1 704 . 1 1 60 60 ASN HB2 H 1 2.695 0.001 . 2 . . . . 60 ASN HB2 . 27017 1 705 . 1 1 60 60 ASN HB3 H 1 3.307 0.007 . 2 . . . . 60 ASN HB3 . 27017 1 706 . 1 1 60 60 ASN HD21 H 1 7.750 0.005 . 1 . . . . 60 ASN HD21 . 27017 1 707 . 1 1 60 60 ASN HD22 H 1 7.058 0.001 . 1 . . . . 60 ASN HD22 . 27017 1 708 . 1 1 60 60 ASN C C 13 176.931 0.015 . 1 . . . . 60 ASN C . 27017 1 709 . 1 1 60 60 ASN CA C 13 52.675 0.086 . 1 . . . . 60 ASN CA . 27017 1 710 . 1 1 60 60 ASN CB C 13 37.456 0.100 . 1 . . . . 60 ASN CB . 27017 1 711 . 1 1 60 60 ASN CG C 13 178.722 0.027 . 1 . . . . 60 ASN CG . 27017 1 712 . 1 1 60 60 ASN N N 15 118.959 0.065 . 1 . . . . 60 ASN N . 27017 1 713 . 1 1 60 60 ASN ND2 N 15 115.259 0.071 . 1 . . . . 60 ASN ND2 . 27017 1 714 . 1 1 61 61 GLY H H 1 10.396 0.004 . 1 . . . . 61 GLY H . 27017 1 715 . 1 1 61 61 GLY HA2 H 1 3.513 0.005 . 2 . . . . 61 GLY HA2 . 27017 1 716 . 1 1 61 61 GLY HA3 H 1 4.286 0.007 . 2 . . . . 61 GLY HA3 . 27017 1 717 . 1 1 61 61 GLY C C 13 173.308 0.000 . 1 . . . . 61 GLY C . 27017 1 718 . 1 1 61 61 GLY CA C 13 45.683 0.072 . 1 . . . . 61 GLY CA . 27017 1 719 . 1 1 61 61 GLY N N 15 112.918 0.033 . 1 . . . . 61 GLY N . 27017 1 720 . 1 1 62 62 THR H H 1 7.624 0.003 . 1 . . . . 62 THR H . 27017 1 721 . 1 1 62 62 THR HA H 1 4.817 0.005 . 1 . . . . 62 THR HA . 27017 1 722 . 1 1 62 62 THR HB H 1 4.025 0.008 . 1 . . . . 62 THR HB . 27017 1 723 . 1 1 62 62 THR HG21 H 1 1.153 0.002 . 1 . . . . 62 THR HG21 . 27017 1 724 . 1 1 62 62 THR HG22 H 1 1.153 0.002 . 1 . . . . 62 THR HG22 . 27017 1 725 . 1 1 62 62 THR HG23 H 1 1.153 0.002 . 1 . . . . 62 THR HG23 . 27017 1 726 . 1 1 62 62 THR C C 13 173.610 0.013 . 1 . . . . 62 THR C . 27017 1 727 . 1 1 62 62 THR CA C 13 59.414 0.086 . 1 . . . . 62 THR CA . 27017 1 728 . 1 1 62 62 THR CB C 13 72.608 0.039 . 1 . . . . 62 THR CB . 27017 1 729 . 1 1 62 62 THR CG2 C 13 22.474 0.055 . 1 . . . . 62 THR CG2 . 27017 1 730 . 1 1 62 62 THR N N 15 108.260 0.010 . 1 . . . . 62 THR N . 27017 1 731 . 1 1 63 63 ILE H H 1 8.506 0.004 . 1 . . . . 63 ILE H . 27017 1 732 . 1 1 63 63 ILE HA H 1 5.068 0.004 . 1 . . . . 63 ILE HA . 27017 1 733 . 1 1 63 63 ILE HB H 1 2.029 0.015 . 1 . . . . 63 ILE HB . 27017 1 734 . 1 1 63 63 ILE HG12 H 1 0.926 0.005 . 1 . . . . 63 ILE HG12 . 27017 1 735 . 1 1 63 63 ILE HG21 H 1 1.246 0.005 . 1 . . . . 63 ILE HG21 . 27017 1 736 . 1 1 63 63 ILE HG22 H 1 1.246 0.005 . 1 . . . . 63 ILE HG22 . 27017 1 737 . 1 1 63 63 ILE HG23 H 1 1.246 0.005 . 1 . . . . 63 ILE HG23 . 27017 1 738 . 1 1 63 63 ILE HD11 H 1 0.772 0.005 . 1 . . . . 63 ILE HD11 . 27017 1 739 . 1 1 63 63 ILE HD12 H 1 0.772 0.005 . 1 . . . . 63 ILE HD12 . 27017 1 740 . 1 1 63 63 ILE HD13 H 1 0.772 0.005 . 1 . . . . 63 ILE HD13 . 27017 1 741 . 1 1 63 63 ILE C C 13 175.533 0.023 . 1 . . . . 63 ILE C . 27017 1 742 . 1 1 63 63 ILE CA C 13 60.066 0.117 . 1 . . . . 63 ILE CA . 27017 1 743 . 1 1 63 63 ILE CB C 13 39.967 0.062 . 1 . . . . 63 ILE CB . 27017 1 744 . 1 1 63 63 ILE CG1 C 13 27.024 0.033 . 1 . . . . 63 ILE CG1 . 27017 1 745 . 1 1 63 63 ILE CG2 C 13 18.039 0.119 . 1 . . . . 63 ILE CG2 . 27017 1 746 . 1 1 63 63 ILE CD1 C 13 13.361 0.021 . 1 . . . . 63 ILE CD1 . 27017 1 747 . 1 1 63 63 ILE N N 15 122.583 0.046 . 1 . . . . 63 ILE N . 27017 1 748 . 1 1 64 64 ASP H H 1 9.195 0.003 . 1 . . . . 64 ASP H . 27017 1 749 . 1 1 64 64 ASP HA H 1 5.556 0.003 . 1 . . . . 64 ASP HA . 27017 1 750 . 1 1 64 64 ASP HB2 H 1 2.881 0.014 . 2 . . . . 64 ASP HB2 . 27017 1 751 . 1 1 64 64 ASP HB3 H 1 3.100 0.004 . 2 . . . . 64 ASP HB3 . 27017 1 752 . 1 1 64 64 ASP C C 13 176.184 0.004 . 1 . . . . 64 ASP C . 27017 1 753 . 1 1 64 64 ASP CA C 13 52.181 0.036 . 1 . . . . 64 ASP CA . 27017 1 754 . 1 1 64 64 ASP CB C 13 42.268 0.053 . 1 . . . . 64 ASP CB . 27017 1 755 . 1 1 64 64 ASP N N 15 129.123 0.029 . 1 . . . . 64 ASP N . 27017 1 756 . 1 1 65 65 PHE H H 1 8.937 0.006 . 1 . . . . 65 PHE H . 27017 1 757 . 1 1 65 65 PHE HA H 1 3.952 0.014 . 1 . . . . 65 PHE HA . 27017 1 758 . 1 1 65 65 PHE HB2 H 1 2.124 0.009 . 2 . . . . 65 PHE HB2 . 27017 1 759 . 1 1 65 65 PHE HB3 H 1 2.873 0.009 . 2 . . . . 65 PHE HB3 . 27017 1 760 . 1 1 65 65 PHE HD1 H 1 6.732 0.004 . 1 . . . . 65 PHE HD1 . 27017 1 761 . 1 1 65 65 PHE HD2 H 1 6.732 0.004 . 1 . . . . 65 PHE HD2 . 27017 1 762 . 1 1 65 65 PHE HE1 H 1 7.195 0.003 . 1 . . . . 65 PHE HE1 . 27017 1 763 . 1 1 65 65 PHE HE2 H 1 7.195 0.003 . 1 . . . . 65 PHE HE2 . 27017 1 764 . 1 1 65 65 PHE HZ H 1 7.430 0.002 . 1 . . . . 65 PHE HZ . 27017 1 765 . 1 1 65 65 PHE C C 13 173.998 0.000 . 1 . . . . 65 PHE C . 27017 1 766 . 1 1 65 65 PHE CA C 13 62.774 0.054 . 1 . . . . 65 PHE CA . 27017 1 767 . 1 1 65 65 PHE CB C 13 36.104 0.063 . 1 . . . . 65 PHE CB . 27017 1 768 . 1 1 65 65 PHE CD1 C 13 131.911 0.082 . 1 . . . . 65 PHE CD1 . 27017 1 769 . 1 1 65 65 PHE CD2 C 13 131.911 0.082 . 1 . . . . 65 PHE CD2 . 27017 1 770 . 1 1 65 65 PHE CE1 C 13 130.623 0.059 . 1 . . . . 65 PHE CE1 . 27017 1 771 . 1 1 65 65 PHE CE2 C 13 130.623 0.059 . 1 . . . . 65 PHE CE2 . 27017 1 772 . 1 1 65 65 PHE CZ C 13 129.662 0.071 . 1 . . . . 65 PHE CZ . 27017 1 773 . 1 1 65 65 PHE N N 15 118.674 0.027 . 1 . . . . 65 PHE N . 27017 1 774 . 1 1 66 66 PRO HA H 1 3.849 0.011 . 1 . . . . 66 PRO HA . 27017 1 775 . 1 1 66 66 PRO HB2 H 1 2.236 0.007 . 1 . . . . 66 PRO HB2 . 27017 1 776 . 1 1 66 66 PRO HG2 H 1 1.903 0.013 . 2 . . . . 66 PRO HG2 . 27017 1 777 . 1 1 66 66 PRO HG3 H 1 2.191 0.009 . 2 . . . . 66 PRO HG3 . 27017 1 778 . 1 1 66 66 PRO HD2 H 1 3.737 0.014 . 1 . . . . 66 PRO HD2 . 27017 1 779 . 1 1 66 66 PRO HD3 H 1 3.737 0.014 . 1 . . . . 66 PRO HD3 . 27017 1 780 . 1 1 66 66 PRO C C 13 180.042 0.022 . 1 . . . . 66 PRO C . 27017 1 781 . 1 1 66 66 PRO CA C 13 66.802 0.061 . 1 . . . . 66 PRO CA . 27017 1 782 . 1 1 66 66 PRO CB C 13 30.623 0.090 . 1 . . . . 66 PRO CB . 27017 1 783 . 1 1 66 66 PRO CG C 13 28.500 0.057 . 1 . . . . 66 PRO CG . 27017 1 784 . 1 1 66 66 PRO CD C 13 49.188 0.086 . 1 . . . . 66 PRO CD . 27017 1 785 . 1 1 67 67 GLU H H 1 8.355 0.003 . 1 . . . . 67 GLU H . 27017 1 786 . 1 1 67 67 GLU HA H 1 4.027 0.007 . 1 . . . . 67 GLU HA . 27017 1 787 . 1 1 67 67 GLU HB2 H 1 2.077 0.019 . 2 . . . . 67 GLU HB2 . 27017 1 788 . 1 1 67 67 GLU HB3 H 1 2.003 0.014 . 2 . . . . 67 GLU HB3 . 27017 1 789 . 1 1 67 67 GLU HG2 H 1 2.322 0.004 . 2 . . . . 67 GLU HG2 . 27017 1 790 . 1 1 67 67 GLU HG3 H 1 2.476 0.006 . 2 . . . . 67 GLU HG3 . 27017 1 791 . 1 1 67 67 GLU C C 13 179.525 0.005 . 1 . . . . 67 GLU C . 27017 1 792 . 1 1 67 67 GLU CA C 13 58.907 0.044 . 1 . . . . 67 GLU CA . 27017 1 793 . 1 1 67 67 GLU CB C 13 29.415 0.128 . 1 . . . . 67 GLU CB . 27017 1 794 . 1 1 67 67 GLU CG C 13 37.292 0.055 . 1 . . . . 67 GLU CG . 27017 1 795 . 1 1 67 67 GLU N N 15 118.357 0.039 . 1 . . . . 67 GLU N . 27017 1 796 . 1 1 68 68 PHE H H 1 8.650 0.005 . 1 . . . . 68 PHE H . 27017 1 797 . 1 1 68 68 PHE HA H 1 3.966 0.006 . 1 . . . . 68 PHE HA . 27017 1 798 . 1 1 68 68 PHE HB2 H 1 3.177 0.007 . 2 . . . . 68 PHE HB2 . 27017 1 799 . 1 1 68 68 PHE HB3 H 1 3.508 0.011 . 2 . . . . 68 PHE HB3 . 27017 1 800 . 1 1 68 68 PHE HD1 H 1 6.972 0.006 . 1 . . . . 68 PHE HD1 . 27017 1 801 . 1 1 68 68 PHE HD2 H 1 6.972 0.006 . 1 . . . . 68 PHE HD2 . 27017 1 802 . 1 1 68 68 PHE HE1 H 1 7.377 0.002 . 1 . . . . 68 PHE HE1 . 27017 1 803 . 1 1 68 68 PHE HE2 H 1 7.377 0.002 . 1 . . . . 68 PHE HE2 . 27017 1 804 . 1 1 68 68 PHE HZ H 1 7.271 0.024 . 1 . . . . 68 PHE HZ . 27017 1 805 . 1 1 68 68 PHE C C 13 176.474 0.015 . 1 . . . . 68 PHE C . 27017 1 806 . 1 1 68 68 PHE CA C 13 61.442 0.056 . 1 . . . . 68 PHE CA . 27017 1 807 . 1 1 68 68 PHE CB C 13 40.610 0.070 . 1 . . . . 68 PHE CB . 27017 1 808 . 1 1 68 68 PHE CD1 C 13 131.856 0.088 . 1 . . . . 68 PHE CD1 . 27017 1 809 . 1 1 68 68 PHE CD2 C 13 131.856 0.088 . 1 . . . . 68 PHE CD2 . 27017 1 810 . 1 1 68 68 PHE CE1 C 13 131.213 0.058 . 1 . . . . 68 PHE CE1 . 27017 1 811 . 1 1 68 68 PHE CE2 C 13 131.213 0.058 . 1 . . . . 68 PHE CE2 . 27017 1 812 . 1 1 68 68 PHE CZ C 13 129.700 0.001 . 1 . . . . 68 PHE CZ . 27017 1 813 . 1 1 68 68 PHE N N 15 123.936 0.020 . 1 . . . . 68 PHE N . 27017 1 814 . 1 1 69 69 LEU H H 1 8.863 0.003 . 1 . . . . 69 LEU H . 27017 1 815 . 1 1 69 69 LEU HA H 1 3.227 0.006 . 1 . . . . 69 LEU HA . 27017 1 816 . 1 1 69 69 LEU HB2 H 1 1.112 0.006 . 2 . . . . 69 LEU HB2 . 27017 1 817 . 1 1 69 69 LEU HB3 H 1 1.202 0.011 . 2 . . . . 69 LEU HB3 . 27017 1 818 . 1 1 69 69 LEU HG H 1 0.868 0.005 . 1 . . . . 69 LEU HG . 27017 1 819 . 1 1 69 69 LEU HD11 H 1 0.430 0.001 . 2 . . . . 69 LEU HD11 . 27017 1 820 . 1 1 69 69 LEU HD12 H 1 0.430 0.001 . 2 . . . . 69 LEU HD12 . 27017 1 821 . 1 1 69 69 LEU HD13 H 1 0.430 0.001 . 2 . . . . 69 LEU HD13 . 27017 1 822 . 1 1 69 69 LEU HD21 H 1 0.503 0.001 . 2 . . . . 69 LEU HD21 . 27017 1 823 . 1 1 69 69 LEU HD22 H 1 0.503 0.001 . 2 . . . . 69 LEU HD22 . 27017 1 824 . 1 1 69 69 LEU HD23 H 1 0.503 0.001 . 2 . . . . 69 LEU HD23 . 27017 1 825 . 1 1 69 69 LEU C C 13 178.822 0.009 . 1 . . . . 69 LEU C . 27017 1 826 . 1 1 69 69 LEU CA C 13 57.724 0.023 . 1 . . . . 69 LEU CA . 27017 1 827 . 1 1 69 69 LEU CB C 13 41.046 0.073 . 1 . . . . 69 LEU CB . 27017 1 828 . 1 1 69 69 LEU CG C 13 25.794 0.089 . 1 . . . . 69 LEU CG . 27017 1 829 . 1 1 69 69 LEU CD1 C 13 25.112 0.106 . 2 . . . . 69 LEU CD1 . 27017 1 830 . 1 1 69 69 LEU CD2 C 13 24.007 0.013 . 2 . . . . 69 LEU CD2 . 27017 1 831 . 1 1 69 69 LEU N N 15 120.301 0.031 . 1 . . . . 69 LEU N . 27017 1 832 . 1 1 70 70 SER H H 1 7.732 0.003 . 1 . . . . 70 SER H . 27017 1 833 . 1 1 70 70 SER HA H 1 3.995 0.003 . 1 . . . . 70 SER HA . 27017 1 834 . 1 1 70 70 SER HB2 H 1 3.891 0.017 . 2 . . . . 70 SER HB2 . 27017 1 835 . 1 1 70 70 SER HB3 H 1 3.869 0.015 . 2 . . . . 70 SER HB3 . 27017 1 836 . 1 1 70 70 SER C C 13 176.843 0.032 . 1 . . . . 70 SER C . 27017 1 837 . 1 1 70 70 SER CA C 13 61.384 0.029 . 1 . . . . 70 SER CA . 27017 1 838 . 1 1 70 70 SER CB C 13 62.703 0.056 . 1 . . . . 70 SER CB . 27017 1 839 . 1 1 70 70 SER N N 15 113.226 0.041 . 1 . . . . 70 SER N . 27017 1 840 . 1 1 71 71 LEU H H 1 7.347 0.003 . 1 . . . . 71 LEU H . 27017 1 841 . 1 1 71 71 LEU HA H 1 3.982 0.005 . 1 . . . . 71 LEU HA . 27017 1 842 . 1 1 71 71 LEU HB2 H 1 1.959 0.012 . 2 . . . . 71 LEU HB2 . 27017 1 843 . 1 1 71 71 LEU HB3 H 1 1.506 0.011 . 2 . . . . 71 LEU HB3 . 27017 1 844 . 1 1 71 71 LEU HG H 1 1.336 0.010 . 1 . . . . 71 LEU HG . 27017 1 845 . 1 1 71 71 LEU HD11 H 1 0.706 0.002 . 2 . . . . 71 LEU HD11 . 27017 1 846 . 1 1 71 71 LEU HD12 H 1 0.706 0.002 . 2 . . . . 71 LEU HD12 . 27017 1 847 . 1 1 71 71 LEU HD13 H 1 0.706 0.002 . 2 . . . . 71 LEU HD13 . 27017 1 848 . 1 1 71 71 LEU HD21 H 1 0.834 0.004 . 2 . . . . 71 LEU HD21 . 27017 1 849 . 1 1 71 71 LEU HD22 H 1 0.834 0.004 . 2 . . . . 71 LEU HD22 . 27017 1 850 . 1 1 71 71 LEU HD23 H 1 0.834 0.004 . 2 . . . . 71 LEU HD23 . 27017 1 851 . 1 1 71 71 LEU C C 13 178.210 0.001 . 1 . . . . 71 LEU C . 27017 1 852 . 1 1 71 71 LEU CA C 13 57.857 0.071 . 1 . . . . 71 LEU CA . 27017 1 853 . 1 1 71 71 LEU CB C 13 41.564 0.087 . 1 . . . . 71 LEU CB . 27017 1 854 . 1 1 71 71 LEU CG C 13 26.644 0.107 . 1 . . . . 71 LEU CG . 27017 1 855 . 1 1 71 71 LEU CD1 C 13 25.549 0.045 . 2 . . . . 71 LEU CD1 . 27017 1 856 . 1 1 71 71 LEU CD2 C 13 23.156 0.031 . 2 . . . . 71 LEU CD2 . 27017 1 857 . 1 1 71 71 LEU N N 15 121.434 0.010 . 1 . . . . 71 LEU N . 27017 1 858 . 1 1 72 72 MET H H 1 7.671 0.004 . 1 . . . . 72 MET H . 27017 1 859 . 1 1 72 72 MET HA H 1 4.087 0.004 . 1 . . . . 72 MET HA . 27017 1 860 . 1 1 72 72 MET HB2 H 1 1.258 0.005 . 2 . . . . 72 MET HB2 . 27017 1 861 . 1 1 72 72 MET HB3 H 1 1.260 0.004 . 2 . . . . 72 MET HB3 . 27017 1 862 . 1 1 72 72 MET HG2 H 1 1.609 0.006 . 1 . . . . 72 MET HG2 . 27017 1 863 . 1 1 72 72 MET HG3 H 1 1.609 0.006 . 1 . . . . 72 MET HG3 . 27017 1 864 . 1 1 72 72 MET HE1 H 1 1.897 0.001 . 1 . . . . 72 MET HE1 . 27017 1 865 . 1 1 72 72 MET HE2 H 1 1.897 0.001 . 1 . . . . 72 MET HE2 . 27017 1 866 . 1 1 72 72 MET HE3 H 1 1.897 0.001 . 1 . . . . 72 MET HE3 . 27017 1 867 . 1 1 72 72 MET C C 13 178.023 0.015 . 1 . . . . 72 MET C . 27017 1 868 . 1 1 72 72 MET CA C 13 55.241 0.026 . 1 . . . . 72 MET CA . 27017 1 869 . 1 1 72 72 MET CB C 13 30.179 0.102 . 1 . . . . 72 MET CB . 27017 1 870 . 1 1 72 72 MET CG C 13 31.610 0.016 . 1 . . . . 72 MET CG . 27017 1 871 . 1 1 72 72 MET CE C 13 16.439 0.002 . 1 . . . . 72 MET CE . 27017 1 872 . 1 1 72 72 MET N N 15 114.415 0.026 . 1 . . . . 72 MET N . 27017 1 873 . 1 1 73 73 ALA H H 1 7.901 0.004 . 1 . . . . 73 ALA H . 27017 1 874 . 1 1 73 73 ALA HA H 1 4.289 0.003 . 1 . . . . 73 ALA HA . 27017 1 875 . 1 1 73 73 ALA HB1 H 1 1.293 0.001 . 1 . . . . 73 ALA HB1 . 27017 1 876 . 1 1 73 73 ALA HB2 H 1 1.293 0.001 . 1 . . . . 73 ALA HB2 . 27017 1 877 . 1 1 73 73 ALA HB3 H 1 1.293 0.001 . 1 . . . . 73 ALA HB3 . 27017 1 878 . 1 1 73 73 ALA C C 13 177.414 0.019 . 1 . . . . 73 ALA C . 27017 1 879 . 1 1 73 73 ALA CA C 13 52.123 0.040 . 1 . . . . 73 ALA CA . 27017 1 880 . 1 1 73 73 ALA CB C 13 19.022 0.077 . 1 . . . . 73 ALA CB . 27017 1 881 . 1 1 73 73 ALA N N 15 120.746 0.021 . 1 . . . . 73 ALA N . 27017 1 882 . 1 1 74 74 ARG H H 1 7.117 0.002 . 1 . . . . 74 ARG H . 27017 1 883 . 1 1 74 74 ARG HA H 1 4.057 0.008 . 1 . . . . 74 ARG HA . 27017 1 884 . 1 1 74 74 ARG HB2 H 1 1.805 0.003 . 2 . . . . 74 ARG HB2 . 27017 1 885 . 1 1 74 74 ARG HB3 H 1 1.880 0.007 . 2 . . . . 74 ARG HB3 . 27017 1 886 . 1 1 74 74 ARG HG2 H 1 1.660 0.010 . 2 . . . . 74 ARG HG2 . 27017 1 887 . 1 1 74 74 ARG HG3 H 1 1.808 0.004 . 2 . . . . 74 ARG HG3 . 27017 1 888 . 1 1 74 74 ARG HD2 H 1 3.177 0.003 . 1 . . . . 74 ARG HD2 . 27017 1 889 . 1 1 74 74 ARG HD3 H 1 3.177 0.003 . 1 . . . . 74 ARG HD3 . 27017 1 890 . 1 1 74 74 ARG HE H 1 7.134 0.003 . 1 . . . . 74 ARG HE . 27017 1 891 . 1 1 74 74 ARG C C 13 176.438 0.045 . 1 . . . . 74 ARG C . 27017 1 892 . 1 1 74 74 ARG CA C 13 57.387 0.094 . 1 . . . . 74 ARG CA . 27017 1 893 . 1 1 74 74 ARG CB C 13 30.885 0.101 . 1 . . . . 74 ARG CB . 27017 1 894 . 1 1 74 74 ARG CG C 13 26.906 0.089 . 1 . . . . 74 ARG CG . 27017 1 895 . 1 1 74 74 ARG CD C 13 43.820 0.076 . 1 . . . . 74 ARG CD . 27017 1 896 . 1 1 74 74 ARG N N 15 119.775 0.014 . 1 . . . . 74 ARG N . 27017 1 897 . 1 1 74 74 ARG NE N 15 84.613 0.035 . 1 . . . . 74 ARG NE . 27017 1 898 . 1 1 75 75 LYS H H 1 8.541 0.004 . 1 . . . . 75 LYS H . 27017 1 899 . 1 1 75 75 LYS HA H 1 4.310 0.003 . 1 . . . . 75 LYS HA . 27017 1 900 . 1 1 75 75 LYS HB2 H 1 1.785 0.006 . 2 . . . . 75 LYS HB2 . 27017 1 901 . 1 1 75 75 LYS HB3 H 1 1.806 0.008 . 2 . . . . 75 LYS HB3 . 27017 1 902 . 1 1 75 75 LYS HG2 H 1 1.443 0.003 . 1 . . . . 75 LYS HG2 . 27017 1 903 . 1 1 75 75 LYS HG3 H 1 1.443 0.003 . 1 . . . . 75 LYS HG3 . 27017 1 904 . 1 1 75 75 LYS HD2 H 1 1.708 0.005 . 1 . . . . 75 LYS HD2 . 27017 1 905 . 1 1 75 75 LYS HD3 H 1 1.708 0.005 . 1 . . . . 75 LYS HD3 . 27017 1 906 . 1 1 75 75 LYS HE2 H 1 3.015 0.003 . 1 . . . . 75 LYS HE2 . 27017 1 907 . 1 1 75 75 LYS HE3 H 1 3.015 0.003 . 1 . . . . 75 LYS HE3 . 27017 1 908 . 1 1 75 75 LYS C C 13 176.318 0.059 . 1 . . . . 75 LYS C . 27017 1 909 . 1 1 75 75 LYS CA C 13 56.279 0.062 . 1 . . . . 75 LYS CA . 27017 1 910 . 1 1 75 75 LYS CB C 13 32.262 0.018 . 1 . . . . 75 LYS CB . 27017 1 911 . 1 1 75 75 LYS CG C 13 24.751 0.046 . 1 . . . . 75 LYS CG . 27017 1 912 . 1 1 75 75 LYS CD C 13 28.843 0.091 . 1 . . . . 75 LYS CD . 27017 1 913 . 1 1 75 75 LYS CE C 13 42.023 0.137 . 1 . . . . 75 LYS CE . 27017 1 914 . 1 1 75 75 LYS N N 15 125.067 0.034 . 1 . . . . 75 LYS N . 27017 1 915 . 1 1 76 76 MET H H 1 8.595 0.005 . 1 . . . . 76 MET H . 27017 1 916 . 1 1 76 76 MET HA H 1 4.707 0.004 . 1 . . . . 76 MET HA . 27017 1 917 . 1 1 76 76 MET HB2 H 1 1.988 0.005 . 2 . . . . 76 MET HB2 . 27017 1 918 . 1 1 76 76 MET HB3 H 1 2.120 0.011 . 2 . . . . 76 MET HB3 . 27017 1 919 . 1 1 76 76 MET HG2 H 1 2.614 0.003 . 2 . . . . 76 MET HG2 . 27017 1 920 . 1 1 76 76 MET HG3 H 1 2.522 0.003 . 2 . . . . 76 MET HG3 . 27017 1 921 . 1 1 76 76 MET HE1 H 1 2.049 0.000 . 1 . . . . 76 MET HE1 . 27017 1 922 . 1 1 76 76 MET HE2 H 1 2.049 0.000 . 1 . . . . 76 MET HE2 . 27017 1 923 . 1 1 76 76 MET HE3 H 1 2.049 0.000 . 1 . . . . 76 MET HE3 . 27017 1 924 . 1 1 76 76 MET C C 13 176.980 0.009 . 1 . . . . 76 MET C . 27017 1 925 . 1 1 76 76 MET CA C 13 54.280 0.049 . 1 . . . . 76 MET CA . 27017 1 926 . 1 1 76 76 MET CB C 13 33.617 0.062 . 1 . . . . 76 MET CB . 27017 1 927 . 1 1 76 76 MET CG C 13 31.665 0.055 . 1 . . . . 76 MET CG . 27017 1 928 . 1 1 76 76 MET CE C 13 16.746 0.000 . 1 . . . . 76 MET CE . 27017 1 929 . 1 1 76 76 MET N N 15 123.706 0.027 . 1 . . . . 76 MET N . 27017 1 930 . 1 1 77 77 LYS H H 1 8.744 0.003 . 1 . . . . 77 LYS H . 27017 1 931 . 1 1 77 77 LYS HA H 1 4.399 0.005 . 1 . . . . 77 LYS HA . 27017 1 932 . 1 1 77 77 LYS HB2 H 1 1.867 0.007 . 2 . . . . 77 LYS HB2 . 27017 1 933 . 1 1 77 77 LYS HB3 H 1 2.008 0.004 . 2 . . . . 77 LYS HB3 . 27017 1 934 . 1 1 77 77 LYS HG2 H 1 1.543 0.003 . 1 . . . . 77 LYS HG2 . 27017 1 935 . 1 1 77 77 LYS HG3 H 1 1.543 0.003 . 1 . . . . 77 LYS HG3 . 27017 1 936 . 1 1 77 77 LYS HD2 H 1 1.750 0.004 . 2 . . . . 77 LYS HD2 . 27017 1 937 . 1 1 77 77 LYS HD3 H 1 1.750 0.004 . 2 . . . . 77 LYS HD3 . 27017 1 938 . 1 1 77 77 LYS HE2 H 1 2.913 0.008 . 2 . . . . 77 LYS HE2 . 27017 1 939 . 1 1 77 77 LYS HE3 H 1 3.027 0.002 . 2 . . . . 77 LYS HE3 . 27017 1 940 . 1 1 77 77 LYS C C 13 177.484 0.033 . 1 . . . . 77 LYS C . 27017 1 941 . 1 1 77 77 LYS CA C 13 56.307 0.054 . 1 . . . . 77 LYS CA . 27017 1 942 . 1 1 77 77 LYS CB C 13 32.997 0.081 . 1 . . . . 77 LYS CB . 27017 1 943 . 1 1 77 77 LYS CG C 13 25.116 0.050 . 1 . . . . 77 LYS CG . 27017 1 944 . 1 1 77 77 LYS CD C 13 29.101 0.008 . 1 . . . . 77 LYS CD . 27017 1 945 . 1 1 77 77 LYS CE C 13 41.797 0.040 . 1 . . . . 77 LYS CE . 27017 1 946 . 1 1 77 77 LYS N N 15 121.588 0.024 . 1 . . . . 77 LYS N . 27017 1 947 . 1 1 78 78 GLU H H 1 8.931 0.004 . 1 . . . . 78 GLU H . 27017 1 948 . 1 1 78 78 GLU HA H 1 4.077 0.003 . 1 . . . . 78 GLU HA . 27017 1 949 . 1 1 78 78 GLU HB2 H 1 2.073 0.004 . 1 . . . . 78 GLU HB2 . 27017 1 950 . 1 1 78 78 GLU HG2 H 1 2.368 0.002 . 1 . . . . 78 GLU HG2 . 27017 1 951 . 1 1 78 78 GLU HG3 H 1 2.368 0.002 . 1 . . . . 78 GLU HG3 . 27017 1 952 . 1 1 78 78 GLU C C 13 178.360 0.044 . 1 . . . . 78 GLU C . 27017 1 953 . 1 1 78 78 GLU CA C 13 59.796 0.062 . 1 . . . . 78 GLU CA . 27017 1 954 . 1 1 78 78 GLU CB C 13 29.397 0.118 . 1 . . . . 78 GLU CB . 27017 1 955 . 1 1 78 78 GLU CG C 13 36.400 0.015 . 1 . . . . 78 GLU CG . 27017 1 956 . 1 1 78 78 GLU N N 15 123.011 0.016 . 1 . . . . 78 GLU N . 27017 1 957 . 1 1 79 79 GLN H H 1 8.750 0.003 . 1 . . . . 79 GLN H . 27017 1 958 . 1 1 79 79 GLN HA H 1 4.237 0.004 . 1 . . . . 79 GLN HA . 27017 1 959 . 1 1 79 79 GLN HB2 H 1 2.097 0.009 . 2 . . . . 79 GLN HB2 . 27017 1 960 . 1 1 79 79 GLN HB3 H 1 2.065 0.014 . 2 . . . . 79 GLN HB3 . 27017 1 961 . 1 1 79 79 GLN HG2 H 1 2.450 0.002 . 1 . . . . 79 GLN HG2 . 27017 1 962 . 1 1 79 79 GLN HG3 H 1 2.450 0.002 . 1 . . . . 79 GLN HG3 . 27017 1 963 . 1 1 79 79 GLN HE21 H 1 7.743 0.002 . 1 . . . . 79 GLN HE21 . 27017 1 964 . 1 1 79 79 GLN HE22 H 1 6.852 0.008 . 1 . . . . 79 GLN HE22 . 27017 1 965 . 1 1 79 79 GLN C C 13 177.135 0.014 . 1 . . . . 79 GLN C . 27017 1 966 . 1 1 79 79 GLN CA C 13 58.145 0.080 . 1 . . . . 79 GLN CA . 27017 1 967 . 1 1 79 79 GLN CB C 13 28.471 0.094 . 1 . . . . 79 GLN CB . 27017 1 968 . 1 1 79 79 GLN CG C 13 33.735 0.046 . 1 . . . . 79 GLN CG . 27017 1 969 . 1 1 79 79 GLN CD C 13 180.579 0.004 . 1 . . . . 79 GLN CD . 27017 1 970 . 1 1 79 79 GLN N N 15 117.844 0.022 . 1 . . . . 79 GLN N . 27017 1 971 . 1 1 79 79 GLN NE2 N 15 112.786 0.096 . 1 . . . . 79 GLN NE2 . 27017 1 972 . 1 1 80 80 ASP H H 1 7.429 0.009 . 1 . . . . 80 ASP H . 27017 1 973 . 1 1 80 80 ASP HA H 1 4.483 0.003 . 1 . . . . 80 ASP HA . 27017 1 974 . 1 1 80 80 ASP HB2 H 1 2.710 0.012 . 2 . . . . 80 ASP HB2 . 27017 1 975 . 1 1 80 80 ASP HB3 H 1 2.738 0.016 . 2 . . . . 80 ASP HB3 . 27017 1 976 . 1 1 80 80 ASP C C 13 177.553 0.048 . 1 . . . . 80 ASP C . 27017 1 977 . 1 1 80 80 ASP CA C 13 56.525 0.114 . 1 . . . . 80 ASP CA . 27017 1 978 . 1 1 80 80 ASP CB C 13 41.075 0.060 . 1 . . . . 80 ASP CB . 27017 1 979 . 1 1 80 80 ASP N N 15 119.598 0.028 . 1 . . . . 80 ASP N . 27017 1 980 . 1 1 81 81 SER H H 1 8.178 0.003 . 1 . . . . 81 SER H . 27017 1 981 . 1 1 81 81 SER HA H 1 4.168 0.002 . 1 . . . . 81 SER HA . 27017 1 982 . 1 1 81 81 SER HB2 H 1 3.966 0.004 . 1 . . . . 81 SER HB2 . 27017 1 983 . 1 1 81 81 SER HB3 H 1 3.966 0.004 . 1 . . . . 81 SER HB3 . 27017 1 984 . 1 1 81 81 SER C C 13 176.703 0.016 . 1 . . . . 81 SER C . 27017 1 985 . 1 1 81 81 SER CA C 13 60.914 0.039 . 1 . . . . 81 SER CA . 27017 1 986 . 1 1 81 81 SER CB C 13 62.940 0.046 . 1 . . . . 81 SER CB . 27017 1 987 . 1 1 81 81 SER N N 15 115.484 0.041 . 1 . . . . 81 SER N . 27017 1 988 . 1 1 82 82 GLU H H 1 8.228 0.004 . 1 . . . . 82 GLU H . 27017 1 989 . 1 1 82 82 GLU HA H 1 4.176 0.008 . 1 . . . . 82 GLU HA . 27017 1 990 . 1 1 82 82 GLU HB2 H 1 2.196 0.004 . 1 . . . . 82 GLU HB2 . 27017 1 991 . 1 1 82 82 GLU HB3 H 1 2.196 0.004 . 1 . . . . 82 GLU HB3 . 27017 1 992 . 1 1 82 82 GLU HG2 H 1 2.403 0.010 . 2 . . . . 82 GLU HG2 . 27017 1 993 . 1 1 82 82 GLU HG3 H 1 2.419 0.008 . 2 . . . . 82 GLU HG3 . 27017 1 994 . 1 1 82 82 GLU C C 13 178.172 0.014 . 1 . . . . 82 GLU C . 27017 1 995 . 1 1 82 82 GLU CA C 13 59.228 0.075 . 1 . . . . 82 GLU CA . 27017 1 996 . 1 1 82 82 GLU CB C 13 29.226 0.057 . 1 . . . . 82 GLU CB . 27017 1 997 . 1 1 82 82 GLU CG C 13 36.018 0.045 . 1 . . . . 82 GLU CG . 27017 1 998 . 1 1 82 82 GLU N N 15 121.946 0.031 . 1 . . . . 82 GLU N . 27017 1 999 . 1 1 83 83 GLU H H 1 8.087 0.005 . 1 . . . . 83 GLU H . 27017 1 1000 . 1 1 83 83 GLU HA H 1 4.090 0.003 . 1 . . . . 83 GLU HA . 27017 1 1001 . 1 1 83 83 GLU HB2 H 1 2.096 0.007 . 2 . . . . 83 GLU HB2 . 27017 1 1002 . 1 1 83 83 GLU HB3 H 1 2.207 0.007 . 2 . . . . 83 GLU HB3 . 27017 1 1003 . 1 1 83 83 GLU HG2 H 1 2.418 0.003 . 2 . . . . 83 GLU HG2 . 27017 1 1004 . 1 1 83 83 GLU HG3 H 1 2.572 0.005 . 2 . . . . 83 GLU HG3 . 27017 1 1005 . 1 1 83 83 GLU C C 13 179.130 0.064 . 1 . . . . 83 GLU C . 27017 1 1006 . 1 1 83 83 GLU CA C 13 59.765 0.051 . 1 . . . . 83 GLU CA . 27017 1 1007 . 1 1 83 83 GLU CB C 13 29.300 0.052 . 1 . . . . 83 GLU CB . 27017 1 1008 . 1 1 83 83 GLU CG C 13 36.517 0.038 . 1 . . . . 83 GLU CG . 27017 1 1009 . 1 1 83 83 GLU N N 15 117.831 0.014 . 1 . . . . 83 GLU N . 27017 1 1010 . 1 1 84 84 GLU H H 1 7.961 0.004 . 1 . . . . 84 GLU H . 27017 1 1011 . 1 1 84 84 GLU HA H 1 3.940 0.007 . 1 . . . . 84 GLU HA . 27017 1 1012 . 1 1 84 84 GLU HB2 H 1 1.948 0.011 . 2 . . . . 84 GLU HB2 . 27017 1 1013 . 1 1 84 84 GLU HB3 H 1 2.322 0.008 . 2 . . . . 84 GLU HB3 . 27017 1 1014 . 1 1 84 84 GLU HG2 H 1 2.650 0.008 . 2 . . . . 84 GLU HG2 . 27017 1 1015 . 1 1 84 84 GLU HG3 H 1 2.158 0.010 . 2 . . . . 84 GLU HG3 . 27017 1 1016 . 1 1 84 84 GLU C C 13 178.646 0.044 . 1 . . . . 84 GLU C . 27017 1 1017 . 1 1 84 84 GLU CA C 13 59.555 0.060 . 1 . . . . 84 GLU CA . 27017 1 1018 . 1 1 84 84 GLU CB C 13 29.708 0.048 . 1 . . . . 84 GLU CB . 27017 1 1019 . 1 1 84 84 GLU CG C 13 37.123 0.101 . 1 . . . . 84 GLU CG . 27017 1 1020 . 1 1 84 84 GLU N N 15 117.085 0.034 . 1 . . . . 84 GLU N . 27017 1 1021 . 1 1 85 85 LEU H H 1 7.656 0.003 . 1 . . . . 85 LEU H . 27017 1 1022 . 1 1 85 85 LEU HA H 1 4.446 0.005 . 1 . . . . 85 LEU HA . 27017 1 1023 . 1 1 85 85 LEU HB2 H 1 1.635 0.005 . 2 . . . . 85 LEU HB2 . 27017 1 1024 . 1 1 85 85 LEU HB3 H 1 2.607 0.015 . 2 . . . . 85 LEU HB3 . 27017 1 1025 . 1 1 85 85 LEU HG H 1 1.990 0.013 . 1 . . . . 85 LEU HG . 27017 1 1026 . 1 1 85 85 LEU HD11 H 1 0.838 0.012 . 2 . . . . 85 LEU HD11 . 27017 1 1027 . 1 1 85 85 LEU HD12 H 1 0.838 0.012 . 2 . . . . 85 LEU HD12 . 27017 1 1028 . 1 1 85 85 LEU HD13 H 1 0.838 0.012 . 2 . . . . 85 LEU HD13 . 27017 1 1029 . 1 1 85 85 LEU HD21 H 1 0.939 0.004 . 2 . . . . 85 LEU HD21 . 27017 1 1030 . 1 1 85 85 LEU HD22 H 1 0.939 0.004 . 2 . . . . 85 LEU HD22 . 27017 1 1031 . 1 1 85 85 LEU HD23 H 1 0.939 0.004 . 2 . . . . 85 LEU HD23 . 27017 1 1032 . 1 1 85 85 LEU C C 13 179.411 0.034 . 1 . . . . 85 LEU C . 27017 1 1033 . 1 1 85 85 LEU CA C 13 58.155 0.061 . 1 . . . . 85 LEU CA . 27017 1 1034 . 1 1 85 85 LEU CB C 13 41.565 0.067 . 1 . . . . 85 LEU CB . 27017 1 1035 . 1 1 85 85 LEU CG C 13 26.795 0.077 . 1 . . . . 85 LEU CG . 27017 1 1036 . 1 1 85 85 LEU CD1 C 13 22.848 0.019 . 2 . . . . 85 LEU CD1 . 27017 1 1037 . 1 1 85 85 LEU CD2 C 13 26.675 0.119 . 2 . . . . 85 LEU CD2 . 27017 1 1038 . 1 1 85 85 LEU N N 15 119.224 0.032 . 1 . . . . 85 LEU N . 27017 1 1039 . 1 1 86 86 ILE H H 1 8.568 0.005 . 1 . . . . 86 ILE H . 27017 1 1040 . 1 1 86 86 ILE HA H 1 3.766 0.005 . 1 . . . . 86 ILE HA . 27017 1 1041 . 1 1 86 86 ILE HB H 1 1.973 0.006 . 1 . . . . 86 ILE HB . 27017 1 1042 . 1 1 86 86 ILE HG12 H 1 0.734 0.010 . 2 . . . . 86 ILE HG12 . 27017 1 1043 . 1 1 86 86 ILE HG13 H 1 1.975 0.006 . 2 . . . . 86 ILE HG13 . 27017 1 1044 . 1 1 86 86 ILE HG21 H 1 0.856 0.001 . 1 . . . . 86 ILE HG21 . 27017 1 1045 . 1 1 86 86 ILE HG22 H 1 0.856 0.001 . 1 . . . . 86 ILE HG22 . 27017 1 1046 . 1 1 86 86 ILE HG23 H 1 0.856 0.001 . 1 . . . . 86 ILE HG23 . 27017 1 1047 . 1 1 86 86 ILE HD11 H 1 0.660 0.002 . 1 . . . . 86 ILE HD11 . 27017 1 1048 . 1 1 86 86 ILE HD12 H 1 0.660 0.002 . 1 . . . . 86 ILE HD12 . 27017 1 1049 . 1 1 86 86 ILE HD13 H 1 0.660 0.002 . 1 . . . . 86 ILE HD13 . 27017 1 1050 . 1 1 86 86 ILE C C 13 178.657 0.001 . 1 . . . . 86 ILE C . 27017 1 1051 . 1 1 86 86 ILE CA C 13 65.617 0.049 . 1 . . . . 86 ILE CA . 27017 1 1052 . 1 1 86 86 ILE CB C 13 38.314 0.076 . 1 . . . . 86 ILE CB . 27017 1 1053 . 1 1 86 86 ILE CG1 C 13 28.984 0.062 . 1 . . . . 86 ILE CG1 . 27017 1 1054 . 1 1 86 86 ILE CG2 C 13 17.231 0.018 . 1 . . . . 86 ILE CG2 . 27017 1 1055 . 1 1 86 86 ILE CD1 C 13 13.500 0.006 . 1 . . . . 86 ILE CD1 . 27017 1 1056 . 1 1 86 86 ILE N N 15 122.126 0.029 . 1 . . . . 86 ILE N . 27017 1 1057 . 1 1 87 87 GLU H H 1 7.969 0.003 . 1 . . . . 87 GLU H . 27017 1 1058 . 1 1 87 87 GLU HA H 1 4.157 0.005 . 1 . . . . 87 GLU HA . 27017 1 1059 . 1 1 87 87 GLU HB2 H 1 2.200 0.011 . 2 . . . . 87 GLU HB2 . 27017 1 1060 . 1 1 87 87 GLU HB3 H 1 2.184 0.012 . 2 . . . . 87 GLU HB3 . 27017 1 1061 . 1 1 87 87 GLU HG2 H 1 2.113 0.008 . 2 . . . . 87 GLU HG2 . 27017 1 1062 . 1 1 87 87 GLU HG3 H 1 2.673 0.008 . 2 . . . . 87 GLU HG3 . 27017 1 1063 . 1 1 87 87 GLU C C 13 180.066 0.018 . 1 . . . . 87 GLU C . 27017 1 1064 . 1 1 87 87 GLU CA C 13 58.598 0.054 . 1 . . . . 87 GLU CA . 27017 1 1065 . 1 1 87 87 GLU CB C 13 28.721 0.045 . 1 . . . . 87 GLU CB . 27017 1 1066 . 1 1 87 87 GLU CG C 13 35.350 0.079 . 1 . . . . 87 GLU CG . 27017 1 1067 . 1 1 87 87 GLU N N 15 116.533 0.032 . 1 . . . . 87 GLU N . 27017 1 1068 . 1 1 88 88 ALA H H 1 8.249 0.003 . 1 . . . . 88 ALA H . 27017 1 1069 . 1 1 88 88 ALA HA H 1 3.918 0.007 . 1 . . . . 88 ALA HA . 27017 1 1070 . 1 1 88 88 ALA HB1 H 1 1.702 0.001 . 1 . . . . 88 ALA HB1 . 27017 1 1071 . 1 1 88 88 ALA HB2 H 1 1.702 0.001 . 1 . . . . 88 ALA HB2 . 27017 1 1072 . 1 1 88 88 ALA HB3 H 1 1.702 0.001 . 1 . . . . 88 ALA HB3 . 27017 1 1073 . 1 1 88 88 ALA C C 13 178.053 0.018 . 1 . . . . 88 ALA C . 27017 1 1074 . 1 1 88 88 ALA CA C 13 55.480 0.049 . 1 . . . . 88 ALA CA . 27017 1 1075 . 1 1 88 88 ALA CB C 13 18.044 0.111 . 1 . . . . 88 ALA CB . 27017 1 1076 . 1 1 88 88 ALA N N 15 120.706 0.012 . 1 . . . . 88 ALA N . 27017 1 1077 . 1 1 89 89 PHE H H 1 8.785 0.004 . 1 . . . . 89 PHE H . 27017 1 1078 . 1 1 89 89 PHE HA H 1 3.061 0.008 . 1 . . . . 89 PHE HA . 27017 1 1079 . 1 1 89 89 PHE HB2 H 1 2.932 0.010 . 2 . . . . 89 PHE HB2 . 27017 1 1080 . 1 1 89 89 PHE HB3 H 1 3.284 0.009 . 2 . . . . 89 PHE HB3 . 27017 1 1081 . 1 1 89 89 PHE HD1 H 1 6.678 0.004 . 1 . . . . 89 PHE HD1 . 27017 1 1082 . 1 1 89 89 PHE HD2 H 1 6.678 0.004 . 1 . . . . 89 PHE HD2 . 27017 1 1083 . 1 1 89 89 PHE HE1 H 1 7.062 0.008 . 1 . . . . 89 PHE HE1 . 27017 1 1084 . 1 1 89 89 PHE HE2 H 1 7.062 0.008 . 1 . . . . 89 PHE HE2 . 27017 1 1085 . 1 1 89 89 PHE HZ H 1 7.246 0.005 . 1 . . . . 89 PHE HZ . 27017 1 1086 . 1 1 89 89 PHE C C 13 176.954 0.029 . 1 . . . . 89 PHE C . 27017 1 1087 . 1 1 89 89 PHE CA C 13 62.734 0.091 . 1 . . . . 89 PHE CA . 27017 1 1088 . 1 1 89 89 PHE CB C 13 39.219 0.102 . 1 . . . . 89 PHE CB . 27017 1 1089 . 1 1 89 89 PHE CD1 C 13 131.913 0.062 . 1 . . . . 89 PHE CD1 . 27017 1 1090 . 1 1 89 89 PHE CD2 C 13 131.913 0.062 . 1 . . . . 89 PHE CD2 . 27017 1 1091 . 1 1 89 89 PHE CE1 C 13 131.452 0.067 . 1 . . . . 89 PHE CE1 . 27017 1 1092 . 1 1 89 89 PHE CE2 C 13 131.452 0.067 . 1 . . . . 89 PHE CE2 . 27017 1 1093 . 1 1 89 89 PHE CZ C 13 131.207 0.079 . 1 . . . . 89 PHE CZ . 27017 1 1094 . 1 1 89 89 PHE N N 15 119.159 0.046 . 1 . . . . 89 PHE N . 27017 1 1095 . 1 1 90 90 LYS H H 1 7.980 0.005 . 1 . . . . 90 LYS H . 27017 1 1096 . 1 1 90 90 LYS HA H 1 3.902 0.005 . 1 . . . . 90 LYS HA . 27017 1 1097 . 1 1 90 90 LYS HB2 H 1 1.939 0.008 . 1 . . . . 90 LYS HB2 . 27017 1 1098 . 1 1 90 90 LYS HG2 H 1 1.577 0.007 . 2 . . . . 90 LYS HG2 . 27017 1 1099 . 1 1 90 90 LYS HG3 H 1 1.925 0.007 . 2 . . . . 90 LYS HG3 . 27017 1 1100 . 1 1 90 90 LYS HD2 H 1 1.701 0.003 . 1 . . . . 90 LYS HD2 . 27017 1 1101 . 1 1 90 90 LYS HD3 H 1 1.700 0.004 . 1 . . . . 90 LYS HD3 . 27017 1 1102 . 1 1 90 90 LYS HE2 H 1 2.901 0.003 . 1 . . . . 90 LYS HE2 . 27017 1 1103 . 1 1 90 90 LYS HE3 H 1 2.901 0.003 . 1 . . . . 90 LYS HE3 . 27017 1 1104 . 1 1 90 90 LYS C C 13 178.807 0.000 . 1 . . . . 90 LYS C . 27017 1 1105 . 1 1 90 90 LYS CA C 13 59.716 0.072 . 1 . . . . 90 LYS CA . 27017 1 1106 . 1 1 90 90 LYS CB C 13 32.869 0.067 . 1 . . . . 90 LYS CB . 27017 1 1107 . 1 1 90 90 LYS CG C 13 25.930 0.039 . 1 . . . . 90 LYS CG . 27017 1 1108 . 1 1 90 90 LYS CD C 13 29.849 0.080 . 1 . . . . 90 LYS CD . 27017 1 1109 . 1 1 90 90 LYS CE C 13 41.717 0.080 . 1 . . . . 90 LYS CE . 27017 1 1110 . 1 1 90 90 LYS N N 15 115.737 0.047 . 1 . . . . 90 LYS N . 27017 1 1111 . 1 1 91 91 VAL H H 1 7.328 0.005 . 1 . . . . 91 VAL H . 27017 1 1112 . 1 1 91 91 VAL HA H 1 3.646 0.007 . 1 . . . . 91 VAL HA . 27017 1 1113 . 1 1 91 91 VAL HB H 1 2.349 0.006 . 1 . . . . 91 VAL HB . 27017 1 1114 . 1 1 91 91 VAL HG11 H 1 0.878 0.002 . 2 . . . . 91 VAL HG11 . 27017 1 1115 . 1 1 91 91 VAL HG12 H 1 0.878 0.002 . 2 . . . . 91 VAL HG12 . 27017 1 1116 . 1 1 91 91 VAL HG13 H 1 0.878 0.002 . 2 . . . . 91 VAL HG13 . 27017 1 1117 . 1 1 91 91 VAL HG21 H 1 1.019 0.002 . 2 . . . . 91 VAL HG21 . 27017 1 1118 . 1 1 91 91 VAL HG22 H 1 1.019 0.002 . 2 . . . . 91 VAL HG22 . 27017 1 1119 . 1 1 91 91 VAL HG23 H 1 1.019 0.002 . 2 . . . . 91 VAL HG23 . 27017 1 1120 . 1 1 91 91 VAL C C 13 177.311 0.020 . 1 . . . . 91 VAL C . 27017 1 1121 . 1 1 91 91 VAL CA C 13 65.553 0.046 . 1 . . . . 91 VAL CA . 27017 1 1122 . 1 1 91 91 VAL CB C 13 31.287 0.053 . 1 . . . . 91 VAL CB . 27017 1 1123 . 1 1 91 91 VAL CG1 C 13 22.574 0.057 . 2 . . . . 91 VAL CG1 . 27017 1 1124 . 1 1 91 91 VAL CG2 C 13 22.387 0.050 . 2 . . . . 91 VAL CG2 . 27017 1 1125 . 1 1 91 91 VAL N N 15 117.104 0.028 . 1 . . . . 91 VAL N . 27017 1 1126 . 1 1 92 92 PHE H H 1 7.353 0.004 . 1 . . . . 92 PHE H . 27017 1 1127 . 1 1 92 92 PHE HA H 1 4.242 0.009 . 1 . . . . 92 PHE HA . 27017 1 1128 . 1 1 92 92 PHE HB2 H 1 2.649 0.006 . 2 . . . . 92 PHE HB2 . 27017 1 1129 . 1 1 92 92 PHE HB3 H 1 2.823 0.010 . 2 . . . . 92 PHE HB3 . 27017 1 1130 . 1 1 92 92 PHE HD1 H 1 7.258 0.005 . 1 . . . . 92 PHE HD1 . 27017 1 1131 . 1 1 92 92 PHE HD2 H 1 7.258 0.005 . 1 . . . . 92 PHE HD2 . 27017 1 1132 . 1 1 92 92 PHE HE1 H 1 7.268 0.004 . 1 . . . . 92 PHE HE1 . 27017 1 1133 . 1 1 92 92 PHE HE2 H 1 7.268 0.004 . 1 . . . . 92 PHE HE2 . 27017 1 1134 . 1 1 92 92 PHE HZ H 1 7.115 0.002 . 1 . . . . 92 PHE HZ . 27017 1 1135 . 1 1 92 92 PHE C C 13 176.745 0.030 . 1 . . . . 92 PHE C . 27017 1 1136 . 1 1 92 92 PHE CA C 13 59.802 0.105 . 1 . . . . 92 PHE CA . 27017 1 1137 . 1 1 92 92 PHE CB C 13 40.109 0.094 . 1 . . . . 92 PHE CB . 27017 1 1138 . 1 1 92 92 PHE CD1 C 13 131.462 0.043 . 1 . . . . 92 PHE CD1 . 27017 1 1139 . 1 1 92 92 PHE CD2 C 13 131.462 0.043 . 1 . . . . 92 PHE CD2 . 27017 1 1140 . 1 1 92 92 PHE CE1 C 13 130.270 0.063 . 1 . . . . 92 PHE CE1 . 27017 1 1141 . 1 1 92 92 PHE CE2 C 13 130.270 0.063 . 1 . . . . 92 PHE CE2 . 27017 1 1142 . 1 1 92 92 PHE CZ C 13 128.636 0.002 . 1 . . . . 92 PHE CZ . 27017 1 1143 . 1 1 92 92 PHE N N 15 117.034 0.057 . 1 . . . . 92 PHE N . 27017 1 1144 . 1 1 93 93 ASP H H 1 7.948 0.007 . 1 . . . . 93 ASP H . 27017 1 1145 . 1 1 93 93 ASP HA H 1 4.553 0.005 . 1 . . . . 93 ASP HA . 27017 1 1146 . 1 1 93 93 ASP HB2 H 1 1.448 0.006 . 2 . . . . 93 ASP HB2 . 27017 1 1147 . 1 1 93 93 ASP HB3 H 1 2.405 0.007 . 2 . . . . 93 ASP HB3 . 27017 1 1148 . 1 1 93 93 ASP C C 13 177.336 0.038 . 1 . . . . 93 ASP C . 27017 1 1149 . 1 1 93 93 ASP CA C 13 52.294 0.024 . 1 . . . . 93 ASP CA . 27017 1 1150 . 1 1 93 93 ASP CB C 13 38.553 0.098 . 1 . . . . 93 ASP CB . 27017 1 1151 . 1 1 93 93 ASP N N 15 116.866 0.032 . 1 . . . . 93 ASP N . 27017 1 1152 . 1 1 94 94 ARG H H 1 7.722 0.004 . 1 . . . . 94 ARG H . 27017 1 1153 . 1 1 94 94 ARG HA H 1 3.959 0.005 . 1 . . . . 94 ARG HA . 27017 1 1154 . 1 1 94 94 ARG HB2 H 1 1.808 0.005 . 2 . . . . 94 ARG HB2 . 27017 1 1155 . 1 1 94 94 ARG HB3 H 1 1.941 0.006 . 2 . . . . 94 ARG HB3 . 27017 1 1156 . 1 1 94 94 ARG HG2 H 1 1.714 0.005 . 2 . . . . 94 ARG HG2 . 27017 1 1157 . 1 1 94 94 ARG HG3 H 1 1.805 0.005 . 2 . . . . 94 ARG HG3 . 27017 1 1158 . 1 1 94 94 ARG HD2 H 1 3.245 0.012 . 1 . . . . 94 ARG HD2 . 27017 1 1159 . 1 1 94 94 ARG HE H 1 7.238 0.000 . 1 . . . . 94 ARG HE . 27017 1 1160 . 1 1 94 94 ARG C C 13 177.965 0.019 . 1 . . . . 94 ARG C . 27017 1 1161 . 1 1 94 94 ARG CA C 13 59.038 0.069 . 1 . . . . 94 ARG CA . 27017 1 1162 . 1 1 94 94 ARG CB C 13 30.715 0.049 . 1 . . . . 94 ARG CB . 27017 1 1163 . 1 1 94 94 ARG CG C 13 26.917 0.033 . 1 . . . . 94 ARG CG . 27017 1 1164 . 1 1 94 94 ARG CD C 13 43.152 0.059 . 1 . . . . 94 ARG CD . 27017 1 1165 . 1 1 94 94 ARG N N 15 125.413 0.044 . 1 . . . . 94 ARG N . 27017 1 1166 . 1 1 94 94 ARG NE N 15 83.501 0.000 . 1 . . . . 94 ARG NE . 27017 1 1167 . 1 1 95 95 ASP H H 1 8.127 0.005 . 1 . . . . 95 ASP H . 27017 1 1168 . 1 1 95 95 ASP HA H 1 4.609 0.014 . 1 . . . . 95 ASP HA . 27017 1 1169 . 1 1 95 95 ASP HB2 H 1 2.648 0.009 . 2 . . . . 95 ASP HB2 . 27017 1 1170 . 1 1 95 95 ASP HB3 H 1 3.105 0.007 . 2 . . . . 95 ASP HB3 . 27017 1 1171 . 1 1 95 95 ASP C C 13 177.884 0.033 . 1 . . . . 95 ASP C . 27017 1 1172 . 1 1 95 95 ASP CA C 13 52.909 0.051 . 1 . . . . 95 ASP CA . 27017 1 1173 . 1 1 95 95 ASP CB C 13 39.652 0.051 . 1 . . . . 95 ASP CB . 27017 1 1174 . 1 1 95 95 ASP N N 15 113.893 0.050 . 1 . . . . 95 ASP N . 27017 1 1175 . 1 1 96 96 GLY H H 1 7.806 0.002 . 1 . . . . 96 GLY H . 27017 1 1176 . 1 1 96 96 GLY HA2 H 1 3.858 0.007 . 2 . . . . 96 GLY HA2 . 27017 1 1177 . 1 1 96 96 GLY HA3 H 1 3.932 0.002 . 2 . . . . 96 GLY HA3 . 27017 1 1178 . 1 1 96 96 GLY C C 13 175.078 0.000 . 1 . . . . 96 GLY C . 27017 1 1179 . 1 1 96 96 GLY CA C 13 47.239 0.035 . 1 . . . . 96 GLY CA . 27017 1 1180 . 1 1 96 96 GLY N N 15 108.767 0.012 . 1 . . . . 96 GLY N . 27017 1 1181 . 1 1 97 97 ASN H H 1 8.185 0.002 . 1 . . . . 97 ASN H . 27017 1 1182 . 1 1 97 97 ASN HA H 1 4.674 0.005 . 1 . . . . 97 ASN HA . 27017 1 1183 . 1 1 97 97 ASN HB2 H 1 2.620 0.007 . 2 . . . . 97 ASN HB2 . 27017 1 1184 . 1 1 97 97 ASN HB3 H 1 3.296 0.003 . 2 . . . . 97 ASN HB3 . 27017 1 1185 . 1 1 97 97 ASN HD21 H 1 7.963 0.003 . 1 . . . . 97 ASN HD21 . 27017 1 1186 . 1 1 97 97 ASN HD22 H 1 6.803 0.005 . 1 . . . . 97 ASN HD22 . 27017 1 1187 . 1 1 97 97 ASN C C 13 176.092 0.031 . 1 . . . . 97 ASN C . 27017 1 1188 . 1 1 97 97 ASN CA C 13 52.512 0.062 . 1 . . . . 97 ASN CA . 27017 1 1189 . 1 1 97 97 ASN CB C 13 37.823 0.048 . 1 . . . . 97 ASN CB . 27017 1 1190 . 1 1 97 97 ASN CG C 13 179.104 0.014 . 1 . . . . 97 ASN CG . 27017 1 1191 . 1 1 97 97 ASN N N 15 119.255 0.000 . 1 . . . . 97 ASN N . 27017 1 1192 . 1 1 97 97 ASN ND2 N 15 115.049 0.062 . 1 . . . . 97 ASN ND2 . 27017 1 1193 . 1 1 98 98 GLY H H 1 10.959 0.002 . 1 . . . . 98 GLY H . 27017 1 1194 . 1 1 98 98 GLY HA2 H 1 3.676 0.005 . 2 . . . . 98 GLY HA2 . 27017 1 1195 . 1 1 98 98 GLY HA3 H 1 4.273 0.004 . 2 . . . . 98 GLY HA3 . 27017 1 1196 . 1 1 98 98 GLY C C 13 172.936 0.000 . 1 . . . . 98 GLY C . 27017 1 1197 . 1 1 98 98 GLY CA C 13 45.490 0.070 . 1 . . . . 98 GLY CA . 27017 1 1198 . 1 1 98 98 GLY N N 15 113.794 0.045 . 1 . . . . 98 GLY N . 27017 1 1199 . 1 1 99 99 LEU H H 1 7.459 0.003 . 1 . . . . 99 LEU H . 27017 1 1200 . 1 1 99 99 LEU HA H 1 4.905 0.013 . 1 . . . . 99 LEU HA . 27017 1 1201 . 1 1 99 99 LEU HB2 H 1 1.580 0.015 . 2 . . . . 99 LEU HB2 . 27017 1 1202 . 1 1 99 99 LEU HB3 H 1 0.965 0.020 . 2 . . . . 99 LEU HB3 . 27017 1 1203 . 1 1 99 99 LEU HG H 1 1.354 0.007 . 1 . . . . 99 LEU HG . 27017 1 1204 . 1 1 99 99 LEU HD11 H 1 0.445 0.003 . 2 . . . . 99 LEU HD11 . 27017 1 1205 . 1 1 99 99 LEU HD12 H 1 0.445 0.003 . 2 . . . . 99 LEU HD12 . 27017 1 1206 . 1 1 99 99 LEU HD13 H 1 0.445 0.003 . 2 . . . . 99 LEU HD13 . 27017 1 1207 . 1 1 99 99 LEU HD21 H 1 0.916 0.003 . 2 . . . . 99 LEU HD21 . 27017 1 1208 . 1 1 99 99 LEU HD22 H 1 0.916 0.003 . 2 . . . . 99 LEU HD22 . 27017 1 1209 . 1 1 99 99 LEU HD23 H 1 0.916 0.003 . 2 . . . . 99 LEU HD23 . 27017 1 1210 . 1 1 99 99 LEU C C 13 175.753 0.031 . 1 . . . . 99 LEU C . 27017 1 1211 . 1 1 99 99 LEU CA C 13 52.744 0.043 . 1 . . . . 99 LEU CA . 27017 1 1212 . 1 1 99 99 LEU CB C 13 46.633 0.109 . 1 . . . . 99 LEU CB . 27017 1 1213 . 1 1 99 99 LEU CG C 13 25.675 0.055 . 1 . . . . 99 LEU CG . 27017 1 1214 . 1 1 99 99 LEU CD1 C 13 25.195 0.041 . 2 . . . . 99 LEU CD1 . 27017 1 1215 . 1 1 99 99 LEU CD2 C 13 23.663 0.081 . 2 . . . . 99 LEU CD2 . 27017 1 1216 . 1 1 99 99 LEU N N 15 118.641 0.020 . 1 . . . . 99 LEU N . 27017 1 1217 . 1 1 100 100 ILE H H 1 9.952 0.009 . 1 . . . . 100 ILE H . 27017 1 1218 . 1 1 100 100 ILE HA H 1 4.815 0.008 . 1 . . . . 100 ILE HA . 27017 1 1219 . 1 1 100 100 ILE HB H 1 2.024 0.010 . 1 . . . . 100 ILE HB . 27017 1 1220 . 1 1 100 100 ILE HG21 H 1 0.986 0.004 . 1 . . . . 100 ILE HG21 . 27017 1 1221 . 1 1 100 100 ILE HG22 H 1 0.986 0.004 . 1 . . . . 100 ILE HG22 . 27017 1 1222 . 1 1 100 100 ILE HG23 H 1 0.986 0.004 . 1 . . . . 100 ILE HG23 . 27017 1 1223 . 1 1 100 100 ILE HD11 H 1 0.370 0.006 . 1 . . . . 100 ILE HD11 . 27017 1 1224 . 1 1 100 100 ILE HD12 H 1 0.370 0.006 . 1 . . . . 100 ILE HD12 . 27017 1 1225 . 1 1 100 100 ILE HD13 H 1 0.370 0.006 . 1 . . . . 100 ILE HD13 . 27017 1 1226 . 1 1 100 100 ILE C C 13 175.882 0.018 . 1 . . . . 100 ILE C . 27017 1 1227 . 1 1 100 100 ILE CA C 13 61.305 0.055 . 1 . . . . 100 ILE CA . 27017 1 1228 . 1 1 100 100 ILE CB C 13 38.355 0.043 . 1 . . . . 100 ILE CB . 27017 1 1229 . 1 1 100 100 ILE CG2 C 13 17.690 0.094 . 1 . . . . 100 ILE CG2 . 27017 1 1230 . 1 1 100 100 ILE CD1 C 13 15.045 0.020 . 1 . . . . 100 ILE CD1 . 27017 1 1231 . 1 1 100 100 ILE N N 15 127.871 0.047 . 1 . . . . 100 ILE N . 27017 1 1232 . 1 1 101 101 SER H H 1 9.293 0.006 . 1 . . . . 101 SER H . 27017 1 1233 . 1 1 101 101 SER HA H 1 4.773 0.000 . 1 . . . . 101 SER HA . 27017 1 1234 . 1 1 101 101 SER HB2 H 1 4.019 0.000 . 2 . . . . 101 SER HB2 . 27017 1 1235 . 1 1 101 101 SER HB3 H 1 4.411 0.000 . 2 . . . . 101 SER HB3 . 27017 1 1236 . 1 1 101 101 SER C C 13 174.938 0.000 . 1 . . . . 101 SER C . 27017 1 1237 . 1 1 101 101 SER CA C 13 55.757 0.024 . 1 . . . . 101 SER CA . 27017 1 1238 . 1 1 101 101 SER CB C 13 67.094 0.063 . 1 . . . . 101 SER CB . 27017 1 1239 . 1 1 101 101 SER N N 15 124.652 0.047 . 1 . . . . 101 SER N . 27017 1 1240 . 1 1 102 102 ALA H H 1 9.233 0.003 . 1 . . . . 102 ALA H . 27017 1 1241 . 1 1 102 102 ALA HA H 1 3.916 0.003 . 1 . . . . 102 ALA HA . 27017 1 1242 . 1 1 102 102 ALA HB1 H 1 1.409 0.002 . 1 . . . . 102 ALA HB1 . 27017 1 1243 . 1 1 102 102 ALA HB2 H 1 1.409 0.002 . 1 . . . . 102 ALA HB2 . 27017 1 1244 . 1 1 102 102 ALA HB3 H 1 1.409 0.002 . 1 . . . . 102 ALA HB3 . 27017 1 1245 . 1 1 102 102 ALA C C 13 179.261 0.040 . 1 . . . . 102 ALA C . 27017 1 1246 . 1 1 102 102 ALA CA C 13 55.920 0.059 . 1 . . . . 102 ALA CA . 27017 1 1247 . 1 1 102 102 ALA CB C 13 17.786 0.083 . 1 . . . . 102 ALA CB . 27017 1 1248 . 1 1 102 102 ALA N N 15 123.243 0.027 . 1 . . . . 102 ALA N . 27017 1 1249 . 1 1 103 103 ALA H H 1 8.218 0.003 . 1 . . . . 103 ALA H . 27017 1 1250 . 1 1 103 103 ALA HA H 1 4.057 0.010 . 1 . . . . 103 ALA HA . 27017 1 1251 . 1 1 103 103 ALA HB1 H 1 1.438 0.002 . 1 . . . . 103 ALA HB1 . 27017 1 1252 . 1 1 103 103 ALA HB2 H 1 1.438 0.002 . 1 . . . . 103 ALA HB2 . 27017 1 1253 . 1 1 103 103 ALA HB3 H 1 1.438 0.002 . 1 . . . . 103 ALA HB3 . 27017 1 1254 . 1 1 103 103 ALA C C 13 181.736 0.036 . 1 . . . . 103 ALA C . 27017 1 1255 . 1 1 103 103 ALA CA C 13 55.263 0.057 . 1 . . . . 103 ALA CA . 27017 1 1256 . 1 1 103 103 ALA CB C 13 18.390 0.080 . 1 . . . . 103 ALA CB . 27017 1 1257 . 1 1 103 103 ALA N N 15 118.608 0.022 . 1 . . . . 103 ALA N . 27017 1 1258 . 1 1 104 104 GLU H H 1 7.895 0.007 . 1 . . . . 104 GLU H . 27017 1 1259 . 1 1 104 104 GLU HA H 1 4.054 0.005 . 1 . . . . 104 GLU HA . 27017 1 1260 . 1 1 104 104 GLU HB2 H 1 2.606 0.009 . 1 . . . . 104 GLU HB2 . 27017 1 1261 . 1 1 104 104 GLU HG2 H 1 2.600 0.012 . 1 . . . . 104 GLU HG2 . 27017 1 1262 . 1 1 104 104 GLU C C 13 178.873 0.019 . 1 . . . . 104 GLU C . 27017 1 1263 . 1 1 104 104 GLU CA C 13 59.489 0.030 . 1 . . . . 104 GLU CA . 27017 1 1264 . 1 1 104 104 GLU CB C 13 29.292 0.100 . 1 . . . . 104 GLU CB . 27017 1 1265 . 1 1 104 104 GLU CG C 13 37.801 0.087 . 1 . . . . 104 GLU CG . 27017 1 1266 . 1 1 104 104 GLU N N 15 120.353 0.063 . 1 . . . . 104 GLU N . 27017 1 1267 . 1 1 105 105 LEU H H 1 8.808 0.004 . 1 . . . . 105 LEU H . 27017 1 1268 . 1 1 105 105 LEU HA H 1 4.100 0.009 . 1 . . . . 105 LEU HA . 27017 1 1269 . 1 1 105 105 LEU HB2 H 1 1.562 0.023 . 2 . . . . 105 LEU HB2 . 27017 1 1270 . 1 1 105 105 LEU HB3 H 1 1.939 0.015 . 2 . . . . 105 LEU HB3 . 27017 1 1271 . 1 1 105 105 LEU HG H 1 1.625 0.004 . 1 . . . . 105 LEU HG . 27017 1 1272 . 1 1 105 105 LEU HD11 H 1 0.864 0.006 . 2 . . . . 105 LEU HD11 . 27017 1 1273 . 1 1 105 105 LEU HD12 H 1 0.864 0.006 . 2 . . . . 105 LEU HD12 . 27017 1 1274 . 1 1 105 105 LEU HD13 H 1 0.864 0.006 . 2 . . . . 105 LEU HD13 . 27017 1 1275 . 1 1 105 105 LEU HD21 H 1 0.925 0.018 . 2 . . . . 105 LEU HD21 . 27017 1 1276 . 1 1 105 105 LEU HD22 H 1 0.925 0.018 . 2 . . . . 105 LEU HD22 . 27017 1 1277 . 1 1 105 105 LEU HD23 H 1 0.925 0.018 . 2 . . . . 105 LEU HD23 . 27017 1 1278 . 1 1 105 105 LEU C C 13 178.543 0.027 . 1 . . . . 105 LEU C . 27017 1 1279 . 1 1 105 105 LEU CA C 13 58.601 0.072 . 1 . . . . 105 LEU CA . 27017 1 1280 . 1 1 105 105 LEU CB C 13 42.269 0.067 . 1 . . . . 105 LEU CB . 27017 1 1281 . 1 1 105 105 LEU CG C 13 27.721 0.020 . 1 . . . . 105 LEU CG . 27017 1 1282 . 1 1 105 105 LEU CD1 C 13 23.963 0.066 . 2 . . . . 105 LEU CD1 . 27017 1 1283 . 1 1 105 105 LEU CD2 C 13 26.346 0.036 . 2 . . . . 105 LEU CD2 . 27017 1 1284 . 1 1 105 105 LEU N N 15 120.738 0.039 . 1 . . . . 105 LEU N . 27017 1 1285 . 1 1 106 106 ARG H H 1 8.774 0.004 . 1 . . . . 106 ARG H . 27017 1 1286 . 1 1 106 106 ARG HA H 1 3.863 0.006 . 1 . . . . 106 ARG HA . 27017 1 1287 . 1 1 106 106 ARG HB2 H 1 1.796 0.007 . 2 . . . . 106 ARG HB2 . 27017 1 1288 . 1 1 106 106 ARG HB3 H 1 1.964 0.006 . 2 . . . . 106 ARG HB3 . 27017 1 1289 . 1 1 106 106 ARG HG2 H 1 1.638 0.010 . 2 . . . . 106 ARG HG2 . 27017 1 1290 . 1 1 106 106 ARG HG3 H 1 1.796 0.006 . 2 . . . . 106 ARG HG3 . 27017 1 1291 . 1 1 106 106 ARG HD2 H 1 3.164 0.007 . 2 . . . . 106 ARG HD2 . 27017 1 1292 . 1 1 106 106 ARG HD3 H 1 3.266 0.005 . 2 . . . . 106 ARG HD3 . 27017 1 1293 . 1 1 106 106 ARG HE H 1 7.314 0.001 . 1 . . . . 106 ARG HE . 27017 1 1294 . 1 1 106 106 ARG C C 13 178.735 0.005 . 1 . . . . 106 ARG C . 27017 1 1295 . 1 1 106 106 ARG CA C 13 60.041 0.068 . 1 . . . . 106 ARG CA . 27017 1 1296 . 1 1 106 106 ARG CB C 13 30.835 0.063 . 1 . . . . 106 ARG CB . 27017 1 1297 . 1 1 106 106 ARG CG C 13 28.031 0.071 . 1 . . . . 106 ARG CG . 27017 1 1298 . 1 1 106 106 ARG CD C 13 43.858 0.073 . 1 . . . . 106 ARG CD . 27017 1 1299 . 1 1 106 106 ARG N N 15 118.001 0.043 . 1 . . . . 106 ARG N . 27017 1 1300 . 1 1 106 106 ARG NE N 15 84.473 0.017 . 1 . . . . 106 ARG NE . 27017 1 1301 . 1 1 107 107 HIS H H 1 7.799 0.004 . 1 . . . . 107 HIS H . 27017 1 1302 . 1 1 107 107 HIS HA H 1 4.263 0.008 . 1 . . . . 107 HIS HA . 27017 1 1303 . 1 1 107 107 HIS HB2 H 1 3.264 0.009 . 2 . . . . 107 HIS HB2 . 27017 1 1304 . 1 1 107 107 HIS HB3 H 1 3.317 0.016 . 2 . . . . 107 HIS HB3 . 27017 1 1305 . 1 1 107 107 HIS HD2 H 1 6.940 0.008 . 1 . . . . 107 HIS HD2 . 27017 1 1306 . 1 1 107 107 HIS HE1 H 1 7.891 0.014 . 1 . . . . 107 HIS HE1 . 27017 1 1307 . 1 1 107 107 HIS C C 13 178.055 0.002 . 1 . . . . 107 HIS C . 27017 1 1308 . 1 1 107 107 HIS CA C 13 59.985 0.078 . 1 . . . . 107 HIS CA . 27017 1 1309 . 1 1 107 107 HIS CB C 13 31.007 0.066 . 1 . . . . 107 HIS CB . 27017 1 1310 . 1 1 107 107 HIS CD2 C 13 118.861 0.113 . 1 . . . . 107 HIS CD2 . 27017 1 1311 . 1 1 107 107 HIS CE1 C 13 138.553 0.036 . 1 . . . . 107 HIS CE1 . 27017 1 1312 . 1 1 107 107 HIS N N 15 118.839 0.068 . 1 . . . . 107 HIS N . 27017 1 1313 . 1 1 108 108 VAL H H 1 8.257 0.004 . 1 . . . . 108 VAL H . 27017 1 1314 . 1 1 108 108 VAL HA H 1 3.432 0.009 . 1 . . . . 108 VAL HA . 27017 1 1315 . 1 1 108 108 VAL HB H 1 1.859 0.013 . 1 . . . . 108 VAL HB . 27017 1 1316 . 1 1 108 108 VAL HG11 H 1 -0.006 0.003 . 2 . . . . 108 VAL HG11 . 27017 1 1317 . 1 1 108 108 VAL HG12 H 1 -0.006 0.003 . 2 . . . . 108 VAL HG12 . 27017 1 1318 . 1 1 108 108 VAL HG13 H 1 -0.006 0.003 . 2 . . . . 108 VAL HG13 . 27017 1 1319 . 1 1 108 108 VAL HG21 H 1 0.916 0.002 . 2 . . . . 108 VAL HG21 . 27017 1 1320 . 1 1 108 108 VAL HG22 H 1 0.916 0.002 . 2 . . . . 108 VAL HG22 . 27017 1 1321 . 1 1 108 108 VAL HG23 H 1 0.916 0.002 . 2 . . . . 108 VAL HG23 . 27017 1 1322 . 1 1 108 108 VAL C C 13 177.998 0.048 . 1 . . . . 108 VAL C . 27017 1 1323 . 1 1 108 108 VAL CA C 13 66.906 0.069 . 1 . . . . 108 VAL CA . 27017 1 1324 . 1 1 108 108 VAL CB C 13 31.403 0.111 . 1 . . . . 108 VAL CB . 27017 1 1325 . 1 1 108 108 VAL CG1 C 13 20.685 0.055 . 2 . . . . 108 VAL CG1 . 27017 1 1326 . 1 1 108 108 VAL CG2 C 13 23.752 0.075 . 2 . . . . 108 VAL CG2 . 27017 1 1327 . 1 1 108 108 VAL N N 15 119.260 0.057 . 1 . . . . 108 VAL N . 27017 1 1328 . 1 1 109 109 MET H H 1 8.566 0.004 . 1 . . . . 109 MET H . 27017 1 1329 . 1 1 109 109 MET HA H 1 4.244 0.003 . 1 . . . . 109 MET HA . 27017 1 1330 . 1 1 109 109 MET HB2 H 1 1.946 0.007 . 2 . . . . 109 MET HB2 . 27017 1 1331 . 1 1 109 109 MET HB3 H 1 2.328 0.010 . 2 . . . . 109 MET HB3 . 27017 1 1332 . 1 1 109 109 MET HG2 H 1 2.677 0.020 . 2 . . . . 109 MET HG2 . 27017 1 1333 . 1 1 109 109 MET HG3 H 1 2.829 0.012 . 2 . . . . 109 MET HG3 . 27017 1 1334 . 1 1 109 109 MET HE1 H 1 2.010 0.000 . 1 . . . . 109 MET HE1 . 27017 1 1335 . 1 1 109 109 MET HE2 H 1 2.010 0.000 . 1 . . . . 109 MET HE2 . 27017 1 1336 . 1 1 109 109 MET HE3 H 1 2.010 0.000 . 1 . . . . 109 MET HE3 . 27017 1 1337 . 1 1 109 109 MET C C 13 179.105 0.066 . 1 . . . . 109 MET C . 27017 1 1338 . 1 1 109 109 MET CA C 13 57.829 0.053 . 1 . . . . 109 MET CA . 27017 1 1339 . 1 1 109 109 MET CB C 13 30.688 0.111 . 1 . . . . 109 MET CB . 27017 1 1340 . 1 1 109 109 MET CG C 13 33.930 0.104 . 1 . . . . 109 MET CG . 27017 1 1341 . 1 1 109 109 MET CE C 13 18.415 0.000 . 1 . . . . 109 MET CE . 27017 1 1342 . 1 1 109 109 MET N N 15 116.436 0.034 . 1 . . . . 109 MET N . 27017 1 1343 . 1 1 110 110 THR H H 1 7.897 0.006 . 1 . . . . 110 THR H . 27017 1 1344 . 1 1 110 110 THR HA H 1 4.034 0.007 . 1 . . . . 110 THR HA . 27017 1 1345 . 1 1 110 110 THR HB H 1 4.231 0.004 . 1 . . . . 110 THR HB . 27017 1 1346 . 1 1 110 110 THR HG21 H 1 1.199 0.001 . 1 . . . . 110 THR HG21 . 27017 1 1347 . 1 1 110 110 THR HG22 H 1 1.199 0.001 . 1 . . . . 110 THR HG22 . 27017 1 1348 . 1 1 110 110 THR HG23 H 1 1.199 0.001 . 1 . . . . 110 THR HG23 . 27017 1 1349 . 1 1 110 110 THR C C 13 178.219 0.011 . 1 . . . . 110 THR C . 27017 1 1350 . 1 1 110 110 THR CA C 13 66.792 0.100 . 1 . . . . 110 THR CA . 27017 1 1351 . 1 1 110 110 THR CB C 13 68.521 0.078 . 1 . . . . 110 THR CB . 27017 1 1352 . 1 1 110 110 THR CG2 C 13 21.417 0.105 . 1 . . . . 110 THR CG2 . 27017 1 1353 . 1 1 110 110 THR N N 15 115.474 0.037 . 1 . . . . 110 THR N . 27017 1 1354 . 1 1 111 111 ASN H H 1 7.514 0.004 . 1 . . . . 111 ASN H . 27017 1 1355 . 1 1 111 111 ASN HA H 1 4.522 0.002 . 1 . . . . 111 ASN HA . 27017 1 1356 . 1 1 111 111 ASN HB2 H 1 2.601 0.010 . 2 . . . . 111 ASN HB2 . 27017 1 1357 . 1 1 111 111 ASN HB3 H 1 2.613 0.008 . 2 . . . . 111 ASN HB3 . 27017 1 1358 . 1 1 111 111 ASN HD21 H 1 6.449 0.007 . 1 . . . . 111 ASN HD21 . 27017 1 1359 . 1 1 111 111 ASN HD22 H 1 6.843 0.000 . 1 . . . . 111 ASN HD22 . 27017 1 1360 . 1 1 111 111 ASN C C 13 175.435 0.020 . 1 . . . . 111 ASN C . 27017 1 1361 . 1 1 111 111 ASN CA C 13 56.053 0.050 . 1 . . . . 111 ASN CA . 27017 1 1362 . 1 1 111 111 ASN CB C 13 38.329 0.076 . 1 . . . . 111 ASN CB . 27017 1 1363 . 1 1 111 111 ASN CG C 13 175.809 0.020 . 1 . . . . 111 ASN CG . 27017 1 1364 . 1 1 111 111 ASN N N 15 122.222 0.036 . 1 . . . . 111 ASN N . 27017 1 1365 . 1 1 111 111 ASN ND2 N 15 112.200 0.065 . 1 . . . . 111 ASN ND2 . 27017 1 1366 . 1 1 112 112 LEU H H 1 7.908 0.003 . 1 . . . . 112 LEU H . 27017 1 1367 . 1 1 112 112 LEU HA H 1 4.405 0.006 . 1 . . . . 112 LEU HA . 27017 1 1368 . 1 1 112 112 LEU HB2 H 1 1.765 0.011 . 2 . . . . 112 LEU HB2 . 27017 1 1369 . 1 1 112 112 LEU HB3 H 1 1.921 0.016 . 2 . . . . 112 LEU HB3 . 27017 1 1370 . 1 1 112 112 LEU HG H 1 1.928 0.010 . 1 . . . . 112 LEU HG . 27017 1 1371 . 1 1 112 112 LEU HD11 H 1 0.742 0.003 . 2 . . . . 112 LEU HD11 . 27017 1 1372 . 1 1 112 112 LEU HD12 H 1 0.742 0.003 . 2 . . . . 112 LEU HD12 . 27017 1 1373 . 1 1 112 112 LEU HD13 H 1 0.742 0.003 . 2 . . . . 112 LEU HD13 . 27017 1 1374 . 1 1 112 112 LEU HD21 H 1 0.803 0.003 . 2 . . . . 112 LEU HD21 . 27017 1 1375 . 1 1 112 112 LEU HD22 H 1 0.803 0.003 . 2 . . . . 112 LEU HD22 . 27017 1 1376 . 1 1 112 112 LEU HD23 H 1 0.803 0.003 . 2 . . . . 112 LEU HD23 . 27017 1 1377 . 1 1 112 112 LEU C C 13 176.542 0.013 . 1 . . . . 112 LEU C . 27017 1 1378 . 1 1 112 112 LEU CA C 13 54.415 0.066 . 1 . . . . 112 LEU CA . 27017 1 1379 . 1 1 112 112 LEU CB C 13 41.210 0.061 . 1 . . . . 112 LEU CB . 27017 1 1380 . 1 1 112 112 LEU CG C 13 26.345 0.025 . 1 . . . . 112 LEU CG . 27017 1 1381 . 1 1 112 112 LEU CD1 C 13 23.629 0.035 . 2 . . . . 112 LEU CD1 . 27017 1 1382 . 1 1 112 112 LEU CD2 C 13 25.529 0.059 . 2 . . . . 112 LEU CD2 . 27017 1 1383 . 1 1 112 112 LEU N N 15 118.584 0.036 . 1 . . . . 112 LEU N . 27017 1 1384 . 1 1 113 113 GLY H H 1 7.879 0.007 . 1 . . . . 113 GLY H . 27017 1 1385 . 1 1 113 113 GLY HA2 H 1 3.776 0.010 . 2 . . . . 113 GLY HA2 . 27017 1 1386 . 1 1 113 113 GLY HA3 H 1 3.989 0.010 . 2 . . . . 113 GLY HA3 . 27017 1 1387 . 1 1 113 113 GLY C C 13 174.158 0.000 . 1 . . . . 113 GLY C . 27017 1 1388 . 1 1 113 113 GLY CA C 13 46.043 0.066 . 1 . . . . 113 GLY CA . 27017 1 1389 . 1 1 113 113 GLY N N 15 108.247 0.028 . 1 . . . . 113 GLY N . 27017 1 1390 . 1 1 114 114 GLU H H 1 7.786 0.003 . 1 . . . . 114 GLU H . 27017 1 1391 . 1 1 114 114 GLU HA H 1 4.319 0.004 . 1 . . . . 114 GLU HA . 27017 1 1392 . 1 1 114 114 GLU HB2 H 1 1.685 0.012 . 2 . . . . 114 GLU HB2 . 27017 1 1393 . 1 1 114 114 GLU HB3 H 1 1.971 0.006 . 2 . . . . 114 GLU HB3 . 27017 1 1394 . 1 1 114 114 GLU HG2 H 1 1.793 0.011 . 1 . . . . 114 GLU HG2 . 27017 1 1395 . 1 1 114 114 GLU C C 13 175.200 0.019 . 1 . . . . 114 GLU C . 27017 1 1396 . 1 1 114 114 GLU CA C 13 54.122 0.056 . 1 . . . . 114 GLU CA . 27017 1 1397 . 1 1 114 114 GLU CB C 13 30.537 0.060 . 1 . . . . 114 GLU CB . 27017 1 1398 . 1 1 114 114 GLU CG C 13 35.950 0.053 . 1 . . . . 114 GLU CG . 27017 1 1399 . 1 1 114 114 GLU N N 15 118.278 0.023 . 1 . . . . 114 GLU N . 27017 1 1400 . 1 1 115 115 LYS H H 1 8.868 0.004 . 1 . . . . 115 LYS H . 27017 1 1401 . 1 1 115 115 LYS HA H 1 4.433 0.004 . 1 . . . . 115 LYS HA . 27017 1 1402 . 1 1 115 115 LYS HB2 H 1 1.591 0.008 . 2 . . . . 115 LYS HB2 . 27017 1 1403 . 1 1 115 115 LYS HB3 H 1 1.775 0.004 . 2 . . . . 115 LYS HB3 . 27017 1 1404 . 1 1 115 115 LYS HG2 H 1 1.277 0.011 . 2 . . . . 115 LYS HG2 . 27017 1 1405 . 1 1 115 115 LYS HG3 H 1 1.321 0.009 . 2 . . . . 115 LYS HG3 . 27017 1 1406 . 1 1 115 115 LYS HD2 H 1 1.634 0.010 . 2 . . . . 115 LYS HD2 . 27017 1 1407 . 1 1 115 115 LYS HD3 H 1 1.632 0.011 . 2 . . . . 115 LYS HD3 . 27017 1 1408 . 1 1 115 115 LYS HE2 H 1 2.941 0.002 . 1 . . . . 115 LYS HE2 . 27017 1 1409 . 1 1 115 115 LYS HE3 H 1 2.941 0.002 . 1 . . . . 115 LYS HE3 . 27017 1 1410 . 1 1 115 115 LYS C C 13 175.382 0.007 . 1 . . . . 115 LYS C . 27017 1 1411 . 1 1 115 115 LYS CA C 13 55.044 0.056 . 1 . . . . 115 LYS CA . 27017 1 1412 . 1 1 115 115 LYS CB C 13 31.802 0.064 . 1 . . . . 115 LYS CB . 27017 1 1413 . 1 1 115 115 LYS CG C 13 24.465 0.070 . 1 . . . . 115 LYS CG . 27017 1 1414 . 1 1 115 115 LYS CD C 13 29.061 0.067 . 1 . . . . 115 LYS CD . 27017 1 1415 . 1 1 115 115 LYS CE C 13 41.982 0.082 . 1 . . . . 115 LYS CE . 27017 1 1416 . 1 1 115 115 LYS N N 15 125.734 0.022 . 1 . . . . 115 LYS N . 27017 1 1417 . 1 1 116 116 LEU H H 1 8.266 0.003 . 1 . . . . 116 LEU H . 27017 1 1418 . 1 1 116 116 LEU HA H 1 4.764 0.006 . 1 . . . . 116 LEU HA . 27017 1 1419 . 1 1 116 116 LEU HB2 H 1 1.484 0.014 . 2 . . . . 116 LEU HB2 . 27017 1 1420 . 1 1 116 116 LEU HB3 H 1 1.573 0.008 . 2 . . . . 116 LEU HB3 . 27017 1 1421 . 1 1 116 116 LEU HG H 1 1.649 0.006 . 1 . . . . 116 LEU HG . 27017 1 1422 . 1 1 116 116 LEU HD11 H 1 0.797 0.005 . 2 . . . . 116 LEU HD11 . 27017 1 1423 . 1 1 116 116 LEU HD12 H 1 0.797 0.005 . 2 . . . . 116 LEU HD12 . 27017 1 1424 . 1 1 116 116 LEU HD13 H 1 0.797 0.005 . 2 . . . . 116 LEU HD13 . 27017 1 1425 . 1 1 116 116 LEU HD21 H 1 0.796 0.003 . 2 . . . . 116 LEU HD21 . 27017 1 1426 . 1 1 116 116 LEU HD22 H 1 0.796 0.003 . 2 . . . . 116 LEU HD22 . 27017 1 1427 . 1 1 116 116 LEU HD23 H 1 0.796 0.003 . 2 . . . . 116 LEU HD23 . 27017 1 1428 . 1 1 116 116 LEU C C 13 178.454 0.024 . 1 . . . . 116 LEU C . 27017 1 1429 . 1 1 116 116 LEU CA C 13 54.034 0.096 . 1 . . . . 116 LEU CA . 27017 1 1430 . 1 1 116 116 LEU CB C 13 44.046 0.052 . 1 . . . . 116 LEU CB . 27017 1 1431 . 1 1 116 116 LEU CG C 13 27.968 0.039 . 1 . . . . 116 LEU CG . 27017 1 1432 . 1 1 116 116 LEU CD1 C 13 26.566 0.032 . 2 . . . . 116 LEU CD1 . 27017 1 1433 . 1 1 116 116 LEU CD2 C 13 23.522 0.098 . 2 . . . . 116 LEU CD2 . 27017 1 1434 . 1 1 116 116 LEU N N 15 124.950 0.027 . 1 . . . . 116 LEU N . 27017 1 1435 . 1 1 117 117 THR H H 1 9.395 0.004 . 1 . . . . 117 THR H . 27017 1 1436 . 1 1 117 117 THR HA H 1 4.434 0.005 . 1 . . . . 117 THR HA . 27017 1 1437 . 1 1 117 117 THR HB H 1 4.740 0.005 . 1 . . . . 117 THR HB . 27017 1 1438 . 1 1 117 117 THR HG21 H 1 1.336 0.014 . 1 . . . . 117 THR HG21 . 27017 1 1439 . 1 1 117 117 THR HG22 H 1 1.336 0.014 . 1 . . . . 117 THR HG22 . 27017 1 1440 . 1 1 117 117 THR HG23 H 1 1.336 0.014 . 1 . . . . 117 THR HG23 . 27017 1 1441 . 1 1 117 117 THR C C 13 175.474 0.019 . 1 . . . . 117 THR C . 27017 1 1442 . 1 1 117 117 THR CA C 13 60.724 0.092 . 1 . . . . 117 THR CA . 27017 1 1443 . 1 1 117 117 THR CB C 13 70.767 0.039 . 1 . . . . 117 THR CB . 27017 1 1444 . 1 1 117 117 THR CG2 C 13 21.599 0.046 . 1 . . . . 117 THR CG2 . 27017 1 1445 . 1 1 117 117 THR N N 15 115.451 0.040 . 1 . . . . 117 THR N . 27017 1 1446 . 1 1 118 118 ASP H H 1 8.917 0.002 . 1 . . . . 118 ASP H . 27017 1 1447 . 1 1 118 118 ASP HA H 1 4.251 0.003 . 1 . . . . 118 ASP HA . 27017 1 1448 . 1 1 118 118 ASP HB2 H 1 2.632 0.006 . 2 . . . . 118 ASP HB2 . 27017 1 1449 . 1 1 118 118 ASP HB3 H 1 2.791 0.004 . 2 . . . . 118 ASP HB3 . 27017 1 1450 . 1 1 118 118 ASP C C 13 178.795 0.002 . 1 . . . . 118 ASP C . 27017 1 1451 . 1 1 118 118 ASP CA C 13 58.225 0.111 . 1 . . . . 118 ASP CA . 27017 1 1452 . 1 1 118 118 ASP CB C 13 39.422 0.024 . 1 . . . . 118 ASP CB . 27017 1 1453 . 1 1 118 118 ASP N N 15 121.237 0.020 . 1 . . . . 118 ASP N . 27017 1 1454 . 1 1 119 119 ASP H H 1 8.292 0.002 . 1 . . . . 119 ASP H . 27017 1 1455 . 1 1 119 119 ASP HA H 1 4.426 0.003 . 1 . . . . 119 ASP HA . 27017 1 1456 . 1 1 119 119 ASP HB2 H 1 2.545 0.004 . 2 . . . . 119 ASP HB2 . 27017 1 1457 . 1 1 119 119 ASP HB3 H 1 2.682 0.006 . 2 . . . . 119 ASP HB3 . 27017 1 1458 . 1 1 119 119 ASP C C 13 178.684 0.017 . 1 . . . . 119 ASP C . 27017 1 1459 . 1 1 119 119 ASP CA C 13 57.181 0.048 . 1 . . . . 119 ASP CA . 27017 1 1460 . 1 1 119 119 ASP CB C 13 40.352 0.057 . 1 . . . . 119 ASP CB . 27017 1 1461 . 1 1 119 119 ASP N N 15 118.259 0.021 . 1 . . . . 119 ASP N . 27017 1 1462 . 1 1 120 120 GLU H H 1 7.765 0.002 . 1 . . . . 120 GLU H . 27017 1 1463 . 1 1 120 120 GLU HA H 1 3.998 0.009 . 1 . . . . 120 GLU HA . 27017 1 1464 . 1 1 120 120 GLU HB2 H 1 1.855 0.006 . 2 . . . . 120 GLU HB2 . 27017 1 1465 . 1 1 120 120 GLU HB3 H 1 2.079 0.009 . 2 . . . . 120 GLU HB3 . 27017 1 1466 . 1 1 120 120 GLU HG2 H 1 2.062 0.005 . 2 . . . . 120 GLU HG2 . 27017 1 1467 . 1 1 120 120 GLU HG3 H 1 2.287 0.002 . 2 . . . . 120 GLU HG3 . 27017 1 1468 . 1 1 120 120 GLU C C 13 180.017 0.008 . 1 . . . . 120 GLU C . 27017 1 1469 . 1 1 120 120 GLU CA C 13 59.264 0.016 . 1 . . . . 120 GLU CA . 27017 1 1470 . 1 1 120 120 GLU CB C 13 30.239 0.061 . 1 . . . . 120 GLU CB . 27017 1 1471 . 1 1 120 120 GLU CG C 13 38.058 0.096 . 1 . . . . 120 GLU CG . 27017 1 1472 . 1 1 120 120 GLU N N 15 121.364 0.037 . 1 . . . . 120 GLU N . 27017 1 1473 . 1 1 121 121 VAL H H 1 8.198 0.008 . 1 . . . . 121 VAL H . 27017 1 1474 . 1 1 121 121 VAL HA H 1 3.528 0.005 . 1 . . . . 121 VAL HA . 27017 1 1475 . 1 1 121 121 VAL HB H 1 2.247 0.009 . 1 . . . . 121 VAL HB . 27017 1 1476 . 1 1 121 121 VAL HG11 H 1 0.974 0.004 . 2 . . . . 121 VAL HG11 . 27017 1 1477 . 1 1 121 121 VAL HG12 H 1 0.974 0.004 . 2 . . . . 121 VAL HG12 . 27017 1 1478 . 1 1 121 121 VAL HG13 H 1 0.974 0.004 . 2 . . . . 121 VAL HG13 . 27017 1 1479 . 1 1 121 121 VAL HG21 H 1 0.988 0.009 . 2 . . . . 121 VAL HG21 . 27017 1 1480 . 1 1 121 121 VAL HG22 H 1 0.988 0.009 . 2 . . . . 121 VAL HG22 . 27017 1 1481 . 1 1 121 121 VAL HG23 H 1 0.988 0.009 . 2 . . . . 121 VAL HG23 . 27017 1 1482 . 1 1 121 121 VAL C C 13 177.212 0.026 . 1 . . . . 121 VAL C . 27017 1 1483 . 1 1 121 121 VAL CA C 13 67.238 0.089 . 1 . . . . 121 VAL CA . 27017 1 1484 . 1 1 121 121 VAL CB C 13 31.446 0.107 . 1 . . . . 121 VAL CB . 27017 1 1485 . 1 1 121 121 VAL CG1 C 13 23.986 0.079 . 2 . . . . 121 VAL CG1 . 27017 1 1486 . 1 1 121 121 VAL CG2 C 13 21.900 0.008 . 2 . . . . 121 VAL CG2 . 27017 1 1487 . 1 1 121 121 VAL N N 15 121.914 0.041 . 1 . . . . 121 VAL N . 27017 1 1488 . 1 1 122 122 ASP H H 1 7.940 0.003 . 1 . . . . 122 ASP H . 27017 1 1489 . 1 1 122 122 ASP HA H 1 4.353 0.002 . 1 . . . . 122 ASP HA . 27017 1 1490 . 1 1 122 122 ASP HB2 H 1 2.655 0.002 . 2 . . . . 122 ASP HB2 . 27017 1 1491 . 1 1 122 122 ASP HB3 H 1 2.830 0.006 . 2 . . . . 122 ASP HB3 . 27017 1 1492 . 1 1 122 122 ASP C C 13 179.132 0.003 . 1 . . . . 122 ASP C . 27017 1 1493 . 1 1 122 122 ASP CA C 13 57.661 0.057 . 1 . . . . 122 ASP CA . 27017 1 1494 . 1 1 122 122 ASP CB C 13 40.417 0.064 . 1 . . . . 122 ASP CB . 27017 1 1495 . 1 1 122 122 ASP N N 15 119.200 0.033 . 1 . . . . 122 ASP N . 27017 1 1496 . 1 1 123 123 GLU H H 1 8.101 0.004 . 1 . . . . 123 GLU H . 27017 1 1497 . 1 1 123 123 GLU HA H 1 4.010 0.004 . 1 . . . . 123 GLU HA . 27017 1 1498 . 1 1 123 123 GLU HB2 H 1 2.103 0.011 . 1 . . . . 123 GLU HB2 . 27017 1 1499 . 1 1 123 123 GLU HG2 H 1 2.292 0.006 . 1 . . . . 123 GLU HG2 . 27017 1 1500 . 1 1 123 123 GLU C C 13 177.777 0.030 . 1 . . . . 123 GLU C . 27017 1 1501 . 1 1 123 123 GLU CA C 13 59.176 0.056 . 1 . . . . 123 GLU CA . 27017 1 1502 . 1 1 123 123 GLU CB C 13 29.490 0.035 . 1 . . . . 123 GLU CB . 27017 1 1503 . 1 1 123 123 GLU CG C 13 35.828 0.033 . 1 . . . . 123 GLU CG . 27017 1 1504 . 1 1 123 123 GLU N N 15 120.208 0.036 . 1 . . . . 123 GLU N . 27017 1 1505 . 1 1 124 124 MET H H 1 7.835 0.003 . 1 . . . . 124 MET H . 27017 1 1506 . 1 1 124 124 MET HA H 1 4.047 0.004 . 1 . . . . 124 MET HA . 27017 1 1507 . 1 1 124 124 MET HB2 H 1 2.083 0.008 . 2 . . . . 124 MET HB2 . 27017 1 1508 . 1 1 124 124 MET HB3 H 1 2.217 0.007 . 2 . . . . 124 MET HB3 . 27017 1 1509 . 1 1 124 124 MET HG2 H 1 2.330 0.007 . 2 . . . . 124 MET HG2 . 27017 1 1510 . 1 1 124 124 MET HG3 H 1 2.710 0.003 . 2 . . . . 124 MET HG3 . 27017 1 1511 . 1 1 124 124 MET HE1 H 1 2.014 0.000 . 1 . . . . 124 MET HE1 . 27017 1 1512 . 1 1 124 124 MET HE2 H 1 2.014 0.000 . 1 . . . . 124 MET HE2 . 27017 1 1513 . 1 1 124 124 MET HE3 H 1 2.014 0.000 . 1 . . . . 124 MET HE3 . 27017 1 1514 . 1 1 124 124 MET C C 13 179.328 0.001 . 1 . . . . 124 MET C . 27017 1 1515 . 1 1 124 124 MET CA C 13 59.485 0.063 . 1 . . . . 124 MET CA . 27017 1 1516 . 1 1 124 124 MET CB C 13 32.853 0.121 . 1 . . . . 124 MET CB . 27017 1 1517 . 1 1 124 124 MET CG C 13 32.428 0.045 . 1 . . . . 124 MET CG . 27017 1 1518 . 1 1 124 124 MET CE C 13 16.730 0.000 . 1 . . . . 124 MET CE . 27017 1 1519 . 1 1 124 124 MET N N 15 120.008 0.044 . 1 . . . . 124 MET N . 27017 1 1520 . 1 1 125 125 ILE H H 1 7.923 0.006 . 1 . . . . 125 ILE H . 27017 1 1521 . 1 1 125 125 ILE HA H 1 3.500 0.004 . 1 . . . . 125 ILE HA . 27017 1 1522 . 1 1 125 125 ILE HB H 1 2.044 0.010 . 1 . . . . 125 ILE HB . 27017 1 1523 . 1 1 125 125 ILE HG12 H 1 1.021 0.010 . 2 . . . . 125 ILE HG12 . 27017 1 1524 . 1 1 125 125 ILE HG13 H 1 1.689 0.005 . 2 . . . . 125 ILE HG13 . 27017 1 1525 . 1 1 125 125 ILE HG21 H 1 0.671 0.003 . 1 . . . . 125 ILE HG21 . 27017 1 1526 . 1 1 125 125 ILE HG22 H 1 0.671 0.003 . 1 . . . . 125 ILE HG22 . 27017 1 1527 . 1 1 125 125 ILE HG23 H 1 0.671 0.003 . 1 . . . . 125 ILE HG23 . 27017 1 1528 . 1 1 125 125 ILE HD11 H 1 0.756 0.005 . 1 . . . . 125 ILE HD11 . 27017 1 1529 . 1 1 125 125 ILE HD12 H 1 0.756 0.005 . 1 . . . . 125 ILE HD12 . 27017 1 1530 . 1 1 125 125 ILE HD13 H 1 0.756 0.005 . 1 . . . . 125 ILE HD13 . 27017 1 1531 . 1 1 125 125 ILE C C 13 177.003 0.027 . 1 . . . . 125 ILE C . 27017 1 1532 . 1 1 125 125 ILE CA C 13 65.055 0.016 . 1 . . . . 125 ILE CA . 27017 1 1533 . 1 1 125 125 ILE CB C 13 36.863 0.084 . 1 . . . . 125 ILE CB . 27017 1 1534 . 1 1 125 125 ILE CG1 C 13 28.836 0.131 . 1 . . . . 125 ILE CG1 . 27017 1 1535 . 1 1 125 125 ILE CG2 C 13 16.242 0.036 . 1 . . . . 125 ILE CG2 . 27017 1 1536 . 1 1 125 125 ILE CD1 C 13 11.775 0.039 . 1 . . . . 125 ILE CD1 . 27017 1 1537 . 1 1 125 125 ILE N N 15 118.004 0.044 . 1 . . . . 125 ILE N . 27017 1 1538 . 1 1 126 126 ARG H H 1 8.402 0.004 . 1 . . . . 126 ARG H . 27017 1 1539 . 1 1 126 126 ARG HA H 1 4.012 0.004 . 1 . . . . 126 ARG HA . 27017 1 1540 . 1 1 126 126 ARG HB2 H 1 1.884 0.006 . 2 . . . . 126 ARG HB2 . 27017 1 1541 . 1 1 126 126 ARG HB3 H 1 1.947 0.002 . 2 . . . . 126 ARG HB3 . 27017 1 1542 . 1 1 126 126 ARG HG2 H 1 1.631 0.005 . 2 . . . . 126 ARG HG2 . 27017 1 1543 . 1 1 126 126 ARG HG3 H 1 1.781 0.006 . 2 . . . . 126 ARG HG3 . 27017 1 1544 . 1 1 126 126 ARG HD2 H 1 3.233 0.002 . 2 . . . . 126 ARG HD2 . 27017 1 1545 . 1 1 126 126 ARG HD3 H 1 3.234 0.003 . 2 . . . . 126 ARG HD3 . 27017 1 1546 . 1 1 126 126 ARG HE H 1 7.537 0.001 . 1 . . . . 126 ARG HE . 27017 1 1547 . 1 1 126 126 ARG C C 13 179.379 0.022 . 1 . . . . 126 ARG C . 27017 1 1548 . 1 1 126 126 ARG CA C 13 59.877 0.043 . 1 . . . . 126 ARG CA . 27017 1 1549 . 1 1 126 126 ARG CB C 13 30.266 0.049 . 1 . . . . 126 ARG CB . 27017 1 1550 . 1 1 126 126 ARG CG C 13 27.884 0.095 . 1 . . . . 126 ARG CG . 27017 1 1551 . 1 1 126 126 ARG CD C 13 43.319 0.068 . 1 . . . . 126 ARG CD . 27017 1 1552 . 1 1 126 126 ARG N N 15 118.644 0.034 . 1 . . . . 126 ARG N . 27017 1 1553 . 1 1 126 126 ARG NE N 15 84.376 0.007 . 1 . . . . 126 ARG NE . 27017 1 1554 . 1 1 127 127 GLU H H 1 7.990 0.004 . 1 . . . . 127 GLU H . 27017 1 1555 . 1 1 127 127 GLU HA H 1 3.987 0.004 . 1 . . . . 127 GLU HA . 27017 1 1556 . 1 1 127 127 GLU HB2 H 1 2.043 0.003 . 2 . . . . 127 GLU HB2 . 27017 1 1557 . 1 1 127 127 GLU HB3 H 1 2.065 0.001 . 2 . . . . 127 GLU HB3 . 27017 1 1558 . 1 1 127 127 GLU HG2 H 1 2.266 0.004 . 2 . . . . 127 GLU HG2 . 27017 1 1559 . 1 1 127 127 GLU HG3 H 1 2.451 0.003 . 2 . . . . 127 GLU HG3 . 27017 1 1560 . 1 1 127 127 GLU C C 13 177.172 0.006 . 1 . . . . 127 GLU C . 27017 1 1561 . 1 1 127 127 GLU CA C 13 58.610 0.081 . 1 . . . . 127 GLU CA . 27017 1 1562 . 1 1 127 127 GLU CB C 13 29.660 0.090 . 1 . . . . 127 GLU CB . 27017 1 1563 . 1 1 127 127 GLU CG C 13 36.427 0.036 . 1 . . . . 127 GLU CG . 27017 1 1564 . 1 1 127 127 GLU N N 15 115.568 0.027 . 1 . . . . 127 GLU N . 27017 1 1565 . 1 1 128 128 ALA H H 1 7.238 0.005 . 1 . . . . 128 ALA H . 27017 1 1566 . 1 1 128 128 ALA HA H 1 4.490 0.003 . 1 . . . . 128 ALA HA . 27017 1 1567 . 1 1 128 128 ALA HB1 H 1 1.400 0.001 . 1 . . . . 128 ALA HB1 . 27017 1 1568 . 1 1 128 128 ALA HB2 H 1 1.400 0.001 . 1 . . . . 128 ALA HB2 . 27017 1 1569 . 1 1 128 128 ALA HB3 H 1 1.400 0.001 . 1 . . . . 128 ALA HB3 . 27017 1 1570 . 1 1 128 128 ALA C C 13 177.925 0.019 . 1 . . . . 128 ALA C . 27017 1 1571 . 1 1 128 128 ALA CA C 13 51.845 0.050 . 1 . . . . 128 ALA CA . 27017 1 1572 . 1 1 128 128 ALA CB C 13 20.883 0.110 . 1 . . . . 128 ALA CB . 27017 1 1573 . 1 1 128 128 ALA N N 15 118.685 0.023 . 1 . . . . 128 ALA N . 27017 1 1574 . 1 1 129 129 ASP H H 1 8.043 0.003 . 1 . . . . 129 ASP H . 27017 1 1575 . 1 1 129 129 ASP HA H 1 4.480 0.006 . 1 . . . . 129 ASP HA . 27017 1 1576 . 1 1 129 129 ASP HB2 H 1 2.552 0.006 . 2 . . . . 129 ASP HB2 . 27017 1 1577 . 1 1 129 129 ASP HB3 H 1 2.850 0.017 . 2 . . . . 129 ASP HB3 . 27017 1 1578 . 1 1 129 129 ASP C C 13 176.003 0.013 . 1 . . . . 129 ASP C . 27017 1 1579 . 1 1 129 129 ASP CA C 13 54.301 0.055 . 1 . . . . 129 ASP CA . 27017 1 1580 . 1 1 129 129 ASP CB C 13 40.409 0.027 . 1 . . . . 129 ASP CB . 27017 1 1581 . 1 1 129 129 ASP N N 15 118.364 0.052 . 1 . . . . 129 ASP N . 27017 1 1582 . 1 1 130 130 ILE H H 1 8.424 0.005 . 1 . . . . 130 ILE H . 27017 1 1583 . 1 1 130 130 ILE HA H 1 3.987 0.006 . 1 . . . . 130 ILE HA . 27017 1 1584 . 1 1 130 130 ILE HB H 1 2.055 0.006 . 1 . . . . 130 ILE HB . 27017 1 1585 . 1 1 130 130 ILE HG12 H 1 1.407 0.005 . 2 . . . . 130 ILE HG12 . 27017 1 1586 . 1 1 130 130 ILE HG13 H 1 1.627 0.006 . 2 . . . . 130 ILE HG13 . 27017 1 1587 . 1 1 130 130 ILE HG21 H 1 0.934 0.002 . 1 . . . . 130 ILE HG21 . 27017 1 1588 . 1 1 130 130 ILE HG22 H 1 0.934 0.002 . 1 . . . . 130 ILE HG22 . 27017 1 1589 . 1 1 130 130 ILE HG23 H 1 0.934 0.002 . 1 . . . . 130 ILE HG23 . 27017 1 1590 . 1 1 130 130 ILE HD11 H 1 0.854 0.002 . 1 . . . . 130 ILE HD11 . 27017 1 1591 . 1 1 130 130 ILE HD12 H 1 0.854 0.002 . 1 . . . . 130 ILE HD12 . 27017 1 1592 . 1 1 130 130 ILE HD13 H 1 0.854 0.002 . 1 . . . . 130 ILE HD13 . 27017 1 1593 . 1 1 130 130 ILE C C 13 177.772 0.025 . 1 . . . . 130 ILE C . 27017 1 1594 . 1 1 130 130 ILE CA C 13 62.822 0.061 . 1 . . . . 130 ILE CA . 27017 1 1595 . 1 1 130 130 ILE CB C 13 38.155 0.082 . 1 . . . . 130 ILE CB . 27017 1 1596 . 1 1 130 130 ILE CG1 C 13 27.594 0.098 . 1 . . . . 130 ILE CG1 . 27017 1 1597 . 1 1 130 130 ILE CG2 C 13 17.245 0.050 . 1 . . . . 130 ILE CG2 . 27017 1 1598 . 1 1 130 130 ILE CD1 C 13 11.664 0.059 . 1 . . . . 130 ILE CD1 . 27017 1 1599 . 1 1 130 130 ILE N N 15 127.497 0.033 . 1 . . . . 130 ILE N . 27017 1 1600 . 1 1 131 131 ASP H H 1 8.214 0.004 . 1 . . . . 131 ASP H . 27017 1 1601 . 1 1 131 131 ASP HA H 1 4.567 0.005 . 1 . . . . 131 ASP HA . 27017 1 1602 . 1 1 131 131 ASP HB2 H 1 2.638 0.008 . 2 . . . . 131 ASP HB2 . 27017 1 1603 . 1 1 131 131 ASP HB3 H 1 3.078 0.002 . 2 . . . . 131 ASP HB3 . 27017 1 1604 . 1 1 131 131 ASP C C 13 178.221 0.012 . 1 . . . . 131 ASP C . 27017 1 1605 . 1 1 131 131 ASP CA C 13 53.766 0.051 . 1 . . . . 131 ASP CA . 27017 1 1606 . 1 1 131 131 ASP CB C 13 39.987 0.086 . 1 . . . . 131 ASP CB . 27017 1 1607 . 1 1 131 131 ASP N N 15 117.009 0.046 . 1 . . . . 131 ASP N . 27017 1 1608 . 1 1 132 132 GLY H H 1 7.575 0.003 . 1 . . . . 132 GLY H . 27017 1 1609 . 1 1 132 132 GLY HA2 H 1 3.836 0.003 . 2 . . . . 132 GLY HA2 . 27017 1 1610 . 1 1 132 132 GLY HA3 H 1 4.012 0.011 . 2 . . . . 132 GLY HA3 . 27017 1 1611 . 1 1 132 132 GLY C C 13 175.337 0.000 . 1 . . . . 132 GLY C . 27017 1 1612 . 1 1 132 132 GLY CA C 13 47.504 0.085 . 1 . . . . 132 GLY CA . 27017 1 1613 . 1 1 132 132 GLY N N 15 108.743 0.018 . 1 . . . . 132 GLY N . 27017 1 1614 . 1 1 133 133 ASP H H 1 8.378 0.002 . 1 . . . . 133 ASP H . 27017 1 1615 . 1 1 133 133 ASP HA H 1 4.638 0.006 . 1 . . . . 133 ASP HA . 27017 1 1616 . 1 1 133 133 ASP HB2 H 1 2.529 0.010 . 2 . . . . 133 ASP HB2 . 27017 1 1617 . 1 1 133 133 ASP HB3 H 1 3.100 0.009 . 2 . . . . 133 ASP HB3 . 27017 1 1618 . 1 1 133 133 ASP C C 13 179.163 0.000 . 1 . . . . 133 ASP C . 27017 1 1619 . 1 1 133 133 ASP CA C 13 53.672 0.202 . 1 . . . . 133 ASP CA . 27017 1 1620 . 1 1 133 133 ASP CB C 13 40.389 0.097 . 1 . . . . 133 ASP CB . 27017 1 1621 . 1 1 133 133 ASP N N 15 121.026 0.014 . 1 . . . . 133 ASP N . 27017 1 1622 . 1 1 134 134 GLY H H 1 10.528 0.007 . 1 . . . . 134 GLY H . 27017 1 1623 . 1 1 134 134 GLY HA2 H 1 3.436 0.005 . 2 . . . . 134 GLY HA2 . 27017 1 1624 . 1 1 134 134 GLY HA3 H 1 4.010 0.009 . 2 . . . . 134 GLY HA3 . 27017 1 1625 . 1 1 134 134 GLY C C 13 172.361 0.000 . 1 . . . . 134 GLY C . 27017 1 1626 . 1 1 134 134 GLY CA C 13 46.130 0.076 . 1 . . . . 134 GLY CA . 27017 1 1627 . 1 1 134 134 GLY N N 15 115.536 0.037 . 1 . . . . 134 GLY N . 27017 1 1628 . 1 1 135 135 HIS H H 1 8.329 0.002 . 1 . . . . 135 HIS H . 27017 1 1629 . 1 1 135 135 HIS HA H 1 5.044 0.005 . 1 . . . . 135 HIS HA . 27017 1 1630 . 1 1 135 135 HIS HB2 H 1 2.736 0.016 . 2 . . . . 135 HIS HB2 . 27017 1 1631 . 1 1 135 135 HIS HB3 H 1 2.908 0.021 . 2 . . . . 135 HIS HB3 . 27017 1 1632 . 1 1 135 135 HIS HD2 H 1 7.036 0.005 . 1 . . . . 135 HIS HD2 . 27017 1 1633 . 1 1 135 135 HIS HE1 H 1 7.806 0.005 . 1 . . . . 135 HIS HE1 . 27017 1 1634 . 1 1 135 135 HIS C C 13 174.747 0.009 . 1 . . . . 135 HIS C . 27017 1 1635 . 1 1 135 135 HIS CA C 13 54.141 0.034 . 1 . . . . 135 HIS CA . 27017 1 1636 . 1 1 135 135 HIS CB C 13 34.723 0.163 . 1 . . . . 135 HIS CB . 27017 1 1637 . 1 1 135 135 HIS CD2 C 13 119.698 0.058 . 1 . . . . 135 HIS CD2 . 27017 1 1638 . 1 1 135 135 HIS CE1 C 13 139.706 0.000 . 1 . . . . 135 HIS CE1 . 27017 1 1639 . 1 1 135 135 HIS N N 15 116.296 0.012 . 1 . . . . 135 HIS N . 27017 1 1640 . 1 1 136 136 ILE H H 1 9.251 0.006 . 1 . . . . 136 ILE H . 27017 1 1641 . 1 1 136 136 ILE HA H 1 5.176 0.007 . 1 . . . . 136 ILE HA . 27017 1 1642 . 1 1 136 136 ILE HB H 1 2.058 0.009 . 1 . . . . 136 ILE HB . 27017 1 1643 . 1 1 136 136 ILE HG12 H 1 1.620 0.004 . 2 . . . . 136 ILE HG12 . 27017 1 1644 . 1 1 136 136 ILE HG13 H 1 0.926 0.006 . 2 . . . . 136 ILE HG13 . 27017 1 1645 . 1 1 136 136 ILE HG21 H 1 1.272 0.006 . 1 . . . . 136 ILE HG21 . 27017 1 1646 . 1 1 136 136 ILE HG22 H 1 1.272 0.006 . 1 . . . . 136 ILE HG22 . 27017 1 1647 . 1 1 136 136 ILE HG23 H 1 1.272 0.006 . 1 . . . . 136 ILE HG23 . 27017 1 1648 . 1 1 136 136 ILE HD11 H 1 0.786 0.007 . 1 . . . . 136 ILE HD11 . 27017 1 1649 . 1 1 136 136 ILE HD12 H 1 0.786 0.007 . 1 . . . . 136 ILE HD12 . 27017 1 1650 . 1 1 136 136 ILE HD13 H 1 0.786 0.007 . 1 . . . . 136 ILE HD13 . 27017 1 1651 . 1 1 136 136 ILE C C 13 176.028 0.007 . 1 . . . . 136 ILE C . 27017 1 1652 . 1 1 136 136 ILE CA C 13 60.170 0.110 . 1 . . . . 136 ILE CA . 27017 1 1653 . 1 1 136 136 ILE CB C 13 39.743 0.103 . 1 . . . . 136 ILE CB . 27017 1 1654 . 1 1 136 136 ILE CG1 C 13 27.104 0.068 . 1 . . . . 136 ILE CG1 . 27017 1 1655 . 1 1 136 136 ILE CG2 C 13 17.935 0.081 . 1 . . . . 136 ILE CG2 . 27017 1 1656 . 1 1 136 136 ILE CD1 C 13 13.142 0.108 . 1 . . . . 136 ILE CD1 . 27017 1 1657 . 1 1 136 136 ILE N N 15 124.645 0.044 . 1 . . . . 136 ILE N . 27017 1 1658 . 1 1 137 137 ASN H H 1 9.543 0.004 . 1 . . . . 137 ASN H . 27017 1 1659 . 1 1 137 137 ASN HA H 1 5.441 0.009 . 1 . . . . 137 ASN HA . 27017 1 1660 . 1 1 137 137 ASN HB2 H 1 3.221 0.004 . 2 . . . . 137 ASN HB2 . 27017 1 1661 . 1 1 137 137 ASN HB3 H 1 3.429 0.003 . 2 . . . . 137 ASN HB3 . 27017 1 1662 . 1 1 137 137 ASN HD21 H 1 6.708 0.003 . 1 . . . . 137 ASN HD21 . 27017 1 1663 . 1 1 137 137 ASN HD22 H 1 7.267 0.000 . 1 . . . . 137 ASN HD22 . 27017 1 1664 . 1 1 137 137 ASN C C 13 175.350 0.001 . 1 . . . . 137 ASN C . 27017 1 1665 . 1 1 137 137 ASN CA C 13 51.192 0.039 . 1 . . . . 137 ASN CA . 27017 1 1666 . 1 1 137 137 ASN CB C 13 38.036 0.089 . 1 . . . . 137 ASN CB . 27017 1 1667 . 1 1 137 137 ASN CG C 13 175.281 0.053 . 1 . . . . 137 ASN CG . 27017 1 1668 . 1 1 137 137 ASN N N 15 129.549 0.039 . 1 . . . . 137 ASN N . 27017 1 1669 . 1 1 137 137 ASN ND2 N 15 107.898 0.018 . 1 . . . . 137 ASN ND2 . 27017 1 1670 . 1 1 138 138 TYR H H 1 8.708 0.004 . 1 . . . . 138 TYR H . 27017 1 1671 . 1 1 138 138 TYR HA H 1 3.504 0.005 . 1 . . . . 138 TYR HA . 27017 1 1672 . 1 1 138 138 TYR HB2 H 1 1.964 0.007 . 2 . . . . 138 TYR HB2 . 27017 1 1673 . 1 1 138 138 TYR HB3 H 1 2.390 0.008 . 2 . . . . 138 TYR HB3 . 27017 1 1674 . 1 1 138 138 TYR HD1 H 1 6.498 0.013 . 1 . . . . 138 TYR HD1 . 27017 1 1675 . 1 1 138 138 TYR HD2 H 1 6.498 0.013 . 1 . . . . 138 TYR HD2 . 27017 1 1676 . 1 1 138 138 TYR HE1 H 1 6.522 0.013 . 1 . . . . 138 TYR HE1 . 27017 1 1677 . 1 1 138 138 TYR HE2 H 1 6.522 0.013 . 1 . . . . 138 TYR HE2 . 27017 1 1678 . 1 1 138 138 TYR C C 13 176.136 0.035 . 1 . . . . 138 TYR C . 27017 1 1679 . 1 1 138 138 TYR CA C 13 63.070 0.086 . 1 . . . . 138 TYR CA . 27017 1 1680 . 1 1 138 138 TYR CB C 13 37.468 0.161 . 1 . . . . 138 TYR CB . 27017 1 1681 . 1 1 138 138 TYR CD1 C 13 132.214 0.097 . 1 . . . . 138 TYR CD1 . 27017 1 1682 . 1 1 138 138 TYR CD2 C 13 132.214 0.097 . 1 . . . . 138 TYR CD2 . 27017 1 1683 . 1 1 138 138 TYR CE1 C 13 118.223 0.043 . 1 . . . . 138 TYR CE1 . 27017 1 1684 . 1 1 138 138 TYR CE2 C 13 118.223 0.043 . 1 . . . . 138 TYR CE2 . 27017 1 1685 . 1 1 138 138 TYR N N 15 119.351 0.025 . 1 . . . . 138 TYR N . 27017 1 1686 . 1 1 139 139 GLU H H 1 8.110 0.002 . 1 . . . . 139 GLU H . 27017 1 1687 . 1 1 139 139 GLU HA H 1 3.667 0.003 . 1 . . . . 139 GLU HA . 27017 1 1688 . 1 1 139 139 GLU HB2 H 1 1.994 0.004 . 2 . . . . 139 GLU HB2 . 27017 1 1689 . 1 1 139 139 GLU HB3 H 1 2.092 0.008 . 2 . . . . 139 GLU HB3 . 27017 1 1690 . 1 1 139 139 GLU HG2 H 1 2.317 0.002 . 1 . . . . 139 GLU HG2 . 27017 1 1691 . 1 1 139 139 GLU HG3 H 1 2.317 0.002 . 1 . . . . 139 GLU HG3 . 27017 1 1692 . 1 1 139 139 GLU C C 13 180.518 0.007 . 1 . . . . 139 GLU C . 27017 1 1693 . 1 1 139 139 GLU CA C 13 60.153 0.032 . 1 . . . . 139 GLU CA . 27017 1 1694 . 1 1 139 139 GLU CB C 13 28.987 0.073 . 1 . . . . 139 GLU CB . 27017 1 1695 . 1 1 139 139 GLU CG C 13 36.839 0.026 . 1 . . . . 139 GLU CG . 27017 1 1696 . 1 1 139 139 GLU N N 15 118.978 0.025 . 1 . . . . 139 GLU N . 27017 1 1697 . 1 1 140 140 GLU H H 1 8.847 0.003 . 1 . . . . 140 GLU H . 27017 1 1698 . 1 1 140 140 GLU HA H 1 4.033 0.006 . 1 . . . . 140 GLU HA . 27017 1 1699 . 1 1 140 140 GLU HB2 H 1 2.060 0.004 . 1 . . . . 140 GLU HB2 . 27017 1 1700 . 1 1 140 140 GLU HG2 H 1 2.283 0.003 . 1 . . . . 140 GLU HG2 . 27017 1 1701 . 1 1 140 140 GLU C C 13 179.323 0.012 . 1 . . . . 140 GLU C . 27017 1 1702 . 1 1 140 140 GLU CA C 13 58.208 0.027 . 1 . . . . 140 GLU CA . 27017 1 1703 . 1 1 140 140 GLU CB C 13 29.951 0.087 . 1 . . . . 140 GLU CB . 27017 1 1704 . 1 1 140 140 GLU CG C 13 36.853 0.038 . 1 . . . . 140 GLU CG . 27017 1 1705 . 1 1 140 140 GLU N N 15 119.821 0.021 . 1 . . . . 140 GLU N . 27017 1 1706 . 1 1 141 141 PHE H H 1 8.978 0.006 . 1 . . . . 141 PHE H . 27017 1 1707 . 1 1 141 141 PHE HA H 1 4.053 0.008 . 1 . . . . 141 PHE HA . 27017 1 1708 . 1 1 141 141 PHE HB2 H 1 3.256 0.010 . 2 . . . . 141 PHE HB2 . 27017 1 1709 . 1 1 141 141 PHE HB3 H 1 3.556 0.010 . 2 . . . . 141 PHE HB3 . 27017 1 1710 . 1 1 141 141 PHE HD1 H 1 7.019 0.004 . 1 . . . . 141 PHE HD1 . 27017 1 1711 . 1 1 141 141 PHE HD2 H 1 7.019 0.004 . 1 . . . . 141 PHE HD2 . 27017 1 1712 . 1 1 141 141 PHE HE1 H 1 7.218 0.004 . 1 . . . . 141 PHE HE1 . 27017 1 1713 . 1 1 141 141 PHE HE2 H 1 7.218 0.004 . 1 . . . . 141 PHE HE2 . 27017 1 1714 . 1 1 141 141 PHE HZ H 1 6.983 0.005 . 1 . . . . 141 PHE HZ . 27017 1 1715 . 1 1 141 141 PHE C C 13 176.447 0.020 . 1 . . . . 141 PHE C . 27017 1 1716 . 1 1 141 141 PHE CA C 13 61.377 0.108 . 1 . . . . 141 PHE CA . 27017 1 1717 . 1 1 141 141 PHE CB C 13 39.913 0.033 . 1 . . . . 141 PHE CB . 27017 1 1718 . 1 1 141 141 PHE CD1 C 13 131.904 0.048 . 1 . . . . 141 PHE CD1 . 27017 1 1719 . 1 1 141 141 PHE CD2 C 13 131.904 0.048 . 1 . . . . 141 PHE CD2 . 27017 1 1720 . 1 1 141 141 PHE CE1 C 13 130.618 0.063 . 1 . . . . 141 PHE CE1 . 27017 1 1721 . 1 1 141 141 PHE CE2 C 13 130.618 0.063 . 1 . . . . 141 PHE CE2 . 27017 1 1722 . 1 1 141 141 PHE CZ C 13 131.798 0.013 . 1 . . . . 141 PHE CZ . 27017 1 1723 . 1 1 141 141 PHE N N 15 125.450 0.053 . 1 . . . . 141 PHE N . 27017 1 1724 . 1 1 142 142 VAL H H 1 8.494 0.004 . 1 . . . . 142 VAL H . 27017 1 1725 . 1 1 142 142 VAL HA H 1 3.114 0.004 . 1 . . . . 142 VAL HA . 27017 1 1726 . 1 1 142 142 VAL HB H 1 1.830 0.009 . 1 . . . . 142 VAL HB . 27017 1 1727 . 1 1 142 142 VAL HG11 H 1 0.556 0.002 . 2 . . . . 142 VAL HG11 . 27017 1 1728 . 1 1 142 142 VAL HG12 H 1 0.556 0.002 . 2 . . . . 142 VAL HG12 . 27017 1 1729 . 1 1 142 142 VAL HG13 H 1 0.556 0.002 . 2 . . . . 142 VAL HG13 . 27017 1 1730 . 1 1 142 142 VAL HG21 H 1 0.777 0.003 . 2 . . . . 142 VAL HG21 . 27017 1 1731 . 1 1 142 142 VAL HG22 H 1 0.777 0.003 . 2 . . . . 142 VAL HG22 . 27017 1 1732 . 1 1 142 142 VAL HG23 H 1 0.777 0.003 . 2 . . . . 142 VAL HG23 . 27017 1 1733 . 1 1 142 142 VAL C C 13 178.180 0.022 . 1 . . . . 142 VAL C . 27017 1 1734 . 1 1 142 142 VAL CA C 13 67.510 0.070 . 1 . . . . 142 VAL CA . 27017 1 1735 . 1 1 142 142 VAL CB C 13 31.636 0.020 . 1 . . . . 142 VAL CB . 27017 1 1736 . 1 1 142 142 VAL CG1 C 13 23.142 0.062 . 2 . . . . 142 VAL CG1 . 27017 1 1737 . 1 1 142 142 VAL CG2 C 13 21.294 0.039 . 2 . . . . 142 VAL CG2 . 27017 1 1738 . 1 1 142 142 VAL N N 15 119.651 0.039 . 1 . . . . 142 VAL N . 27017 1 1739 . 1 1 143 143 ARG H H 1 7.513 0.005 . 1 . . . . 143 ARG H . 27017 1 1740 . 1 1 143 143 ARG HA H 1 3.963 0.006 . 1 . . . . 143 ARG HA . 27017 1 1741 . 1 1 143 143 ARG HB2 H 1 1.859 0.002 . 2 . . . . 143 ARG HB2 . 27017 1 1742 . 1 1 143 143 ARG HB3 H 1 1.883 0.003 . 2 . . . . 143 ARG HB3 . 27017 1 1743 . 1 1 143 143 ARG HG2 H 1 1.557 0.009 . 2 . . . . 143 ARG HG2 . 27017 1 1744 . 1 1 143 143 ARG HG3 H 1 1.708 0.005 . 2 . . . . 143 ARG HG3 . 27017 1 1745 . 1 1 143 143 ARG HD2 H 1 3.225 0.002 . 1 . . . . 143 ARG HD2 . 27017 1 1746 . 1 1 143 143 ARG HD3 H 1 3.225 0.002 . 1 . . . . 143 ARG HD3 . 27017 1 1747 . 1 1 143 143 ARG HE H 1 7.384 0.001 . 1 . . . . 143 ARG HE . 27017 1 1748 . 1 1 143 143 ARG C C 13 178.936 0.020 . 1 . . . . 143 ARG C . 27017 1 1749 . 1 1 143 143 ARG CA C 13 59.385 0.065 . 1 . . . . 143 ARG CA . 27017 1 1750 . 1 1 143 143 ARG CB C 13 29.722 0.062 . 1 . . . . 143 ARG CB . 27017 1 1751 . 1 1 143 143 ARG CG C 13 27.457 0.102 . 1 . . . . 143 ARG CG . 27017 1 1752 . 1 1 143 143 ARG CD C 13 43.277 0.048 . 1 . . . . 143 ARG CD . 27017 1 1753 . 1 1 143 143 ARG N N 15 117.374 0.038 . 1 . . . . 143 ARG N . 27017 1 1754 . 1 1 143 143 ARG NE N 15 84.709 0.023 . 1 . . . . 143 ARG NE . 27017 1 1755 . 1 1 144 144 MET H H 1 7.921 0.003 . 1 . . . . 144 MET H . 27017 1 1756 . 1 1 144 144 MET HA H 1 4.118 0.004 . 1 . . . . 144 MET HA . 27017 1 1757 . 1 1 144 144 MET HB2 H 1 2.203 0.005 . 2 . . . . 144 MET HB2 . 27017 1 1758 . 1 1 144 144 MET HB3 H 1 2.097 0.002 . 2 . . . . 144 MET HB3 . 27017 1 1759 . 1 1 144 144 MET HG2 H 1 2.410 0.007 . 2 . . . . 144 MET HG2 . 27017 1 1760 . 1 1 144 144 MET HG3 H 1 2.523 0.005 . 2 . . . . 144 MET HG3 . 27017 1 1761 . 1 1 144 144 MET HE1 H 1 1.398 0.000 . 1 . . . . 144 MET HE1 . 27017 1 1762 . 1 1 144 144 MET HE2 H 1 1.398 0.000 . 1 . . . . 144 MET HE2 . 27017 1 1763 . 1 1 144 144 MET HE3 H 1 1.398 0.000 . 1 . . . . 144 MET HE3 . 27017 1 1764 . 1 1 144 144 MET C C 13 177.682 0.002 . 1 . . . . 144 MET C . 27017 1 1765 . 1 1 144 144 MET CA C 13 58.196 0.076 . 1 . . . . 144 MET CA . 27017 1 1766 . 1 1 144 144 MET CB C 13 32.682 0.037 . 1 . . . . 144 MET CB . 27017 1 1767 . 1 1 144 144 MET CG C 13 31.820 0.095 . 1 . . . . 144 MET CG . 27017 1 1768 . 1 1 144 144 MET CE C 13 20.997 0.000 . 1 . . . . 144 MET CE . 27017 1 1769 . 1 1 144 144 MET N N 15 119.057 0.065 . 1 . . . . 144 MET N . 27017 1 1770 . 1 1 145 145 MET H H 1 7.656 0.003 . 1 . . . . 145 MET H . 27017 1 1771 . 1 1 145 145 MET HA H 1 4.497 0.003 . 1 . . . . 145 MET HA . 27017 1 1772 . 1 1 145 145 MET HB2 H 1 2.002 0.000 . 1 . . . . 145 MET HB2 . 27017 1 1773 . 1 1 145 145 MET HG2 H 1 1.766 0.001 . 2 . . . . 145 MET HG2 . 27017 1 1774 . 1 1 145 145 MET HG3 H 1 2.002 0.005 . 2 . . . . 145 MET HG3 . 27017 1 1775 . 1 1 145 145 MET HE1 H 1 1.950 0.000 . 1 . . . . 145 MET HE1 . 27017 1 1776 . 1 1 145 145 MET HE2 H 1 1.950 0.000 . 1 . . . . 145 MET HE2 . 27017 1 1777 . 1 1 145 145 MET HE3 H 1 1.950 0.000 . 1 . . . . 145 MET HE3 . 27017 1 1778 . 1 1 145 145 MET C C 13 178.044 0.008 . 1 . . . . 145 MET C . 27017 1 1779 . 1 1 145 145 MET CA C 13 54.766 0.065 . 1 . . . . 145 MET CA . 27017 1 1780 . 1 1 145 145 MET CB C 13 30.459 0.057 . 1 . . . . 145 MET CB . 27017 1 1781 . 1 1 145 145 MET CG C 13 31.428 0.055 . 1 . . . . 145 MET CG . 27017 1 1782 . 1 1 145 145 MET CE C 13 15.294 0.000 . 1 . . . . 145 MET CE . 27017 1 1783 . 1 1 145 145 MET N N 15 117.493 0.062 . 1 . . . . 145 MET N . 27017 1 1784 . 1 1 146 146 VAL H H 1 8.004 0.004 . 1 . . . . 146 VAL H . 27017 1 1785 . 1 1 146 146 VAL HA H 1 4.357 0.002 . 1 . . . . 146 VAL HA . 27017 1 1786 . 1 1 146 146 VAL HB H 1 2.254 0.001 . 1 . . . . 146 VAL HB . 27017 1 1787 . 1 1 146 146 VAL HG11 H 1 0.906 0.006 . 2 . . . . 146 VAL HG11 . 27017 1 1788 . 1 1 146 146 VAL HG12 H 1 0.906 0.006 . 2 . . . . 146 VAL HG12 . 27017 1 1789 . 1 1 146 146 VAL HG13 H 1 0.906 0.006 . 2 . . . . 146 VAL HG13 . 27017 1 1790 . 1 1 146 146 VAL HG21 H 1 0.911 0.006 . 2 . . . . 146 VAL HG21 . 27017 1 1791 . 1 1 146 146 VAL HG22 H 1 0.911 0.006 . 2 . . . . 146 VAL HG22 . 27017 1 1792 . 1 1 146 146 VAL HG23 H 1 0.911 0.006 . 2 . . . . 146 VAL HG23 . 27017 1 1793 . 1 1 146 146 VAL C C 13 176.606 0.005 . 1 . . . . 146 VAL C . 27017 1 1794 . 1 1 146 146 VAL CA C 13 62.035 0.058 . 1 . . . . 146 VAL CA . 27017 1 1795 . 1 1 146 146 VAL CB C 13 32.545 0.071 . 1 . . . . 146 VAL CB . 27017 1 1796 . 1 1 146 146 VAL CG1 C 13 20.718 0.088 . 2 . . . . 146 VAL CG1 . 27017 1 1797 . 1 1 146 146 VAL CG2 C 13 19.551 0.076 . 2 . . . . 146 VAL CG2 . 27017 1 1798 . 1 1 146 146 VAL N N 15 115.365 0.023 . 1 . . . . 146 VAL N . 27017 1 1799 . 1 1 147 147 SER H H 1 7.779 0.002 . 1 . . . . 147 SER H . 27017 1 1800 . 1 1 147 147 SER HA H 1 4.381 0.002 . 1 . . . . 147 SER HA . 27017 1 1801 . 1 1 147 147 SER HB2 H 1 3.925 0.026 . 2 . . . . 147 SER HB2 . 27017 1 1802 . 1 1 147 147 SER HB3 H 1 3.932 0.026 . 2 . . . . 147 SER HB3 . 27017 1 1803 . 1 1 147 147 SER C C 13 173.658 0.031 . 1 . . . . 147 SER C . 27017 1 1804 . 1 1 147 147 SER CA C 13 58.999 0.031 . 1 . . . . 147 SER CA . 27017 1 1805 . 1 1 147 147 SER CB C 13 63.813 0.037 . 1 . . . . 147 SER CB . 27017 1 1806 . 1 1 147 147 SER N N 15 119.128 0.028 . 1 . . . . 147 SER N . 27017 1 1807 . 1 1 148 148 LYS H H 1 8.124 0.002 . 1 . . . . 148 LYS H . 27017 1 1808 . 1 1 148 148 LYS HA H 1 4.150 0.002 . 1 . . . . 148 LYS HA . 27017 1 1809 . 1 1 148 148 LYS HB2 H 1 1.822 0.002 . 2 . . . . 148 LYS HB2 . 27017 1 1810 . 1 1 148 148 LYS HB3 H 1 1.715 0.002 . 2 . . . . 148 LYS HB3 . 27017 1 1811 . 1 1 148 148 LYS HG2 H 1 1.420 0.001 . 1 . . . . 148 LYS HG2 . 27017 1 1812 . 1 1 148 148 LYS HG3 H 1 1.420 0.001 . 1 . . . . 148 LYS HG3 . 27017 1 1813 . 1 1 148 148 LYS HD2 H 1 1.676 0.015 . 2 . . . . 148 LYS HD2 . 27017 1 1814 . 1 1 148 148 LYS HD3 H 1 1.681 0.004 . 2 . . . . 148 LYS HD3 . 27017 1 1815 . 1 1 148 148 LYS HE2 H 1 2.989 0.002 . 1 . . . . 148 LYS HE2 . 27017 1 1816 . 1 1 148 148 LYS HE3 H 1 2.989 0.002 . 1 . . . . 148 LYS HE3 . 27017 1 1817 . 1 1 148 148 LYS C C 13 181.516 0.000 . 1 . . . . 148 LYS C . 27017 1 1818 . 1 1 148 148 LYS CA C 13 57.989 0.086 . 1 . . . . 148 LYS CA . 27017 1 1819 . 1 1 148 148 LYS CB C 13 33.561 0.052 . 1 . . . . 148 LYS CB . 27017 1 1820 . 1 1 148 148 LYS CG C 13 24.825 0.057 . 1 . . . . 148 LYS CG . 27017 1 1821 . 1 1 148 148 LYS CD C 13 28.911 0.080 . 1 . . . . 148 LYS CD . 27017 1 1822 . 1 1 148 148 LYS CE C 13 41.903 0.003 . 1 . . . . 148 LYS CE . 27017 1 1823 . 1 1 148 148 LYS N N 15 128.701 0.007 . 1 . . . . 148 LYS N . 27017 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shift_list_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shift_list_2 _Assigned_chem_shift_list.Entry_ID 27017 _Assigned_chem_shift_list.ID 2 _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 . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 27017 2 2 '3D HNCACB' . . . 27017 2 3 '3D CBCA(CO)NH' . . . 27017 2 4 '3D HNCO' . . . 27017 2 5 '3D C(CO)NH' . . . 27017 2 6 '3D HBHA(CO)NH' . . . 27017 2 7 '3D 1H-15N NOESY' . . . 27017 2 8 '2D 1H-13C HMQC' . . . 27017 2 9 '3D 1H-13C NOESY' . . . 27017 2 10 '3D HCACO' . . . 27017 2 11 '3D HCCH-TOCSY' . . . 27017 2 12 '2D 1H-13C CT-HSQC aromatic' . . . 27017 2 13 '2D (HB)CB(CGCD)HD' . . . 27017 2 14 '2D (HB)CB(CGCDCE)HE' . . . 27017 2 15 '2D 1H-1H gCOSY' . . . 27017 2 16 '2D 1H-1H TOCSY' . . . 27017 2 17 '2D 1H-1H NOESY' . . . 27017 2 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $Analysis . . 27017 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 2 2 1 1 GLY HA2 H 1 3.741 0.007 . 2 . . . . -4 GLY HA2 . 27017 2 2 . 2 2 1 1 GLY HA3 H 1 3.996 0.010 . 2 . . . . -4 GLY HA3 . 27017 2 3 . 2 2 1 1 GLY C C 13 168.786 0.073 . 1 . . . . -4 GLY C . 27017 2 4 . 2 2 1 1 GLY CA C 13 42.970 0.165 . 1 . . . . -4 GLY CA . 27017 2 5 . 2 2 2 2 PRO HA H 1 4.494 0.001 . 1 . . . . -3 PRO HA . 27017 2 6 . 2 2 2 2 PRO HB2 H 1 2.003 0.003 . 2 . . . . -3 PRO HB2 . 27017 2 7 . 2 2 2 2 PRO HB3 H 1 2.321 0.001 . 2 . . . . -3 PRO HB3 . 27017 2 8 . 2 2 2 2 PRO HG2 H 1 2.050 0.001 . 1 . . . . -3 PRO HG2 . 27017 2 9 . 2 2 2 2 PRO HG3 H 1 2.050 0.001 . 1 . . . . -3 PRO HG3 . 27017 2 10 . 2 2 2 2 PRO HD2 H 1 3.604 0.002 . 1 . . . . -3 PRO HD2 . 27017 2 11 . 2 2 2 2 PRO HD3 H 1 3.604 0.002 . 1 . . . . -3 PRO HD3 . 27017 2 12 . 2 2 2 2 PRO C C 13 177.389 0.024 . 1 . . . . -3 PRO C . 27017 2 13 . 2 2 2 2 PRO CA C 13 63.458 0.029 . 1 . . . . -3 PRO CA . 27017 2 14 . 2 2 2 2 PRO CB C 13 32.193 0.038 . 1 . . . . -3 PRO CB . 27017 2 15 . 2 2 2 2 PRO CG C 13 27.077 0.028 . 1 . . . . -3 PRO CG . 27017 2 16 . 2 2 2 2 PRO CD C 13 49.600 0.062 . 1 . . . . -3 PRO CD . 27017 2 17 . 2 2 3 3 GLY H H 1 8.645 0.001 . 1 . . . . -2 GLY H . 27017 2 18 . 2 2 3 3 GLY HA2 H 1 4.002 0.002 . 1 . . . . -2 GLY HA2 . 27017 2 19 . 2 2 3 3 GLY HA3 H 1 4.002 0.002 . 1 . . . . -2 GLY HA3 . 27017 2 20 . 2 2 3 3 GLY C C 13 174.042 0.006 . 1 . . . . -2 GLY C . 27017 2 21 . 2 2 3 3 GLY CA C 13 45.193 0.090 . 1 . . . . -2 GLY CA . 27017 2 22 . 2 2 3 3 GLY N N 15 109.855 0.008 . 1 . . . . -2 GLY N . 27017 2 23 . 2 2 4 4 SER H H 1 8.191 0.001 . 1 . . . . -1 SER H . 27017 2 24 . 2 2 4 4 SER HA H 1 4.553 0.001 . 1 . . . . -1 SER HA . 27017 2 25 . 2 2 4 4 SER HB2 H 1 3.893 0.002 . 2 . . . . -1 SER HB2 . 27017 2 26 . 2 2 4 4 SER HB3 H 1 4.028 0.007 . 2 . . . . -1 SER HB3 . 27017 2 27 . 2 2 4 4 SER C C 13 174.996 0.031 . 1 . . . . -1 SER C . 27017 2 28 . 2 2 4 4 SER CA C 13 58.148 0.047 . 1 . . . . -1 SER CA . 27017 2 29 . 2 2 4 4 SER CB C 13 63.977 0.067 . 1 . . . . -1 SER CB . 27017 2 30 . 2 2 4 4 SER N N 15 115.303 0.009 . 1 . . . . -1 SER N . 27017 2 31 . 2 2 5 5 SER H H 1 8.505 0.002 . 1 . . . . 397 SER H . 27017 2 32 . 2 2 5 5 SER HA H 1 4.469 0.001 . 1 . . . . 397 SER HA . 27017 2 33 . 2 2 5 5 SER HB2 H 1 3.944 0.009 . 2 . . . . 397 SER HB2 . 27017 2 34 . 2 2 5 5 SER HB3 H 1 4.081 0.009 . 2 . . . . 397 SER HB3 . 27017 2 35 . 2 2 5 5 SER C C 13 175.003 0.029 . 1 . . . . 397 SER C . 27017 2 36 . 2 2 5 5 SER CA C 13 58.965 0.037 . 1 . . . . 397 SER CA . 27017 2 37 . 2 2 5 5 SER CB C 13 63.866 0.079 . 1 . . . . 397 SER CB . 27017 2 38 . 2 2 5 5 SER N N 15 119.230 0.018 . 1 . . . . 397 SER N . 27017 2 39 . 2 2 6 6 ALA H H 1 8.559 0.002 . 1 . . . . 398 ALA H . 27017 2 40 . 2 2 6 6 ALA HA H 1 4.027 0.005 . 1 . . . . 398 ALA HA . 27017 2 41 . 2 2 6 6 ALA HB1 H 1 1.366 0.001 . 1 . . . . 398 ALA HB1 . 27017 2 42 . 2 2 6 6 ALA HB2 H 1 1.366 0.001 . 1 . . . . 398 ALA HB2 . 27017 2 43 . 2 2 6 6 ALA HB3 H 1 1.366 0.001 . 1 . . . . 398 ALA HB3 . 27017 2 44 . 2 2 6 6 ALA C C 13 179.548 0.032 . 1 . . . . 398 ALA C . 27017 2 45 . 2 2 6 6 ALA CA C 13 54.622 0.077 . 1 . . . . 398 ALA CA . 27017 2 46 . 2 2 6 6 ALA CB C 13 18.253 0.103 . 1 . . . . 398 ALA CB . 27017 2 47 . 2 2 6 6 ALA N N 15 124.819 0.011 . 1 . . . . 398 ALA N . 27017 2 48 . 2 2 7 7 ALA H H 1 8.138 0.002 . 1 . . . . 399 ALA H . 27017 2 49 . 2 2 7 7 ALA HA H 1 4.118 0.003 . 1 . . . . 399 ALA HA . 27017 2 50 . 2 2 7 7 ALA HB1 H 1 1.439 0.004 . 1 . . . . 399 ALA HB1 . 27017 2 51 . 2 2 7 7 ALA HB2 H 1 1.439 0.004 . 1 . . . . 399 ALA HB2 . 27017 2 52 . 2 2 7 7 ALA HB3 H 1 1.439 0.004 . 1 . . . . 399 ALA HB3 . 27017 2 53 . 2 2 7 7 ALA C C 13 179.856 0.033 . 1 . . . . 399 ALA C . 27017 2 54 . 2 2 7 7 ALA CA C 13 54.523 0.109 . 1 . . . . 399 ALA CA . 27017 2 55 . 2 2 7 7 ALA CB C 13 18.355 0.057 . 1 . . . . 399 ALA CB . 27017 2 56 . 2 2 7 7 ALA N N 15 120.610 0.016 . 1 . . . . 399 ALA N . 27017 2 57 . 2 2 8 8 ALA H H 1 7.912 0.002 . 1 . . . . 400 ALA H . 27017 2 58 . 2 2 8 8 ALA HA H 1 4.268 0.001 . 1 . . . . 400 ALA HA . 27017 2 59 . 2 2 8 8 ALA HB1 H 1 1.511 0.001 . 1 . . . . 400 ALA HB1 . 27017 2 60 . 2 2 8 8 ALA HB2 H 1 1.511 0.001 . 1 . . . . 400 ALA HB2 . 27017 2 61 . 2 2 8 8 ALA HB3 H 1 1.511 0.001 . 1 . . . . 400 ALA HB3 . 27017 2 62 . 2 2 8 8 ALA C C 13 179.447 0.007 . 1 . . . . 400 ALA C . 27017 2 63 . 2 2 8 8 ALA CA C 13 53.930 0.070 . 1 . . . . 400 ALA CA . 27017 2 64 . 2 2 8 8 ALA CB C 13 18.586 0.088 . 1 . . . . 400 ALA CB . 27017 2 65 . 2 2 8 8 ALA N N 15 120.792 0.026 . 1 . . . . 400 ALA N . 27017 2 66 . 2 2 9 9 ARG H H 1 7.940 0.009 . 1 . . . . 401 ARG H . 27017 2 67 . 2 2 9 9 ARG HA H 1 4.376 0.007 . 1 . . . . 401 ARG HA . 27017 2 68 . 2 2 9 9 ARG HB2 H 1 1.700 0.005 . 1 . . . . 401 ARG HB2 . 27017 2 69 . 2 2 9 9 ARG HG2 H 1 1.698 0.002 . 1 . . . . 401 ARG HG2 . 27017 2 70 . 2 2 9 9 ARG HD2 H 1 2.990 0.003 . 1 . . . . 401 ARG HD2 . 27017 2 71 . 2 2 9 9 ARG HE H 1 9.040 0.000 . 1 . . . . 401 ARG HE . 27017 2 72 . 2 2 9 9 ARG C C 13 176.475 0.015 . 1 . . . . 401 ARG C . 27017 2 73 . 2 2 9 9 ARG CA C 13 55.992 0.051 . 1 . . . . 401 ARG CA . 27017 2 74 . 2 2 9 9 ARG CB C 13 29.706 0.062 . 1 . . . . 401 ARG CB . 27017 2 75 . 2 2 9 9 ARG CG C 13 26.903 0.003 . 1 . . . . 401 ARG CG . 27017 2 76 . 2 2 9 9 ARG N N 15 116.803 0.056 . 1 . . . . 401 ARG N . 27017 2 77 . 2 2 9 9 ARG NE N 15 83.701 0.000 . 1 . . . . 401 ARG NE . 27017 2 78 . 2 2 10 10 LYS H H 1 7.432 0.006 . 1 . . . . 402 LYS H . 27017 2 79 . 2 2 10 10 LYS HA H 1 3.839 0.005 . 1 . . . . 402 LYS HA . 27017 2 80 . 2 2 10 10 LYS HB2 H 1 2.026 0.006 . 2 . . . . 402 LYS HB2 . 27017 2 81 . 2 2 10 10 LYS HB3 H 1 1.854 0.005 . 2 . . . . 402 LYS HB3 . 27017 2 82 . 2 2 10 10 LYS HG2 H 1 1.336 0.005 . 2 . . . . 402 LYS HG2 . 27017 2 83 . 2 2 10 10 LYS HG3 H 1 1.495 0.004 . 2 . . . . 402 LYS HG3 . 27017 2 84 . 2 2 10 10 LYS HD2 H 1 1.717 0.003 . 1 . . . . 402 LYS HD2 . 27017 2 85 . 2 2 10 10 LYS HD3 H 1 1.717 0.003 . 1 . . . . 402 LYS HD3 . 27017 2 86 . 2 2 10 10 LYS HE2 H 1 2.934 0.008 . 1 . . . . 402 LYS HE2 . 27017 2 87 . 2 2 10 10 LYS HE3 H 1 2.934 0.008 . 1 . . . . 402 LYS HE3 . 27017 2 88 . 2 2 10 10 LYS C C 13 178.116 0.059 . 1 . . . . 402 LYS C . 27017 2 89 . 2 2 10 10 LYS CA C 13 60.893 0.048 . 1 . . . . 402 LYS CA . 27017 2 90 . 2 2 10 10 LYS CB C 13 32.706 0.083 . 1 . . . . 402 LYS CB . 27017 2 91 . 2 2 10 10 LYS CG C 13 24.609 0.042 . 1 . . . . 402 LYS CG . 27017 2 92 . 2 2 10 10 LYS CD C 13 29.357 0.052 . 1 . . . . 402 LYS CD . 27017 2 93 . 2 2 10 10 LYS CE C 13 41.506 0.042 . 1 . . . . 402 LYS CE . 27017 2 94 . 2 2 10 10 LYS N N 15 120.151 0.052 . 1 . . . . 402 LYS N . 27017 2 95 . 2 2 11 11 GLU H H 1 8.353 0.007 . 1 . . . . 403 GLU H . 27017 2 96 . 2 2 11 11 GLU HA H 1 4.312 0.011 . 1 . . . . 403 GLU HA . 27017 2 97 . 2 2 11 11 GLU HB2 H 1 1.955 0.006 . 1 . . . . 403 GLU HB2 . 27017 2 98 . 2 2 11 11 GLU HG2 H 1 2.361 0.005 . 1 . . . . 403 GLU HG2 . 27017 2 99 . 2 2 11 11 GLU HG3 H 1 2.361 0.005 . 1 . . . . 403 GLU HG3 . 27017 2 100 . 2 2 11 11 GLU C C 13 179.303 0.001 . 1 . . . . 403 GLU C . 27017 2 101 . 2 2 11 11 GLU CA C 13 58.165 0.064 . 1 . . . . 403 GLU CA . 27017 2 102 . 2 2 11 11 GLU CB C 13 28.724 0.021 . 1 . . . . 403 GLU CB . 27017 2 103 . 2 2 11 11 GLU CG C 13 35.308 0.026 . 1 . . . . 403 GLU CG . 27017 2 104 . 2 2 11 11 GLU N N 15 116.964 0.016 . 1 . . . . 403 GLU N . 27017 2 105 . 2 2 12 12 ILE H H 1 7.599 0.003 . 1 . . . . 404 ILE H . 27017 2 106 . 2 2 12 12 ILE HA H 1 3.538 0.005 . 1 . . . . 404 ILE HA . 27017 2 107 . 2 2 12 12 ILE HB H 1 1.959 0.009 . 1 . . . . 404 ILE HB . 27017 2 108 . 2 2 12 12 ILE HG12 H 1 1.153 0.009 . 2 . . . . 404 ILE HG12 . 27017 2 109 . 2 2 12 12 ILE HG13 H 1 1.795 0.008 . 2 . . . . 404 ILE HG13 . 27017 2 110 . 2 2 12 12 ILE HG21 H 1 0.946 0.005 . 1 . . . . 404 ILE HG21 . 27017 2 111 . 2 2 12 12 ILE HG22 H 1 0.946 0.005 . 1 . . . . 404 ILE HG22 . 27017 2 112 . 2 2 12 12 ILE HG23 H 1 0.946 0.005 . 1 . . . . 404 ILE HG23 . 27017 2 113 . 2 2 12 12 ILE HD11 H 1 0.992 0.006 . 1 . . . . 404 ILE HD11 . 27017 2 114 . 2 2 12 12 ILE HD12 H 1 0.992 0.006 . 1 . . . . 404 ILE HD12 . 27017 2 115 . 2 2 12 12 ILE HD13 H 1 0.992 0.006 . 1 . . . . 404 ILE HD13 . 27017 2 116 . 2 2 12 12 ILE C C 13 178.312 0.021 . 1 . . . . 404 ILE C . 27017 2 117 . 2 2 12 12 ILE CA C 13 66.232 0.074 . 1 . . . . 404 ILE CA . 27017 2 118 . 2 2 12 12 ILE CB C 13 38.678 0.044 . 1 . . . . 404 ILE CB . 27017 2 119 . 2 2 12 12 ILE CG1 C 13 30.130 0.065 . 1 . . . . 404 ILE CG1 . 27017 2 120 . 2 2 12 12 ILE CG2 C 13 17.742 0.058 . 1 . . . . 404 ILE CG2 . 27017 2 121 . 2 2 12 12 ILE CD1 C 13 14.312 0.043 . 1 . . . . 404 ILE CD1 . 27017 2 122 . 2 2 12 12 ILE N N 15 121.235 0.026 . 1 . . . . 404 ILE N . 27017 2 123 . 2 2 13 13 ILE H H 1 8.433 0.007 . 1 . . . . 405 ILE H . 27017 2 124 . 2 2 13 13 ILE HA H 1 3.398 0.010 . 1 . . . . 405 ILE HA . 27017 2 125 . 2 2 13 13 ILE HB H 1 1.927 0.008 . 1 . . . . 405 ILE HB . 27017 2 126 . 2 2 13 13 ILE HG21 H 1 0.844 0.005 . 1 . . . . 405 ILE HG21 . 27017 2 127 . 2 2 13 13 ILE HG22 H 1 0.844 0.005 . 1 . . . . 405 ILE HG22 . 27017 2 128 . 2 2 13 13 ILE HG23 H 1 0.844 0.005 . 1 . . . . 405 ILE HG23 . 27017 2 129 . 2 2 13 13 ILE HD11 H 1 0.831 0.005 . 1 . . . . 405 ILE HD11 . 27017 2 130 . 2 2 13 13 ILE HD12 H 1 0.831 0.005 . 1 . . . . 405 ILE HD12 . 27017 2 131 . 2 2 13 13 ILE HD13 H 1 0.831 0.005 . 1 . . . . 405 ILE HD13 . 27017 2 132 . 2 2 13 13 ILE C C 13 177.910 0.008 . 1 . . . . 405 ILE C . 27017 2 133 . 2 2 13 13 ILE CA C 13 66.864 0.048 . 1 . . . . 405 ILE CA . 27017 2 134 . 2 2 13 13 ILE CB C 13 37.788 0.023 . 1 . . . . 405 ILE CB . 27017 2 135 . 2 2 13 13 ILE CG2 C 13 17.474 0.059 . 1 . . . . 405 ILE CG2 . 27017 2 136 . 2 2 13 13 ILE CD1 C 13 13.655 0.063 . 1 . . . . 405 ILE CD1 . 27017 2 137 . 2 2 13 13 ILE N N 15 120.044 0.020 . 1 . . . . 405 ILE N . 27017 2 138 . 2 2 14 14 ARG H H 1 8.377 0.002 . 1 . . . . 406 ARG H . 27017 2 139 . 2 2 14 14 ARG HA H 1 3.826 0.008 . 1 . . . . 406 ARG HA . 27017 2 140 . 2 2 14 14 ARG HB2 H 1 2.033 0.004 . 1 . . . . 406 ARG HB2 . 27017 2 141 . 2 2 14 14 ARG HG2 H 1 1.572 0.008 . 1 . . . . 406 ARG HG2 . 27017 2 142 . 2 2 14 14 ARG HD2 H 1 3.240 0.007 . 1 . . . . 406 ARG HD2 . 27017 2 143 . 2 2 14 14 ARG HE H 1 7.245 0.007 . 1 . . . . 406 ARG HE . 27017 2 144 . 2 2 14 14 ARG C C 13 178.368 0.005 . 1 . . . . 406 ARG C . 27017 2 145 . 2 2 14 14 ARG CA C 13 61.256 0.106 . 1 . . . . 406 ARG CA . 27017 2 146 . 2 2 14 14 ARG CB C 13 30.471 0.040 . 1 . . . . 406 ARG CB . 27017 2 147 . 2 2 14 14 ARG CG C 13 28.078 0.089 . 1 . . . . 406 ARG CG . 27017 2 148 . 2 2 14 14 ARG CD C 13 44.603 0.056 . 1 . . . . 406 ARG CD . 27017 2 149 . 2 2 14 14 ARG N N 15 118.396 0.041 . 1 . . . . 406 ARG N . 27017 2 150 . 2 2 14 14 ARG NE N 15 82.975 0.035 . 1 . . . . 406 ARG NE . 27017 2 151 . 2 2 15 15 ASN H H 1 8.362 0.015 . 1 . . . . 407 ASN H . 27017 2 152 . 2 2 15 15 ASN HA H 1 4.569 0.005 . 1 . . . . 407 ASN HA . 27017 2 153 . 2 2 15 15 ASN HB2 H 1 2.443 0.017 . 2 . . . . 407 ASN HB2 . 27017 2 154 . 2 2 15 15 ASN HB3 H 1 3.003 0.016 . 2 . . . . 407 ASN HB3 . 27017 2 155 . 2 2 15 15 ASN HD21 H 1 6.745 0.007 . 1 . . . . 407 ASN HD21 . 27017 2 156 . 2 2 15 15 ASN HD22 H 1 5.826 0.000 . 1 . . . . 407 ASN HD22 . 27017 2 157 . 2 2 15 15 ASN C C 13 178.085 0.008 . 1 . . . . 407 ASN C . 27017 2 158 . 2 2 15 15 ASN CA C 13 56.303 0.065 . 1 . . . . 407 ASN CA . 27017 2 159 . 2 2 15 15 ASN CB C 13 38.337 0.075 . 1 . . . . 407 ASN CB . 27017 2 160 . 2 2 15 15 ASN CG C 13 174.142 0.000 . 1 . . . . 407 ASN CG . 27017 2 161 . 2 2 15 15 ASN N N 15 117.188 0.043 . 1 . . . . 407 ASN N . 27017 2 162 . 2 2 15 15 ASN ND2 N 15 109.576 0.043 . 1 . . . . 407 ASN ND2 . 27017 2 163 . 2 2 16 16 LYS H H 1 8.565 0.010 . 1 . . . . 408 LYS H . 27017 2 164 . 2 2 16 16 LYS HA H 1 4.078 0.009 . 1 . . . . 408 LYS HA . 27017 2 165 . 2 2 16 16 LYS HB2 H 1 2.366 0.006 . 1 . . . . 408 LYS HB2 . 27017 2 166 . 2 2 16 16 LYS C C 13 177.864 0.027 . 1 . . . . 408 LYS C . 27017 2 167 . 2 2 16 16 LYS CA C 13 61.642 0.072 . 1 . . . . 408 LYS CA . 27017 2 168 . 2 2 16 16 LYS CB C 13 34.015 0.070 . 1 . . . . 408 LYS CB . 27017 2 169 . 2 2 16 16 LYS N N 15 121.416 0.037 . 1 . . . . 408 LYS N . 27017 2 170 . 2 2 17 17 ILE H H 1 8.420 0.006 . 1 . . . . 409 ILE H . 27017 2 171 . 2 2 17 17 ILE HA H 1 3.717 0.006 . 1 . . . . 409 ILE HA . 27017 2 172 . 2 2 17 17 ILE HB H 1 2.094 0.013 . 1 . . . . 409 ILE HB . 27017 2 173 . 2 2 17 17 ILE HG21 H 1 1.253 0.007 . 1 . . . . 409 ILE HG21 . 27017 2 174 . 2 2 17 17 ILE HG22 H 1 1.253 0.007 . 1 . . . . 409 ILE HG22 . 27017 2 175 . 2 2 17 17 ILE HG23 H 1 1.253 0.007 . 1 . . . . 409 ILE HG23 . 27017 2 176 . 2 2 17 17 ILE HD11 H 1 0.864 0.010 . 1 . . . . 409 ILE HD11 . 27017 2 177 . 2 2 17 17 ILE HD12 H 1 0.864 0.010 . 1 . . . . 409 ILE HD12 . 27017 2 178 . 2 2 17 17 ILE HD13 H 1 0.864 0.010 . 1 . . . . 409 ILE HD13 . 27017 2 179 . 2 2 17 17 ILE C C 13 178.220 0.079 . 1 . . . . 409 ILE C . 27017 2 180 . 2 2 17 17 ILE CA C 13 66.648 0.024 . 1 . . . . 409 ILE CA . 27017 2 181 . 2 2 17 17 ILE CB C 13 37.744 0.042 . 1 . . . . 409 ILE CB . 27017 2 182 . 2 2 17 17 ILE CG2 C 13 18.113 0.028 . 1 . . . . 409 ILE CG2 . 27017 2 183 . 2 2 17 17 ILE CD1 C 13 14.061 0.086 . 1 . . . . 409 ILE CD1 . 27017 2 184 . 2 2 17 17 ILE N N 15 118.738 0.030 . 1 . . . . 409 ILE N . 27017 2 185 . 2 2 18 18 ARG H H 1 8.792 0.005 . 1 . . . . 410 ARG H . 27017 2 186 . 2 2 18 18 ARG HA H 1 4.024 0.010 . 1 . . . . 410 ARG HA . 27017 2 187 . 2 2 18 18 ARG HB2 H 1 1.905 0.004 . 2 . . . . 410 ARG HB2 . 27017 2 188 . 2 2 18 18 ARG HB3 H 1 2.075 0.003 . 2 . . . . 410 ARG HB3 . 27017 2 189 . 2 2 18 18 ARG HG2 H 1 1.899 0.011 . 2 . . . . 410 ARG HG2 . 27017 2 190 . 2 2 18 18 ARG HG3 H 1 2.074 0.006 . 2 . . . . 410 ARG HG3 . 27017 2 191 . 2 2 18 18 ARG HD2 H 1 3.289 0.006 . 1 . . . . 410 ARG HD2 . 27017 2 192 . 2 2 18 18 ARG HD3 H 1 3.289 0.006 . 1 . . . . 410 ARG HD3 . 27017 2 193 . 2 2 18 18 ARG HE H 1 7.755 0.001 . 1 . . . . 410 ARG HE . 27017 2 194 . 2 2 18 18 ARG C C 13 178.848 0.033 . 1 . . . . 410 ARG C . 27017 2 195 . 2 2 18 18 ARG CA C 13 59.717 0.058 . 1 . . . . 410 ARG CA . 27017 2 196 . 2 2 18 18 ARG CB C 13 30.046 0.066 . 1 . . . . 410 ARG CB . 27017 2 197 . 2 2 18 18 ARG CG C 13 28.382 0.068 . 1 . . . . 410 ARG CG . 27017 2 198 . 2 2 18 18 ARG CD C 13 43.073 0.074 . 1 . . . . 410 ARG CD . 27017 2 199 . 2 2 18 18 ARG N N 15 119.132 0.079 . 1 . . . . 410 ARG N . 27017 2 200 . 2 2 18 18 ARG NE N 15 84.945 0.036 . 1 . . . . 410 ARG NE . 27017 2 201 . 2 2 19 19 ALA H H 1 8.459 0.005 . 1 . . . . 411 ALA H . 27017 2 202 . 2 2 19 19 ALA HA H 1 4.140 0.001 . 1 . . . . 411 ALA HA . 27017 2 203 . 2 2 19 19 ALA HB1 H 1 1.965 0.004 . 1 . . . . 411 ALA HB1 . 27017 2 204 . 2 2 19 19 ALA HB2 H 1 1.965 0.004 . 1 . . . . 411 ALA HB2 . 27017 2 205 . 2 2 19 19 ALA HB3 H 1 1.965 0.004 . 1 . . . . 411 ALA HB3 . 27017 2 206 . 2 2 19 19 ALA C C 13 179.575 0.035 . 1 . . . . 411 ALA C . 27017 2 207 . 2 2 19 19 ALA CA C 13 55.838 0.069 . 1 . . . . 411 ALA CA . 27017 2 208 . 2 2 19 19 ALA CB C 13 18.499 0.121 . 1 . . . . 411 ALA CB . 27017 2 209 . 2 2 19 19 ALA N N 15 121.612 0.014 . 1 . . . . 411 ALA N . 27017 2 210 . 2 2 20 20 ILE H H 1 8.309 0.013 . 1 . . . . 412 ILE H . 27017 2 211 . 2 2 20 20 ILE HA H 1 4.051 0.005 . 1 . . . . 412 ILE HA . 27017 2 212 . 2 2 20 20 ILE HB H 1 2.344 0.008 . 1 . . . . 412 ILE HB . 27017 2 213 . 2 2 20 20 ILE HG12 H 1 1.708 0.008 . 2 . . . . 412 ILE HG12 . 27017 2 214 . 2 2 20 20 ILE HG13 H 1 1.812 0.008 . 2 . . . . 412 ILE HG13 . 27017 2 215 . 2 2 20 20 ILE HG21 H 1 1.006 0.001 . 1 . . . . 412 ILE HG21 . 27017 2 216 . 2 2 20 20 ILE HG22 H 1 1.006 0.001 . 1 . . . . 412 ILE HG22 . 27017 2 217 . 2 2 20 20 ILE HG23 H 1 1.006 0.001 . 1 . . . . 412 ILE HG23 . 27017 2 218 . 2 2 20 20 ILE HD11 H 1 0.848 0.004 . 1 . . . . 412 ILE HD11 . 27017 2 219 . 2 2 20 20 ILE HD12 H 1 0.848 0.004 . 1 . . . . 412 ILE HD12 . 27017 2 220 . 2 2 20 20 ILE HD13 H 1 0.848 0.004 . 1 . . . . 412 ILE HD13 . 27017 2 221 . 2 2 20 20 ILE C C 13 178.353 0.023 . 1 . . . . 412 ILE C . 27017 2 222 . 2 2 20 20 ILE CA C 13 63.523 0.057 . 1 . . . . 412 ILE CA . 27017 2 223 . 2 2 20 20 ILE CB C 13 36.633 0.037 . 1 . . . . 412 ILE CB . 27017 2 224 . 2 2 20 20 ILE CG1 C 13 27.725 0.076 . 1 . . . . 412 ILE CG1 . 27017 2 225 . 2 2 20 20 ILE CG2 C 13 18.864 0.079 . 1 . . . . 412 ILE CG2 . 27017 2 226 . 2 2 20 20 ILE CD1 C 13 12.245 0.097 . 1 . . . . 412 ILE CD1 . 27017 2 227 . 2 2 20 20 ILE N N 15 115.893 0.045 . 1 . . . . 412 ILE N . 27017 2 228 . 2 2 21 21 GLY H H 1 8.881 0.016 . 1 . . . . 413 GLY H . 27017 2 229 . 2 2 21 21 GLY HA2 H 1 3.766 0.005 . 2 . . . . 413 GLY HA2 . 27017 2 230 . 2 2 21 21 GLY HA3 H 1 4.039 0.012 . 2 . . . . 413 GLY HA3 . 27017 2 231 . 2 2 21 21 GLY C C 13 175.156 0.000 . 1 . . . . 413 GLY C . 27017 2 232 . 2 2 21 21 GLY CA C 13 48.306 0.074 . 1 . . . . 413 GLY CA . 27017 2 233 . 2 2 21 21 GLY N N 15 108.950 0.045 . 1 . . . . 413 GLY N . 27017 2 234 . 2 2 22 22 LYS H H 1 8.435 0.005 . 1 . . . . 414 LYS H . 27017 2 235 . 2 2 22 22 LYS HA H 1 4.010 0.005 . 1 . . . . 414 LYS HA . 27017 2 236 . 2 2 22 22 LYS HB2 H 1 1.753 0.006 . 2 . . . . 414 LYS HB2 . 27017 2 237 . 2 2 22 22 LYS HB3 H 1 2.020 0.007 . 2 . . . . 414 LYS HB3 . 27017 2 238 . 2 2 22 22 LYS HG2 H 1 1.591 0.009 . 1 . . . . 414 LYS HG2 . 27017 2 239 . 2 2 22 22 LYS HD2 H 1 1.872 0.004 . 1 . . . . 414 LYS HD2 . 27017 2 240 . 2 2 22 22 LYS HE2 H 1 3.221 0.008 . 2 . . . . 414 LYS HE2 . 27017 2 241 . 2 2 22 22 LYS HE3 H 1 3.220 0.007 . 2 . . . . 414 LYS HE3 . 27017 2 242 . 2 2 22 22 LYS C C 13 179.486 0.006 . 1 . . . . 414 LYS C . 27017 2 243 . 2 2 22 22 LYS CA C 13 60.276 0.087 . 1 . . . . 414 LYS CA . 27017 2 244 . 2 2 22 22 LYS CB C 13 32.327 0.038 . 1 . . . . 414 LYS CB . 27017 2 245 . 2 2 22 22 LYS CG C 13 25.514 0.012 . 1 . . . . 414 LYS CG . 27017 2 246 . 2 2 22 22 LYS CD C 13 29.413 0.013 . 1 . . . . 414 LYS CD . 27017 2 247 . 2 2 22 22 LYS CE C 13 44.939 0.022 . 1 . . . . 414 LYS CE . 27017 2 248 . 2 2 22 22 LYS N N 15 120.332 0.031 . 1 . . . . 414 LYS N . 27017 2 249 . 2 2 23 23 MET H H 1 8.158 0.003 . 1 . . . . 415 MET H . 27017 2 250 . 2 2 23 23 MET HA H 1 4.262 0.005 . 1 . . . . 415 MET HA . 27017 2 251 . 2 2 23 23 MET HB2 H 1 1.982 0.010 . 2 . . . . 415 MET HB2 . 27017 2 252 . 2 2 23 23 MET HB3 H 1 2.271 0.010 . 2 . . . . 415 MET HB3 . 27017 2 253 . 2 2 23 23 MET HG2 H 1 2.570 0.014 . 2 . . . . 415 MET HG2 . 27017 2 254 . 2 2 23 23 MET HG3 H 1 2.751 0.008 . 2 . . . . 415 MET HG3 . 27017 2 255 . 2 2 23 23 MET HE1 H 1 1.618 0.000 . 1 . . . . 415 MET HE1 . 27017 2 256 . 2 2 23 23 MET HE2 H 1 1.618 0.000 . 1 . . . . 415 MET HE2 . 27017 2 257 . 2 2 23 23 MET HE3 H 1 1.618 0.000 . 1 . . . . 415 MET HE3 . 27017 2 258 . 2 2 23 23 MET C C 13 177.792 0.003 . 1 . . . . 415 MET C . 27017 2 259 . 2 2 23 23 MET CA C 13 57.561 0.052 . 1 . . . . 415 MET CA . 27017 2 260 . 2 2 23 23 MET CB C 13 32.002 0.069 . 1 . . . . 415 MET CB . 27017 2 261 . 2 2 23 23 MET CG C 13 32.994 0.068 . 1 . . . . 415 MET CG . 27017 2 262 . 2 2 23 23 MET CE C 13 16.724 0.000 . 1 . . . . 415 MET CE . 27017 2 263 . 2 2 23 23 MET N N 15 116.825 0.048 . 1 . . . . 415 MET N . 27017 2 264 . 2 2 24 24 ALA H H 1 9.133 0.003 . 1 . . . . 416 ALA H . 27017 2 265 . 2 2 24 24 ALA HA H 1 4.181 0.007 . 1 . . . . 416 ALA HA . 27017 2 266 . 2 2 24 24 ALA HB1 H 1 1.570 0.001 . 1 . . . . 416 ALA HB1 . 27017 2 267 . 2 2 24 24 ALA HB2 H 1 1.570 0.001 . 1 . . . . 416 ALA HB2 . 27017 2 268 . 2 2 24 24 ALA HB3 H 1 1.570 0.001 . 1 . . . . 416 ALA HB3 . 27017 2 269 . 2 2 24 24 ALA C C 13 180.119 0.002 . 1 . . . . 416 ALA C . 27017 2 270 . 2 2 24 24 ALA CA C 13 55.344 0.082 . 1 . . . . 416 ALA CA . 27017 2 271 . 2 2 24 24 ALA CB C 13 18.338 0.068 . 1 . . . . 416 ALA CB . 27017 2 272 . 2 2 24 24 ALA N N 15 121.207 0.017 . 1 . . . . 416 ALA N . 27017 2 273 . 2 2 25 25 ARG H H 1 8.330 0.003 . 1 . . . . 417 ARG H . 27017 2 274 . 2 2 25 25 ARG HA H 1 4.166 0.006 . 1 . . . . 417 ARG HA . 27017 2 275 . 2 2 25 25 ARG HB2 H 1 1.895 0.009 . 2 . . . . 417 ARG HB2 . 27017 2 276 . 2 2 25 25 ARG HB3 H 1 2.252 0.012 . 2 . . . . 417 ARG HB3 . 27017 2 277 . 2 2 25 25 ARG HG2 H 1 1.737 0.010 . 1 . . . . 417 ARG HG2 . 27017 2 278 . 2 2 25 25 ARG HD2 H 1 3.259 0.013 . 1 . . . . 417 ARG HD2 . 27017 2 279 . 2 2 25 25 ARG HD3 H 1 3.259 0.013 . 1 . . . . 417 ARG HD3 . 27017 2 280 . 2 2 25 25 ARG HE H 1 7.762 0.001 . 1 . . . . 417 ARG HE . 27017 2 281 . 2 2 25 25 ARG C C 13 177.645 0.037 . 1 . . . . 417 ARG C . 27017 2 282 . 2 2 25 25 ARG CA C 13 59.140 0.030 . 1 . . . . 417 ARG CA . 27017 2 283 . 2 2 25 25 ARG CB C 13 29.738 0.063 . 1 . . . . 417 ARG CB . 27017 2 284 . 2 2 25 25 ARG CG C 13 27.363 0.044 . 1 . . . . 417 ARG CG . 27017 2 285 . 2 2 25 25 ARG CD C 13 43.444 0.075 . 1 . . . . 417 ARG CD . 27017 2 286 . 2 2 25 25 ARG N N 15 119.205 0.046 . 1 . . . . 417 ARG N . 27017 2 287 . 2 2 25 25 ARG NE N 15 84.922 0.006 . 1 . . . . 417 ARG NE . 27017 2 288 . 2 2 26 26 VAL H H 1 7.857 0.005 . 1 . . . . 418 VAL H . 27017 2 289 . 2 2 26 26 VAL HA H 1 3.630 0.005 . 1 . . . . 418 VAL HA . 27017 2 290 . 2 2 26 26 VAL HB H 1 2.287 0.004 . 1 . . . . 418 VAL HB . 27017 2 291 . 2 2 26 26 VAL HG11 H 1 0.976 0.003 . 2 . . . . 418 VAL HG11 . 27017 2 292 . 2 2 26 26 VAL HG12 H 1 0.976 0.003 . 2 . . . . 418 VAL HG12 . 27017 2 293 . 2 2 26 26 VAL HG13 H 1 0.976 0.003 . 2 . . . . 418 VAL HG13 . 27017 2 294 . 2 2 26 26 VAL HG21 H 1 1.092 0.001 . 2 . . . . 418 VAL HG21 . 27017 2 295 . 2 2 26 26 VAL HG22 H 1 1.092 0.001 . 2 . . . . 418 VAL HG22 . 27017 2 296 . 2 2 26 26 VAL HG23 H 1 1.092 0.001 . 2 . . . . 418 VAL HG23 . 27017 2 297 . 2 2 26 26 VAL C C 13 178.034 0.039 . 1 . . . . 418 VAL C . 27017 2 298 . 2 2 26 26 VAL CA C 13 66.740 0.037 . 1 . . . . 418 VAL CA . 27017 2 299 . 2 2 26 26 VAL CB C 13 31.344 0.029 . 1 . . . . 418 VAL CB . 27017 2 300 . 2 2 26 26 VAL CG1 C 13 21.935 0.027 . 2 . . . . 418 VAL CG1 . 27017 2 301 . 2 2 26 26 VAL CG2 C 13 22.429 0.050 . 2 . . . . 418 VAL CG2 . 27017 2 302 . 2 2 26 26 VAL N N 15 119.708 0.052 . 1 . . . . 418 VAL N . 27017 2 303 . 2 2 27 27 PHE H H 1 8.047 0.003 . 1 . . . . 419 PHE H . 27017 2 304 . 2 2 27 27 PHE HA H 1 4.396 0.004 . 1 . . . . 419 PHE HA . 27017 2 305 . 2 2 27 27 PHE HB2 H 1 3.230 0.008 . 2 . . . . 419 PHE HB2 . 27017 2 306 . 2 2 27 27 PHE HB3 H 1 3.452 0.012 . 2 . . . . 419 PHE HB3 . 27017 2 307 . 2 2 27 27 PHE HD1 H 1 7.315 0.005 . 1 . . . . 419 PHE HD1 . 27017 2 308 . 2 2 27 27 PHE HD2 H 1 7.315 0.005 . 1 . . . . 419 PHE HD2 . 27017 2 309 . 2 2 27 27 PHE HE1 H 1 7.346 0.006 . 1 . . . . 419 PHE HE1 . 27017 2 310 . 2 2 27 27 PHE HE2 H 1 7.346 0.006 . 1 . . . . 419 PHE HE2 . 27017 2 311 . 2 2 27 27 PHE HZ H 1 7.090 0.001 . 1 . . . . 419 PHE HZ . 27017 2 312 . 2 2 27 27 PHE C C 13 176.602 0.035 . 1 . . . . 419 PHE C . 27017 2 313 . 2 2 27 27 PHE CA C 13 60.110 0.072 . 1 . . . . 419 PHE CA . 27017 2 314 . 2 2 27 27 PHE CB C 13 38.837 0.063 . 1 . . . . 419 PHE CB . 27017 2 315 . 2 2 27 27 PHE CD1 C 13 131.827 0.079 . 1 . . . . 419 PHE CD1 . 27017 2 316 . 2 2 27 27 PHE CD2 C 13 131.827 0.079 . 1 . . . . 419 PHE CD2 . 27017 2 317 . 2 2 27 27 PHE CE1 C 13 130.851 0.001 . 1 . . . . 419 PHE CE1 . 27017 2 318 . 2 2 27 27 PHE CE2 C 13 130.851 0.001 . 1 . . . . 419 PHE CE2 . 27017 2 319 . 2 2 27 27 PHE CZ C 13 128.772 0.086 . 1 . . . . 419 PHE CZ . 27017 2 320 . 2 2 27 27 PHE N N 15 117.898 0.039 . 1 . . . . 419 PHE N . 27017 2 321 . 2 2 28 28 SER H H 1 8.328 0.004 . 1 . . . . 420 SER H . 27017 2 322 . 2 2 28 28 SER HA H 1 3.897 0.007 . 1 . . . . 420 SER HA . 27017 2 323 . 2 2 28 28 SER HB2 H 1 3.969 0.005 . 2 . . . . 420 SER HB2 . 27017 2 324 . 2 2 28 28 SER HB3 H 1 3.987 0.005 . 2 . . . . 420 SER HB3 . 27017 2 325 . 2 2 28 28 SER C C 13 177.259 0.044 . 1 . . . . 420 SER C . 27017 2 326 . 2 2 28 28 SER CA C 13 61.525 0.044 . 1 . . . . 420 SER CA . 27017 2 327 . 2 2 28 28 SER CB C 13 62.932 0.053 . 1 . . . . 420 SER CB . 27017 2 328 . 2 2 28 28 SER N N 15 114.451 0.046 . 1 . . . . 420 SER N . 27017 2 329 . 2 2 29 29 VAL H H 1 8.078 0.002 . 1 . . . . 421 VAL H . 27017 2 330 . 2 2 29 29 VAL HA H 1 3.773 0.005 . 1 . . . . 421 VAL HA . 27017 2 331 . 2 2 29 29 VAL HB H 1 2.204 0.009 . 1 . . . . 421 VAL HB . 27017 2 332 . 2 2 29 29 VAL HG11 H 1 0.915 0.002 . 2 . . . . 421 VAL HG11 . 27017 2 333 . 2 2 29 29 VAL HG12 H 1 0.915 0.002 . 2 . . . . 421 VAL HG12 . 27017 2 334 . 2 2 29 29 VAL HG13 H 1 0.915 0.002 . 2 . . . . 421 VAL HG13 . 27017 2 335 . 2 2 29 29 VAL HG21 H 1 1.014 0.001 . 2 . . . . 421 VAL HG21 . 27017 2 336 . 2 2 29 29 VAL HG22 H 1 1.014 0.001 . 2 . . . . 421 VAL HG22 . 27017 2 337 . 2 2 29 29 VAL HG23 H 1 1.014 0.001 . 2 . . . . 421 VAL HG23 . 27017 2 338 . 2 2 29 29 VAL C C 13 178.668 0.006 . 1 . . . . 421 VAL C . 27017 2 339 . 2 2 29 29 VAL CA C 13 65.655 0.066 . 1 . . . . 421 VAL CA . 27017 2 340 . 2 2 29 29 VAL CB C 13 31.641 0.103 . 1 . . . . 421 VAL CB . 27017 2 341 . 2 2 29 29 VAL CG1 C 13 21.125 0.051 . 2 . . . . 421 VAL CG1 . 27017 2 342 . 2 2 29 29 VAL CG2 C 13 22.294 0.028 . 2 . . . . 421 VAL CG2 . 27017 2 343 . 2 2 29 29 VAL N N 15 121.268 0.020 . 1 . . . . 421 VAL N . 27017 2 344 . 2 2 30 30 LEU H H 1 7.855 0.002 . 1 . . . . 422 LEU H . 27017 2 345 . 2 2 30 30 LEU HA H 1 4.145 0.005 . 1 . . . . 422 LEU HA . 27017 2 346 . 2 2 30 30 LEU HB2 H 1 1.635 0.009 . 2 . . . . 422 LEU HB2 . 27017 2 347 . 2 2 30 30 LEU HB3 H 1 2.002 0.007 . 2 . . . . 422 LEU HB3 . 27017 2 348 . 2 2 30 30 LEU HD11 H 1 0.911 0.006 . 2 . . . . 422 LEU HD11 . 27017 2 349 . 2 2 30 30 LEU HD12 H 1 0.911 0.006 . 2 . . . . 422 LEU HD12 . 27017 2 350 . 2 2 30 30 LEU HD13 H 1 0.911 0.006 . 2 . . . . 422 LEU HD13 . 27017 2 351 . 2 2 30 30 LEU HD21 H 1 0.929 0.006 . 2 . . . . 422 LEU HD21 . 27017 2 352 . 2 2 30 30 LEU HD22 H 1 0.929 0.006 . 2 . . . . 422 LEU HD22 . 27017 2 353 . 2 2 30 30 LEU HD23 H 1 0.929 0.006 . 2 . . . . 422 LEU HD23 . 27017 2 354 . 2 2 30 30 LEU C C 13 179.332 0.046 . 1 . . . . 422 LEU C . 27017 2 355 . 2 2 30 30 LEU CA C 13 57.181 0.019 . 1 . . . . 422 LEU CA . 27017 2 356 . 2 2 30 30 LEU CB C 13 41.671 0.064 . 1 . . . . 422 LEU CB . 27017 2 357 . 2 2 30 30 LEU CD1 C 13 23.166 0.072 . 2 . . . . 422 LEU CD1 . 27017 2 358 . 2 2 30 30 LEU CD2 C 13 26.875 0.007 . 2 . . . . 422 LEU CD2 . 27017 2 359 . 2 2 30 30 LEU N N 15 120.299 0.015 . 1 . . . . 422 LEU N . 27017 2 360 . 2 2 31 31 ARG H H 1 7.658 0.003 . 1 . . . . 423 ARG H . 27017 2 361 . 2 2 31 31 ARG HA H 1 4.211 0.004 . 1 . . . . 423 ARG HA . 27017 2 362 . 2 2 31 31 ARG HB2 H 1 1.631 0.009 . 2 . . . . 423 ARG HB2 . 27017 2 363 . 2 2 31 31 ARG HB3 H 1 1.706 0.008 . 2 . . . . 423 ARG HB3 . 27017 2 364 . 2 2 31 31 ARG HG2 H 1 1.357 0.007 . 2 . . . . 423 ARG HG2 . 27017 2 365 . 2 2 31 31 ARG HG3 H 1 1.370 0.011 . 2 . . . . 423 ARG HG3 . 27017 2 366 . 2 2 31 31 ARG HD2 H 1 2.954 0.004 . 2 . . . . 423 ARG HD2 . 27017 2 367 . 2 2 31 31 ARG HD3 H 1 2.865 0.009 . 2 . . . . 423 ARG HD3 . 27017 2 368 . 2 2 31 31 ARG HE H 1 8.100 0.004 . 1 . . . . 423 ARG HE . 27017 2 369 . 2 2 31 31 ARG C C 13 176.927 0.024 . 1 . . . . 423 ARG C . 27017 2 370 . 2 2 31 31 ARG CA C 13 56.776 0.055 . 1 . . . . 423 ARG CA . 27017 2 371 . 2 2 31 31 ARG CB C 13 30.299 0.043 . 1 . . . . 423 ARG CB . 27017 2 372 . 2 2 31 31 ARG CG C 13 27.098 0.039 . 1 . . . . 423 ARG CG . 27017 2 373 . 2 2 31 31 ARG CD C 13 42.946 0.070 . 1 . . . . 423 ARG CD . 27017 2 374 . 2 2 31 31 ARG N N 15 117.798 0.023 . 1 . . . . 423 ARG N . 27017 2 375 . 2 2 31 31 ARG NE N 15 86.155 0.028 . 1 . . . . 423 ARG NE . 27017 2 376 . 2 2 32 32 GLU H H 1 7.854 0.003 . 1 . . . . 424 GLU H . 27017 2 377 . 2 2 32 32 GLU HA H 1 4.197 0.002 . 1 . . . . 424 GLU HA . 27017 2 378 . 2 2 32 32 GLU HB2 H 1 2.092 0.003 . 2 . . . . 424 GLU HB2 . 27017 2 379 . 2 2 32 32 GLU HB3 H 1 2.092 0.004 . 2 . . . . 424 GLU HB3 . 27017 2 380 . 2 2 32 32 GLU HG2 H 1 2.314 0.003 . 2 . . . . 424 GLU HG2 . 27017 2 381 . 2 2 32 32 GLU HG3 H 1 2.413 0.003 . 2 . . . . 424 GLU HG3 . 27017 2 382 . 2 2 32 32 GLU C C 13 176.829 0.009 . 1 . . . . 424 GLU C . 27017 2 383 . 2 2 32 32 GLU CA C 13 57.302 0.075 . 1 . . . . 424 GLU CA . 27017 2 384 . 2 2 32 32 GLU CB C 13 30.045 0.063 . 1 . . . . 424 GLU CB . 27017 2 385 . 2 2 32 32 GLU CG C 13 36.132 0.009 . 1 . . . . 424 GLU CG . 27017 2 386 . 2 2 32 32 GLU N N 15 120.720 0.016 . 1 . . . . 424 GLU N . 27017 2 387 . 2 2 33 33 GLU H H 1 8.157 0.002 . 1 . . . . 425 GLU H . 27017 2 388 . 2 2 33 33 GLU HA H 1 4.363 0.005 . 1 . . . . 425 GLU HA . 27017 2 389 . 2 2 33 33 GLU HB2 H 1 1.972 0.005 . 2 . . . . 425 GLU HB2 . 27017 2 390 . 2 2 33 33 GLU HB3 H 1 2.138 0.003 . 2 . . . . 425 GLU HB3 . 27017 2 391 . 2 2 33 33 GLU HG2 H 1 2.369 0.002 . 2 . . . . 425 GLU HG2 . 27017 2 392 . 2 2 33 33 GLU HG3 H 1 2.293 0.003 . 2 . . . . 425 GLU HG3 . 27017 2 393 . 2 2 33 33 GLU C C 13 175.771 0.001 . 1 . . . . 425 GLU C . 27017 2 394 . 2 2 33 33 GLU CA C 13 56.561 0.055 . 1 . . . . 425 GLU CA . 27017 2 395 . 2 2 33 33 GLU CB C 13 30.305 0.053 . 1 . . . . 425 GLU CB . 27017 2 396 . 2 2 33 33 GLU CG C 13 36.163 0.034 . 1 . . . . 425 GLU CG . 27017 2 397 . 2 2 33 33 GLU N N 15 121.022 0.004 . 1 . . . . 425 GLU N . 27017 2 398 . 2 2 34 34 SER H H 1 7.864 0.001 . 1 . . . . 426 SER H . 27017 2 399 . 2 2 34 34 SER HA H 1 4.272 0.001 . 1 . . . . 426 SER HA . 27017 2 400 . 2 2 34 34 SER HB2 H 1 3.869 0.001 . 2 . . . . 426 SER HB2 . 27017 2 401 . 2 2 34 34 SER HB3 H 1 3.870 0.000 . 2 . . . . 426 SER HB3 . 27017 2 402 . 2 2 34 34 SER C C 13 178.764 0.000 . 1 . . . . 426 SER C . 27017 2 403 . 2 2 34 34 SER CA C 13 60.060 0.044 . 1 . . . . 426 SER CA . 27017 2 404 . 2 2 34 34 SER CB C 13 64.851 0.033 . 1 . . . . 426 SER CB . 27017 2 405 . 2 2 34 34 SER N N 15 122.389 0.004 . 1 . . . . 426 SER N . 27017 2 stop_ save_