################################### # 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 19399 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $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 '3D 1H-15N NOESY' . . . 19399 1 2 '3D 1H-13C NOESY' . . . 19399 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 . 2 2 1 1 MET HA H 1 4.194 0.006 . 1 . . . A 1 MET HA . 19399 1 2 . 2 2 1 1 MET HB2 H 1 2.112 0.011 . 2 . . . A 1 MET HB2 . 19399 1 3 . 2 2 1 1 MET HB3 H 1 2.053 0.011 . 2 . . . A 1 MET HB3 . 19399 1 4 . 2 2 1 1 MET HG2 H 1 2.498 0.006 . 2 . . . A 1 MET HG2 . 19399 1 5 . 2 2 1 1 MET HG3 H 1 1.973 0.006 . 2 . . . A 1 MET HG3 . 19399 1 6 . 2 2 1 1 MET HE1 H 1 1.624 0.003 . 1 . . . A 1 MET HE1 . 19399 1 7 . 2 2 1 1 MET HE2 H 1 1.624 0.003 . 1 . . . A 1 MET HE2 . 19399 1 8 . 2 2 1 1 MET HE3 H 1 1.624 0.003 . 1 . . . A 1 MET HE3 . 19399 1 9 . 2 2 1 1 MET CA C 13 54.296 0.031 . 1 . . . A 1 MET CA . 19399 1 10 . 2 2 1 1 MET CB C 13 33.035 0.042 . 1 . . . A 1 MET CB . 19399 1 11 . 2 2 1 1 MET CG C 13 30.814 0.031 . 1 . . . A 1 MET CG . 19399 1 12 . 2 2 1 1 MET CE C 13 17.805 0.068 . 1 . . . A 1 MET CE . 19399 1 13 . 2 2 2 2 GLN H H 1 8.937 0.002 . 1 . . . A 2 GLN H . 19399 1 14 . 2 2 2 2 GLN HA H 1 5.239 0.008 . 1 . . . A 2 GLN HA . 19399 1 15 . 2 2 2 2 GLN HB2 H 1 1.627 0.022 . 2 . . . A 2 GLN HB2 . 19399 1 16 . 2 2 2 2 GLN HB3 H 1 1.816 0.008 . 2 . . . A 2 GLN HB3 . 19399 1 17 . 2 2 2 2 GLN HG2 H 1 2.187 0.005 . 1 . . . A 2 GLN HG2 . 19399 1 18 . 2 2 2 2 GLN HG3 H 1 2.187 0.005 . 1 . . . A 2 GLN HG3 . 19399 1 19 . 2 2 2 2 GLN HE21 H 1 6.709 0.000 . 1 . . . A 2 GLN HE21 . 19399 1 20 . 2 2 2 2 GLN HE22 H 1 7.700 0.000 . 1 . . . A 2 GLN HE22 . 19399 1 21 . 2 2 2 2 GLN CA C 13 55.079 0.000 . 1 . . . A 2 GLN CA . 19399 1 22 . 2 2 2 2 GLN CB C 13 30.742 0.006 . 1 . . . A 2 GLN CB . 19399 1 23 . 2 2 2 2 GLN CG C 13 34.618 0.000 . 1 . . . A 2 GLN CG . 19399 1 24 . 2 2 2 2 GLN N N 15 123.070 0.083 . 1 . . . A 2 GLN N . 19399 1 25 . 2 2 2 2 GLN NE2 N 15 112.103 0.001 . 1 . . . A 2 GLN NE2 . 19399 1 26 . 2 2 3 3 ILE H H 1 8.275 0.020 . 1 . . . A 3 ILE H . 19399 1 27 . 2 2 3 3 ILE HA H 1 4.171 0.018 . 1 . . . A 3 ILE HA . 19399 1 28 . 2 2 3 3 ILE HB H 1 1.754 0.015 . 1 . . . A 3 ILE HB . 19399 1 29 . 2 2 3 3 ILE HG12 H 1 1.026 0.009 . 2 . . . A 3 ILE HG12 . 19399 1 30 . 2 2 3 3 ILE HG13 H 1 0.800 0.014 . 2 . . . A 3 ILE HG13 . 19399 1 31 . 2 2 3 3 ILE HG21 H 1 0.606 0.008 . 1 . . . A 3 ILE HG21 . 19399 1 32 . 2 2 3 3 ILE HG22 H 1 0.606 0.008 . 1 . . . A 3 ILE HG22 . 19399 1 33 . 2 2 3 3 ILE HG23 H 1 0.606 0.008 . 1 . . . A 3 ILE HG23 . 19399 1 34 . 2 2 3 3 ILE HD11 H 1 0.566 0.006 . 1 . . . A 3 ILE HD11 . 19399 1 35 . 2 2 3 3 ILE HD12 H 1 0.566 0.006 . 1 . . . A 3 ILE HD12 . 19399 1 36 . 2 2 3 3 ILE HD13 H 1 0.566 0.006 . 1 . . . A 3 ILE HD13 . 19399 1 37 . 2 2 3 3 ILE CA C 13 59.616 0.034 . 1 . . . A 3 ILE CA . 19399 1 38 . 2 2 3 3 ILE CB C 13 42.232 0.000 . 1 . . . A 3 ILE CB . 19399 1 39 . 2 2 3 3 ILE CG1 C 13 24.987 0.052 . 1 . . . A 3 ILE CG1 . 19399 1 40 . 2 2 3 3 ILE CG2 C 13 17.926 0.018 . 1 . . . A 3 ILE CG2 . 19399 1 41 . 2 2 3 3 ILE CD1 C 13 14.246 0.025 . 1 . . . A 3 ILE CD1 . 19399 1 42 . 2 2 3 3 ILE N N 15 115.330 0.048 . 1 . . . A 3 ILE N . 19399 1 43 . 2 2 4 4 PHE H H 1 8.538 0.014 . 1 . . . A 4 PHE H . 19399 1 44 . 2 2 4 4 PHE HA H 1 5.570 0.014 . 1 . . . A 4 PHE HA . 19399 1 45 . 2 2 4 4 PHE HB2 H 1 2.839 0.014 . 2 . . . A 4 PHE HB2 . 19399 1 46 . 2 2 4 4 PHE HB3 H 1 3.013 0.013 . 2 . . . A 4 PHE HB3 . 19399 1 47 . 2 2 4 4 PHE HD1 H 1 7.052 0.005 . 3 . . . A 4 PHE HD1 . 19399 1 48 . 2 2 4 4 PHE HD2 H 1 7.052 0.005 . 3 . . . A 4 PHE HD2 . 19399 1 49 . 2 2 4 4 PHE HE1 H 1 7.209 0.001 . 3 . . . A 4 PHE HE1 . 19399 1 50 . 2 2 4 4 PHE HE2 H 1 7.209 0.001 . 3 . . . A 4 PHE HE2 . 19399 1 51 . 2 2 4 4 PHE CA C 13 55.260 0.000 . 1 . . . A 4 PHE CA . 19399 1 52 . 2 2 4 4 PHE CB C 13 41.233 0.019 . 1 . . . A 4 PHE CB . 19399 1 53 . 2 2 4 4 PHE N N 15 118.730 0.000 . 1 . . . A 4 PHE N . 19399 1 54 . 2 2 5 5 VAL H H 1 9.312 0.003 . 1 . . . A 5 VAL H . 19399 1 55 . 2 2 5 5 VAL HA H 1 4.686 0.015 . 1 . . . A 5 VAL HA . 19399 1 56 . 2 2 5 5 VAL HB H 1 1.899 0.008 . 1 . . . A 5 VAL HB . 19399 1 57 . 2 2 5 5 VAL HG11 H 1 0.704 0.013 . 1 . . . A 5 VAL HG11 . 19399 1 58 . 2 2 5 5 VAL HG12 H 1 0.704 0.013 . 1 . . . A 5 VAL HG12 . 19399 1 59 . 2 2 5 5 VAL HG13 H 1 0.704 0.013 . 1 . . . A 5 VAL HG13 . 19399 1 60 . 2 2 5 5 VAL HG21 H 1 0.672 0.007 . 1 . . . A 5 VAL HG21 . 19399 1 61 . 2 2 5 5 VAL HG22 H 1 0.672 0.007 . 1 . . . A 5 VAL HG22 . 19399 1 62 . 2 2 5 5 VAL HG23 H 1 0.672 0.007 . 1 . . . A 5 VAL HG23 . 19399 1 63 . 2 2 5 5 VAL CA C 13 60.581 0.027 . 1 . . . A 5 VAL CA . 19399 1 64 . 2 2 5 5 VAL CB C 13 34.159 0.008 . 1 . . . A 5 VAL CB . 19399 1 65 . 2 2 5 5 VAL CG1 C 13 20.759 0.026 . 1 . . . A 5 VAL CG1 . 19399 1 66 . 2 2 5 5 VAL CG2 C 13 22.627 0.027 . 1 . . . A 5 VAL CG2 . 19399 1 67 . 2 2 5 5 VAL N N 15 121.902 0.039 . 1 . . . A 5 VAL N . 19399 1 68 . 2 2 6 6 LYS H H 1 8.925 0.002 . 1 . . . A 6 LYS H . 19399 1 69 . 2 2 6 6 LYS HA H 1 5.383 0.036 . 1 . . . A 6 LYS HA . 19399 1 70 . 2 2 6 6 LYS HB2 H 1 1.289 0.008 . 2 . . . A 6 LYS HB2 . 19399 1 71 . 2 2 6 6 LYS HB3 H 1 1.645 0.016 . 2 . . . A 6 LYS HB3 . 19399 1 72 . 2 2 6 6 LYS HG2 H 1 1.253 0.013 . 2 . . . A 6 LYS HG2 . 19399 1 73 . 2 2 6 6 LYS HG3 H 1 1.489 0.015 . 2 . . . A 6 LYS HG3 . 19399 1 74 . 2 2 6 6 LYS HD2 H 1 1.574 0.005 . 1 . . . A 6 LYS HD2 . 19399 1 75 . 2 2 6 6 LYS HD3 H 1 1.514 0.017 . 2 . . . A 6 LYS HD3 . 19399 1 76 . 2 2 6 6 LYS HE2 H 1 2.854 0.004 . 1 . . . A 6 LYS HE2 . 19399 1 77 . 2 2 6 6 LYS HE3 H 1 2.854 0.004 . 1 . . . A 6 LYS HE3 . 19399 1 78 . 2 2 6 6 LYS CA C 13 54.410 0.031 . 1 . . . A 6 LYS CA . 19399 1 79 . 2 2 6 6 LYS CB C 13 35.271 0.002 . 1 . . . A 6 LYS CB . 19399 1 80 . 2 2 6 6 LYS CG C 13 25.214 0.007 . 1 . . . A 6 LYS CG . 19399 1 81 . 2 2 6 6 LYS CD C 13 29.331 0.037 . 1 . . . A 6 LYS CD . 19399 1 82 . 2 2 6 6 LYS CE C 13 41.811 0.016 . 1 . . . A 6 LYS CE . 19399 1 83 . 2 2 6 6 LYS N N 15 128.033 0.061 . 1 . . . A 6 LYS N . 19399 1 84 . 2 2 7 7 THR H H 1 8.645 0.002 . 1 . . . A 7 THR H . 19399 1 85 . 2 2 7 7 THR HA H 1 5.033 0.021 . 1 . . . A 7 THR HA . 19399 1 86 . 2 2 7 7 THR HB H 1 4.783 0.020 . 1 . . . A 7 THR HB . 19399 1 87 . 2 2 7 7 THR HG21 H 1 1.157 0.007 . 1 . . . A 7 THR HG21 . 19399 1 88 . 2 2 7 7 THR HG22 H 1 1.157 0.007 . 1 . . . A 7 THR HG22 . 19399 1 89 . 2 2 7 7 THR HG23 H 1 1.157 0.007 . 1 . . . A 7 THR HG23 . 19399 1 90 . 2 2 7 7 THR CA C 13 60.245 0.033 . 1 . . . A 7 THR CA . 19399 1 91 . 2 2 7 7 THR CB C 13 70.480 0.035 . 1 . . . A 7 THR CB . 19399 1 92 . 2 2 7 7 THR CG2 C 13 21.525 0.027 . 1 . . . A 7 THR CG2 . 19399 1 93 . 2 2 7 7 THR N N 15 114.076 0.000 . 1 . . . A 7 THR N . 19399 1 94 . 2 2 8 8 LEU H H 1 9.240 0.003 . 1 . . . A 8 LEU H . 19399 1 95 . 2 2 8 8 LEU HA H 1 4.209 0.004 . 1 . . . A 8 LEU HA . 19399 1 96 . 2 2 8 8 LEU HB2 H 1 1.677 0.005 . 2 . . . A 8 LEU HB2 . 19399 1 97 . 2 2 8 8 LEU HB3 H 1 1.843 0.006 . 2 . . . A 8 LEU HB3 . 19399 1 98 . 2 2 8 8 LEU HG H 1 1.784 0.006 . 1 . . . A 8 LEU HG . 19399 1 99 . 2 2 8 8 LEU HD11 H 1 0.806 0.026 . 2 . . . A 8 LEU HD11 . 19399 1 100 . 2 2 8 8 LEU HD12 H 1 0.806 0.026 . 2 . . . A 8 LEU HD12 . 19399 1 101 . 2 2 8 8 LEU HD13 H 1 0.806 0.026 . 2 . . . A 8 LEU HD13 . 19399 1 102 . 2 2 8 8 LEU HD21 H 1 0.918 0.005 . 2 . . . A 8 LEU HD21 . 19399 1 103 . 2 2 8 8 LEU HD22 H 1 0.918 0.005 . 2 . . . A 8 LEU HD22 . 19399 1 104 . 2 2 8 8 LEU HD23 H 1 0.918 0.005 . 2 . . . A 8 LEU HD23 . 19399 1 105 . 2 2 8 8 LEU CA C 13 57.414 0.000 . 1 . . . A 8 LEU CA . 19399 1 106 . 2 2 8 8 LEU CB C 13 41.875 0.001 . 1 . . . A 8 LEU CB . 19399 1 107 . 2 2 8 8 LEU CG C 13 27.361 0.000 . 1 . . . A 8 LEU CG . 19399 1 108 . 2 2 8 8 LEU CD1 C 13 24.032 0.080 . 2 . . . A 8 LEU CD1 . 19399 1 109 . 2 2 8 8 LEU CD2 C 13 25.278 0.041 . 2 . . . A 8 LEU CD2 . 19399 1 110 . 2 2 8 8 LEU N N 15 122.035 0.056 . 1 . . . A 8 LEU N . 19399 1 111 . 2 2 9 9 THR H H 1 7.551 0.002 . 1 . . . A 9 THR H . 19399 1 112 . 2 2 9 9 THR HA H 1 4.368 0.005 . 1 . . . A 9 THR HA . 19399 1 113 . 2 2 9 9 THR HB H 1 4.540 0.005 . 1 . . . A 9 THR HB . 19399 1 114 . 2 2 9 9 THR HG21 H 1 1.192 0.006 . 1 . . . A 9 THR HG21 . 19399 1 115 . 2 2 9 9 THR HG22 H 1 1.192 0.006 . 1 . . . A 9 THR HG22 . 19399 1 116 . 2 2 9 9 THR HG23 H 1 1.192 0.006 . 1 . . . A 9 THR HG23 . 19399 1 117 . 2 2 9 9 THR CA C 13 61.199 0.048 . 1 . . . A 9 THR CA . 19399 1 118 . 2 2 9 9 THR CB C 13 68.857 0.048 . 1 . . . A 9 THR CB . 19399 1 119 . 2 2 9 9 THR CG2 C 13 21.987 0.000 . 1 . . . A 9 THR CG2 . 19399 1 120 . 2 2 9 9 THR N N 15 105.609 0.000 . 1 . . . A 9 THR N . 19399 1 121 . 2 2 10 10 GLY H H 1 7.813 0.002 . 1 . . . A 10 GLY H . 19399 1 122 . 2 2 10 10 GLY HA2 H 1 3.583 0.009 . 2 . . . A 10 GLY HA2 . 19399 1 123 . 2 2 10 10 GLY HA3 H 1 4.293 0.008 . 2 . . . A 10 GLY HA3 . 19399 1 124 . 2 2 10 10 GLY CA C 13 45.321 0.001 . 1 . . . A 10 GLY CA . 19399 1 125 . 2 2 10 10 GLY N N 15 109.211 0.000 . 1 . . . A 10 GLY N . 19399 1 126 . 2 2 11 11 LYS H H 1 7.286 0.002 . 1 . . . A 11 LYS H . 19399 1 127 . 2 2 11 11 LYS HA H 1 4.332 0.004 . 1 . . . A 11 LYS HA . 19399 1 128 . 2 2 11 11 LYS HB2 H 1 1.783 0.019 . 2 . . . A 11 LYS HB2 . 19399 1 129 . 2 2 11 11 LYS HB3 H 1 1.677 0.009 . 2 . . . A 11 LYS HB3 . 19399 1 130 . 2 2 11 11 LYS HG2 H 1 1.218 0.011 . 2 . . . A 11 LYS HG2 . 19399 1 131 . 2 2 11 11 LYS HG3 H 1 1.373 0.011 . 2 . . . A 11 LYS HG3 . 19399 1 132 . 2 2 11 11 LYS HD2 H 1 1.582 0.010 . 1 . . . A 11 LYS HD2 . 19399 1 133 . 2 2 11 11 LYS HD3 H 1 1.582 0.010 . 1 . . . A 11 LYS HD3 . 19399 1 134 . 2 2 11 11 LYS HE2 H 1 2.882 0.011 . 1 . . . A 11 LYS HE2 . 19399 1 135 . 2 2 11 11 LYS HE3 H 1 2.882 0.011 . 1 . . . A 11 LYS HE3 . 19399 1 136 . 2 2 11 11 LYS CA C 13 56.212 0.000 . 1 . . . A 11 LYS CA . 19399 1 137 . 2 2 11 11 LYS CB C 13 33.207 0.000 . 1 . . . A 11 LYS CB . 19399 1 138 . 2 2 11 11 LYS CG C 13 25.018 0.035 . 1 . . . A 11 LYS CG . 19399 1 139 . 2 2 11 11 LYS CD C 13 29.213 0.000 . 1 . . . A 11 LYS CD . 19399 1 140 . 2 2 11 11 LYS CE C 13 41.800 0.000 . 1 . . . A 11 LYS CE . 19399 1 141 . 2 2 11 11 LYS N N 15 121.934 0.000 . 1 . . . A 11 LYS N . 19399 1 142 . 2 2 12 12 THR H H 1 8.604 0.005 . 1 . . . A 12 THR H . 19399 1 143 . 2 2 12 12 THR HA H 1 5.010 0.012 . 1 . . . A 12 THR HA . 19399 1 144 . 2 2 12 12 THR HB H 1 3.921 0.008 . 1 . . . A 12 THR HB . 19399 1 145 . 2 2 12 12 THR HG21 H 1 1.059 0.012 . 1 . . . A 12 THR HG21 . 19399 1 146 . 2 2 12 12 THR HG22 H 1 1.059 0.012 . 1 . . . A 12 THR HG22 . 19399 1 147 . 2 2 12 12 THR HG23 H 1 1.059 0.012 . 1 . . . A 12 THR HG23 . 19399 1 148 . 2 2 12 12 THR CA C 13 62.375 0.000 . 1 . . . A 12 THR CA . 19399 1 149 . 2 2 12 12 THR CB C 13 69.776 0.017 . 1 . . . A 12 THR CB . 19399 1 150 . 2 2 12 12 THR CG2 C 13 22.029 0.000 . 1 . . . A 12 THR CG2 . 19399 1 151 . 2 2 12 12 THR N N 15 120.682 0.023 . 1 . . . A 12 THR N . 19399 1 152 . 2 2 13 13 ILE H H 1 9.624 0.003 . 1 . . . A 13 ILE H . 19399 1 153 . 2 2 13 13 ILE HA H 1 4.476 0.024 . 1 . . . A 13 ILE HA . 19399 1 154 . 2 2 13 13 ILE HB H 1 1.838 0.010 . 1 . . . A 13 ILE HB . 19399 1 155 . 2 2 13 13 ILE HG12 H 1 1.428 0.005 . 2 . . . A 13 ILE HG12 . 19399 1 156 . 2 2 13 13 ILE HG13 H 1 1.056 0.010 . 2 . . . A 13 ILE HG13 . 19399 1 157 . 2 2 13 13 ILE HG21 H 1 0.849 0.008 . 1 . . . A 13 ILE HG21 . 19399 1 158 . 2 2 13 13 ILE HG22 H 1 0.849 0.008 . 1 . . . A 13 ILE HG22 . 19399 1 159 . 2 2 13 13 ILE HG23 H 1 0.849 0.008 . 1 . . . A 13 ILE HG23 . 19399 1 160 . 2 2 13 13 ILE HD11 H 1 0.693 0.008 . 1 . . . A 13 ILE HD11 . 19399 1 161 . 2 2 13 13 ILE HD12 H 1 0.693 0.008 . 1 . . . A 13 ILE HD12 . 19399 1 162 . 2 2 13 13 ILE HD13 H 1 0.693 0.008 . 1 . . . A 13 ILE HD13 . 19399 1 163 . 2 2 13 13 ILE CA C 13 60.016 0.000 . 1 . . . A 13 ILE CA . 19399 1 164 . 2 2 13 13 ILE CB C 13 40.824 0.031 . 1 . . . A 13 ILE CB . 19399 1 165 . 2 2 13 13 ILE CG1 C 13 26.948 0.042 . 1 . . . A 13 ILE CG1 . 19399 1 166 . 2 2 13 13 ILE CG2 C 13 17.849 0.000 . 1 . . . A 13 ILE CG2 . 19399 1 167 . 2 2 13 13 ILE CD1 C 13 14.506 0.026 . 1 . . . A 13 ILE CD1 . 19399 1 168 . 2 2 13 13 ILE N N 15 128.922 0.000 . 1 . . . A 13 ILE N . 19399 1 169 . 2 2 14 14 THR H H 1 8.745 0.002 . 1 . . . A 14 THR H . 19399 1 170 . 2 2 14 14 THR HA H 1 4.923 0.009 . 1 . . . A 14 THR HA . 19399 1 171 . 2 2 14 14 THR HB H 1 4.004 0.005 . 1 . . . A 14 THR HB . 19399 1 172 . 2 2 14 14 THR HG21 H 1 1.103 0.007 . 1 . . . A 14 THR HG21 . 19399 1 173 . 2 2 14 14 THR HG22 H 1 1.103 0.007 . 1 . . . A 14 THR HG22 . 19399 1 174 . 2 2 14 14 THR HG23 H 1 1.103 0.007 . 1 . . . A 14 THR HG23 . 19399 1 175 . 2 2 14 14 THR CA C 13 61.860 0.034 . 1 . . . A 14 THR CA . 19399 1 176 . 2 2 14 14 THR CB C 13 69.361 0.042 . 1 . . . A 14 THR CB . 19399 1 177 . 2 2 14 14 THR CG2 C 13 21.784 0.037 . 1 . . . A 14 THR CG2 . 19399 1 178 . 2 2 14 14 THR N N 15 122.640 0.000 . 1 . . . A 14 THR N . 19399 1 179 . 2 2 15 15 LEU H H 1 8.679 0.010 . 1 . . . A 15 LEU H . 19399 1 180 . 2 2 15 15 LEU HA H 1 4.744 0.010 . 1 . . . A 15 LEU HA . 19399 1 181 . 2 2 15 15 LEU HB2 H 1 1.340 0.006 . 2 . . . A 15 LEU HB2 . 19399 1 182 . 2 2 15 15 LEU HB3 H 1 1.184 0.009 . 2 . . . A 15 LEU HB3 . 19399 1 183 . 2 2 15 15 LEU HG H 1 1.394 0.008 . 1 . . . A 15 LEU HG . 19399 1 184 . 2 2 15 15 LEU HD11 H 1 0.741 0.005 . 1 . . . A 15 LEU HD11 . 19399 1 185 . 2 2 15 15 LEU HD12 H 1 0.741 0.005 . 1 . . . A 15 LEU HD12 . 19399 1 186 . 2 2 15 15 LEU HD13 H 1 0.741 0.005 . 1 . . . A 15 LEU HD13 . 19399 1 187 . 2 2 15 15 LEU HD21 H 1 0.741 0.005 . 1 . . . A 15 LEU HD21 . 19399 1 188 . 2 2 15 15 LEU HD22 H 1 0.741 0.005 . 1 . . . A 15 LEU HD22 . 19399 1 189 . 2 2 15 15 LEU HD23 H 1 0.741 0.005 . 1 . . . A 15 LEU HD23 . 19399 1 190 . 2 2 15 15 LEU CA C 13 52.682 0.037 . 1 . . . A 15 LEU CA . 19399 1 191 . 2 2 15 15 LEU CB C 13 46.972 0.029 . 1 . . . A 15 LEU CB . 19399 1 192 . 2 2 15 15 LEU CG C 13 26.809 0.000 . 1 . . . A 15 LEU CG . 19399 1 193 . 2 2 15 15 LEU CD1 C 13 24.134 0.098 . 1 . . . A 15 LEU CD1 . 19399 1 194 . 2 2 15 15 LEU CD2 C 13 24.131 0.098 . 1 . . . A 15 LEU CD2 . 19399 1 195 . 2 2 15 15 LEU N N 15 125.401 0.000 . 1 . . . A 15 LEU N . 19399 1 196 . 2 2 16 16 GLU H H 1 8.093 0.002 . 1 . . . A 16 GLU H . 19399 1 197 . 2 2 16 16 GLU HA H 1 4.869 0.011 . 1 . . . A 16 GLU HA . 19399 1 198 . 2 2 16 16 GLU HB2 H 1 1.809 0.009 . 2 . . . A 16 GLU HB2 . 19399 1 199 . 2 2 16 16 GLU HB3 H 1 1.903 0.012 . 2 . . . A 16 GLU HB3 . 19399 1 200 . 2 2 16 16 GLU HG2 H 1 2.243 0.019 . 2 . . . A 16 GLU HG2 . 19399 1 201 . 2 2 16 16 GLU HG3 H 1 2.094 0.022 . 2 . . . A 16 GLU HG3 . 19399 1 202 . 2 2 16 16 GLU CA C 13 54.789 0.000 . 1 . . . A 16 GLU CA . 19399 1 203 . 2 2 16 16 GLU CB C 13 29.480 0.082 . 1 . . . A 16 GLU CB . 19399 1 204 . 2 2 16 16 GLU CG C 13 35.086 0.001 . 1 . . . A 16 GLU CG . 19399 1 205 . 2 2 16 16 GLU N N 15 122.589 0.005 . 1 . . . A 16 GLU N . 19399 1 206 . 2 2 17 17 VAL H H 1 8.926 0.002 . 1 . . . A 17 VAL H . 19399 1 207 . 2 2 17 17 VAL HA H 1 4.678 0.009 . 1 . . . A 17 VAL HA . 19399 1 208 . 2 2 17 17 VAL HB H 1 2.310 0.012 . 1 . . . A 17 VAL HB . 19399 1 209 . 2 2 17 17 VAL HG11 H 1 0.406 0.010 . 2 . . . A 17 VAL HG11 . 19399 1 210 . 2 2 17 17 VAL HG12 H 1 0.406 0.010 . 2 . . . A 17 VAL HG12 . 19399 1 211 . 2 2 17 17 VAL HG13 H 1 0.406 0.010 . 2 . . . A 17 VAL HG13 . 19399 1 212 . 2 2 17 17 VAL HG21 H 1 0.686 0.010 . 2 . . . A 17 VAL HG21 . 19399 1 213 . 2 2 17 17 VAL HG22 H 1 0.686 0.010 . 2 . . . A 17 VAL HG22 . 19399 1 214 . 2 2 17 17 VAL HG23 H 1 0.686 0.010 . 2 . . . A 17 VAL HG23 . 19399 1 215 . 2 2 17 17 VAL CA C 13 58.398 0.000 . 1 . . . A 17 VAL CA . 19399 1 216 . 2 2 17 17 VAL CB C 13 36.355 0.000 . 1 . . . A 17 VAL CB . 19399 1 217 . 2 2 17 17 VAL CG1 C 13 19.668 0.000 . 2 . . . A 17 VAL CG1 . 19399 1 218 . 2 2 17 17 VAL CG2 C 13 22.324 0.040 . 2 . . . A 17 VAL CG2 . 19399 1 219 . 2 2 17 17 VAL N N 15 117.736 0.000 . 1 . . . A 17 VAL N . 19399 1 220 . 2 2 18 18 GLU H H 1 8.634 0.002 . 1 . . . A 18 GLU H . 19399 1 221 . 2 2 18 18 GLU HA H 1 5.060 0.008 . 1 . . . A 18 GLU HA . 19399 1 222 . 2 2 18 18 GLU HB2 H 1 2.157 0.006 . 2 . . . A 18 GLU HB2 . 19399 1 223 . 2 2 18 18 GLU HB3 H 1 1.601 0.016 . 2 . . . A 18 GLU HB3 . 19399 1 224 . 2 2 18 18 GLU HG2 H 1 2.246 0.004 . 2 . . . A 18 GLU HG2 . 19399 1 225 . 2 2 18 18 GLU HG3 H 1 2.374 0.007 . 2 . . . A 18 GLU HG3 . 19399 1 226 . 2 2 18 18 GLU CA C 13 52.540 0.047 . 1 . . . A 18 GLU CA . 19399 1 227 . 2 2 18 18 GLU CB C 13 30.497 0.000 . 1 . . . A 18 GLU CB . 19399 1 228 . 2 2 18 18 GLU CG C 13 34.586 0.026 . 1 . . . A 18 GLU CG . 19399 1 229 . 2 2 18 18 GLU N N 15 119.472 0.000 . 1 . . . A 18 GLU N . 19399 1 230 . 2 2 19 19 PRO HA H 1 4.109 0.006 . 1 . . . A 19 PRO HA . 19399 1 231 . 2 2 19 19 PRO HB2 H 1 1.983 0.006 . 2 . . . A 19 PRO HB2 . 19399 1 232 . 2 2 19 19 PRO HB3 H 1 2.422 0.006 . 2 . . . A 19 PRO HB3 . 19399 1 233 . 2 2 19 19 PRO HG2 H 1 2.190 0.005 . 2 . . . A 19 PRO HG2 . 19399 1 234 . 2 2 19 19 PRO HG3 H 1 2.040 0.009 . 2 . . . A 19 PRO HG3 . 19399 1 235 . 2 2 19 19 PRO HD2 H 1 3.786 0.008 . 2 . . . A 19 PRO HD2 . 19399 1 236 . 2 2 19 19 PRO HD3 H 1 3.983 0.005 . 2 . . . A 19 PRO HD3 . 19399 1 237 . 2 2 19 19 PRO CA C 13 65.322 0.000 . 1 . . . A 19 PRO CA . 19399 1 238 . 2 2 19 19 PRO CB C 13 31.906 0.003 . 1 . . . A 19 PRO CB . 19399 1 239 . 2 2 19 19 PRO CG C 13 28.048 0.000 . 1 . . . A 19 PRO CG . 19399 1 240 . 2 2 19 19 PRO CD C 13 50.391 0.031 . 1 . . . A 19 PRO CD . 19399 1 241 . 2 2 20 20 SER H H 1 7.005 0.005 . 1 . . . A 20 SER H . 19399 1 242 . 2 2 20 20 SER HA H 1 4.338 0.007 . 1 . . . A 20 SER HA . 19399 1 243 . 2 2 20 20 SER HB2 H 1 4.123 0.010 . 2 . . . A 20 SER HB2 . 19399 1 244 . 2 2 20 20 SER HB3 H 1 3.757 0.006 . 2 . . . A 20 SER HB3 . 19399 1 245 . 2 2 20 20 SER CA C 13 57.240 0.000 . 1 . . . A 20 SER CA . 19399 1 246 . 2 2 20 20 SER CB C 13 63.280 0.001 . 1 . . . A 20 SER CB . 19399 1 247 . 2 2 20 20 SER N N 15 103.554 0.000 . 1 . . . A 20 SER N . 19399 1 248 . 2 2 21 21 ASP H H 1 8.030 0.002 . 1 . . . A 21 ASP H . 19399 1 249 . 2 2 21 21 ASP HA H 1 4.663 0.009 . 1 . . . A 21 ASP HA . 19399 1 250 . 2 2 21 21 ASP HB2 H 1 2.508 0.017 . 2 . . . A 21 ASP HB2 . 19399 1 251 . 2 2 21 21 ASP HB3 H 1 2.926 0.015 . 2 . . . A 21 ASP HB3 . 19399 1 252 . 2 2 21 21 ASP CA C 13 55.793 0.000 . 1 . . . A 21 ASP CA . 19399 1 253 . 2 2 21 21 ASP CB C 13 40.837 0.003 . 1 . . . A 21 ASP CB . 19399 1 254 . 2 2 21 21 ASP N N 15 124.274 0.040 . 1 . . . A 21 ASP N . 19399 1 255 . 2 2 22 22 THR H H 1 7.855 0.003 . 1 . . . A 22 THR H . 19399 1 256 . 2 2 22 22 THR HA H 1 4.889 0.008 . 1 . . . A 22 THR HA . 19399 1 257 . 2 2 22 22 THR HB H 1 4.798 0.013 . 1 . . . A 22 THR HB . 19399 1 258 . 2 2 22 22 THR HG21 H 1 1.241 0.010 . 1 . . . A 22 THR HG21 . 19399 1 259 . 2 2 22 22 THR HG22 H 1 1.241 0.010 . 1 . . . A 22 THR HG22 . 19399 1 260 . 2 2 22 22 THR HG23 H 1 1.241 0.010 . 1 . . . A 22 THR HG23 . 19399 1 261 . 2 2 22 22 THR CA C 13 59.687 0.000 . 1 . . . A 22 THR CA . 19399 1 262 . 2 2 22 22 THR CB C 13 70.990 0.034 . 1 . . . A 22 THR CB . 19399 1 263 . 2 2 22 22 THR CG2 C 13 22.171 0.035 . 1 . . . A 22 THR CG2 . 19399 1 264 . 2 2 22 22 THR N N 15 109.319 0.039 . 1 . . . A 22 THR N . 19399 1 265 . 2 2 23 23 ILE H H 1 8.504 0.002 . 1 . . . A 23 ILE H . 19399 1 266 . 2 2 23 23 ILE HA H 1 3.620 0.015 . 1 . . . A 23 ILE HA . 19399 1 267 . 2 2 23 23 ILE HB H 1 2.540 0.005 . 1 . . . A 23 ILE HB . 19399 1 268 . 2 2 23 23 ILE HG12 H 1 1.257 0.012 . 2 . . . A 23 ILE HG12 . 19399 1 269 . 2 2 23 23 ILE HG13 H 1 1.878 0.007 . 2 . . . A 23 ILE HG13 . 19399 1 270 . 2 2 23 23 ILE HG21 H 1 0.755 0.007 . 1 . . . A 23 ILE HG21 . 19399 1 271 . 2 2 23 23 ILE HG22 H 1 0.755 0.007 . 1 . . . A 23 ILE HG22 . 19399 1 272 . 2 2 23 23 ILE HG23 H 1 0.755 0.007 . 1 . . . A 23 ILE HG23 . 19399 1 273 . 2 2 23 23 ILE HD11 H 1 0.551 0.006 . 1 . . . A 23 ILE HD11 . 19399 1 274 . 2 2 23 23 ILE HD12 H 1 0.551 0.006 . 1 . . . A 23 ILE HD12 . 19399 1 275 . 2 2 23 23 ILE HD13 H 1 0.551 0.006 . 1 . . . A 23 ILE HD13 . 19399 1 276 . 2 2 23 23 ILE CA C 13 62.149 0.033 . 1 . . . A 23 ILE CA . 19399 1 277 . 2 2 23 23 ILE CB C 13 34.389 0.000 . 1 . . . A 23 ILE CB . 19399 1 278 . 2 2 23 23 ILE CG1 C 13 27.775 0.037 . 1 . . . A 23 ILE CG1 . 19399 1 279 . 2 2 23 23 ILE CG2 C 13 18.003 0.037 . 1 . . . A 23 ILE CG2 . 19399 1 280 . 2 2 23 23 ILE CD1 C 13 9.762 0.000 . 1 . . . A 23 ILE CD1 . 19399 1 281 . 2 2 23 23 ILE N N 15 121.672 0.043 . 1 . . . A 23 ILE N . 19399 1 282 . 2 2 24 24 GLU HA H 1 3.879 0.016 . 1 . . . A 24 GLU HA . 19399 1 283 . 2 2 24 24 GLU HB2 H 1 2.018 0.009 . 2 . . . A 24 GLU HB2 . 19399 1 284 . 2 2 24 24 GLU HB3 H 1 2.018 0.009 . 2 . . . A 24 GLU HB3 . 19399 1 285 . 2 2 24 24 GLU HG2 H 1 2.323 0.014 . 2 . . . A 24 GLU HG2 . 19399 1 286 . 2 2 24 24 GLU HG3 H 1 2.431 0.011 . 2 . . . A 24 GLU HG3 . 19399 1 287 . 2 2 24 24 GLU CA C 13 60.225 0.000 . 1 . . . A 24 GLU CA . 19399 1 288 . 2 2 24 24 GLU CB C 13 28.328 0.009 . 1 . . . A 24 GLU CB . 19399 1 289 . 2 2 24 24 GLU CG C 13 34.789 0.041 . 1 . . . A 24 GLU CG . 19399 1 290 . 2 2 25 25 ASN H H 1 7.903 0.002 . 1 . . . A 25 ASN H . 19399 1 291 . 2 2 25 25 ASN HA H 1 4.505 0.004 . 1 . . . A 25 ASN HA . 19399 1 292 . 2 2 25 25 ASN HB2 H 1 3.186 0.006 . 2 . . . A 25 ASN HB2 . 19399 1 293 . 2 2 25 25 ASN HB3 H 1 2.846 0.013 . 2 . . . A 25 ASN HB3 . 19399 1 294 . 2 2 25 25 ASN HD21 H 1 6.865 0.002 . 1 . . . A 25 ASN HD21 . 19399 1 295 . 2 2 25 25 ASN HD22 H 1 7.812 0.000 . 1 . . . A 25 ASN HD22 . 19399 1 296 . 2 2 25 25 ASN CA C 13 56.035 0.000 . 1 . . . A 25 ASN CA . 19399 1 297 . 2 2 25 25 ASN CB C 13 38.329 0.032 . 1 . . . A 25 ASN CB . 19399 1 298 . 2 2 25 25 ASN N N 15 121.465 0.000 . 1 . . . A 25 ASN N . 19399 1 299 . 2 2 25 25 ASN ND2 N 15 109.985 0.000 . 1 . . . A 25 ASN ND2 . 19399 1 300 . 2 2 26 26 VAL H H 1 8.103 0.006 . 1 . . . A 26 VAL H . 19399 1 301 . 2 2 26 26 VAL HA H 1 3.367 0.009 . 1 . . . A 26 VAL HA . 19399 1 302 . 2 2 26 26 VAL HB H 1 2.324 0.012 . 1 . . . A 26 VAL HB . 19399 1 303 . 2 2 26 26 VAL HG11 H 1 0.674 0.007 . 2 . . . A 26 VAL HG11 . 19399 1 304 . 2 2 26 26 VAL HG12 H 1 0.674 0.007 . 2 . . . A 26 VAL HG12 . 19399 1 305 . 2 2 26 26 VAL HG13 H 1 0.674 0.007 . 2 . . . A 26 VAL HG13 . 19399 1 306 . 2 2 26 26 VAL HG21 H 1 0.962 0.008 . 2 . . . A 26 VAL HG21 . 19399 1 307 . 2 2 26 26 VAL HG22 H 1 0.962 0.008 . 2 . . . A 26 VAL HG22 . 19399 1 308 . 2 2 26 26 VAL HG23 H 1 0.962 0.008 . 2 . . . A 26 VAL HG23 . 19399 1 309 . 2 2 26 26 VAL CA C 13 67.668 0.000 . 1 . . . A 26 VAL CA . 19399 1 310 . 2 2 26 26 VAL CB C 13 30.877 0.000 . 1 . . . A 26 VAL CB . 19399 1 311 . 2 2 26 26 VAL CG1 C 13 21.493 0.030 . 2 . . . A 26 VAL CG1 . 19399 1 312 . 2 2 26 26 VAL CG2 C 13 23.580 0.027 . 2 . . . A 26 VAL CG2 . 19399 1 313 . 2 2 26 26 VAL N N 15 122.565 0.047 . 1 . . . A 26 VAL N . 19399 1 314 . 2 2 27 27 LYS H H 1 8.509 0.002 . 1 . . . A 27 LYS H . 19399 1 315 . 2 2 27 27 LYS HA H 1 4.558 0.007 . 1 . . . A 27 LYS HA . 19399 1 316 . 2 2 27 27 LYS HB2 H 1 1.998 0.015 . 2 . . . A 27 LYS HB2 . 19399 1 317 . 2 2 27 27 LYS HB3 H 1 1.406 0.009 . 2 . . . A 27 LYS HB3 . 19399 1 318 . 2 2 27 27 LYS HG2 H 1 1.368 0.004 . 2 . . . A 27 LYS HG2 . 19399 1 319 . 2 2 27 27 LYS HG3 H 1 1.549 0.009 . 2 . . . A 27 LYS HG3 . 19399 1 320 . 2 2 27 27 LYS HD2 H 1 1.643 0.007 . 2 . . . A 27 LYS HD2 . 19399 1 321 . 2 2 27 27 LYS HD3 H 1 1.644 0.007 . 2 . . . A 27 LYS HD3 . 19399 1 322 . 2 2 27 27 LYS HE2 H 1 2.605 0.007 . 1 . . . A 27 LYS HE2 . 19399 1 323 . 2 2 27 27 LYS HE3 H 1 2.604 0.007 . 1 . . . A 27 LYS HE3 . 19399 1 324 . 2 2 27 27 LYS CA C 13 59.265 0.000 . 1 . . . A 27 LYS CA . 19399 1 325 . 2 2 27 27 LYS CB C 13 33.713 0.011 . 1 . . . A 27 LYS CB . 19399 1 326 . 2 2 27 27 LYS CG C 13 26.191 0.000 . 1 . . . A 27 LYS CG . 19399 1 327 . 2 2 27 27 LYS CD C 13 30.229 0.180 . 1 . . . A 27 LYS CD . 19399 1 328 . 2 2 27 27 LYS CE C 13 42.308 0.000 . 1 . . . A 27 LYS CE . 19399 1 329 . 2 2 27 27 LYS N N 15 119.302 0.042 . 1 . . . A 27 LYS N . 19399 1 330 . 2 2 28 28 ALA H H 1 7.961 0.001 . 1 . . . A 28 ALA H . 19399 1 331 . 2 2 28 28 ALA HA H 1 4.136 0.008 . 1 . . . A 28 ALA HA . 19399 1 332 . 2 2 28 28 ALA HB1 H 1 1.607 0.010 . 1 . . . A 28 ALA HB1 . 19399 1 333 . 2 2 28 28 ALA HB2 H 1 1.607 0.010 . 1 . . . A 28 ALA HB2 . 19399 1 334 . 2 2 28 28 ALA HB3 H 1 1.607 0.010 . 1 . . . A 28 ALA HB3 . 19399 1 335 . 2 2 28 28 ALA CA C 13 55.340 0.013 . 1 . . . A 28 ALA CA . 19399 1 336 . 2 2 28 28 ALA CB C 13 17.788 0.022 . 1 . . . A 28 ALA CB . 19399 1 337 . 2 2 28 28 ALA N N 15 123.716 0.042 . 1 . . . A 28 ALA N . 19399 1 338 . 2 2 29 29 LYS H H 1 7.884 0.002 . 1 . . . A 29 LYS H . 19399 1 339 . 2 2 29 29 LYS HA H 1 4.178 0.010 . 1 . . . A 29 LYS HA . 19399 1 340 . 2 2 29 29 LYS HB2 H 1 1.910 0.006 . 2 . . . A 29 LYS HB2 . 19399 1 341 . 2 2 29 29 LYS HB3 H 1 2.123 0.008 . 2 . . . A 29 LYS HB3 . 19399 1 342 . 2 2 29 29 LYS HG2 H 1 1.765 0.007 . 2 . . . A 29 LYS HG2 . 19399 1 343 . 2 2 29 29 LYS HG3 H 1 1.583 0.006 . 2 . . . A 29 LYS HG3 . 19399 1 344 . 2 2 29 29 LYS HD2 H 1 1.444 0.008 . 2 . . . A 29 LYS HD2 . 19399 1 345 . 2 2 29 29 LYS HD3 H 1 1.766 0.006 . 2 . . . A 29 LYS HD3 . 19399 1 346 . 2 2 29 29 LYS HE2 H 1 3.159 0.006 . 2 . . . A 29 LYS HE2 . 19399 1 347 . 2 2 29 29 LYS HE3 H 1 2.956 0.003 . 2 . . . A 29 LYS HE3 . 19399 1 348 . 2 2 29 29 LYS CA C 13 59.619 0.034 . 1 . . . A 29 LYS CA . 19399 1 349 . 2 2 29 29 LYS CB C 13 33.293 0.104 . 1 . . . A 29 LYS CB . 19399 1 350 . 2 2 29 29 LYS CG C 13 26.411 0.031 . 1 . . . A 29 LYS CG . 19399 1 351 . 2 2 29 29 LYS CD C 13 29.880 0.067 . 1 . . . A 29 LYS CD . 19399 1 352 . 2 2 29 29 LYS CE C 13 42.134 0.033 . 1 . . . A 29 LYS CE . 19399 1 353 . 2 2 29 29 LYS N N 15 120.704 0.057 . 1 . . . A 29 LYS N . 19399 1 354 . 2 2 30 30 ILE H H 1 8.245 0.002 . 1 . . . A 30 ILE H . 19399 1 355 . 2 2 30 30 ILE HA H 1 3.480 0.010 . 1 . . . A 30 ILE HA . 19399 1 356 . 2 2 30 30 ILE HB H 1 2.339 0.011 . 1 . . . A 30 ILE HB . 19399 1 357 . 2 2 30 30 ILE HG12 H 1 1.991 0.009 . 1 . . . A 30 ILE HG12 . 19399 1 358 . 2 2 30 30 ILE HG13 H 1 1.991 0.009 . 1 . . . A 30 ILE HG13 . 19399 1 359 . 2 2 30 30 ILE HG21 H 1 0.672 0.009 . 1 . . . A 30 ILE HG21 . 19399 1 360 . 2 2 30 30 ILE HG22 H 1 0.672 0.009 . 1 . . . A 30 ILE HG22 . 19399 1 361 . 2 2 30 30 ILE HG23 H 1 0.672 0.009 . 1 . . . A 30 ILE HG23 . 19399 1 362 . 2 2 30 30 ILE HD11 H 1 0.868 0.006 . 1 . . . A 30 ILE HD11 . 19399 1 363 . 2 2 30 30 ILE HD12 H 1 0.868 0.006 . 1 . . . A 30 ILE HD12 . 19399 1 364 . 2 2 30 30 ILE HD13 H 1 0.868 0.006 . 1 . . . A 30 ILE HD13 . 19399 1 365 . 2 2 30 30 ILE CA C 13 66.081 0.023 . 1 . . . A 30 ILE CA . 19399 1 366 . 2 2 30 30 ILE CB C 13 36.871 0.018 . 1 . . . A 30 ILE CB . 19399 1 367 . 2 2 30 30 ILE CG1 C 13 31.083 0.039 . 1 . . . A 30 ILE CG1 . 19399 1 368 . 2 2 30 30 ILE CG2 C 13 17.101 0.000 . 1 . . . A 30 ILE CG2 . 19399 1 369 . 2 2 30 30 ILE CD1 C 13 15.185 0.027 . 1 . . . A 30 ILE CD1 . 19399 1 370 . 2 2 30 30 ILE N N 15 121.823 0.044 . 1 . . . A 30 ILE N . 19399 1 371 . 2 2 31 31 GLN H H 1 8.502 0.001 . 1 . . . A 31 GLN H . 19399 1 372 . 2 2 31 31 GLN HA H 1 3.793 0.007 . 1 . . . A 31 GLN HA . 19399 1 373 . 2 2 31 31 GLN HB2 H 1 1.956 0.009 . 2 . . . A 31 GLN HB2 . 19399 1 374 . 2 2 31 31 GLN HB3 H 1 2.483 0.010 . 2 . . . A 31 GLN HB3 . 19399 1 375 . 2 2 31 31 GLN HG2 H 1 1.907 0.005 . 2 . . . A 31 GLN HG2 . 19399 1 376 . 2 2 31 31 GLN HG3 H 1 2.242 0.005 . 2 . . . A 31 GLN HG3 . 19399 1 377 . 2 2 31 31 GLN HE21 H 1 6.785 0.000 . 1 . . . A 31 GLN HE21 . 19399 1 378 . 2 2 31 31 GLN HE22 H 1 7.626 0.000 . 1 . . . A 31 GLN HE22 . 19399 1 379 . 2 2 31 31 GLN CA C 13 59.982 0.000 . 1 . . . A 31 GLN CA . 19399 1 380 . 2 2 31 31 GLN CB C 13 27.649 0.033 . 1 . . . A 31 GLN CB . 19399 1 381 . 2 2 31 31 GLN CG C 13 33.641 0.030 . 1 . . . A 31 GLN CG . 19399 1 382 . 2 2 31 31 GLN N N 15 123.747 0.000 . 1 . . . A 31 GLN N . 19399 1 383 . 2 2 31 31 GLN NE2 N 15 110.255 0.004 . 1 . . . A 31 GLN NE2 . 19399 1 384 . 2 2 32 32 ASP H H 1 8.071 0.002 . 1 . . . A 32 ASP H . 19399 1 385 . 2 2 32 32 ASP HA H 1 4.312 0.013 . 1 . . . A 32 ASP HA . 19399 1 386 . 2 2 32 32 ASP HB2 H 1 2.846 0.019 . 2 . . . A 32 ASP HB2 . 19399 1 387 . 2 2 32 32 ASP HB3 H 1 2.753 0.018 . 2 . . . A 32 ASP HB3 . 19399 1 388 . 2 2 32 32 ASP CA C 13 57.220 0.024 . 1 . . . A 32 ASP CA . 19399 1 389 . 2 2 32 32 ASP CB C 13 40.536 0.058 . 1 . . . A 32 ASP CB . 19399 1 390 . 2 2 32 32 ASP N N 15 120.236 0.044 . 1 . . . A 32 ASP N . 19399 1 391 . 2 2 33 33 LYS H H 1 7.445 0.002 . 1 . . . A 33 LYS H . 19399 1 392 . 2 2 33 33 LYS HA H 1 4.296 0.013 . 1 . . . A 33 LYS HA . 19399 1 393 . 2 2 33 33 LYS HB2 H 1 1.830 0.009 . 2 . . . A 33 LYS HB2 . 19399 1 394 . 2 2 33 33 LYS HB3 H 1 1.968 0.005 . 2 . . . A 33 LYS HB3 . 19399 1 395 . 2 2 33 33 LYS HG2 H 1 1.581 0.005 . 1 . . . A 33 LYS HG2 . 19399 1 396 . 2 2 33 33 LYS HG3 H 1 1.581 0.005 . 1 . . . A 33 LYS HG3 . 19399 1 397 . 2 2 33 33 LYS HD2 H 1 1.687 0.005 . 1 . . . A 33 LYS HD2 . 19399 1 398 . 2 2 33 33 LYS HD3 H 1 1.687 0.005 . 1 . . . A 33 LYS HD3 . 19399 1 399 . 2 2 33 33 LYS HE2 H 1 3.130 0.013 . 1 . . . A 33 LYS HE2 . 19399 1 400 . 2 2 33 33 LYS HE3 H 1 3.130 0.013 . 1 . . . A 33 LYS HE3 . 19399 1 401 . 2 2 33 33 LYS CA C 13 58.018 0.000 . 1 . . . A 33 LYS CA . 19399 1 402 . 2 2 33 33 LYS CB C 13 34.135 0.000 . 1 . . . A 33 LYS CB . 19399 1 403 . 2 2 33 33 LYS CG C 13 25.246 0.028 . 1 . . . A 33 LYS CG . 19399 1 404 . 2 2 33 33 LYS CD C 13 28.867 0.034 . 1 . . . A 33 LYS CD . 19399 1 405 . 2 2 33 33 LYS CE C 13 42.030 0.024 . 1 . . . A 33 LYS CE . 19399 1 406 . 2 2 33 33 LYS N N 15 115.876 0.044 . 1 . . . A 33 LYS N . 19399 1 407 . 2 2 34 34 GLU H H 1 8.665 0.002 . 1 . . . A 34 GLU H . 19399 1 408 . 2 2 34 34 GLU HA H 1 4.603 0.015 . 1 . . . A 34 GLU HA . 19399 1 409 . 2 2 34 34 GLU HB2 H 1 2.263 0.008 . 2 . . . A 34 GLU HB2 . 19399 1 410 . 2 2 34 34 GLU HB3 H 1 1.665 0.015 . 2 . . . A 34 GLU HB3 . 19399 1 411 . 2 2 34 34 GLU HG2 H 1 2.155 0.008 . 1 . . . A 34 GLU HG2 . 19399 1 412 . 2 2 34 34 GLU HG3 H 1 2.155 0.008 . 1 . . . A 34 GLU HG3 . 19399 1 413 . 2 2 34 34 GLU CA C 13 55.109 0.000 . 1 . . . A 34 GLU CA . 19399 1 414 . 2 2 34 34 GLU CB C 13 32.709 0.000 . 1 . . . A 34 GLU CB . 19399 1 415 . 2 2 34 34 GLU CG C 13 35.242 0.000 . 1 . . . A 34 GLU CG . 19399 1 416 . 2 2 34 34 GLU N N 15 114.203 0.000 . 1 . . . A 34 GLU N . 19399 1 417 . 2 2 35 35 GLY H H 1 8.478 0.002 . 1 . . . A 35 GLY H . 19399 1 418 . 2 2 35 35 GLY HA2 H 1 4.114 0.008 . 2 . . . A 35 GLY HA2 . 19399 1 419 . 2 2 35 35 GLY HA3 H 1 3.880 0.008 . 2 . . . A 35 GLY HA3 . 19399 1 420 . 2 2 35 35 GLY CA C 13 45.970 0.000 . 1 . . . A 35 GLY CA . 19399 1 421 . 2 2 35 35 GLY N N 15 109.243 0.054 . 1 . . . A 35 GLY N . 19399 1 422 . 2 2 36 36 ILE H H 1 6.114 0.001 . 1 . . . A 36 ILE H . 19399 1 423 . 2 2 36 36 ILE HA H 1 4.348 0.008 . 1 . . . A 36 ILE HA . 19399 1 424 . 2 2 36 36 ILE HB H 1 1.382 0.010 . 1 . . . A 36 ILE HB . 19399 1 425 . 2 2 36 36 ILE HG12 H 1 1.339 0.005 . 2 . . . A 36 ILE HG12 . 19399 1 426 . 2 2 36 36 ILE HG13 H 1 1.010 0.010 . 2 . . . A 36 ILE HG13 . 19399 1 427 . 2 2 36 36 ILE HG21 H 1 0.886 0.004 . 1 . . . A 36 ILE HG21 . 19399 1 428 . 2 2 36 36 ILE HG22 H 1 0.886 0.004 . 1 . . . A 36 ILE HG22 . 19399 1 429 . 2 2 36 36 ILE HG23 H 1 0.886 0.004 . 1 . . . A 36 ILE HG23 . 19399 1 430 . 2 2 36 36 ILE HD11 H 1 0.731 0.004 . 1 . . . A 36 ILE HD11 . 19399 1 431 . 2 2 36 36 ILE HD12 H 1 0.731 0.004 . 1 . . . A 36 ILE HD12 . 19399 1 432 . 2 2 36 36 ILE HD13 H 1 0.731 0.004 . 1 . . . A 36 ILE HD13 . 19399 1 433 . 2 2 36 36 ILE CA C 13 57.631 0.036 . 1 . . . A 36 ILE CA . 19399 1 434 . 2 2 36 36 ILE CB C 13 40.385 0.033 . 1 . . . A 36 ILE CB . 19399 1 435 . 2 2 36 36 ILE CG1 C 13 26.885 0.035 . 1 . . . A 36 ILE CG1 . 19399 1 436 . 2 2 36 36 ILE CG2 C 13 17.778 0.034 . 1 . . . A 36 ILE CG2 . 19399 1 437 . 2 2 36 36 ILE CD1 C 13 13.621 0.000 . 1 . . . A 36 ILE CD1 . 19399 1 438 . 2 2 36 36 ILE N N 15 120.726 0.065 . 1 . . . A 36 ILE N . 19399 1 439 . 2 2 37 37 PRO HA H 1 4.606 0.004 . 1 . . . A 37 PRO HA . 19399 1 440 . 2 2 37 37 PRO HB2 H 1 2.395 0.007 . 2 . . . A 37 PRO HB2 . 19399 1 441 . 2 2 37 37 PRO HB3 H 1 1.938 0.007 . 2 . . . A 37 PRO HB3 . 19399 1 442 . 2 2 37 37 PRO HG2 H 1 2.021 0.004 . 2 . . . A 37 PRO HG2 . 19399 1 443 . 2 2 37 37 PRO HG3 H 1 2.085 0.009 . 2 . . . A 37 PRO HG3 . 19399 1 444 . 2 2 37 37 PRO HD2 H 1 3.520 0.005 . 2 . . . A 37 PRO HD2 . 19399 1 445 . 2 2 37 37 PRO HD3 H 1 4.160 0.003 . 2 . . . A 37 PRO HD3 . 19399 1 446 . 2 2 37 37 PRO CA C 13 61.558 0.000 . 1 . . . A 37 PRO CA . 19399 1 447 . 2 2 37 37 PRO CB C 13 31.759 0.034 . 1 . . . A 37 PRO CB . 19399 1 448 . 2 2 37 37 PRO CG C 13 28.306 0.013 . 1 . . . A 37 PRO CG . 19399 1 449 . 2 2 37 37 PRO CD C 13 51.040 0.011 . 1 . . . A 37 PRO CD . 19399 1 450 . 2 2 38 38 PRO HA H 1 4.097 0.005 . 1 . . . A 38 PRO HA . 19399 1 451 . 2 2 38 38 PRO HB2 H 1 2.209 0.010 . 2 . . . A 38 PRO HB2 . 19399 1 452 . 2 2 38 38 PRO HB3 H 1 2.021 0.010 . 2 . . . A 38 PRO HB3 . 19399 1 453 . 2 2 38 38 PRO HG2 H 1 2.166 0.005 . 2 . . . A 38 PRO HG2 . 19399 1 454 . 2 2 38 38 PRO HG3 H 1 1.599 0.008 . 2 . . . A 38 PRO HG3 . 19399 1 455 . 2 2 38 38 PRO HD2 H 1 3.733 0.005 . 1 . . . A 38 PRO HD2 . 19399 1 456 . 2 2 38 38 PRO HD3 H 1 3.732 0.005 . 1 . . . A 38 PRO HD3 . 19399 1 457 . 2 2 38 38 PRO CA C 13 66.022 0.033 . 1 . . . A 38 PRO CA . 19399 1 458 . 2 2 38 38 PRO CB C 13 32.892 0.000 . 1 . . . A 38 PRO CB . 19399 1 459 . 2 2 38 38 PRO CG C 13 27.581 0.034 . 1 . . . A 38 PRO CG . 19399 1 460 . 2 2 38 38 PRO CD C 13 51.140 0.000 . 1 . . . A 38 PRO CD . 19399 1 461 . 2 2 39 39 ASP H H 1 8.512 0.002 . 1 . . . A 39 ASP H . 19399 1 462 . 2 2 39 39 ASP HA H 1 4.394 0.012 . 1 . . . A 39 ASP HA . 19399 1 463 . 2 2 39 39 ASP HB2 H 1 2.776 0.014 . 2 . . . A 39 ASP HB2 . 19399 1 464 . 2 2 39 39 ASP HB3 H 1 2.668 0.013 . 2 . . . A 39 ASP HB3 . 19399 1 465 . 2 2 39 39 ASP CA C 13 55.609 0.000 . 1 . . . A 39 ASP CA . 19399 1 466 . 2 2 39 39 ASP CB C 13 39.411 0.071 . 1 . . . A 39 ASP CB . 19399 1 467 . 2 2 39 39 ASP N N 15 113.783 0.000 . 1 . . . A 39 ASP N . 19399 1 468 . 2 2 40 40 GLN H H 1 7.774 0.002 . 1 . . . A 40 GLN H . 19399 1 469 . 2 2 40 40 GLN HA H 1 4.438 0.015 . 1 . . . A 40 GLN HA . 19399 1 470 . 2 2 40 40 GLN HB2 H 1 1.812 0.012 . 2 . . . A 40 GLN HB2 . 19399 1 471 . 2 2 40 40 GLN HB3 H 1 2.454 0.004 . 2 . . . A 40 GLN HB3 . 19399 1 472 . 2 2 40 40 GLN HG2 H 1 2.378 0.005 . 1 . . . A 40 GLN HG2 . 19399 1 473 . 2 2 40 40 GLN HG3 H 1 2.378 0.005 . 1 . . . A 40 GLN HG3 . 19399 1 474 . 2 2 40 40 GLN HE21 H 1 6.705 0.000 . 1 . . . A 40 GLN HE21 . 19399 1 475 . 2 2 40 40 GLN HE22 H 1 7.640 0.000 . 1 . . . A 40 GLN HE22 . 19399 1 476 . 2 2 40 40 GLN CA C 13 55.563 0.037 . 1 . . . A 40 GLN CA . 19399 1 477 . 2 2 40 40 GLN CB C 13 30.111 0.004 . 1 . . . A 40 GLN CB . 19399 1 478 . 2 2 40 40 GLN CG C 13 34.182 0.009 . 1 . . . A 40 GLN CG . 19399 1 479 . 2 2 40 40 GLN N N 15 117.107 0.056 . 1 . . . A 40 GLN N . 19399 1 480 . 2 2 40 40 GLN NE2 N 15 110.920 0.002 . 1 . . . A 40 GLN NE2 . 19399 1 481 . 2 2 41 41 GLN H H 1 7.455 0.002 . 1 . . . A 41 GLN H . 19399 1 482 . 2 2 41 41 GLN HA H 1 4.206 0.013 . 1 . . . A 41 GLN HA . 19399 1 483 . 2 2 41 41 GLN HB2 H 1 1.954 0.012 . 2 . . . A 41 GLN HB2 . 19399 1 484 . 2 2 41 41 GLN HB3 H 1 1.868 0.007 . 2 . . . A 41 GLN HB3 . 19399 1 485 . 2 2 41 41 GLN HG2 H 1 1.610 0.007 . 2 . . . A 41 GLN HG2 . 19399 1 486 . 2 2 41 41 GLN HG3 H 1 2.496 0.005 . 2 . . . A 41 GLN HG3 . 19399 1 487 . 2 2 41 41 GLN CA C 13 56.537 0.000 . 1 . . . A 41 GLN CA . 19399 1 488 . 2 2 41 41 GLN CB C 13 31.524 0.037 . 1 . . . A 41 GLN CB . 19399 1 489 . 2 2 41 41 GLN CG C 13 33.398 0.030 . 1 . . . A 41 GLN CG . 19399 1 490 . 2 2 41 41 GLN N N 15 118.003 0.043 . 1 . . . A 41 GLN N . 19399 1 491 . 2 2 42 42 ARG H H 1 8.429 0.001 . 1 . . . A 42 ARG H . 19399 1 492 . 2 2 42 42 ARG HA H 1 4.477 0.011 . 1 . . . A 42 ARG HA . 19399 1 493 . 2 2 42 42 ARG HB2 H 1 1.573 0.009 . 2 . . . A 42 ARG HB2 . 19399 1 494 . 2 2 42 42 ARG HB3 H 1 1.720 0.007 . 2 . . . A 42 ARG HB3 . 19399 1 495 . 2 2 42 42 ARG HG2 H 1 1.402 0.010 . 2 . . . A 42 ARG HG2 . 19399 1 496 . 2 2 42 42 ARG HG3 H 1 1.472 0.008 . 2 . . . A 42 ARG HG3 . 19399 1 497 . 2 2 42 42 ARG HD2 H 1 2.993 0.005 . 2 . . . A 42 ARG HD2 . 19399 1 498 . 2 2 42 42 ARG HD3 H 1 3.083 0.006 . 2 . . . A 42 ARG HD3 . 19399 1 499 . 2 2 42 42 ARG CA C 13 54.894 0.034 . 1 . . . A 42 ARG CA . 19399 1 500 . 2 2 42 42 ARG CB C 13 31.706 0.002 . 1 . . . A 42 ARG CB . 19399 1 501 . 2 2 42 42 ARG CG C 13 26.895 0.035 . 1 . . . A 42 ARG CG . 19399 1 502 . 2 2 42 42 ARG CD C 13 43.561 0.002 . 1 . . . A 42 ARG CD . 19399 1 503 . 2 2 42 42 ARG N N 15 123.058 0.045 . 1 . . . A 42 ARG N . 19399 1 504 . 2 2 43 43 LEU H H 1 8.756 0.002 . 1 . . . A 43 LEU H . 19399 1 505 . 2 2 43 43 LEU HA H 1 5.313 0.011 . 1 . . . A 43 LEU HA . 19399 1 506 . 2 2 43 43 LEU HB2 H 1 1.117 0.007 . 2 . . . A 43 LEU HB2 . 19399 1 507 . 2 2 43 43 LEU HB3 H 1 1.547 0.013 . 2 . . . A 43 LEU HB3 . 19399 1 508 . 2 2 43 43 LEU HG H 1 1.431 0.011 . 1 . . . A 43 LEU HG . 19399 1 509 . 2 2 43 43 LEU HD11 H 1 0.775 0.014 . 2 . . . A 43 LEU HD11 . 19399 1 510 . 2 2 43 43 LEU HD12 H 1 0.775 0.014 . 2 . . . A 43 LEU HD12 . 19399 1 511 . 2 2 43 43 LEU HD13 H 1 0.775 0.014 . 2 . . . A 43 LEU HD13 . 19399 1 512 . 2 2 43 43 LEU HD21 H 1 0.738 0.009 . 2 . . . A 43 LEU HD21 . 19399 1 513 . 2 2 43 43 LEU HD22 H 1 0.738 0.009 . 2 . . . A 43 LEU HD22 . 19399 1 514 . 2 2 43 43 LEU HD23 H 1 0.738 0.009 . 2 . . . A 43 LEU HD23 . 19399 1 515 . 2 2 43 43 LEU CA C 13 52.972 0.019 . 1 . . . A 43 LEU CA . 19399 1 516 . 2 2 43 43 LEU CB C 13 45.659 0.029 . 1 . . . A 43 LEU CB . 19399 1 517 . 2 2 43 43 LEU CG C 13 27.359 0.147 . 1 . . . A 43 LEU CG . 19399 1 518 . 2 2 43 43 LEU CD1 C 13 26.476 0.040 . 2 . . . A 43 LEU CD1 . 19399 1 519 . 2 2 43 43 LEU CD2 C 13 24.310 0.000 . 2 . . . A 43 LEU CD2 . 19399 1 520 . 2 2 43 43 LEU N N 15 124.449 0.000 . 1 . . . A 43 LEU N . 19399 1 521 . 2 2 44 44 ILE H H 1 9.103 0.002 . 1 . . . A 44 ILE H . 19399 1 522 . 2 2 44 44 ILE HA H 1 4.964 0.005 . 1 . . . A 44 ILE HA . 19399 1 523 . 2 2 44 44 ILE HB H 1 1.620 0.005 . 1 . . . A 44 ILE HB . 19399 1 524 . 2 2 44 44 ILE HG12 H 1 1.254 0.006 . 2 . . . A 44 ILE HG12 . 19399 1 525 . 2 2 44 44 ILE HG13 H 1 0.996 0.005 . 2 . . . A 44 ILE HG13 . 19399 1 526 . 2 2 44 44 ILE HG21 H 1 0.613 0.005 . 1 . . . A 44 ILE HG21 . 19399 1 527 . 2 2 44 44 ILE HG22 H 1 0.613 0.005 . 1 . . . A 44 ILE HG22 . 19399 1 528 . 2 2 44 44 ILE HG23 H 1 0.613 0.005 . 1 . . . A 44 ILE HG23 . 19399 1 529 . 2 2 44 44 ILE HD11 H 1 0.604 0.004 . 1 . . . A 44 ILE HD11 . 19399 1 530 . 2 2 44 44 ILE HD12 H 1 0.604 0.004 . 1 . . . A 44 ILE HD12 . 19399 1 531 . 2 2 44 44 ILE HD13 H 1 0.604 0.004 . 1 . . . A 44 ILE HD13 . 19399 1 532 . 2 2 44 44 ILE CA C 13 58.735 0.061 . 1 . . . A 44 ILE CA . 19399 1 533 . 2 2 44 44 ILE CB C 13 41.312 0.037 . 1 . . . A 44 ILE CB . 19399 1 534 . 2 2 44 44 ILE CG1 C 13 28.096 0.007 . 1 . . . A 44 ILE CG1 . 19399 1 535 . 2 2 44 44 ILE CG2 C 13 17.679 0.015 . 1 . . . A 44 ILE CG2 . 19399 1 536 . 2 2 44 44 ILE CD1 C 13 13.086 0.004 . 1 . . . A 44 ILE CD1 . 19399 1 537 . 2 2 44 44 ILE N N 15 123.074 0.054 . 1 . . . A 44 ILE N . 19399 1 538 . 2 2 45 45 PHE H H 1 8.775 0.003 . 1 . . . A 45 PHE H . 19399 1 539 . 2 2 45 45 PHE HA H 1 5.010 0.005 . 1 . . . A 45 PHE HA . 19399 1 540 . 2 2 45 45 PHE HB2 H 1 2.768 0.008 . 2 . . . A 45 PHE HB2 . 19399 1 541 . 2 2 45 45 PHE HB3 H 1 3.017 0.003 . 2 . . . A 45 PHE HB3 . 19399 1 542 . 2 2 45 45 PHE HD1 H 1 7.326 0.004 . 3 . . . A 45 PHE HD1 . 19399 1 543 . 2 2 45 45 PHE HD2 H 1 7.326 0.004 . 3 . . . A 45 PHE HD2 . 19399 1 544 . 2 2 45 45 PHE HE1 H 1 7.510 0.003 . 3 . . . A 45 PHE HE1 . 19399 1 545 . 2 2 45 45 PHE HE2 H 1 7.510 0.003 . 3 . . . A 45 PHE HE2 . 19399 1 546 . 2 2 45 45 PHE CA C 13 56.925 0.028 . 1 . . . A 45 PHE CA . 19399 1 547 . 2 2 45 45 PHE CB C 13 43.954 0.014 . 1 . . . A 45 PHE CB . 19399 1 548 . 2 2 45 45 PHE N N 15 125.292 0.086 . 1 . . . A 45 PHE N . 19399 1 549 . 2 2 46 46 ALA H H 1 8.899 0.000 . 1 . . . A 46 ALA H . 19399 1 550 . 2 2 46 46 ALA HA H 1 3.629 0.005 . 1 . . . A 46 ALA HA . 19399 1 551 . 2 2 46 46 ALA HB1 H 1 0.878 0.005 . 1 . . . A 46 ALA HB1 . 19399 1 552 . 2 2 46 46 ALA HB2 H 1 0.878 0.005 . 1 . . . A 46 ALA HB2 . 19399 1 553 . 2 2 46 46 ALA HB3 H 1 0.878 0.005 . 1 . . . A 46 ALA HB3 . 19399 1 554 . 2 2 46 46 ALA CA C 13 52.446 0.000 . 1 . . . A 46 ALA CA . 19399 1 555 . 2 2 46 46 ALA CB C 13 16.649 0.003 . 1 . . . A 46 ALA CB . 19399 1 556 . 2 2 46 46 ALA N N 15 132.792 0.000 . 1 . . . A 46 ALA N . 19399 1 557 . 2 2 47 47 GLY H H 1 7.917 0.004 . 1 . . . A 47 GLY H . 19399 1 558 . 2 2 47 47 GLY HA2 H 1 3.995 0.010 . 2 . . . A 47 GLY HA2 . 19399 1 559 . 2 2 47 47 GLY HA3 H 1 3.336 0.006 . 2 . . . A 47 GLY HA3 . 19399 1 560 . 2 2 47 47 GLY CA C 13 45.290 0.047 . 1 . . . A 47 GLY CA . 19399 1 561 . 2 2 47 47 GLY N N 15 102.277 0.000 . 1 . . . A 47 GLY N . 19399 1 562 . 2 2 48 48 LYS H H 1 7.823 0.002 . 1 . . . A 48 LYS H . 19399 1 563 . 2 2 48 48 LYS HA H 1 4.622 0.013 . 1 . . . A 48 LYS HA . 19399 1 564 . 2 2 48 48 LYS HB2 H 1 1.861 0.008 . 2 . . . A 48 LYS HB2 . 19399 1 565 . 2 2 48 48 LYS HB3 H 1 1.861 0.008 . 2 . . . A 48 LYS HB3 . 19399 1 566 . 2 2 48 48 LYS HG2 H 1 1.495 0.013 . 1 . . . A 48 LYS HG2 . 19399 1 567 . 2 2 48 48 LYS HG3 H 1 1.495 0.013 . 1 . . . A 48 LYS HG3 . 19399 1 568 . 2 2 48 48 LYS HD2 H 1 1.838 0.010 . 1 . . . A 48 LYS HD2 . 19399 1 569 . 2 2 48 48 LYS HD3 H 1 1.838 0.009 . 1 . . . A 48 LYS HD3 . 19399 1 570 . 2 2 48 48 LYS HE2 H 1 3.134 0.004 . 1 . . . A 48 LYS HE2 . 19399 1 571 . 2 2 48 48 LYS HE3 H 1 3.134 0.004 . 1 . . . A 48 LYS HE3 . 19399 1 572 . 2 2 48 48 LYS CA C 13 54.408 0.000 . 1 . . . A 48 LYS CA . 19399 1 573 . 2 2 48 48 LYS CB C 13 34.638 0.000 . 1 . . . A 48 LYS CB . 19399 1 574 . 2 2 48 48 LYS CG C 13 24.527 0.000 . 1 . . . A 48 LYS CG . 19399 1 575 . 2 2 48 48 LYS CD C 13 29.014 0.039 . 1 . . . A 48 LYS CD . 19399 1 576 . 2 2 48 48 LYS CE C 13 42.036 0.000 . 1 . . . A 48 LYS CE . 19399 1 577 . 2 2 48 48 LYS N N 15 121.030 0.000 . 1 . . . A 48 LYS N . 19399 1 578 . 2 2 49 49 GLN H H 1 8.667 0.002 . 1 . . . A 49 GLN H . 19399 1 579 . 2 2 49 49 GLN HA H 1 4.536 0.021 . 1 . . . A 49 GLN HA . 19399 1 580 . 2 2 49 49 GLN HB2 H 1 1.965 0.016 . 1 . . . A 49 GLN HB2 . 19399 1 581 . 2 2 49 49 GLN HB3 H 1 1.965 0.016 . 1 . . . A 49 GLN HB3 . 19399 1 582 . 2 2 49 49 GLN HG2 H 1 2.199 0.011 . 2 . . . A 49 GLN HG2 . 19399 1 583 . 2 2 49 49 GLN HG3 H 1 2.200 0.009 . 2 . . . A 49 GLN HG3 . 19399 1 584 . 2 2 49 49 GLN HE21 H 1 6.845 0.000 . 1 . . . A 49 GLN HE21 . 19399 1 585 . 2 2 49 49 GLN HE22 H 1 7.611 0.000 . 1 . . . A 49 GLN HE22 . 19399 1 586 . 2 2 49 49 GLN CA C 13 55.584 0.035 . 1 . . . A 49 GLN CA . 19399 1 587 . 2 2 49 49 GLN CB C 13 29.159 0.000 . 1 . . . A 49 GLN CB . 19399 1 588 . 2 2 49 49 GLN CG C 13 34.785 0.000 . 1 . . . A 49 GLN CG . 19399 1 589 . 2 2 49 49 GLN N N 15 122.971 0.000 . 1 . . . A 49 GLN N . 19399 1 590 . 2 2 49 49 GLN NE2 N 15 112.192 0.000 . 1 . . . A 49 GLN NE2 . 19399 1 591 . 2 2 50 50 LEU H H 1 8.533 0.001 . 1 . . . A 50 LEU H . 19399 1 592 . 2 2 50 50 LEU HA H 1 4.052 0.007 . 1 . . . A 50 LEU HA . 19399 1 593 . 2 2 50 50 LEU HB2 H 1 1.001 0.013 . 2 . . . A 50 LEU HB2 . 19399 1 594 . 2 2 50 50 LEU HB3 H 1 1.458 0.012 . 2 . . . A 50 LEU HB3 . 19399 1 595 . 2 2 50 50 LEU HG H 1 1.466 0.017 . 1 . . . A 50 LEU HG . 19399 1 596 . 2 2 50 50 LEU HD11 H 1 -0.184 0.012 . 2 . . . A 50 LEU HD11 . 19399 1 597 . 2 2 50 50 LEU HD12 H 1 -0.184 0.012 . 2 . . . A 50 LEU HD12 . 19399 1 598 . 2 2 50 50 LEU HD13 H 1 -0.184 0.012 . 2 . . . A 50 LEU HD13 . 19399 1 599 . 2 2 50 50 LEU HD21 H 1 0.493 0.007 . 2 . . . A 50 LEU HD21 . 19399 1 600 . 2 2 50 50 LEU HD22 H 1 0.493 0.007 . 2 . . . A 50 LEU HD22 . 19399 1 601 . 2 2 50 50 LEU HD23 H 1 0.493 0.007 . 2 . . . A 50 LEU HD23 . 19399 1 602 . 2 2 50 50 LEU CA C 13 54.158 0.033 . 1 . . . A 50 LEU CA . 19399 1 603 . 2 2 50 50 LEU CB C 13 41.315 0.075 . 1 . . . A 50 LEU CB . 19399 1 604 . 2 2 50 50 LEU CG C 13 25.922 0.075 . 1 . . . A 50 LEU CG . 19399 1 605 . 2 2 50 50 LEU CD1 C 13 19.627 0.020 . 2 . . . A 50 LEU CD1 . 19399 1 606 . 2 2 50 50 LEU CD2 C 13 25.922 0.026 . 2 . . . A 50 LEU CD2 . 19399 1 607 . 2 2 50 50 LEU N N 15 125.868 0.038 . 1 . . . A 50 LEU N . 19399 1 608 . 2 2 51 51 GLU H H 1 8.374 0.001 . 1 . . . A 51 GLU H . 19399 1 609 . 2 2 51 51 GLU HA H 1 4.454 0.009 . 1 . . . A 51 GLU HA . 19399 1 610 . 2 2 51 51 GLU HB2 H 1 1.964 0.014 . 2 . . . A 51 GLU HB2 . 19399 1 611 . 2 2 51 51 GLU HB3 H 1 2.215 0.017 . 2 . . . A 51 GLU HB3 . 19399 1 612 . 2 2 51 51 GLU HG2 H 1 2.341 0.022 . 2 . . . A 51 GLU HG2 . 19399 1 613 . 2 2 51 51 GLU HG3 H 1 2.437 0.019 . 2 . . . A 51 GLU HG3 . 19399 1 614 . 2 2 51 51 GLU CA C 13 55.812 0.036 . 1 . . . A 51 GLU CA . 19399 1 615 . 2 2 51 51 GLU CB C 13 31.537 0.042 . 1 . . . A 51 GLU CB . 19399 1 616 . 2 2 51 51 GLU CG C 13 36.155 0.001 . 1 . . . A 51 GLU CG . 19399 1 617 . 2 2 51 51 GLU N N 15 123.494 0.049 . 1 . . . A 51 GLU N . 19399 1 618 . 2 2 52 52 ASP H H 1 8.144 0.001 . 1 . . . A 52 ASP H . 19399 1 619 . 2 2 52 52 ASP HA H 1 4.339 0.005 . 1 . . . A 52 ASP HA . 19399 1 620 . 2 2 52 52 ASP HB2 H 1 2.645 0.021 . 2 . . . A 52 ASP HB2 . 19399 1 621 . 2 2 52 52 ASP HB3 H 1 2.515 0.014 . 2 . . . A 52 ASP HB3 . 19399 1 622 . 2 2 52 52 ASP CA C 13 56.722 0.032 . 1 . . . A 52 ASP CA . 19399 1 623 . 2 2 52 52 ASP CB C 13 40.799 0.002 . 1 . . . A 52 ASP CB . 19399 1 624 . 2 2 52 52 ASP N N 15 120.831 0.046 . 1 . . . A 52 ASP N . 19399 1 625 . 2 2 53 53 GLY HA2 H 1 3.918 0.013 . 2 . . . A 53 GLY HA2 . 19399 1 626 . 2 2 53 53 GLY HA3 H 1 4.128 0.000 . 2 . . . A 53 GLY HA3 . 19399 1 627 . 2 2 53 53 GLY CA C 13 45.131 0.007 . 1 . . . A 53 GLY CA . 19399 1 628 . 2 2 54 54 ARG H H 1 7.440 0.002 . 1 . . . A 54 ARG H . 19399 1 629 . 2 2 54 54 ARG HA H 1 4.670 0.004 . 1 . . . A 54 ARG HA . 19399 1 630 . 2 2 54 54 ARG HB2 H 1 2.040 0.012 . 2 . . . A 54 ARG HB2 . 19399 1 631 . 2 2 54 54 ARG HB3 H 1 2.215 0.010 . 2 . . . A 54 ARG HB3 . 19399 1 632 . 2 2 54 54 ARG HG2 H 1 1.599 0.009 . 2 . . . A 54 ARG HG2 . 19399 1 633 . 2 2 54 54 ARG HG3 H 1 1.805 0.009 . 2 . . . A 54 ARG HG3 . 19399 1 634 . 2 2 54 54 ARG HD2 H 1 3.125 0.005 . 2 . . . A 54 ARG HD2 . 19399 1 635 . 2 2 54 54 ARG HD3 H 1 3.047 0.004 . 2 . . . A 54 ARG HD3 . 19399 1 636 . 2 2 54 54 ARG CA C 13 54.395 0.000 . 1 . . . A 54 ARG CA . 19399 1 637 . 2 2 54 54 ARG CB C 13 32.672 0.001 . 1 . . . A 54 ARG CB . 19399 1 638 . 2 2 54 54 ARG CG C 13 27.554 0.007 . 1 . . . A 54 ARG CG . 19399 1 639 . 2 2 54 54 ARG CD C 13 42.708 0.032 . 1 . . . A 54 ARG CD . 19399 1 640 . 2 2 54 54 ARG N N 15 119.697 0.052 . 1 . . . A 54 ARG N . 19399 1 641 . 2 2 55 55 THR H H 1 8.795 0.001 . 1 . . . A 55 THR H . 19399 1 642 . 2 2 55 55 THR HA H 1 5.208 0.011 . 1 . . . A 55 THR HA . 19399 1 643 . 2 2 55 55 THR HB H 1 4.517 0.017 . 1 . . . A 55 THR HB . 19399 1 644 . 2 2 55 55 THR HG21 H 1 1.102 0.009 . 1 . . . A 55 THR HG21 . 19399 1 645 . 2 2 55 55 THR HG22 H 1 1.102 0.009 . 1 . . . A 55 THR HG22 . 19399 1 646 . 2 2 55 55 THR HG23 H 1 1.102 0.009 . 1 . . . A 55 THR HG23 . 19399 1 647 . 2 2 55 55 THR CA C 13 59.718 0.000 . 1 . . . A 55 THR CA . 19399 1 648 . 2 2 55 55 THR CB C 13 72.193 0.000 . 1 . . . A 55 THR CB . 19399 1 649 . 2 2 55 55 THR CG2 C 13 22.275 0.000 . 1 . . . A 55 THR CG2 . 19399 1 650 . 2 2 55 55 THR N N 15 109.075 0.050 . 1 . . . A 55 THR N . 19399 1 651 . 2 2 56 56 LEU H H 1 8.122 0.009 . 1 . . . A 56 LEU H . 19399 1 652 . 2 2 56 56 LEU HA H 1 4.038 0.009 . 1 . . . A 56 LEU HA . 19399 1 653 . 2 2 56 56 LEU HB2 H 1 1.193 0.011 . 2 . . . A 56 LEU HB2 . 19399 1 654 . 2 2 56 56 LEU HB3 H 1 2.089 0.010 . 2 . . . A 56 LEU HB3 . 19399 1 655 . 2 2 56 56 LEU HG H 1 1.695 0.008 . 1 . . . A 56 LEU HG . 19399 1 656 . 2 2 56 56 LEU HD11 H 1 0.602 0.008 . 2 . . . A 56 LEU HD11 . 19399 1 657 . 2 2 56 56 LEU HD12 H 1 0.602 0.008 . 2 . . . A 56 LEU HD12 . 19399 1 658 . 2 2 56 56 LEU HD13 H 1 0.602 0.008 . 2 . . . A 56 LEU HD13 . 19399 1 659 . 2 2 56 56 LEU HD21 H 1 0.729 0.008 . 2 . . . A 56 LEU HD21 . 19399 1 660 . 2 2 56 56 LEU HD22 H 1 0.729 0.008 . 2 . . . A 56 LEU HD22 . 19399 1 661 . 2 2 56 56 LEU HD23 H 1 0.729 0.008 . 2 . . . A 56 LEU HD23 . 19399 1 662 . 2 2 56 56 LEU CA C 13 58.715 0.000 . 1 . . . A 56 LEU CA . 19399 1 663 . 2 2 56 56 LEU CB C 13 40.328 0.001 . 1 . . . A 56 LEU CB . 19399 1 664 . 2 2 56 56 LEU CG C 13 26.830 0.000 . 1 . . . A 56 LEU CG . 19399 1 665 . 2 2 56 56 LEU CD1 C 13 23.346 0.000 . 2 . . . A 56 LEU CD1 . 19399 1 666 . 2 2 56 56 LEU CD2 C 13 26.901 0.000 . 2 . . . A 56 LEU CD2 . 19399 1 667 . 2 2 56 56 LEU N N 15 118.357 0.046 . 1 . . . A 56 LEU N . 19399 1 668 . 2 2 57 57 SER H H 1 8.449 0.001 . 1 . . . A 57 SER H . 19399 1 669 . 2 2 57 57 SER HA H 1 4.219 0.010 . 1 . . . A 57 SER HA . 19399 1 670 . 2 2 57 57 SER HB2 H 1 3.725 0.020 . 2 . . . A 57 SER HB2 . 19399 1 671 . 2 2 57 57 SER HB3 H 1 3.815 0.009 . 2 . . . A 57 SER HB3 . 19399 1 672 . 2 2 57 57 SER CA C 13 60.805 0.071 . 1 . . . A 57 SER CA . 19399 1 673 . 2 2 57 57 SER CB C 13 62.300 0.031 . 1 . . . A 57 SER CB . 19399 1 674 . 2 2 57 57 SER N N 15 113.781 0.043 . 1 . . . A 57 SER N . 19399 1 675 . 2 2 58 58 ASP H H 1 7.918 0.001 . 1 . . . A 58 ASP H . 19399 1 676 . 2 2 58 58 ASP HA H 1 4.254 0.014 . 1 . . . A 58 ASP HA . 19399 1 677 . 2 2 58 58 ASP HB2 H 1 2.987 0.016 . 2 . . . A 58 ASP HB2 . 19399 1 678 . 2 2 58 58 ASP HB3 H 1 2.258 0.016 . 2 . . . A 58 ASP HB3 . 19399 1 679 . 2 2 58 58 ASP CA C 13 57.213 0.000 . 1 . . . A 58 ASP CA . 19399 1 680 . 2 2 58 58 ASP CB C 13 40.180 0.002 . 1 . . . A 58 ASP CB . 19399 1 681 . 2 2 58 58 ASP N N 15 124.902 0.046 . 1 . . . A 58 ASP N . 19399 1 682 . 2 2 59 59 TYR H H 1 7.222 0.002 . 1 . . . A 59 TYR H . 19399 1 683 . 2 2 59 59 TYR HA H 1 4.630 0.014 . 1 . . . A 59 TYR HA . 19399 1 684 . 2 2 59 59 TYR HB2 H 1 2.507 0.014 . 2 . . . A 59 TYR HB2 . 19399 1 685 . 2 2 59 59 TYR HB3 H 1 3.444 0.012 . 2 . . . A 59 TYR HB3 . 19399 1 686 . 2 2 59 59 TYR HD1 H 1 6.868 0.000 . 3 . . . A 59 TYR HD1 . 19399 1 687 . 2 2 59 59 TYR HD2 H 1 6.868 0.000 . 3 . . . A 59 TYR HD2 . 19399 1 688 . 2 2 59 59 TYR CA C 13 58.172 0.042 . 1 . . . A 59 TYR CA . 19399 1 689 . 2 2 59 59 TYR CB C 13 39.929 0.000 . 1 . . . A 59 TYR CB . 19399 1 690 . 2 2 59 59 TYR N N 15 116.058 0.051 . 1 . . . A 59 TYR N . 19399 1 691 . 2 2 60 60 ASN H H 1 8.127 0.001 . 1 . . . A 60 ASN H . 19399 1 692 . 2 2 60 60 ASN HA H 1 4.323 0.009 . 1 . . . A 60 ASN HA . 19399 1 693 . 2 2 60 60 ASN HB2 H 1 2.761 0.005 . 2 . . . A 60 ASN HB2 . 19399 1 694 . 2 2 60 60 ASN HB3 H 1 3.284 0.007 . 2 . . . A 60 ASN HB3 . 19399 1 695 . 2 2 60 60 ASN HD21 H 1 7.522 0.000 . 1 . . . A 60 ASN HD21 . 19399 1 696 . 2 2 60 60 ASN HD22 H 1 6.788 0.000 . 1 . . . A 60 ASN HD22 . 19399 1 697 . 2 2 60 60 ASN CA C 13 53.935 0.033 . 1 . . . A 60 ASN CA . 19399 1 698 . 2 2 60 60 ASN CB C 13 37.388 0.009 . 1 . . . A 60 ASN CB . 19399 1 699 . 2 2 60 60 ASN N N 15 116.081 0.058 . 1 . . . A 60 ASN N . 19399 1 700 . 2 2 60 60 ASN ND2 N 15 111.643 0.003 . 1 . . . A 60 ASN ND2 . 19399 1 701 . 2 2 61 61 ILE H H 1 7.231 0.002 . 1 . . . A 61 ILE H . 19399 1 702 . 2 2 61 61 ILE HA H 1 3.355 0.010 . 1 . . . A 61 ILE HA . 19399 1 703 . 2 2 61 61 ILE HB H 1 1.373 0.010 . 1 . . . A 61 ILE HB . 19399 1 704 . 2 2 61 61 ILE HG12 H 1 1.092 0.013 . 2 . . . A 61 ILE HG12 . 19399 1 705 . 2 2 61 61 ILE HG13 H 1 -0.399 0.026 . 2 . . . A 61 ILE HG13 . 19399 1 706 . 2 2 61 61 ILE HG21 H 1 0.450 0.008 . 1 . . . A 61 ILE HG21 . 19399 1 707 . 2 2 61 61 ILE HG22 H 1 0.450 0.008 . 1 . . . A 61 ILE HG22 . 19399 1 708 . 2 2 61 61 ILE HG23 H 1 0.450 0.008 . 1 . . . A 61 ILE HG23 . 19399 1 709 . 2 2 61 61 ILE HD11 H 1 0.389 0.008 . 1 . . . A 61 ILE HD11 . 19399 1 710 . 2 2 61 61 ILE HD12 H 1 0.389 0.008 . 1 . . . A 61 ILE HD12 . 19399 1 711 . 2 2 61 61 ILE HD13 H 1 0.389 0.008 . 1 . . . A 61 ILE HD13 . 19399 1 712 . 2 2 61 61 ILE CA C 13 62.317 0.035 . 1 . . . A 61 ILE CA . 19399 1 713 . 2 2 61 61 ILE CB C 13 36.635 0.032 . 1 . . . A 61 ILE CB . 19399 1 714 . 2 2 61 61 ILE CG1 C 13 28.284 0.046 . 1 . . . A 61 ILE CG1 . 19399 1 715 . 2 2 61 61 ILE CG2 C 13 17.300 0.025 . 1 . . . A 61 ILE CG2 . 19399 1 716 . 2 2 61 61 ILE CD1 C 13 14.577 0.000 . 1 . . . A 61 ILE CD1 . 19399 1 717 . 2 2 61 61 ILE N N 15 119.287 0.076 . 1 . . . A 61 ILE N . 19399 1 718 . 2 2 62 62 GLN H H 1 7.606 0.001 . 1 . . . A 62 GLN H . 19399 1 719 . 2 2 62 62 GLN HA H 1 4.466 0.008 . 1 . . . A 62 GLN HA . 19399 1 720 . 2 2 62 62 GLN HB2 H 1 1.865 0.009 . 2 . . . A 62 GLN HB2 . 19399 1 721 . 2 2 62 62 GLN HB3 H 1 2.224 0.008 . 2 . . . A 62 GLN HB3 . 19399 1 722 . 2 2 62 62 GLN HG2 H 1 2.274 0.012 . 2 . . . A 62 GLN HG2 . 19399 1 723 . 2 2 62 62 GLN HG3 H 1 2.333 0.013 . 2 . . . A 62 GLN HG3 . 19399 1 724 . 2 2 62 62 GLN HE21 H 1 6.787 0.000 . 1 . . . A 62 GLN HE21 . 19399 1 725 . 2 2 62 62 GLN HE22 H 1 7.260 0.000 . 1 . . . A 62 GLN HE22 . 19399 1 726 . 2 2 62 62 GLN CA C 13 53.437 0.031 . 1 . . . A 62 GLN CA . 19399 1 727 . 2 2 62 62 GLN CB C 13 31.535 0.044 . 1 . . . A 62 GLN CB . 19399 1 728 . 2 2 62 62 GLN CG C 13 33.377 0.000 . 1 . . . A 62 GLN CG . 19399 1 729 . 2 2 62 62 GLN N N 15 125.246 0.067 . 1 . . . A 62 GLN N . 19399 1 730 . 2 2 62 62 GLN NE2 N 15 112.502 0.001 . 1 . . . A 62 GLN NE2 . 19399 1 731 . 2 2 63 63 LYS H H 1 8.446 0.001 . 1 . . . A 63 LYS H . 19399 1 732 . 2 2 63 63 LYS HA H 1 3.960 0.012 . 1 . . . A 63 LYS HA . 19399 1 733 . 2 2 63 63 LYS HB2 H 1 2.033 0.010 . 2 . . . A 63 LYS HB2 . 19399 1 734 . 2 2 63 63 LYS HB3 H 1 1.874 0.011 . 2 . . . A 63 LYS HB3 . 19399 1 735 . 2 2 63 63 LYS HG2 H 1 1.477 0.011 . 1 . . . A 63 LYS HG2 . 19399 1 736 . 2 2 63 63 LYS HG3 H 1 1.477 0.011 . 1 . . . A 63 LYS HG3 . 19399 1 737 . 2 2 63 63 LYS HD2 H 1 1.714 0.008 . 2 . . . A 63 LYS HD2 . 19399 1 738 . 2 2 63 63 LYS HD3 H 1 1.713 0.009 . 2 . . . A 63 LYS HD3 . 19399 1 739 . 2 2 63 63 LYS HE2 H 1 3.010 0.003 . 1 . . . A 63 LYS HE2 . 19399 1 740 . 2 2 63 63 LYS HE3 H 1 3.010 0.003 . 1 . . . A 63 LYS HE3 . 19399 1 741 . 2 2 63 63 LYS CA C 13 57.636 0.025 . 1 . . . A 63 LYS CA . 19399 1 742 . 2 2 63 63 LYS CB C 13 32.631 0.013 . 1 . . . A 63 LYS CB . 19399 1 743 . 2 2 63 63 LYS CG C 13 23.911 0.033 . 1 . . . A 63 LYS CG . 19399 1 744 . 2 2 63 63 LYS CD C 13 29.648 0.033 . 1 . . . A 63 LYS CD . 19399 1 745 . 2 2 63 63 LYS CE C 13 41.848 0.003 . 1 . . . A 63 LYS CE . 19399 1 746 . 2 2 63 63 LYS N N 15 120.856 0.045 . 1 . . . A 63 LYS N . 19399 1 747 . 2 2 64 64 GLU H H 1 9.273 0.002 . 1 . . . A 64 GLU H . 19399 1 748 . 2 2 64 64 GLU HA H 1 3.397 0.037 . 1 . . . A 64 GLU HA . 19399 1 749 . 2 2 64 64 GLU HB2 H 1 2.413 0.011 . 2 . . . A 64 GLU HB2 . 19399 1 750 . 2 2 64 64 GLU HB3 H 1 2.547 0.017 . 2 . . . A 64 GLU HB3 . 19399 1 751 . 2 2 64 64 GLU HG2 H 1 2.325 0.009 . 2 . . . A 64 GLU HG2 . 19399 1 752 . 2 2 64 64 GLU HG3 H 1 2.223 0.007 . 2 . . . A 64 GLU HG3 . 19399 1 753 . 2 2 64 64 GLU CA C 13 57.803 0.037 . 1 . . . A 64 GLU CA . 19399 1 754 . 2 2 64 64 GLU CB C 13 25.935 0.001 . 1 . . . A 64 GLU CB . 19399 1 755 . 2 2 64 64 GLU CG C 13 36.235 0.033 . 1 . . . A 64 GLU CG . 19399 1 756 . 2 2 64 64 GLU N N 15 115.065 0.068 . 1 . . . A 64 GLU N . 19399 1 757 . 2 2 65 65 SER H H 1 7.645 0.002 . 1 . . . A 65 SER H . 19399 1 758 . 2 2 65 65 SER HA H 1 4.603 0.006 . 1 . . . A 65 SER HA . 19399 1 759 . 2 2 65 65 SER HB2 H 1 3.617 0.009 . 2 . . . A 65 SER HB2 . 19399 1 760 . 2 2 65 65 SER HB3 H 1 3.863 0.003 . 2 . . . A 65 SER HB3 . 19399 1 761 . 2 2 65 65 SER CA C 13 60.842 0.000 . 1 . . . A 65 SER CA . 19399 1 762 . 2 2 65 65 SER CB C 13 64.898 0.023 . 1 . . . A 65 SER CB . 19399 1 763 . 2 2 65 65 SER N N 15 115.131 0.111 . 1 . . . A 65 SER N . 19399 1 764 . 2 2 66 66 THR H H 1 8.672 0.002 . 1 . . . A 66 THR H . 19399 1 765 . 2 2 66 66 THR HA H 1 5.232 0.002 . 1 . . . A 66 THR HA . 19399 1 766 . 2 2 66 66 THR HB H 1 4.027 0.015 . 1 . . . A 66 THR HB . 19399 1 767 . 2 2 66 66 THR HG21 H 1 0.864 0.012 . 1 . . . A 66 THR HG21 . 19399 1 768 . 2 2 66 66 THR HG22 H 1 0.864 0.012 . 1 . . . A 66 THR HG22 . 19399 1 769 . 2 2 66 66 THR HG23 H 1 0.864 0.012 . 1 . . . A 66 THR HG23 . 19399 1 770 . 2 2 66 66 THR CA C 13 62.301 0.000 . 1 . . . A 66 THR CA . 19399 1 771 . 2 2 66 66 THR CB C 13 69.942 0.000 . 1 . . . A 66 THR CB . 19399 1 772 . 2 2 66 66 THR CG2 C 13 21.555 0.014 . 1 . . . A 66 THR CG2 . 19399 1 773 . 2 2 66 66 THR N N 15 117.761 0.051 . 1 . . . A 66 THR N . 19399 1 774 . 2 2 67 67 LEU H H 1 9.375 0.004 . 1 . . . A 67 LEU H . 19399 1 775 . 2 2 67 67 LEU HA H 1 5.007 0.006 . 1 . . . A 67 LEU HA . 19399 1 776 . 2 2 67 67 LEU HB2 H 1 1.575 0.007 . 1 . . . A 67 LEU HB2 . 19399 1 777 . 2 2 67 67 LEU HB3 H 1 1.575 0.007 . 1 . . . A 67 LEU HB3 . 19399 1 778 . 2 2 67 67 LEU HG H 1 1.742 0.014 . 1 . . . A 67 LEU HG . 19399 1 779 . 2 2 67 67 LEU HD11 H 1 0.634 0.006 . 2 . . . A 67 LEU HD11 . 19399 1 780 . 2 2 67 67 LEU HD12 H 1 0.634 0.006 . 2 . . . A 67 LEU HD12 . 19399 1 781 . 2 2 67 67 LEU HD13 H 1 0.634 0.006 . 2 . . . A 67 LEU HD13 . 19399 1 782 . 2 2 67 67 LEU HD21 H 1 0.662 0.007 . 2 . . . A 67 LEU HD21 . 19399 1 783 . 2 2 67 67 LEU HD22 H 1 0.662 0.007 . 2 . . . A 67 LEU HD22 . 19399 1 784 . 2 2 67 67 LEU HD23 H 1 0.662 0.007 . 2 . . . A 67 LEU HD23 . 19399 1 785 . 2 2 67 67 LEU CA C 13 53.709 0.037 . 1 . . . A 67 LEU CA . 19399 1 786 . 2 2 67 67 LEU CB C 13 44.172 0.033 . 1 . . . A 67 LEU CB . 19399 1 787 . 2 2 67 67 LEU CG C 13 29.480 0.037 . 1 . . . A 67 LEU CG . 19399 1 788 . 2 2 67 67 LEU CD1 C 13 24.877 0.024 . 2 . . . A 67 LEU CD1 . 19399 1 789 . 2 2 67 67 LEU CD2 C 13 25.290 0.003 . 2 . . . A 67 LEU CD2 . 19399 1 790 . 2 2 67 67 LEU N N 15 128.001 0.052 . 1 . . . A 67 LEU N . 19399 1 791 . 2 2 68 68 HIS H H 1 9.091 0.007 . 1 . . . A 68 HIS H . 19399 1 792 . 2 2 68 68 HIS HA H 1 5.173 0.009 . 1 . . . A 68 HIS HA . 19399 1 793 . 2 2 68 68 HIS HB2 H 1 2.944 0.007 . 2 . . . A 68 HIS HB2 . 19399 1 794 . 2 2 68 68 HIS HB3 H 1 2.832 0.005 . 2 . . . A 68 HIS HB3 . 19399 1 795 . 2 2 68 68 HIS HD2 H 1 8.811 0.004 . 1 . . . A 68 HIS HD2 . 19399 1 796 . 2 2 68 68 HIS CA C 13 54.839 0.058 . 1 . . . A 68 HIS CA . 19399 1 797 . 2 2 68 68 HIS CB C 13 30.650 0.000 . 1 . . . A 68 HIS CB . 19399 1 798 . 2 2 68 68 HIS N N 15 119.380 0.053 . 1 . . . A 68 HIS N . 19399 1 799 . 2 2 69 69 LEU H H 1 8.422 0.003 . 1 . . . A 69 LEU H . 19399 1 800 . 2 2 69 69 LEU HA H 1 5.168 0.009 . 1 . . . A 69 LEU HA . 19399 1 801 . 2 2 69 69 LEU HB2 H 1 1.564 0.010 . 2 . . . A 69 LEU HB2 . 19399 1 802 . 2 2 69 69 LEU HB3 H 1 1.059 0.009 . 2 . . . A 69 LEU HB3 . 19399 1 803 . 2 2 69 69 LEU HG H 1 1.311 0.007 . 1 . . . A 69 LEU HG . 19399 1 804 . 2 2 69 69 LEU HD11 H 1 0.710 0.005 . 2 . . . A 69 LEU HD11 . 19399 1 805 . 2 2 69 69 LEU HD12 H 1 0.710 0.005 . 2 . . . A 69 LEU HD12 . 19399 1 806 . 2 2 69 69 LEU HD13 H 1 0.710 0.005 . 2 . . . A 69 LEU HD13 . 19399 1 807 . 2 2 69 69 LEU HD21 H 1 0.835 0.006 . 2 . . . A 69 LEU HD21 . 19399 1 808 . 2 2 69 69 LEU HD22 H 1 0.835 0.006 . 2 . . . A 69 LEU HD22 . 19399 1 809 . 2 2 69 69 LEU HD23 H 1 0.835 0.006 . 2 . . . A 69 LEU HD23 . 19399 1 810 . 2 2 69 69 LEU CA C 13 53.739 0.039 . 1 . . . A 69 LEU CA . 19399 1 811 . 2 2 69 69 LEU CB C 13 44.323 0.047 . 1 . . . A 69 LEU CB . 19399 1 812 . 2 2 69 69 LEU CG C 13 27.568 0.034 . 1 . . . A 69 LEU CG . 19399 1 813 . 2 2 69 69 LEU CD1 C 13 26.228 0.000 . 2 . . . A 69 LEU CD1 . 19399 1 814 . 2 2 69 69 LEU CD2 C 13 23.903 0.061 . 2 . . . A 69 LEU CD2 . 19399 1 815 . 2 2 69 69 LEU N N 15 124.184 0.000 . 1 . . . A 69 LEU N . 19399 1 816 . 2 2 70 70 VAL H H 1 9.128 0.001 . 1 . . . A 70 VAL H . 19399 1 817 . 2 2 70 70 VAL HA H 1 4.320 0.004 . 1 . . . A 70 VAL HA . 19399 1 818 . 2 2 70 70 VAL HB H 1 1.963 0.005 . 1 . . . A 70 VAL HB . 19399 1 819 . 2 2 70 70 VAL HG11 H 1 0.931 0.004 . 2 . . . A 70 VAL HG11 . 19399 1 820 . 2 2 70 70 VAL HG12 H 1 0.931 0.004 . 2 . . . A 70 VAL HG12 . 19399 1 821 . 2 2 70 70 VAL HG13 H 1 0.931 0.004 . 2 . . . A 70 VAL HG13 . 19399 1 822 . 2 2 70 70 VAL HG21 H 1 0.827 0.005 . 2 . . . A 70 VAL HG21 . 19399 1 823 . 2 2 70 70 VAL HG22 H 1 0.827 0.005 . 2 . . . A 70 VAL HG22 . 19399 1 824 . 2 2 70 70 VAL HG23 H 1 0.827 0.005 . 2 . . . A 70 VAL HG23 . 19399 1 825 . 2 2 70 70 VAL CA C 13 60.655 0.029 . 1 . . . A 70 VAL CA . 19399 1 826 . 2 2 70 70 VAL CB C 13 34.782 0.031 . 1 . . . A 70 VAL CB . 19399 1 827 . 2 2 70 70 VAL CG1 C 13 21.526 0.026 . 2 . . . A 70 VAL CG1 . 19399 1 828 . 2 2 70 70 VAL CG2 C 13 21.031 0.003 . 2 . . . A 70 VAL CG2 . 19399 1 829 . 2 2 70 70 VAL N N 15 127.044 0.000 . 1 . . . A 70 VAL N . 19399 1 830 . 2 2 71 71 LEU H H 1 8.153 0.002 . 1 . . . A 71 LEU H . 19399 1 831 . 2 2 71 71 LEU HA H 1 5.058 0.005 . 1 . . . A 71 LEU HA . 19399 1 832 . 2 2 71 71 LEU HB2 H 1 1.498 0.009 . 2 . . . A 71 LEU HB2 . 19399 1 833 . 2 2 71 71 LEU HB3 H 1 1.643 0.011 . 2 . . . A 71 LEU HB3 . 19399 1 834 . 2 2 71 71 LEU HG H 1 1.634 0.006 . 1 . . . A 71 LEU HG . 19399 1 835 . 2 2 71 71 LEU HD11 H 1 0.824 0.006 . 2 . . . A 71 LEU HD11 . 19399 1 836 . 2 2 71 71 LEU HD12 H 1 0.824 0.006 . 2 . . . A 71 LEU HD12 . 19399 1 837 . 2 2 71 71 LEU HD13 H 1 0.824 0.006 . 2 . . . A 71 LEU HD13 . 19399 1 838 . 2 2 71 71 LEU HD21 H 1 0.915 0.005 . 2 . . . A 71 LEU HD21 . 19399 1 839 . 2 2 71 71 LEU HD22 H 1 0.915 0.005 . 2 . . . A 71 LEU HD22 . 19399 1 840 . 2 2 71 71 LEU HD23 H 1 0.915 0.005 . 2 . . . A 71 LEU HD23 . 19399 1 841 . 2 2 71 71 LEU CA C 13 53.816 0.000 . 1 . . . A 71 LEU CA . 19399 1 842 . 2 2 71 71 LEU CB C 13 42.719 0.042 . 1 . . . A 71 LEU CB . 19399 1 843 . 2 2 71 71 LEU CG C 13 27.633 0.039 . 1 . . . A 71 LEU CG . 19399 1 844 . 2 2 71 71 LEU CD1 C 13 24.059 0.048 . 2 . . . A 71 LEU CD1 . 19399 1 845 . 2 2 71 71 LEU CD2 C 13 25.095 0.036 . 2 . . . A 71 LEU CD2 . 19399 1 846 . 2 2 71 71 LEU N N 15 124.079 0.000 . 1 . . . A 71 LEU N . 19399 1 847 . 2 2 72 72 ARG H H 1 8.574 0.001 . 1 . . . A 72 ARG H . 19399 1 848 . 2 2 72 72 ARG HA H 1 4.297 0.010 . 1 . . . A 72 ARG HA . 19399 1 849 . 2 2 72 72 ARG HB2 H 1 1.516 0.004 . 2 . . . A 72 ARG HB2 . 19399 1 850 . 2 2 72 72 ARG HB3 H 1 1.749 0.014 . 2 . . . A 72 ARG HB3 . 19399 1 851 . 2 2 72 72 ARG HG2 H 1 1.508 0.007 . 2 . . . A 72 ARG HG2 . 19399 1 852 . 2 2 72 72 ARG HG3 H 1 1.509 0.008 . 2 . . . A 72 ARG HG3 . 19399 1 853 . 2 2 72 72 ARG HD2 H 1 3.122 0.004 . 1 . . . A 72 ARG HD2 . 19399 1 854 . 2 2 72 72 ARG HD3 H 1 3.122 0.004 . 1 . . . A 72 ARG HD3 . 19399 1 855 . 2 2 72 72 ARG CA C 13 55.535 0.000 . 1 . . . A 72 ARG CA . 19399 1 856 . 2 2 72 72 ARG CB C 13 31.330 0.035 . 1 . . . A 72 ARG CB . 19399 1 857 . 2 2 72 72 ARG CG C 13 27.321 0.002 . 1 . . . A 72 ARG CG . 19399 1 858 . 2 2 72 72 ARG CD C 13 43.383 0.000 . 1 . . . A 72 ARG CD . 19399 1 859 . 2 2 72 72 ARG N N 15 123.329 0.000 . 1 . . . A 72 ARG N . 19399 1 860 . 2 2 73 73 LEU H H 1 8.340 0.001 . 1 . . . A 73 LEU H . 19399 1 861 . 2 2 73 73 LEU HA H 1 4.365 0.007 . 1 . . . A 73 LEU HA . 19399 1 862 . 2 2 73 73 LEU HB2 H 1 1.532 0.011 . 2 . . . A 73 LEU HB2 . 19399 1 863 . 2 2 73 73 LEU HB3 H 1 1.612 0.013 . 2 . . . A 73 LEU HB3 . 19399 1 864 . 2 2 73 73 LEU HG H 1 1.601 0.009 . 1 . . . A 73 LEU HG . 19399 1 865 . 2 2 73 73 LEU HD11 H 1 0.883 0.004 . 2 . . . A 73 LEU HD11 . 19399 1 866 . 2 2 73 73 LEU HD12 H 1 0.883 0.004 . 2 . . . A 73 LEU HD12 . 19399 1 867 . 2 2 73 73 LEU HD13 H 1 0.883 0.004 . 2 . . . A 73 LEU HD13 . 19399 1 868 . 2 2 73 73 LEU HD21 H 1 0.828 0.005 . 2 . . . A 73 LEU HD21 . 19399 1 869 . 2 2 73 73 LEU HD22 H 1 0.828 0.005 . 2 . . . A 73 LEU HD22 . 19399 1 870 . 2 2 73 73 LEU HD23 H 1 0.828 0.005 . 2 . . . A 73 LEU HD23 . 19399 1 871 . 2 2 73 73 LEU CA C 13 54.856 0.000 . 1 . . . A 73 LEU CA . 19399 1 872 . 2 2 73 73 LEU CB C 13 42.498 0.001 . 1 . . . A 73 LEU CB . 19399 1 873 . 2 2 73 73 LEU CG C 13 27.090 0.042 . 1 . . . A 73 LEU CG . 19399 1 874 . 2 2 73 73 LEU CD1 C 13 25.026 0.036 . 2 . . . A 73 LEU CD1 . 19399 1 875 . 2 2 73 73 LEU CD2 C 13 23.371 0.083 . 2 . . . A 73 LEU CD2 . 19399 1 876 . 2 2 73 73 LEU N N 15 124.213 0.000 . 1 . . . A 73 LEU N . 19399 1 877 . 2 2 74 74 ARG H H 1 8.390 0.001 . 1 . . . A 74 ARG H . 19399 1 878 . 2 2 74 74 ARG HA H 1 4.278 0.007 . 1 . . . A 74 ARG HA . 19399 1 879 . 2 2 74 74 ARG HB2 H 1 1.842 0.008 . 2 . . . A 74 ARG HB2 . 19399 1 880 . 2 2 74 74 ARG HB3 H 1 1.758 0.010 . 2 . . . A 74 ARG HB3 . 19399 1 881 . 2 2 74 74 ARG HG2 H 1 1.608 0.012 . 2 . . . A 74 ARG HG2 . 19399 1 882 . 2 2 74 74 ARG HG3 H 1 1.610 0.010 . 2 . . . A 74 ARG HG3 . 19399 1 883 . 2 2 74 74 ARG HD2 H 1 3.163 0.006 . 1 . . . A 74 ARG HD2 . 19399 1 884 . 2 2 74 74 ARG HD3 H 1 3.163 0.006 . 1 . . . A 74 ARG HD3 . 19399 1 885 . 2 2 74 74 ARG CA C 13 56.259 0.034 . 1 . . . A 74 ARG CA . 19399 1 886 . 2 2 74 74 ARG CB C 13 30.881 0.043 . 1 . . . A 74 ARG CB . 19399 1 887 . 2 2 74 74 ARG CG C 13 27.087 0.000 . 1 . . . A 74 ARG CG . 19399 1 888 . 2 2 74 74 ARG CD C 13 43.154 0.034 . 1 . . . A 74 ARG CD . 19399 1 889 . 2 2 74 74 ARG N N 15 121.782 0.000 . 1 . . . A 74 ARG N . 19399 1 890 . 2 2 75 75 GLY H H 1 8.437 0.001 . 1 . . . A 75 GLY H . 19399 1 891 . 2 2 75 75 GLY HA2 H 1 3.918 0.001 . 1 . . . A 75 GLY HA2 . 19399 1 892 . 2 2 75 75 GLY HA3 H 1 3.918 0.001 . 1 . . . A 75 GLY HA3 . 19399 1 893 . 2 2 75 75 GLY N N 15 110.997 0.000 . 1 . . . A 75 GLY N . 19399 1 894 . 2 2 76 76 GLY H H 1 7.920 0.001 . 1 . . . A 76 GLY H . 19399 1 895 . 2 2 76 76 GLY HA2 H 1 3.759 0.000 . 2 . . . A 76 GLY HA2 . 19399 1 896 . 2 2 76 76 GLY HA3 H 1 3.696 0.000 . 2 . . . A 76 GLY HA3 . 19399 1 897 . 2 2 76 76 GLY N N 15 115.215 0.000 . 1 . . . A 76 GLY N . 19399 1 898 . 1 1 1 1 ASP HA H 1 4.680 0.006 . 1 . . . B 22 ASP HA . 19399 1 899 . 1 1 1 1 ASP HB2 H 1 2.708 0.007 . 1 . . . B 22 ASP HB2 . 19399 1 900 . 1 1 1 1 ASP HB3 H 1 2.708 0.007 . 1 . . . B 22 ASP HB3 . 19399 1 901 . 1 1 1 1 ASP H H 1 8.373 0.001 . 1 . . . B 22 ASP H1 . 19399 1 902 . 1 1 1 1 ASP C C 13 176.435 0.000 . 1 . . . B 22 ASP C . 19399 1 903 . 1 1 1 1 ASP CA C 13 54.093 0.127 . 1 . . . B 22 ASP CA . 19399 1 904 . 1 1 1 1 ASP CB C 13 41.249 0.071 . 1 . . . B 22 ASP CB . 19399 1 905 . 1 1 1 1 ASP N N 15 119.667 0.000 . 1 . . . B 22 ASP N . 19399 1 906 . 1 1 2 2 THR H H 1 7.932 0.002 . 1 . . . B 23 THR H . 19399 1 907 . 1 1 2 2 THR HA H 1 4.394 0.008 . 1 . . . B 23 THR HA . 19399 1 908 . 1 1 2 2 THR HB H 1 4.326 0.004 . 1 . . . B 23 THR HB . 19399 1 909 . 1 1 2 2 THR HG21 H 1 1.204 0.006 . 1 . . . B 23 THR HG21 . 19399 1 910 . 1 1 2 2 THR HG22 H 1 1.204 0.006 . 1 . . . B 23 THR HG22 . 19399 1 911 . 1 1 2 2 THR HG23 H 1 1.204 0.006 . 1 . . . B 23 THR HG23 . 19399 1 912 . 1 1 2 2 THR C C 13 174.827 0.000 . 1 . . . B 23 THR C . 19399 1 913 . 1 1 2 2 THR CA C 13 61.570 0.033 . 1 . . . B 23 THR CA . 19399 1 914 . 1 1 2 2 THR CB C 13 69.954 0.038 . 1 . . . B 23 THR CB . 19399 1 915 . 1 1 2 2 THR CG2 C 13 21.662 0.037 . 1 . . . B 23 THR CG2 . 19399 1 916 . 1 1 2 2 THR N N 15 112.528 0.017 . 1 . . . B 23 THR N . 19399 1 917 . 1 1 3 3 GLN H H 1 8.493 0.004 . 1 . . . B 24 GLN H . 19399 1 918 . 1 1 3 3 GLN HA H 1 4.230 0.010 . 1 . . . B 24 GLN HA . 19399 1 919 . 1 1 3 3 GLN HB2 H 1 2.135 0.003 . 2 . . . B 24 GLN HB2 . 19399 1 920 . 1 1 3 3 GLN HB3 H 1 2.031 0.005 . 2 . . . B 24 GLN HB3 . 19399 1 921 . 1 1 3 3 GLN HG2 H 1 2.325 0.005 . 1 . . . B 24 GLN HG2 . 19399 1 922 . 1 1 3 3 GLN HG3 H 1 2.325 0.005 . 1 . . . B 24 GLN HG3 . 19399 1 923 . 1 1 3 3 GLN HE21 H 1 6.778 0.000 . 1 . . . B 24 GLN HE21 . 19399 1 924 . 1 1 3 3 GLN HE22 H 1 7.564 0.000 . 1 . . . B 24 GLN HE22 . 19399 1 925 . 1 1 3 3 GLN C C 13 176.231 0.000 . 1 . . . B 24 GLN C . 19399 1 926 . 1 1 3 3 GLN CA C 13 57.066 0.044 . 1 . . . B 24 GLN CA . 19399 1 927 . 1 1 3 3 GLN CB C 13 29.124 0.031 . 1 . . . B 24 GLN CB . 19399 1 928 . 1 1 3 3 GLN CG C 13 33.854 0.041 . 1 . . . B 24 GLN CG . 19399 1 929 . 1 1 3 3 GLN N N 15 122.034 0.011 . 1 . . . B 24 GLN N . 19399 1 930 . 1 1 3 3 GLN NE2 N 15 112.060 0.009 . 1 . . . B 24 GLN NE2 . 19399 1 931 . 1 1 4 4 ASP H H 1 8.350 0.003 . 1 . . . B 25 ASP H . 19399 1 932 . 1 1 4 4 ASP HA H 1 4.504 0.006 . 1 . . . B 25 ASP HA . 19399 1 933 . 1 1 4 4 ASP HB2 H 1 2.637 0.006 . 1 . . . B 25 ASP HB2 . 19399 1 934 . 1 1 4 4 ASP HB3 H 1 2.637 0.006 . 1 . . . B 25 ASP HB3 . 19399 1 935 . 1 1 4 4 ASP C C 13 176.888 0.000 . 1 . . . B 25 ASP C . 19399 1 936 . 1 1 4 4 ASP CA C 13 55.704 0.030 . 1 . . . B 25 ASP CA . 19399 1 937 . 1 1 4 4 ASP CB C 13 41.340 0.046 . 1 . . . B 25 ASP CB . 19399 1 938 . 1 1 4 4 ASP N N 15 120.475 0.001 . 1 . . . B 25 ASP N . 19399 1 939 . 1 1 5 5 ASP H H 1 8.222 0.001 . 1 . . . B 26 ASP H . 19399 1 940 . 1 1 5 5 ASP HA H 1 4.465 0.006 . 1 . . . B 26 ASP HA . 19399 1 941 . 1 1 5 5 ASP HB2 H 1 2.625 0.005 . 1 . . . B 26 ASP HB2 . 19399 1 942 . 1 1 5 5 ASP HB3 H 1 2.625 0.005 . 1 . . . B 26 ASP HB3 . 19399 1 943 . 1 1 5 5 ASP C C 13 177.030 0.000 . 1 . . . B 26 ASP C . 19399 1 944 . 1 1 5 5 ASP CA C 13 55.881 0.026 . 1 . . . B 26 ASP CA . 19399 1 945 . 1 1 5 5 ASP CB C 13 40.723 0.036 . 1 . . . B 26 ASP CB . 19399 1 946 . 1 1 5 5 ASP N N 15 120.312 0.033 . 1 . . . B 26 ASP N . 19399 1 947 . 1 1 6 6 PHE H H 1 8.231 0.007 . 1 . . . B 27 PHE H . 19399 1 948 . 1 1 6 6 PHE HA H 1 4.261 0.007 . 1 . . . B 27 PHE HA . 19399 1 949 . 1 1 6 6 PHE HB2 H 1 3.083 0.006 . 2 . . . B 27 PHE HB2 . 19399 1 950 . 1 1 6 6 PHE HB3 H 1 3.015 0.005 . 2 . . . B 27 PHE HB3 . 19399 1 951 . 1 1 6 6 PHE HD1 H 1 7.057 0.010 . 3 . . . B 27 PHE HD1 . 19399 1 952 . 1 1 6 6 PHE HD2 H 1 7.057 0.010 . 3 . . . B 27 PHE HD2 . 19399 1 953 . 1 1 6 6 PHE HE1 H 1 7.231 0.012 . 3 . . . B 27 PHE HE1 . 19399 1 954 . 1 1 6 6 PHE HE2 H 1 7.231 0.012 . 3 . . . B 27 PHE HE2 . 19399 1 955 . 1 1 6 6 PHE C C 13 177.016 0.000 . 1 . . . B 27 PHE C . 19399 1 956 . 1 1 6 6 PHE CA C 13 60.513 0.106 . 1 . . . B 27 PHE CA . 19399 1 957 . 1 1 6 6 PHE CB C 13 39.001 0.027 . 1 . . . B 27 PHE CB . 19399 1 958 . 1 1 6 6 PHE CD1 C 13 131.739 0.000 . 3 . . . B 27 PHE CD1 . 19399 1 959 . 1 1 6 6 PHE CD2 C 13 131.739 0.000 . 3 . . . B 27 PHE CD2 . 19399 1 960 . 1 1 6 6 PHE CE1 C 13 131.357 0.000 . 3 . . . B 27 PHE CE1 . 19399 1 961 . 1 1 6 6 PHE CE2 C 13 131.357 0.000 . 3 . . . B 27 PHE CE2 . 19399 1 962 . 1 1 6 6 PHE N N 15 120.994 0.052 . 1 . . . B 27 PHE N . 19399 1 963 . 1 1 7 7 LEU H H 1 8.035 0.002 . 1 . . . B 28 LEU H . 19399 1 964 . 1 1 7 7 LEU HA H 1 4.055 0.004 . 1 . . . B 28 LEU HA . 19399 1 965 . 1 1 7 7 LEU HB2 H 1 1.538 0.004 . 2 . . . B 28 LEU HB2 . 19399 1 966 . 1 1 7 7 LEU HB3 H 1 1.742 0.006 . 2 . . . B 28 LEU HB3 . 19399 1 967 . 1 1 7 7 LEU HG H 1 1.602 0.007 . 1 . . . B 28 LEU HG . 19399 1 968 . 1 1 7 7 LEU HD11 H 1 0.808 0.004 . 2 . . . B 28 LEU HD11 . 19399 1 969 . 1 1 7 7 LEU HD12 H 1 0.808 0.004 . 2 . . . B 28 LEU HD12 . 19399 1 970 . 1 1 7 7 LEU HD13 H 1 0.808 0.004 . 2 . . . B 28 LEU HD13 . 19399 1 971 . 1 1 7 7 LEU HD21 H 1 0.898 0.007 . 2 . . . B 28 LEU HD21 . 19399 1 972 . 1 1 7 7 LEU HD22 H 1 0.898 0.007 . 2 . . . B 28 LEU HD22 . 19399 1 973 . 1 1 7 7 LEU HD23 H 1 0.898 0.007 . 2 . . . B 28 LEU HD23 . 19399 1 974 . 1 1 7 7 LEU C C 13 178.432 0.000 . 1 . . . B 28 LEU C . 19399 1 975 . 1 1 7 7 LEU CA C 13 56.844 0.093 . 1 . . . B 28 LEU CA . 19399 1 976 . 1 1 7 7 LEU CB C 13 41.560 0.083 . 1 . . . B 28 LEU CB . 19399 1 977 . 1 1 7 7 LEU CG C 13 26.981 0.011 . 1 . . . B 28 LEU CG . 19399 1 978 . 1 1 7 7 LEU CD1 C 13 23.411 0.044 . 2 . . . B 28 LEU CD1 . 19399 1 979 . 1 1 7 7 LEU CD2 C 13 25.009 0.035 . 2 . . . B 28 LEU CD2 . 19399 1 980 . 1 1 7 7 LEU N N 15 119.658 0.014 . 1 . . . B 28 LEU N . 19399 1 981 . 1 1 8 8 LYS H H 1 7.778 0.004 . 1 . . . B 29 LYS H . 19399 1 982 . 1 1 8 8 LYS HA H 1 3.939 0.004 . 1 . . . B 29 LYS HA . 19399 1 983 . 1 1 8 8 LYS HB2 H 1 1.733 0.004 . 2 . . . B 29 LYS HB2 . 19399 1 984 . 1 1 8 8 LYS HB3 H 1 1.661 0.003 . 2 . . . B 29 LYS HB3 . 19399 1 985 . 1 1 8 8 LYS HG2 H 1 1.322 0.008 . 2 . . . B 29 LYS HG2 . 19399 1 986 . 1 1 8 8 LYS HG3 H 1 1.225 0.004 . 2 . . . B 29 LYS HG3 . 19399 1 987 . 1 1 8 8 LYS HD2 H 1 1.598 0.004 . 1 . . . B 29 LYS HD2 . 19399 1 988 . 1 1 8 8 LYS HD3 H 1 1.598 0.004 . 1 . . . B 29 LYS HD3 . 19399 1 989 . 1 1 8 8 LYS HE2 H 1 2.878 0.005 . 1 . . . B 29 LYS HE2 . 19399 1 990 . 1 1 8 8 LYS HE3 H 1 2.878 0.005 . 1 . . . B 29 LYS HE3 . 19399 1 991 . 1 1 8 8 LYS C C 13 177.895 0.000 . 1 . . . B 29 LYS C . 19399 1 992 . 1 1 8 8 LYS CA C 13 58.327 0.067 . 1 . . . B 29 LYS CA . 19399 1 993 . 1 1 8 8 LYS CB C 13 32.364 0.038 . 1 . . . B 29 LYS CB . 19399 1 994 . 1 1 8 8 LYS CG C 13 25.045 0.022 . 1 . . . B 29 LYS CG . 19399 1 995 . 1 1 8 8 LYS CD C 13 29.305 0.032 . 1 . . . B 29 LYS CD . 19399 1 996 . 1 1 8 8 LYS CE C 13 42.031 0.047 . 1 . . . B 29 LYS CE . 19399 1 997 . 1 1 8 8 LYS N N 15 119.090 0.072 . 1 . . . B 29 LYS N . 19399 1 998 . 1 1 9 9 TRP H H 1 7.660 0.003 . 1 . . . B 30 TRP H . 19399 1 999 . 1 1 9 9 TRP HA H 1 4.353 0.005 . 1 . . . B 30 TRP HA . 19399 1 1000 . 1 1 9 9 TRP HB2 H 1 3.165 0.005 . 2 . . . B 30 TRP HB2 . 19399 1 1001 . 1 1 9 9 TRP HB3 H 1 3.253 0.006 . 2 . . . B 30 TRP HB3 . 19399 1 1002 . 1 1 9 9 TRP HD1 H 1 7.193 0.003 . 1 . . . B 30 TRP HD1 . 19399 1 1003 . 1 1 9 9 TRP HE1 H 1 10.141 0.003 . 1 . . . B 30 TRP HE1 . 19399 1 1004 . 1 1 9 9 TRP HE3 H 1 7.265 0.020 . 1 . . . B 30 TRP HE3 . 19399 1 1005 . 1 1 9 9 TRP HZ2 H 1 7.364 0.019 . 1 . . . B 30 TRP HZ2 . 19399 1 1006 . 1 1 9 9 TRP HZ3 H 1 7.144 0.004 . 1 . . . B 30 TRP HZ3 . 19399 1 1007 . 1 1 9 9 TRP HH2 H 1 7.175 0.006 . 1 . . . B 30 TRP HH2 . 19399 1 1008 . 1 1 9 9 TRP C C 13 175.521 0.000 . 1 . . . B 30 TRP C . 19399 1 1009 . 1 1 9 9 TRP CA C 13 58.947 0.028 . 1 . . . B 30 TRP CA . 19399 1 1010 . 1 1 9 9 TRP CB C 13 28.729 0.026 . 1 . . . B 30 TRP CB . 19399 1 1011 . 1 1 9 9 TRP CD1 C 13 127.070 0.000 . 1 . . . B 30 TRP CD1 . 19399 1 1012 . 1 1 9 9 TRP CE3 C 13 120.467 0.000 . 1 . . . B 30 TRP CE3 . 19399 1 1013 . 1 1 9 9 TRP CZ2 C 13 114.524 0.000 . 1 . . . B 30 TRP CZ2 . 19399 1 1014 . 1 1 9 9 TRP CZ3 C 13 129.464 0.000 . 1 . . . B 30 TRP CZ3 . 19399 1 1015 . 1 1 9 9 TRP CH2 C 13 124.482 0.000 . 1 . . . B 30 TRP CH2 . 19399 1 1016 . 1 1 9 9 TRP N N 15 120.165 0.009 . 1 . . . B 30 TRP N . 19399 1 1017 . 1 1 9 9 TRP NE1 N 15 129.806 0.028 . 1 . . . B 30 TRP NE1 . 19399 1 1018 . 1 1 10 10 TRP H H 1 8.158 0.003 . 1 . . . B 31 TRP H . 19399 1 1019 . 1 1 10 10 TRP HA H 1 3.962 0.003 . 1 . . . B 31 TRP HA . 19399 1 1020 . 1 1 10 10 TRP HB2 H 1 2.825 0.008 . 2 . . . B 31 TRP HB2 . 19399 1 1021 . 1 1 10 10 TRP HB3 H 1 2.970 0.004 . 2 . . . B 31 TRP HB3 . 19399 1 1022 . 1 1 10 10 TRP HD1 H 1 6.974 0.005 . 1 . . . B 31 TRP HD1 . 19399 1 1023 . 1 1 10 10 TRP HE1 H 1 9.994 0.003 . 1 . . . B 31 TRP HE1 . 19399 1 1024 . 1 1 10 10 TRP HE3 H 1 6.968 0.004 . 1 . . . B 31 TRP HE3 . 19399 1 1025 . 1 1 10 10 TRP HZ2 H 1 7.368 0.006 . 1 . . . B 31 TRP HZ2 . 19399 1 1026 . 1 1 10 10 TRP HZ3 H 1 6.964 0.004 . 1 . . . B 31 TRP HZ3 . 19399 1 1027 . 1 1 10 10 TRP HH2 H 1 7.092 0.003 . 1 . . . B 31 TRP HH2 . 19399 1 1028 . 1 1 10 10 TRP C C 13 176.327 0.000 . 1 . . . B 31 TRP C . 19399 1 1029 . 1 1 10 10 TRP CA C 13 58.688 0.070 . 1 . . . B 31 TRP CA . 19399 1 1030 . 1 1 10 10 TRP CB C 13 29.109 0.026 . 1 . . . B 31 TRP CB . 19399 1 1031 . 1 1 10 10 TRP CD1 C 13 126.471 0.000 . 1 . . . B 31 TRP CD1 . 19399 1 1032 . 1 1 10 10 TRP CE3 C 13 121.659 0.000 . 1 . . . B 31 TRP CE3 . 19399 1 1033 . 1 1 10 10 TRP CZ2 C 13 114.302 0.000 . 1 . . . B 31 TRP CZ2 . 19399 1 1034 . 1 1 10 10 TRP CZ3 C 13 129.418 0.000 . 1 . . . B 31 TRP CZ3 . 19399 1 1035 . 1 1 10 10 TRP CH2 C 13 124.000 0.000 . 1 . . . B 31 TRP CH2 . 19399 1 1036 . 1 1 10 10 TRP N N 15 121.173 0.015 . 1 . . . B 31 TRP N . 19399 1 1037 . 1 1 10 10 TRP NE1 N 15 128.831 0.008 . 1 . . . B 31 TRP NE1 . 19399 1 1038 . 1 1 11 11 ARG H H 1 7.808 0.004 . 1 . . . B 32 ARG H . 19399 1 1039 . 1 1 11 11 ARG HA H 1 4.086 0.007 . 1 . . . B 32 ARG HA . 19399 1 1040 . 1 1 11 11 ARG HB2 H 1 1.786 0.003 . 2 . . . B 32 ARG HB2 . 19399 1 1041 . 1 1 11 11 ARG HB3 H 1 1.699 0.004 . 2 . . . B 32 ARG HB3 . 19399 1 1042 . 1 1 11 11 ARG HG2 H 1 1.536 0.005 . 2 . . . B 32 ARG HG2 . 19399 1 1043 . 1 1 11 11 ARG HG3 H 1 1.616 0.020 . 2 . . . B 32 ARG HG3 . 19399 1 1044 . 1 1 11 11 ARG HD2 H 1 3.106 0.004 . 1 . . . B 32 ARG HD2 . 19399 1 1045 . 1 1 11 11 ARG HD3 H 1 3.106 0.004 . 1 . . . B 32 ARG HD3 . 19399 1 1046 . 1 1 11 11 ARG HE H 1 7.231 0.000 . 1 . . . B 32 ARG HE . 19399 1 1047 . 1 1 11 11 ARG C C 13 176.629 0.000 . 1 . . . B 32 ARG C . 19399 1 1048 . 1 1 11 11 ARG CA C 13 56.736 0.074 . 1 . . . B 32 ARG CA . 19399 1 1049 . 1 1 11 11 ARG CB C 13 30.648 0.027 . 1 . . . B 32 ARG CB . 19399 1 1050 . 1 1 11 11 ARG CG C 13 27.410 0.028 . 1 . . . B 32 ARG CG . 19399 1 1051 . 1 1 11 11 ARG CD C 13 43.325 0.038 . 1 . . . B 32 ARG CD . 19399 1 1052 . 1 1 11 11 ARG N N 15 118.781 0.058 . 1 . . . B 32 ARG N . 19399 1 1053 . 1 1 11 11 ARG NE N 15 108.420 0.000 . 1 . . . B 32 ARG NE . 19399 1 1054 . 1 1 12 12 SER H H 1 7.848 0.003 . 1 . . . B 33 SER H . 19399 1 1055 . 1 1 12 12 SER HA H 1 4.249 0.004 . 1 . . . B 33 SER HA . 19399 1 1056 . 1 1 12 12 SER HB2 H 1 3.835 0.004 . 2 . . . B 33 SER HB2 . 19399 1 1057 . 1 1 12 12 SER HB3 H 1 3.891 0.005 . 2 . . . B 33 SER HB3 . 19399 1 1058 . 1 1 12 12 SER C C 13 177.148 0.000 . 1 . . . B 33 SER C . 19399 1 1059 . 1 1 12 12 SER CA C 13 59.200 0.038 . 1 . . . B 33 SER CA . 19399 1 1060 . 1 1 12 12 SER CB C 13 63.565 0.081 . 1 . . . B 33 SER CB . 19399 1 1061 . 1 1 12 12 SER N N 15 115.910 0.019 . 1 . . . B 33 SER N . 19399 1 1062 . 1 1 13 13 GLU H H 1 8.208 0.002 . 1 . . . B 34 GLU H . 19399 1 1063 . 1 1 13 13 GLU HA H 1 4.089 0.005 . 1 . . . B 34 GLU HA . 19399 1 1064 . 1 1 13 13 GLU HB2 H 1 1.628 0.005 . 2 . . . B 34 GLU HB2 . 19399 1 1065 . 1 1 13 13 GLU HB3 H 1 1.867 0.004 . 2 . . . B 34 GLU HB3 . 19399 1 1066 . 1 1 13 13 GLU HG2 H 1 1.961 0.004 . 1 . . . B 34 GLU HG2 . 19399 1 1067 . 1 1 13 13 GLU HG3 H 1 1.961 0.004 . 1 . . . B 34 GLU HG3 . 19399 1 1068 . 1 1 13 13 GLU C C 13 176.430 0.000 . 1 . . . B 34 GLU C . 19399 1 1069 . 1 1 13 13 GLU CB C 13 29.969 0.039 . 1 . . . B 34 GLU CB . 19399 1 1070 . 1 1 13 13 GLU CG C 13 35.743 0.135 . 1 . . . B 34 GLU CG . 19399 1 1071 . 1 1 13 13 GLU N N 15 122.201 0.017 . 1 . . . B 34 GLU N . 19399 1 1072 . 1 1 14 14 GLU H H 1 8.063 0.005 . 1 . . . B 35 GLU H . 19399 1 1073 . 1 1 14 14 GLU HA H 1 4.079 0.008 . 1 . . . B 35 GLU HA . 19399 1 1074 . 1 1 14 14 GLU HB2 H 1 1.795 0.005 . 2 . . . B 35 GLU HB2 . 19399 1 1075 . 1 1 14 14 GLU HB3 H 1 1.904 0.006 . 2 . . . B 35 GLU HB3 . 19399 1 1076 . 1 1 14 14 GLU HG2 H 1 2.166 0.004 . 1 . . . B 35 GLU HG2 . 19399 1 1077 . 1 1 14 14 GLU HG3 H 1 2.166 0.004 . 1 . . . B 35 GLU HG3 . 19399 1 1078 . 1 1 14 14 GLU C C 13 176.355 0.000 . 1 . . . B 35 GLU C . 19399 1 1079 . 1 1 14 14 GLU CA C 13 56.999 0.062 . 1 . . . B 35 GLU CA . 19399 1 1080 . 1 1 14 14 GLU CB C 13 29.989 0.048 . 1 . . . B 35 GLU CB . 19399 1 1081 . 1 1 14 14 GLU CG C 13 36.391 0.039 . 1 . . . B 35 GLU CG . 19399 1 1082 . 1 1 14 14 GLU N N 15 120.042 0.008 . 1 . . . B 35 GLU N . 19399 1 1083 . 1 1 15 15 ALA H H 1 7.919 0.010 . 1 . . . B 36 ALA H . 19399 1 1084 . 1 1 15 15 ALA HA H 1 4.180 0.006 . 1 . . . B 36 ALA HA . 19399 1 1085 . 1 1 15 15 ALA HB1 H 1 1.243 0.007 . 1 . . . B 36 ALA HB1 . 19399 1 1086 . 1 1 15 15 ALA HB2 H 1 1.243 0.007 . 1 . . . B 36 ALA HB2 . 19399 1 1087 . 1 1 15 15 ALA HB3 H 1 1.243 0.007 . 1 . . . B 36 ALA HB3 . 19399 1 1088 . 1 1 15 15 ALA C C 13 177.583 0.000 . 1 . . . B 36 ALA C . 19399 1 1089 . 1 1 15 15 ALA CA C 13 52.563 0.034 . 1 . . . B 36 ALA CA . 19399 1 1090 . 1 1 15 15 ALA CB C 13 19.018 0.034 . 1 . . . B 36 ALA CB . 19399 1 1091 . 1 1 15 15 ALA N N 15 123.727 0.055 . 1 . . . B 36 ALA N . 19399 1 1092 . 1 1 16 16 GLN H H 1 8.078 0.006 . 1 . . . B 37 GLN H . 19399 1 1093 . 1 1 16 16 GLN HA H 1 4.230 0.004 . 1 . . . B 37 GLN HA . 19399 1 1094 . 1 1 16 16 GLN HB2 H 1 1.927 0.005 . 2 . . . B 37 GLN HB2 . 19399 1 1095 . 1 1 16 16 GLN HB3 H 1 2.079 0.004 . 2 . . . B 37 GLN HB3 . 19399 1 1096 . 1 1 16 16 GLN HG2 H 1 2.307 0.004 . 1 . . . B 37 GLN HG2 . 19399 1 1097 . 1 1 16 16 GLN HG3 H 1 2.308 0.004 . 1 . . . B 37 GLN HG3 . 19399 1 1098 . 1 1 16 16 GLN HE21 H 1 6.743 0.000 . 1 . . . B 37 GLN HE21 . 19399 1 1099 . 1 1 16 16 GLN HE22 H 1 7.445 0.000 . 1 . . . B 37 GLN HE22 . 19399 1 1100 . 1 1 16 16 GLN C C 13 175.634 0.000 . 1 . . . B 37 GLN C . 19399 1 1101 . 1 1 16 16 GLN CA C 13 55.713 0.052 . 1 . . . B 37 GLN CA . 19399 1 1102 . 1 1 16 16 GLN CB C 13 29.517 0.034 . 1 . . . B 37 GLN CB . 19399 1 1103 . 1 1 16 16 GLN CG C 13 33.697 0.039 . 1 . . . B 37 GLN CG . 19399 1 1104 . 1 1 16 16 GLN N N 15 118.623 0.032 . 1 . . . B 37 GLN N . 19399 1 1105 . 1 1 16 16 GLN NE2 N 15 112.518 0.002 . 1 . . . B 37 GLN NE2 . 19399 1 1106 . 1 1 17 17 ASP H H 1 8.284 0.001 . 1 . . . B 38 ASP H . 19399 1 1107 . 1 1 17 17 ASP HA H 1 4.585 0.005 . 1 . . . B 38 ASP HA . 19399 1 1108 . 1 1 17 17 ASP HB2 H 1 2.612 0.006 . 2 . . . B 38 ASP HB2 . 19399 1 1109 . 1 1 17 17 ASP HB3 H 1 2.717 0.004 . 2 . . . B 38 ASP HB3 . 19399 1 1110 . 1 1 17 17 ASP C C 13 176.106 0.000 . 1 . . . B 38 ASP C . 19399 1 1111 . 1 1 17 17 ASP CA C 13 54.356 0.039 . 1 . . . B 38 ASP CA . 19399 1 1112 . 1 1 17 17 ASP CB C 13 41.116 0.039 . 1 . . . B 38 ASP CB . 19399 1 1113 . 1 1 17 17 ASP N N 15 120.925 0.004 . 1 . . . B 38 ASP N . 19399 1 1114 . 1 1 18 18 MET H H 1 8.284 0.002 . 1 . . . B 39 MET H . 19399 1 1115 . 1 1 18 18 MET HA H 1 4.505 0.004 . 1 . . . B 39 MET HA . 19399 1 1116 . 1 1 18 18 MET HB2 H 1 1.985 0.003 . 2 . . . B 39 MET HB2 . 19399 1 1117 . 1 1 18 18 MET HB3 H 1 2.157 0.003 . 2 . . . B 39 MET HB3 . 19399 1 1118 . 1 1 18 18 MET HG2 H 1 2.501 0.005 . 2 . . . B 39 MET HG2 . 19399 1 1119 . 1 1 18 18 MET HG3 H 1 2.611 0.005 . 2 . . . B 39 MET HG3 . 19399 1 1120 . 1 1 18 18 MET HE1 H 1 2.060 0.005 . 1 . . . B 39 MET HE1 . 19399 1 1121 . 1 1 18 18 MET HE2 H 1 2.060 0.005 . 1 . . . B 39 MET HE2 . 19399 1 1122 . 1 1 18 18 MET HE3 H 1 2.060 0.005 . 1 . . . B 39 MET HE3 . 19399 1 1123 . 1 1 18 18 MET C C 13 175.834 0.000 . 1 . . . B 39 MET C . 19399 1 1124 . 1 1 18 18 MET CA C 13 55.283 0.037 . 1 . . . B 39 MET CA . 19399 1 1125 . 1 1 18 18 MET CB C 13 32.740 0.052 . 1 . . . B 39 MET CB . 19399 1 1126 . 1 1 18 18 MET CG C 13 32.305 0.049 . 1 . . . B 39 MET CG . 19399 1 1127 . 1 1 18 18 MET CE C 13 16.890 0.065 . 1 . . . B 39 MET CE . 19399 1 1128 . 1 1 18 18 MET N N 15 121.220 0.006 . 1 . . . B 39 MET N . 19399 1 1129 . 1 1 19 19 GLY H H 1 8.080 0.001 . 1 . . . B 40 GLY H . 19399 1 1130 . 1 1 19 19 GLY HA2 H 1 3.737 0.003 . 1 . . . B 40 GLY HA2 . 19399 1 1131 . 1 1 19 19 GLY HA3 H 1 3.737 0.003 . 1 . . . B 40 GLY HA3 . 19399 1 1132 . 1 1 19 19 GLY CA C 13 46.218 0.045 . 1 . . . B 40 GLY CA . 19399 1 1133 . 1 1 19 19 GLY N N 15 115.777 0.001 . 1 . . . B 40 GLY N . 19399 1 stop_ save_